A0A087X6G2_POEFO Loading...

CWF19-like protein 2

AlphaFold DB , UniProt , Accession A0A087X6G2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 922 aa.

						>A0A087X6G2_POEFO|A0A087X6G2
MATHGVSFESSSNINERKEKKRQARQEAIEKAKQQYEREERRKELKRQRGEDTWILPEVDQRLQQMEEEGSVKSKKKKEKKSKKKKEKKKKIKKEKKAEEGNGSSESSQDSEEEWVEAQPQPVKAWKLPAQPKASEGSLSPAEDVQRDEWMTFDFLAMKTTSTAERKAEKDRQKEEERAKAQAIEQAGLHKLELNPYWKDGGTGLPPEDIAHTAATKAGPVVNDGGLSWLRKSYQRMKEQAEREQRSLSDIVAQRYGSMEEFQKRLADAEKAVHGESRGNRERSAREGWRRGEEDDRERWRAREDDRQDRDRWRRSERDLSPREKGSNRRGDTKERDRGREDDRGRDGERDRGSARDRDGEKDKNRVRERERDRHRDKEKDFSTRASSSSSGESWNQRSSSLGSLKSRFLKPSEDDDSVEAHQRPPPTRPPAGFLKPSPDDEDSPQKQSSIQAWKKRGASGQEPDRTGTPQENKTQPEATGDAPHVASSARTENDSEEEEEAKEEIPLLSEEEMNKLGSKLIKAEIMGNTAMVEKLKSQLEAAQKAKEIHAVRKKEHEAAKLKQVGSQSREDQEVLLFRTDESGRAWPVKGPSGPQEPHGGRRKKKPIETHVDGERVRYFQDDDNVGLQEMVRREKMSSAQDQHALYSRMAAKMMGKTDGDNYTLDDMFVSSAAQREGEGRDEDRMRNRAIGESRRLAVSMEKCPHCFSSQELPKHLIVAIGSKVYLSLPAGVSMTEGHCLICPLQHHTCATGLDEDVWSEMQLFRRALVRMFESQELDCVFMETHMNLRRKQHMVLECIPLPRELGDMAPIYFKKAIMECEEEWAMNKKLVDLSSKDIRRAVPRGLPYFAVDFGLQGGFAHVIENEQKFPHYFGKEVVGGMMDLEPRRWRKLIRENFDDQRKKVLQFAQWWKSYDCTKTVV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	54.9	Low	248 Å²	248	124.7 Å²	124.7	100%	1.222	74%	0.738	S	S	*	*				0	86.1	0	-70.5	-70.5	-122	0	0	108.6
2	A	39.7	Very low	57.1	Low	91 Å²	91	121.1 Å²	121.1	75%	0.752	72%	0.724	S	S	*	*			trans	-154.7	103.2	178.1	0	0	0	0	0	110.7	H4	A2-H4 PolarHBondContact O-N 3.35Å
3	T	44.6	Very low	59.2	Low	139 Å²	139	117.5 Å²	117.5	85%	0.853	70%	0.699	S	S	*	*			trans	25.5	84.5	152.3	55.4	0	0	0	0	118.1	G5	T3-G5 PolarHBondContact O-N 3.33Å
4	H	45.3	Very low	61	Low	184 Å²	184	113.2 Å²	113.2	85%	0.852	67%	0.67	S	S	*	*			trans	-67.3	107.5	149.2	-88.2	-68.7	0	0	0	108.5	A2 V6	A2-H4 PolarHBondContact O-N 3.35Å; H4-V6 PolarHBondContact O-N 3.25Å
5	G	45.3	Very low	62.7	Low	80 Å²	80	111.6 Å²	111.6	83%	0.825	66%	0.657	S	S	*	*			trans	-70.5	69.5	170.5	0	0	0	0	0	111.8	T3 S7	T3-G5 PolarHBondContact O-N 3.33Å; G5-S7 PolarHBondContact O-N 2.95Å; G5-S7 VanDerWaalsContact O-N 3.14Å
6	V	48.8	Very low	64.4	Low	119 Å²	119	109.8 Å²	109.8	72%	0.721	64%	0.64	S	S	*	*			trans	-64	112.6	165.8	178.5	0	0	0	0	106.9	H4 F8	H4-V6 PolarHBondContact O-N 3.25Å; V6-F8 VanDerWaalsContact C-N 3.27Å; V6-F8 PolarHBondContact O-N 3.3Å
7	S	55.8	Low	65.9	Low	108 Å²	108	111.2 Å²	111.2	76%	0.755	63%	0.632	S	S	*	*			trans	-66.6	90.4	171.6	56.4	0	0	0	0	108.7	G5 E9	G5-S7 PolarHBondContact O-N 2.95Å; G5-S7 VanDerWaalsContact O-N 3.14Å; S7-E9 PolarHBondContact O-N 3.22Å
8	F	56	Low	67.3	Low	175 Å²	175	111.3 Å²	111.3	77%	0.768	62%	0.624	S	S	*	*			trans	-68.5	81.9	177	-175.6	-101.2	0	0	0	109.2	V6 S10	V6-F8 VanDerWaalsContact C-N 3.27Å; V6-F8 PolarHBondContact O-N 3.3Å; F8-S10 PolarHBondContact O-N 3.21Å
9	E	63.9	Low	68.6	Low	95 Å²	95	111.1 Å²	111.1	44%	0.444	62%	0.618	S	S	.	*			trans	-56.9	106.7	161.3	-75.8	-162.3	175	0	0	106.6	S7 I14 R17	S7-E9 PolarHBondContact O-N 3.22Å; E9-I14 HydrophobicContact CB-CD1 4.01Å; E9-I14 HydrophobicContact CB-CG1 3.91Å; E9-I14 WeakPolarHBondContact OE2-CG1 3.11Å; E9-R17 IonicContact OE1-NH1 3.34Å
10	S	80.2	Confident	69.9	Low	45 Å²	45	111.3 Å²	111.3	32%	0.315	61%	0.612	S	S	.	*			trans	-58.4	147.4	-179.3	67.7	0	0	0	0	109.8	F8 S12 N13 I14	F8-S10 PolarHBondContact O-N 3.21Å; S10-S12 PolarHBondContact O-N 3.24Å; S10-N13 PolarHBondContact O-N 2.86Å; S10-N13 PolarHBondContact OG-N 2.93Å; S10-I14 PolarHBondContact O-N 3.14Å; S10-I14 VanDerWaalsContact O-N 3.09Å
11	S	79.9	Confident	71	Confident	88 Å²	88	111.9 Å²	111.9	62%	0.615	61%	0.609	S	S	*	*	H	α-helix	trans	-52.6	-32	175.4	53.5	0	0	0	0	111.8	N15	S11-N15 VanDerWaalsContact O-CB 3.24Å; S11-N15 WeakPolarHBondContact O-CB 3.36Å; S11-N15 PolarHBondContact O-N 2.99Å; S11-N15 PolarHBondContact O-ND2 3.28Å
12	S	81.1	Confident	73.4	Confident	81 Å²	81	108.4 Å²	108.4	57%	0.566	58%	0.582	S	S	*	*	H	α-helix	trans	-58	-54.7	170.2	-166.2	0	0	0	0	112.8	S10 I14 N15 E16	S10-S12 PolarHBondContact O-N 3.24Å; S12-I14 PolarHBondContact O-N 2.93Å; S12-N15 CarbonylContact O-C 3.57Å; S12-N15 PolarHBondContact O-N 3.07Å; S12-N15 VanDerWaalsContact O-N 3.1Å; S12-E16 WeakPolarHBondContact O-CB 3.12Å; S12-E16 PolarHBondContact O-N 3.42Å
13	N	84.2	Confident	76	Confident	75 Å²	75	108.3 Å²	108.3	40%	0.401	57%	0.566	S	S	.	*	H	α-helix	trans	-63.1	-41	-179.2	-169.6	-25.4	0	0	0	111.9	S10 N15 E16 R17	S10-N13 PolarHBondContact O-N 2.86Å; S10-N13 PolarHBondContact OG-N 2.93Å; N13-N15 VanDerWaalsContact C-N 3.31Å; N13-N15 PolarHBondContact O-N 3.13Å; N13-E16 PolarHBondContact O-N 2.88Å; N13-R17 VanDerWaalsContact O-CB 3.28Å; N13-R17 WeakPolarHBondContact O-CB 3.33Å; N13-R17 PolarHBondContact O-N 2.95Å
14	I	84.3	Confident	78.4	Confident	57 Å²	57	104.3 Å²	104.3	29%	0.292	55%	0.547	S	S	.	.	H	α-helix	trans	-61.3	-40.7	174	-64.6	174.9	0	0	0	111	E9 S10 S12 K18	E9-I14 HydrophobicContact CB-CD1 4.01Å; E9-I14 HydrophobicContact CB-CG1 3.91Å; E9-I14 WeakPolarHBondContact OE2-CG1 3.11Å; S10-I14 PolarHBondContact O-N 3.14Å; S10-I14 VanDerWaalsContact O-N 3.09Å; S12-I14 PolarHBondContact O-N 2.93Å; I14-K18 HydrophobicContact CG2-CD 4.16Å; I14-K18 WeakPolarHBondContact O-CD 3.48Å; I14-K18 VanDerWaalsContact O-CG 3.25Å; I14-K18 WeakPolarHBondContact O-CG 3.39Å; I14-K18 PolarHBondContact O-N 3.48Å
15	N	87.3	Confident	80.7	Confident	89 Å²	89	104.4 Å²	104.4	48%	0.476	54%	0.54	S	S	.	.	H	α-helix	trans	-71.2	-43.5	177.6	-73.8	-17.9	0	0	0	112	S11 S12 N13 R17 K18 E19	S11-N15 VanDerWaalsContact O-CB 3.24Å; S11-N15 WeakPolarHBondContact O-CB 3.36Å; S11-N15 PolarHBondContact O-N 2.99Å; S11-N15 PolarHBondContact O-ND2 3.28Å; S12-N15 CarbonylContact O-C 3.57Å; S12-N15 PolarHBondContact O-N 3.07Å; S12-N15 VanDerWaalsContact O-N 3.1Å; N13-N15 VanDerWaalsContact C-N 3.31Å; N13-N15 PolarHBondContact O-N 3.13Å; N15-R17 VanDerWaalsContact C-N 3.28Å; N15-R17 PolarHBondContact O-N 3.32Å; N15-K18 CarbonylContact O-C 3.59Å; N15-K18 WeakPolarHBondContact O-CA 3.36Å; N15-K18 WeakPolarHBondContact O-CB 3.25Å; N15-K18 PolarHBondContact O-N 3.39Å; N15-E19 WeakPolarHBondContact O-CB 3.48Å; N15-E19 PolarHBondContact O-N 3Å
16	E	90.1	Very high	83.1	Confident	83 Å²	83	105.8 Å²	105.8	39%	0.388	53%	0.525	S	S	.	.	H	α-helix	trans	-57.7	-40.9	173.6	-168.4	-164.5	159	0	0	111.2	S12 N13 E19 K20	S12-E16 WeakPolarHBondContact O-CB 3.12Å; S12-E16 PolarHBondContact O-N 3.42Å; N13-E16 PolarHBondContact O-N 2.88Å; E16-E19 PolarHBondContact O-N 2.97Å; E16-K20 HydrophobicContact CG-CD 4.29Å; E16-K20 WeakPolarHBondContact O-CB 3.43Å; E16-K20 WeakPolarHBondContact O-CG 3.34Å; E16-K20 PolarHBondContact O-N 3.2Å; E16-K20 VanDerWaalsContact OE1-CE 3.28Å; E16-K20 WeakPolarHBondContact OE1-CE 3.19Å; E16-K20 IonicContact OE1-NZ 2.7Å; E16-K20 PolarHBondContact OE1-NZ 2.86Å
17	R	88.8	Confident	85.3	Confident	133 Å²	133	104.7 Å²	104.7	50%	0.502	51%	0.512	S	S	.	.	H	α-helix	trans	-70.2	-30.2	174.8	-167.2	178.2	-174.5	-169.8	4.9	112.9	E9 N13 N15 K21	E9-R17 IonicContact OE1-NH1 3.34Å; N13-R17 VanDerWaalsContact O-CB 3.28Å; N13-R17 WeakPolarHBondContact O-CB 3.33Å; N13-R17 PolarHBondContact O-N 2.95Å; N15-R17 VanDerWaalsContact C-N 3.28Å; N15-R17 PolarHBondContact O-N 3.32Å; R17-K21 WeakPolarHBondContact O-CD 3.37Å; R17-K21 VanDerWaalsContact O-CG 3.27Å; R17-K21 WeakPolarHBondContact O-CG 3.37Å; R17-K21 PolarHBondContact O-N 2.91Å
18	K	91.9	Very high	87.1	Confident	113 Å²	113	102.3 Å²	102.3	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-73.6	-35.1	170.1	-73.2	164.2	-176.5	170.1	0	111.3	I14 N15 K21 R22	I14-K18 HydrophobicContact CG2-CD 4.16Å; I14-K18 WeakPolarHBondContact O-CD 3.48Å; I14-K18 VanDerWaalsContact O-CG 3.25Å; I14-K18 WeakPolarHBondContact O-CG 3.39Å; I14-K18 PolarHBondContact O-N 3.48Å; N15-K18 CarbonylContact O-C 3.59Å; N15-K18 WeakPolarHBondContact O-CA 3.36Å; N15-K18 WeakPolarHBondContact O-CB 3.25Å; N15-K18 PolarHBondContact O-N 3.39Å; K18-K21 WeakPolarHBondContact O-CB 3.12Å; K18-K21 PolarHBondContact O-N 2.95Å; K18-R22 WeakPolarHBondContact O-CG 3.27Å; K18-R22 PolarHBondContact O-N 2.8Å
19	E	92.7	Very high	89	Confident	107 Å²	107	98.5 Å²	98.5	50%	0.5	49%	0.485	S	S	.	.	H	α-helix	trans	-74.2	-46.4	-180	-177.1	162.9	-158.9	0	0	111.9	N15 E16 K21 R22 Q23	N15-E19 WeakPolarHBondContact O-CB 3.48Å; N15-E19 PolarHBondContact O-N 3Å; E16-E19 PolarHBondContact O-N 2.97Å; E19-K21 PolarHBondContact O-N 3.33Å; E19-R22 CarbonylContact O-C 3.58Å; E19-R22 WeakPolarHBondContact O-CA 3.45Å; E19-R22 WeakPolarHBondContact O-CB 3.41Å; E19-R22 PolarHBondContact O-N 3.16Å; E19-Q23 HydrophobicContact CG-CG 4.39Å; E19-Q23 WeakPolarHBondContact O-CG 3.39Å; E19-Q23 PolarHBondContact O-N 3.38Å
20	K	93.3	Very high	90.6	Very high	116 Å²	116	99.1 Å²	99.1	50%	0.504	49%	0.488	S	S	.	.	H	α-helix	trans	-54	-35.4	168.7	-75	168.9	170.7	173.2	0	112	E16 A24	E16-K20 HydrophobicContact CG-CD 4.29Å; E16-K20 WeakPolarHBondContact O-CB 3.43Å; E16-K20 WeakPolarHBondContact O-CG 3.34Å; E16-K20 PolarHBondContact O-N 3.2Å; E16-K20 VanDerWaalsContact OE1-CE 3.28Å; E16-K20 WeakPolarHBondContact OE1-CE 3.19Å; E16-K20 IonicContact OE1-NZ 2.7Å; E16-K20 PolarHBondContact OE1-NZ 2.86Å; K20-A24 VanDerWaalsContact O-CB 3.25Å; K20-A24 WeakPolarHBondContact O-CB 3.2Å; K20-A24 PolarHBondContact O-N 3.43Å
21	K	93.6	Very high	91.3	Very high	124 Å²	124	102.1 Å²	102.1	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-72.6	-27.1	171.5	-74.5	171.8	-177.3	173.3	0	114	R17 K18 E19 R25	R17-K21 WeakPolarHBondContact O-CD 3.37Å; R17-K21 VanDerWaalsContact O-CG 3.27Å; R17-K21 WeakPolarHBondContact O-CG 3.37Å; R17-K21 PolarHBondContact O-N 2.91Å; K18-K21 WeakPolarHBondContact O-CB 3.12Å; K18-K21 PolarHBondContact O-N 2.95Å; E19-K21 PolarHBondContact O-N 3.33Å; K21-R25 WeakPolarHBondContact O-CD 3.4Å; K21-R25 VanDerWaalsContact O-CG 3.22Å; K21-R25 WeakPolarHBondContact O-CG 3.37Å; K21-R25 PolarHBondContact O-N 3.36Å
22	R	93.8	Very high	92	Very high	175 Å²	175	100.5 Å²	100.5	66%	0.66	49%	0.487	S	S	*	.	H	α-helix	trans	-75.1	-48.8	172	-73.1	172.9	177.5	-167.2	-1.4	110.5	K18 E19 A24 R25 Q26	K18-R22 WeakPolarHBondContact O-CG 3.27Å; K18-R22 PolarHBondContact O-N 2.8Å; E19-R22 CarbonylContact O-C 3.58Å; E19-R22 WeakPolarHBondContact O-CA 3.45Å; E19-R22 WeakPolarHBondContact O-CB 3.41Å; E19-R22 PolarHBondContact O-N 3.16Å; R22-A24 PolarHBondContact O-N 2.79Å; R22-R25 CarbonylContact O-C 3.59Å; R22-R25 WeakPolarHBondContact O-CA 3.32Å; R22-R25 WeakPolarHBondContact O-CB 3.4Å; R22-R25 PolarHBondContact O-N 2.98Å; R22-Q26 WeakPolarHBondContact O-CG 3.4Å; R22-Q26 PolarHBondContact O-N 2.87Å; R22-Q26 PolarHBondContact O-OE1 2.85Å
23	Q	95	Very high	92.7	Very high	88 Å²	88	102.7 Å²	102.7	41%	0.411	49%	0.486	S	S	.	.	H	α-helix	trans	-55.7	-50.9	175.2	-68.5	168.3	-9.2	0	0	111.1	E19 R25 Q26 E27	E19-Q23 HydrophobicContact CG-CG 4.39Å; E19-Q23 WeakPolarHBondContact O-CG 3.39Å; E19-Q23 PolarHBondContact O-N 3.38Å; Q23-R25 PolarHBondContact O-N 2.68Å; Q23-Q26 PolarHBondContact O-N 3.13Å; Q23-E27 PolarHBondContact O-N 2.9Å
24	A	94.3	Very high	93.2	Very high	55 Å²	55	103 Å²	103	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-30.5	176.2	0	0	0	0	0	113.7	K20 R22 A28	K20-A24 VanDerWaalsContact O-CB 3.25Å; K20-A24 WeakPolarHBondContact O-CB 3.2Å; K20-A24 PolarHBondContact O-N 3.43Å; R22-A24 PolarHBondContact O-N 2.79Å; A24-A28 WeakPolarHBondContact O-CB 3.29Å; A24-A28 PolarHBondContact O-N 3.29Å; A24-A28 VanDerWaalsContact O-N 3.08Å
25	R	94.1	Very high	93.6	Very high	187 Å²	187	104.9 Å²	104.9	71%	0.706	49%	0.493	S	S	*	.	H	α-helix	trans	-75	-40.1	172.7	-76.5	172.6	175.3	-161.5	-2.5	112.2	K21 R22 Q23 A28 I29	K21-R25 WeakPolarHBondContact O-CD 3.4Å; K21-R25 VanDerWaalsContact O-CG 3.22Å; K21-R25 WeakPolarHBondContact O-CG 3.37Å; K21-R25 PolarHBondContact O-N 3.36Å; R22-R25 CarbonylContact O-C 3.59Å; R22-R25 WeakPolarHBondContact O-CA 3.32Å; R22-R25 WeakPolarHBondContact O-CB 3.4Å; R22-R25 PolarHBondContact O-N 2.98Å; Q23-R25 PolarHBondContact O-N 2.68Å; R25-A28 PolarHBondContact O-N 3.07Å; R25-I29 WeakPolarHBondContact O-CD1 3.2Å; R25-I29 VanDerWaalsContact O-CG1 3.26Å; R25-I29 WeakPolarHBondContact O-CG1 3.26Å; R25-I29 PolarHBondContact O-N 2.84Å
26	Q	95.2	Very high	93.9	Very high	109 Å²	109	107.5 Å²	107.5	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-62.9	-49.1	174.8	-72.2	164.6	-64.5	0	0	110.2	R22 Q23 A28 I29 E30	R22-Q26 WeakPolarHBondContact O-CG 3.4Å; R22-Q26 PolarHBondContact O-N 2.87Å; R22-Q26 PolarHBondContact O-OE1 2.85Å; Q23-Q26 PolarHBondContact O-N 3.13Å; Q26-A28 VanDerWaalsContact C-N 3.3Å; Q26-A28 PolarHBondContact O-N 2.87Å; Q26-I29 CarbonylContact O-C 3.58Å; Q26-I29 PolarHBondContact O-N 2.79Å; Q26-I29 VanDerWaalsContact O-N 3.11Å; Q26-E30 WeakPolarHBondContact O-CB 3.49Å; Q26-E30 WeakPolarHBondContact O-CG 3.5Å; Q26-E30 PolarHBondContact O-N 3.38Å
27	E	96.3	Very high	94.1	Very high	95 Å²	95	107.8 Å²	107.8	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-54.4	-43	171.1	-79.7	-171.7	-121.1	0	0	112.6	Q23 E30 K31	Q23-E27 PolarHBondContact O-N 2.9Å; E27-E30 PolarHBondContact O-N 2.91Å; E27-K31 VanDerWaalsContact O-CB 3.22Å; E27-K31 WeakPolarHBondContact O-CB 3.33Å; E27-K31 WeakPolarHBondContact O-CD 3.24Å; E27-K31 WeakPolarHBondContact O-CG 3.01Å; E27-K31 PolarHBondContact O-N 2.87Å; E27-K31 IonicContact OE2-NZ 2.58Å; E27-K31 PolarHBondContact OE2-NZ 2.81Å
28	A	94.2	Very high	94.3	Very high	58 Å²	58	107.6 Å²	107.6	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-39.4	178.3	0	0	0	0	0	112	A24 R25 Q26 A32	A24-A28 WeakPolarHBondContact O-CB 3.29Å; A24-A28 PolarHBondContact O-N 3.29Å; A24-A28 VanDerWaalsContact O-N 3.08Å; R25-A28 PolarHBondContact O-N 3.07Å; Q26-A28 VanDerWaalsContact C-N 3.3Å; Q26-A28 PolarHBondContact O-N 2.87Å; A28-A32 WeakPolarHBondContact O-CB 3.32Å; A28-A32 PolarHBondContact O-N 3.27Å
29	I	95.9	Very high	94	Very high	96 Å²	96	107.7 Å²	107.7	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-41.9	175	-69.6	162.9	0	0	0	110.8	R25 Q26 A32 K33	R25-I29 WeakPolarHBondContact O-CD1 3.2Å; R25-I29 VanDerWaalsContact O-CG1 3.26Å; R25-I29 WeakPolarHBondContact O-CG1 3.26Å; R25-I29 PolarHBondContact O-N 2.84Å; Q26-I29 CarbonylContact O-C 3.58Å; Q26-I29 PolarHBondContact O-N 2.79Å; Q26-I29 VanDerWaalsContact O-N 3.11Å; I29-A32 WeakPolarHBondContact O-CB 3.32Å; I29-A32 PolarHBondContact O-N 3.47Å; I29-K33 HydrophobicContact CG2-CD 4.42Å; I29-K33 WeakPolarHBondContact O-CG 3.44Å; I29-K33 PolarHBondContact O-N 2.97Å
30	E	95.9	Very high	93.8	Very high	107 Å²	107	105.7 Å²	105.7	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-68.1	-42	176.9	-74	172.1	-164.1	0	0	112.1	Q26 E27 A32 K33 Q34	Q26-E30 WeakPolarHBondContact O-CB 3.49Å; Q26-E30 WeakPolarHBondContact O-CG 3.5Å; Q26-E30 PolarHBondContact O-N 3.38Å; E27-E30 PolarHBondContact O-N 2.91Å; E30-A32 VanDerWaalsContact C-N 3.27Å; E30-A32 PolarHBondContact O-N 3.38Å; E30-K33 PolarHBondContact O-N 3.45Å; E30-Q34 WeakPolarHBondContact O-CB 3.4Å; E30-Q34 WeakPolarHBondContact O-CG 3.49Å; E30-Q34 PolarHBondContact O-N 2.94Å
31	K	95.8	Very high	93.5	Very high	109 Å²	109	107.1 Å²	107.1	47%	0.474	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-36.3	172.7	-71.7	163.1	-169.1	172.1	0	111	E27 Q35	E27-K31 VanDerWaalsContact O-CB 3.22Å; E27-K31 WeakPolarHBondContact O-CB 3.33Å; E27-K31 WeakPolarHBondContact O-CD 3.24Å; E27-K31 WeakPolarHBondContact O-CG 3.01Å; E27-K31 PolarHBondContact O-N 2.87Å; E27-K31 IonicContact OE2-NZ 2.58Å; E27-K31 PolarHBondContact OE2-NZ 2.81Å; K31-Q35 WeakPolarHBondContact O-CB 3.36Å; K31-Q35 VanDerWaalsContact O-CG 3.27Å; K31-Q35 WeakPolarHBondContact O-CG 3.34Å; K31-Q35 PolarHBondContact O-N 2.9Å
32	A	94	Very high	92.9	Very high	53 Å²	53	109.2 Å²	109.2	44%	0.438	50%	0.497	S	S	.	.	H	α-helix	trans	-68.8	-45.1	172.6	0	0	0	0	0	112.7	A28 I29 E30 Q35 Y36	A28-A32 WeakPolarHBondContact O-CB 3.32Å; A28-A32 PolarHBondContact O-N 3.27Å; I29-A32 WeakPolarHBondContact O-CB 3.32Å; I29-A32 PolarHBondContact O-N 3.47Å; E30-A32 VanDerWaalsContact C-N 3.27Å; E30-A32 PolarHBondContact O-N 3.38Å; A32-Q35 WeakPolarHBondContact O-CB 3.27Å; A32-Q35 PolarHBondContact O-N 2.95Å; A32-Q35 VanDerWaalsContact O-N 3.12Å; A32-Y36 PolarHBondContact O-N 3.2Å
33	K	96.4	Very high	92.2	Very high	127 Å²	127	105.9 Å²	105.9	55%	0.552	49%	0.488	S	S	*	.	H	α-helix	trans	-57.8	-48.4	173.4	-75.2	177.2	177.2	-175.7	0	111.5	I29 E30 Q35 Y36 E37	I29-K33 HydrophobicContact CG2-CD 4.42Å; I29-K33 WeakPolarHBondContact O-CG 3.44Å; I29-K33 PolarHBondContact O-N 2.97Å; E30-K33 PolarHBondContact O-N 3.45Å; K33-Q35 VanDerWaalsContact C-N 3.26Å; K33-Q35 PolarHBondContact O-N 3.27Å; K33-Y36 PolarHBondContact O-N 3.3Å; K33-E37 WeakPolarHBondContact O-CG 3.5Å; K33-E37 PolarHBondContact O-N 3.41Å
34	Q	95.2	Very high	91.6	Very high	83 Å²	83	104.8 Å²	104.8	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-66	-23.7	176	-69.7	-175.5	25.6	0	0	113.7	E30 R38	E30-Q34 WeakPolarHBondContact O-CB 3.4Å; E30-Q34 WeakPolarHBondContact O-CG 3.49Å; E30-Q34 PolarHBondContact O-N 2.94Å; Q34-R38 WeakPolarHBondContact O-CB 3.46Å; Q34-R38 VanDerWaalsContact O-CD 3.26Å; Q34-R38 WeakPolarHBondContact O-CD 2.8Å; Q34-R38 WeakPolarHBondContact O-CG 3.18Å; Q34-R38 PolarHBondContact O-N 2.89Å; Q34-R38 PolarHBondContact O-NH1 3.4Å
35	Q	92.3	Very high	90.9	Very high	96 Å²	96	106.9 Å²	106.9	45%	0.449	49%	0.486	S	S	.	.	H	α-helix	trans	-74	-50.9	170.4	-80.2	178.3	-31.6	0	0	109.7	K31 A32 K33 E37 R38 E39	K31-Q35 WeakPolarHBondContact O-CB 3.36Å; K31-Q35 VanDerWaalsContact O-CG 3.27Å; K31-Q35 WeakPolarHBondContact O-CG 3.34Å; K31-Q35 PolarHBondContact O-N 2.9Å; A32-Q35 WeakPolarHBondContact O-CB 3.27Å; A32-Q35 PolarHBondContact O-N 2.95Å; A32-Q35 VanDerWaalsContact O-N 3.12Å; K33-Q35 VanDerWaalsContact C-N 3.26Å; K33-Q35 PolarHBondContact O-N 3.27Å; Q35-E37 PolarHBondContact O-N 3.01Å; Q35-R38 PolarHBondContact O-N 3.22Å; Q35-R38 VanDerWaalsContact O-N 3.11Å; Q35-E39 WeakPolarHBondContact O-CG 3.47Å; Q35-E39 PolarHBondContact O-N 2.96Å
36	Y	93.3	Very high	90	Very high	143 Å²	143	100.5 Å²	100.5	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-54.6	-51.4	175.6	-175.9	-96.5	0	0	0	112.4	A32 K33 R38 E39 E40	A32-Y36 PolarHBondContact O-N 3.2Å; K33-Y36 PolarHBondContact O-N 3.3Å; Y36-R38 VanDerWaalsContact C-N 3.26Å; Y36-R38 PolarHBondContact O-N 3Å; Y36-E39 CarbonylContact O-C 3.53Å; Y36-E39 PolarHBondContact O-N 3.03Å; Y36-E40 HydrophobicContact CD1-CG 3.91Å; Y36-E40 HydrophobicContact CE1-CG 3.49Å; Y36-E40 VanDerWaalsContact CE1-CG 3.49Å; Y36-E40 HydrophobicContact CE2-CG 4.23Å; Y36-E40 HydrophobicContact CG-CG 4.43Å; Y36-E40 WeakPolarHBondContact O-CG 3.37Å; Y36-E40 PolarHBondContact O-N 2.98Å
37	E	94.6	Very high	89	Confident	89 Å²	89	102.7 Å²	102.7	42%	0.416	47%	0.467	S	S	.	.	H	α-helix	trans	-63.2	-27.2	178.1	-70.2	171	-149.4	0	0	114.4	K33 Q35 R41	K33-E37 WeakPolarHBondContact O-CG 3.5Å; K33-E37 PolarHBondContact O-N 3.41Å; Q35-E37 PolarHBondContact O-N 3.01Å; E37-R41 VanDerWaalsContact O-CB 3.29Å; E37-R41 WeakPolarHBondContact O-CB 3.17Å; E37-R41 VanDerWaalsContact O-CG 3.29Å; E37-R41 WeakPolarHBondContact O-CG 3.41Å; E37-R41 PolarHBondContact O-N 3.44Å; E37-R41 VanDerWaalsContact O-N 3.12Å; E37-R41 PolarHBondContact O-NE 3.18Å; E37-R41 IonicContact OE2-NH2 2.67Å; E37-R41 PolarHBondContact OE2-NH2 2.96Å
38	R	91.7	Very high	87.9	Confident	130 Å²	130	104.4 Å²	104.4	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-78.6	-34.1	174.1	-75.2	174	-170.6	123	4.7	110.7	Q34 Q35 Y36 R42	Q34-R38 WeakPolarHBondContact O-CB 3.46Å; Q34-R38 VanDerWaalsContact O-CD 3.26Å; Q34-R38 WeakPolarHBondContact O-CD 2.8Å; Q34-R38 WeakPolarHBondContact O-CG 3.18Å; Q34-R38 PolarHBondContact O-N 2.89Å; Q34-R38 PolarHBondContact O-NH1 3.4Å; Q35-R38 PolarHBondContact O-N 3.22Å; Q35-R38 VanDerWaalsContact O-N 3.11Å; Y36-R38 VanDerWaalsContact C-N 3.26Å; Y36-R38 PolarHBondContact O-N 3Å; R38-R42 VanDerWaalsContact O-CB 3.25Å; R38-R42 WeakPolarHBondContact O-CB 3.36Å; R38-R42 PolarHBondContact O-N 3.3Å
39	E	87	Confident	86.7	Confident	114 Å²	114	110.4 Å²	110.4	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-70.8	-44.6	174.1	-73.4	171.5	-166	0	0	111.4	Q35 Y36 R42 K43	Q35-E39 WeakPolarHBondContact O-CG 3.47Å; Q35-E39 PolarHBondContact O-N 2.96Å; Y36-E39 CarbonylContact O-C 3.53Å; Y36-E39 PolarHBondContact O-N 3.03Å; E39-R42 CarbonylContact O-C 3.49Å; E39-R42 WeakPolarHBondContact O-CA 3.39Å; E39-R42 WeakPolarHBondContact O-CB 3.17Å; E39-R42 PolarHBondContact O-N 3.24Å; E39-R42 VanDerWaalsContact O-N 3.13Å; E39-K43 WeakPolarHBondContact O-CG 3.42Å; E39-K43 PolarHBondContact O-N 3.47Å
40	E	87.5	Confident	85.2	Confident	66 Å²	66	107 Å²	107	31%	0.308	47%	0.473	S	S	.	.	H	α-helix	trans	-61.1	-48.1	172.7	-69.2	-53.8	112.9	0	0	111.9	Y36 R42 K43 E44	Y36-E40 HydrophobicContact CD1-CG 3.91Å; Y36-E40 HydrophobicContact CE1-CG 3.49Å; Y36-E40 VanDerWaalsContact CE1-CG 3.49Å; Y36-E40 HydrophobicContact CE2-CG 4.23Å; Y36-E40 HydrophobicContact CG-CG 4.43Å; Y36-E40 WeakPolarHBondContact O-CG 3.37Å; Y36-E40 PolarHBondContact O-N 2.98Å; E40-R42 PolarHBondContact O-N 3.44Å; E40-K43 PolarHBondContact O-N 2.91Å; E40-K43 WeakPolarHBondContact OE1-CD 3.38Å; E40-K43 WeakPolarHBondContact OE1-CE 3.36Å; E40-K43 IonicContact OE1-NZ 3.78Å; E40-K43 PolarHBondContact OE1-NZ 2.89Å; E40-E44 WeakPolarHBondContact O-CB 3.47Å; E40-E44 PolarHBondContact O-N 3.1Å
41	R	87.6	Confident	83.8	Confident	145 Å²	145	103 Å²	103	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-59.1	-33.4	173.1	-81.2	178.6	-87.6	-164.8	-14.1	112.4	E37 L45	E37-R41 VanDerWaalsContact O-CB 3.29Å; E37-R41 WeakPolarHBondContact O-CB 3.17Å; E37-R41 VanDerWaalsContact O-CG 3.29Å; E37-R41 WeakPolarHBondContact O-CG 3.41Å; E37-R41 PolarHBondContact O-N 3.44Å; E37-R41 VanDerWaalsContact O-N 3.12Å; E37-R41 PolarHBondContact O-NE 3.18Å; E37-R41 IonicContact OE2-NH2 2.67Å; E37-R41 PolarHBondContact OE2-NH2 2.96Å; R41-L45 VanDerWaalsContact O-CG 3.3Å; R41-L45 WeakPolarHBondContact O-CG 3.49Å; R41-L45 PolarHBondContact O-N 3.09Å; R41-L45 VanDerWaalsContact O-N 3.09Å
42	R	80.9	Confident	82.3	Confident	168 Å²	168	102.3 Å²	102.3	63%	0.634	46%	0.456	S	S	*	.	H	α-helix	trans	-72.1	-43.8	175.3	-172.1	179	-179.4	-160.9	-1.3	111.8	R38 E39 E40 E44 L45 K46	R38-R42 VanDerWaalsContact O-CB 3.25Å; R38-R42 WeakPolarHBondContact O-CB 3.36Å; R38-R42 PolarHBondContact O-N 3.3Å; E39-R42 CarbonylContact O-C 3.49Å; E39-R42 WeakPolarHBondContact O-CA 3.39Å; E39-R42 WeakPolarHBondContact O-CB 3.17Å; E39-R42 PolarHBondContact O-N 3.24Å; E39-R42 VanDerWaalsContact O-N 3.13Å; E40-R42 PolarHBondContact O-N 3.44Å; R42-E44 VanDerWaalsContact C-N 3.3Å; R42-E44 PolarHBondContact O-N 2.95Å; R42-L45 PolarHBondContact O-N 2.67Å; R42-K46 VanDerWaalsContact O-CG 3.28Å; R42-K46 WeakPolarHBondContact O-CG 3.46Å; R42-K46 PolarHBondContact O-N 3.34Å
43	K	80.1	Confident	81.1	Confident	106 Å²	106	104.9 Å²	104.9	46%	0.461	47%	0.466	S	S	.	.	H	α-helix	trans	-58.1	-44.3	172.5	-69	172.2	-170.6	173	0	110.7	E39 E40 L45 K46 R47	E39-K43 WeakPolarHBondContact O-CG 3.42Å; E39-K43 PolarHBondContact O-N 3.47Å; E40-K43 PolarHBondContact O-N 2.91Å; E40-K43 WeakPolarHBondContact OE1-CD 3.38Å; E40-K43 WeakPolarHBondContact OE1-CE 3.36Å; E40-K43 IonicContact OE1-NZ 3.78Å; E40-K43 PolarHBondContact OE1-NZ 2.89Å; K43-L45 PolarHBondContact O-N 3Å; K43-K46 WeakPolarHBondContact O-CA 3.4Å; K43-K46 WeakPolarHBondContact O-CB 3.4Å; K43-K46 PolarHBondContact O-N 2.94Å; K43-K46 VanDerWaalsContact O-N 3.09Å; K43-R47 WeakPolarHBondContact O-CB 2.89Å; K43-R47 PolarHBondContact O-N 3.19Å
44	E	81.1	Confident	80.3	Confident	64 Å²	64	101.2 Å²	101.2	30%	0.299	45%	0.449	S	S	.	.	H	α-helix	trans	-63	-41.2	178.9	-178.3	55.2	-161.1	0	0	112.1	E40 R42 K46 R47 Q48	E40-E44 WeakPolarHBondContact O-CB 3.47Å; E40-E44 PolarHBondContact O-N 3.1Å; R42-E44 VanDerWaalsContact C-N 3.3Å; R42-E44 PolarHBondContact O-N 2.95Å; E44-K46 VanDerWaalsContact C-N 3.33Å; E44-K46 PolarHBondContact O-N 3.35Å; E44-R47 PolarHBondContact O-N 2.87Å; E44-R47 IonicContact OE1-CZ 3.18Å; E44-R47 IonicContact OE1-NE 2.64Å; E44-R47 IonicContact OE1-NH2 3.99Å; E44-R47 PolarHBondContact OE1-NH2 2.82Å; E44-R47 IonicContact OE2-CZ 2.75Å; E44-R47 IonicContact OE2-NE 2.69Å; E44-R47 PolarHBondContact OE2-NE 2.86Å; E44-R47 IonicContact OE2-NH2 2.76Å; E44-R47 PolarHBondContact OE2-NH2 3.1Å; E44-Q48 WeakPolarHBondContact O-CB 3.46Å; E44-Q48 VanDerWaalsContact O-CG 3.25Å; E44-Q48 WeakPolarHBondContact O-CG 3.36Å; E44-Q48 PolarHBondContact O-N 3.17Å; E44-Q48 PolarHBondContact OE1-NE2 3.03Å
45	L	79.4	Confident	79.7	Confident	99 Å²	99	98.7 Å²	98.7	52%	0.518	44%	0.438	S	S	.	.	H	α-helix	trans	-64	-35.2	172.3	-73	167.8	0	0	0	113	R41 R42 K43 R49	R41-L45 VanDerWaalsContact O-CG 3.3Å; R41-L45 WeakPolarHBondContact O-CG 3.49Å; R41-L45 PolarHBondContact O-N 3.09Å; R41-L45 VanDerWaalsContact O-N 3.09Å; R42-L45 PolarHBondContact O-N 2.67Å; K43-L45 PolarHBondContact O-N 3Å; L45-R49 WeakPolarHBondContact O-CD 3.47Å; L45-R49 VanDerWaalsContact O-CG 3.25Å; L45-R49 WeakPolarHBondContact O-CG 3.26Å; L45-R49 PolarHBondContact O-N 2.99Å
46	K	75.7	Confident	79.2	Confident	54 Å²	54	94.9 Å²	94.9	24%	0.235	42%	0.421	C	S	.	.	H	α-helix	trans	-66.7	-44.1	173.5	-67.7	175.7	93	-56.7	0	111.2	R42 K43 E44 R49 G50 E51 D52	R42-K46 VanDerWaalsContact O-CG 3.28Å; R42-K46 WeakPolarHBondContact O-CG 3.46Å; R42-K46 PolarHBondContact O-N 3.34Å; K43-K46 WeakPolarHBondContact O-CA 3.4Å; K43-K46 WeakPolarHBondContact O-CB 3.4Å; K43-K46 PolarHBondContact O-N 2.94Å; K43-K46 VanDerWaalsContact O-N 3.09Å; E44-K46 VanDerWaalsContact C-N 3.33Å; E44-K46 PolarHBondContact O-N 3.35Å; K46-R49 PolarHBondContact O-N 3.19Å; K46-G50 PolarHBondContact O-N 2.87Å; K46-G50 VanDerWaalsContact O-N 3.14Å; K46-E51 HydrophobicContact CB-CB 4.08Å; K46-E51 HydrophobicContact CB-CG 4.45Å; K46-E51 WeakPolarHBondContact CE-OE2 3.09Å; K46-E51 WeakPolarHBondContact CG-OE2 3.26Å; K46-E51 IonicContact NZ-OE2 2.62Å; K46-E51 PolarHBondContact NZ-OE2 3.36Å; K46-E51 PolarHBondContact O-N 2.97Å; K46-D52 VanDerWaalsContact CB-OD2 3.32Å; K46-D52 WeakPolarHBondContact CB-OD2 3.5Å; K46-D52 IonicContact NZ-OD1 3.15Å; K46-D52 PolarHBondContact NZ-OD1 3.48Å
47	R	75.3	Confident	78.5	Confident	155 Å²	155	92.8 Å²	92.8	59%	0.585	43%	0.425	S	S	*	.	H	α-helix	trans	-61.1	-44.7	175.5	-168.1	176.4	73	120.7	6.7	112.1	K43 E44 R49 G50	K43-R47 WeakPolarHBondContact O-CB 2.89Å; K43-R47 PolarHBondContact O-N 3.19Å; E44-R47 PolarHBondContact O-N 2.87Å; E44-R47 IonicContact OE1-CZ 3.18Å; E44-R47 IonicContact OE1-NE 2.64Å; E44-R47 IonicContact OE1-NH2 3.99Å; E44-R47 PolarHBondContact OE1-NH2 2.82Å; E44-R47 IonicContact OE2-CZ 2.75Å; E44-R47 IonicContact OE2-NE 2.69Å; E44-R47 PolarHBondContact OE2-NE 2.86Å; E44-R47 IonicContact OE2-NH2 2.76Å; E44-R47 PolarHBondContact OE2-NH2 3.1Å; R47-R49 VanDerWaalsContact C-N 3.26Å; R47-R49 PolarHBondContact O-N 2.87Å; R47-G50 PolarHBondContact O-N 2.84Å
48	Q	72.6	Confident	77.8	Confident	131 Å²	131	92.6 Å²	92.6	61%	0.612	42%	0.424	S	S	*	.	H	α-helix	trans	-64.4	-28.1	177.1	-73.6	172.9	8.7	0	0	113.4	E44	E44-Q48 WeakPolarHBondContact O-CB 3.46Å; E44-Q48 VanDerWaalsContact O-CG 3.25Å; E44-Q48 WeakPolarHBondContact O-CG 3.36Å; E44-Q48 PolarHBondContact O-N 3.17Å; E44-Q48 PolarHBondContact OE1-NE2 3.03Å
49	R	69.1	Low	77.3	Confident	184 Å²	184	86.6 Å²	86.6	69%	0.694	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-7.6	171.5	-70.4	168.2	176.4	-164	-6.6	114	L45 K46 R47 E51	L45-R49 WeakPolarHBondContact O-CD 3.47Å; L45-R49 VanDerWaalsContact O-CG 3.25Å; L45-R49 WeakPolarHBondContact O-CG 3.26Å; L45-R49 PolarHBondContact O-N 2.99Å; K46-R49 PolarHBondContact O-N 3.19Å; R47-R49 VanDerWaalsContact C-N 3.26Å; R47-R49 PolarHBondContact O-N 2.87Å; R49-E51 VanDerWaalsContact C-N 3.28Å; R49-E51 HydrophobicContact CB-CG 3.83Å; R49-E51 WeakPolarHBondContact CD-OE1 3.39Å; R49-E51 IonicContact CZ-OE1 2.9Å; R49-E51 IonicContact NE-OE1 2.81Å; R49-E51 IonicContact NH1-OE1 3.72Å; R49-E51 PolarHBondContact NH1-OE1 2.95Å; R49-E51 PolarHBondContact O-N 2.89Å
50	G	64.9	Low	77.2	Confident	24 Å²	24	84.5 Å²	84.5	25%	0.247	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	9.9	-172.5	0	0	0	0	0	115.1	K46 R47 D52 T53 W54	K46-G50 PolarHBondContact O-N 2.87Å; K46-G50 VanDerWaalsContact O-N 3.14Å; R47-G50 PolarHBondContact O-N 2.84Å; G50-D52 PolarHBondContact O-N 2.84Å; G50-T53 PolarHBondContact O-N 2.86Å; G50-T53 VanDerWaalsContact O-N 3.12Å; G50-W54 PolarHBondContact O-N 3.22Å
51	E	66.2	Low	76.9	Confident	24 Å²	24	87 Å²	87	11%	0.112	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-34	-176.2	-61.2	-175.3	-162.1	0	0	112.7	K46 R49 T53 F898	K46-E51 HydrophobicContact CB-CB 4.08Å; K46-E51 HydrophobicContact CB-CG 4.45Å; K46-E51 WeakPolarHBondContact CE-OE2 3.09Å; K46-E51 WeakPolarHBondContact CG-OE2 3.26Å; K46-E51 IonicContact NZ-OE2 2.62Å; K46-E51 PolarHBondContact NZ-OE2 3.36Å; K46-E51 PolarHBondContact O-N 2.97Å; R49-E51 VanDerWaalsContact C-N 3.28Å; R49-E51 HydrophobicContact CB-CG 3.83Å; R49-E51 WeakPolarHBondContact CD-OE1 3.39Å; R49-E51 IonicContact CZ-OE1 2.9Å; R49-E51 IonicContact NE-OE1 2.81Å; R49-E51 IonicContact NH1-OE1 3.72Å; R49-E51 PolarHBondContact NH1-OE1 2.95Å; R49-E51 PolarHBondContact O-N 2.89Å; E51-T53 VanDerWaalsContact C-N 3.34Å; E51-F898 HydrophobicContact CB-CD1 4.35Å; E51-F898 HydrophobicContact CB-CD2 3.71Å; E51-F898 HydrophobicContact CB-CE1 4.48Å; E51-F898 HydrophobicContact CB-CE2 3.85Å; E51-F898 HydrophobicContact CB-CG 3.98Å; E51-F898 HydrophobicContact CB-CZ 4.25Å; E51-F898 HydrophobicContact CG-CB 3.87Å; E51-F898 HydrophobicContact CG-CD1 3.88Å; E51-F898 HydrophobicContact CG-CD2 3.82Å; E51-F898 HydrophobicContact CG-CE1 4.41Å; E51-F898 HydrophobicContact CG-CE2 4.35Å; E51-F898 HydrophobicContact CG-CG 3.55Å; E51-F898 VanDerWaalsContact O-CE2 3.23Å; E51-F898 WeakPolarHBondContact O-CE2 3.41Å
52	D	63.3	Low	76.7	Confident	93 Å²	93	83.9 Å²	83.9	50%	0.497	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.4	-177.5	-60.1	-32.2	0	0	0	113	K46 G50	K46-D52 VanDerWaalsContact CB-OD2 3.32Å; K46-D52 WeakPolarHBondContact CB-OD2 3.5Å; K46-D52 IonicContact NZ-OD1 3.15Å; K46-D52 PolarHBondContact NZ-OD1 3.48Å; G50-D52 PolarHBondContact O-N 2.84Å
53	T	68.8	Low	76.8	Confident	107 Å²	107	76.5 Å²	76.5	66%	0.656	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-28.8	-173.9	-43.6	0	0	0	0	113.2	G50 E51 I55	G50-T53 PolarHBondContact O-N 2.86Å; G50-T53 VanDerWaalsContact O-N 3.12Å; E51-T53 VanDerWaalsContact C-N 3.34Å; T53-I55 PolarHBondContact O-N 3.09Å
54	W	79.4	Confident	76.8	Confident	50 Å²	50	76 Å²	76	19%	0.189	37%	0.366	C	S	.	.			trans	-75	120.7	-174.1	-178.2	79.7	0	0	0	112.6	G50 L56 H716 F898 R902 V905 L906	G50-W54 PolarHBondContact O-N 3.22Å; W54-L56 HydrophobicContact CH2-CD2 4.24Å; W54-L56 HydrophobicContact CZ2-CD2 4.23Å; W54-H716 HydrophobicContact CE3-CB 3.95Å; W54-H716 HydrophobicContact CZ3-CB 4.21Å; W54-H716 WeakPolarHBondContact O-CB 3.45Å; W54-F898 HydrophobicContact CB-CZ 4.13Å; W54-F898 HydrophobicContact CE3-CE1 4.5Å; W54-F898 HydrophobicContact CE3-CZ 4.01Å; W54-R902 HydrophobicContact CD2-CG 4.12Å; W54-R902 HydrophobicContact CE3-CB 4.21Å; W54-R902 HydrophobicContact CE3-CG 3.88Å; W54-R902 HydrophobicContact CH2-CB 4.35Å; W54-R902 HydrophobicContact CH2-CG 3.7Å; W54-R902 HydrophobicContact CZ2-CG 3.9Å; W54-R902 HydrophobicContact CZ3-CB 3.94Å; W54-R902 HydrophobicContact CZ3-CG 3.68Å; W54-V905 HydrophobicContact CH2-CB 4.24Å; W54-V905 HydrophobicContact CH2-CG1 3.95Å; W54-V905 HydrophobicContact CZ3-CB 4.46Å; W54-V905 HydrophobicContact CZ3-CG1 4.33Å; W54-L906 HydrophobicContact CH2-CD2 4.49Å; W54-L906 HydrophobicContact CH2-CG 4.2Å; W54-L906 HydrophobicContact CZ2-CD1 4.34Å; W54-L906 HydrophobicContact CZ2-CD2 4.04Å; W54-L906 HydrophobicContact CZ2-CG 4.09Å
55	I	82.2	Confident	76.8	Confident	31 Å²	31	76.2 Å²	76.2	16%	0.159	37%	0.367	C	S	.	.			trans	-134.5	158.4	175.1	-58.8	175.8	0	0	0	107.1	T53 V59 L63 K715	T53-I55 PolarHBondContact O-N 3.09Å; I55-V59 HydrophobicContact CG2-CB 3.92Å; I55-V59 HydrophobicContact CG2-CG1 3.76Å; I55-L63 HydrophobicContact CD1-CD1 4.33Å; I55-K715 HydrophobicContact CD1-CB 3.83Å; I55-K715 HydrophobicContact CD1-CD 4.12Å; I55-K715 HydrophobicContact CG1-CB 4.2Å
56	L	81.6	Confident	76.8	Confident	15 Å²	15	74.5 Å²	74.5	8%	0.079	36%	0.358	C	S	.	.			trans	-60.2	132.4	170	-71.5	174.7	0	0	0	110.7	W54 E58 V59 D60 V905 L906 A909	W54-L56 HydrophobicContact CH2-CD2 4.24Å; W54-L56 HydrophobicContact CZ2-CD2 4.23Å; L56-E58 VanDerWaalsContact C-N 3.29Å; L56-E58 PolarHBondContact O-N 3.36Å; L56-V59 HydrophobicContact CB-CB 4.16Å; L56-V59 HydrophobicContact CB-CG2 3.95Å; L56-V59 HydrophobicContact CD1-CG2 4.34Å; L56-V59 WeakPolarHBondContact O-CA 3.19Å; L56-V59 WeakPolarHBondContact O-CB 3.28Å; L56-V59 PolarHBondContact O-N 3.28Å; L56-D60 PolarHBondContact O-N 2.75Å; L56-V905 HydrophobicContact CD1-CG1 3.78Å; L56-V905 HydrophobicContact CD2-CG1 4.09Å; L56-V905 HydrophobicContact CG-CG1 3.83Å; L56-L906 HydrophobicContact CD2-CD2 4Å; L56-A909 HydrophobicContact CD1-CB 3.83Å; L56-A909 HydrophobicContact CD2-CB 4.21Å
57	P	80.1	Confident	76.9	Confident	99 Å²	99	78.9 Å²	78.9	64%	0.643	38%	0.379	S	S	*	.	H	α-helix	trans	-58.7	-35.6	-177.1	-28	35.7	0	0	0	114.6	V59 D60 Q61	P57-V59 VanDerWaalsContact C-N 3.28Å; P57-V59 PolarHBondContact O-N 3Å; P57-D60 PolarHBondContact O-N 2.92Å; P57-Q61 WeakPolarHBondContact O-CB 3.49Å; P57-Q61 PolarHBondContact O-N 2.88Å
58	E	79.3	Confident	76.9	Confident	85 Å²	85	77.9 Å²	77.9	40%	0.397	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-32.7	176	-59.9	-177.4	171	0	0	111.7	L56 R62 K913 K919	L56-E58 VanDerWaalsContact C-N 3.29Å; L56-E58 PolarHBondContact O-N 3.36Å; E58-R62 PolarHBondContact O-N 3.44Å; E58-K913 IonicContact OE1-NZ 3.98Å; E58-K913 PolarHBondContact OE1-NZ 2.98Å; E58-K919 WeakPolarHBondContact OE2-CE 3.35Å; E58-K919 IonicContact OE2-NZ 3.91Å; E58-K919 PolarHBondContact OE2-NZ 2.96Å
59	V	81.4	Confident	76.9	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.03	37%	0.373	C	S	.	.	H	α-helix	trans	-76.3	-45.9	176.2	174.8	0	0	0	0	110.5	I55 L56 P57 Q61 R62 L63 I718 V719 I721	I55-V59 HydrophobicContact CG2-CB 3.92Å; I55-V59 HydrophobicContact CG2-CG1 3.76Å; L56-V59 HydrophobicContact CB-CB 4.16Å; L56-V59 HydrophobicContact CB-CG2 3.95Å; L56-V59 HydrophobicContact CD1-CG2 4.34Å; L56-V59 WeakPolarHBondContact O-CA 3.19Å; L56-V59 WeakPolarHBondContact O-CB 3.28Å; L56-V59 PolarHBondContact O-N 3.28Å; P57-V59 VanDerWaalsContact C-N 3.28Å; P57-V59 PolarHBondContact O-N 3Å; V59-Q61 PolarHBondContact O-N 2.84Å; V59-R62 CarbonylContact O-C 3.59Å; V59-R62 WeakPolarHBondContact O-CA 3.3Å; V59-R62 WeakPolarHBondContact O-CB 3.48Å; V59-R62 PolarHBondContact O-N 3.24Å; V59-L63 WeakPolarHBondContact O-CG 3.16Å; V59-L63 PolarHBondContact O-N 2.8Å; V59-I718 HydrophobicContact CG1-CB 4.37Å; V59-I718 HydrophobicContact CG1-CG2 3.99Å; V59-V719 WeakPolarHBondContact CG2-O 3.39Å; V59-I721 HydrophobicContact CG1-CD1 3.66Å; V59-I721 HydrophobicContact CG1-CG1 4.18Å
60	D	83.9	Confident	76.8	Confident	69 Å²	69	69.2 Å²	69.2	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-58	-45.7	176.8	178.9	36.7	0	0	0	111.8	L56 P57 R62 L63 Q64	L56-D60 PolarHBondContact O-N 2.75Å; P57-D60 PolarHBondContact O-N 2.92Å; D60-R62 VanDerWaalsContact C-N 3.26Å; D60-R62 PolarHBondContact O-N 2.91Å; D60-L63 WeakPolarHBondContact O-CB 3.33Å; D60-L63 PolarHBondContact O-N 3.43Å; D60-L63 VanDerWaalsContact O-N 3.1Å; D60-Q64 WeakPolarHBondContact O-CG 3.47Å; D60-Q64 PolarHBondContact O-N 2.79Å; D60-Q64 PolarHBondContact OD1-NE2 2.8Å; D60-Q64 PolarHBondContact OD2-NE2 2.71Å
61	Q	82.7	Confident	76.9	Confident	118 Å²	118	69.9 Å²	69.9	55%	0.551	36%	0.359	S	S	*	.	H	α-helix	trans	-57.5	-38.8	172.8	-170.5	-178.7	29.9	0	0	112.2	P57 V59 Q64 Q65	P57-Q61 WeakPolarHBondContact O-CB 3.49Å; P57-Q61 PolarHBondContact O-N 2.88Å; V59-Q61 PolarHBondContact O-N 2.84Å; Q61-Q64 PolarHBondContact O-N 3.48Å; Q61-Q65 WeakPolarHBondContact O-CG 3.5Å; Q61-Q65 PolarHBondContact O-N 2.92Å; Q61-Q65 VanDerWaalsContact O-N 3.09Å
62	R	81.9	Confident	76.8	Confident	80 Å²	80	72.8 Å²	72.8	30%	0.302	38%	0.378	S	S	.	.	H	α-helix	trans	-71.1	-33.3	177.3	-166.4	55.4	159.8	-178.7	-6.1	112.5	E58 V59 D60 M66 I721	E58-R62 PolarHBondContact O-N 3.44Å; V59-R62 CarbonylContact O-C 3.59Å; V59-R62 WeakPolarHBondContact O-CA 3.3Å; V59-R62 WeakPolarHBondContact O-CB 3.48Å; V59-R62 PolarHBondContact O-N 3.24Å; D60-R62 VanDerWaalsContact C-N 3.26Å; D60-R62 PolarHBondContact O-N 2.91Å; R62-M66 WeakPolarHBondContact O-CG 3.44Å; R62-M66 PolarHBondContact O-N 3.46Å; R62-M66 VanDerWaalsContact O-N 3.11Å; R62-I721 HydrophobicContact CG-CB 4.33Å; R62-I721 HydrophobicContact CG-CG2 4.48Å
63	L	83.1	Confident	76.8	Confident	14 Å²	14	74.4 Å²	74.4	7%	0.073	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-47.5	171.9	-64.1	-170.8	0	0	0	111.3	I55 V59 D60 Q65 M66 E67 F708 I721	I55-L63 HydrophobicContact CD1-CD1 4.33Å; V59-L63 WeakPolarHBondContact O-CG 3.16Å; V59-L63 PolarHBondContact O-N 2.8Å; D60-L63 WeakPolarHBondContact O-CB 3.33Å; D60-L63 PolarHBondContact O-N 3.43Å; D60-L63 VanDerWaalsContact O-N 3.1Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 2.86Å; L63-M66 HydrophobicContact CD2-CE 3.59Å; L63-M66 PolarHBondContact O-N 3.46Å; L63-M66 VanDerWaalsContact O-N 3.09Å; L63-E67 PolarHBondContact O-N 3.05Å; L63-F708 HydrophobicContact CD1-CZ 4.05Å; L63-F708 HydrophobicContact CD2-CE1 4.21Å; L63-F708 HydrophobicContact CD2-CE2 3.78Å; L63-F708 HydrophobicContact CD2-CZ 3.31Å; L63-F708 HydrophobicContact CG-CZ 4.31Å; L63-I721 HydrophobicContact CD2-CD1 3.36Å; L63-I721 HydrophobicContact CG-CD1 4.25Å
64	Q	81.6	Confident	76.5	Confident	95 Å²	95	72.6 Å²	72.6	44%	0.444	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-44.3	177.8	-66.4	165.3	26.4	0	0	111.2	D60 Q61 M66 E67 E68	D60-Q64 WeakPolarHBondContact O-CG 3.47Å; D60-Q64 PolarHBondContact O-N 2.79Å; D60-Q64 PolarHBondContact OD1-NE2 2.8Å; D60-Q64 PolarHBondContact OD2-NE2 2.71Å; Q61-Q64 PolarHBondContact O-N 3.48Å; Q64-M66 PolarHBondContact O-N 3.49Å; Q64-E67 PolarHBondContact O-N 3.31Å; Q64-E68 WeakPolarHBondContact O-CG 3.37Å; Q64-E68 PolarHBondContact O-N 3.42Å
65	Q	81.3	Confident	75.9	Confident	69 Å²	69	76.5 Å²	76.5	32%	0.322	39%	0.391	S	S	.	.	H	α-helix	trans	-57.6	-43.9	173	-72.2	170.2	7.3	0	0	113	Q61 L63 E68 E69	Q61-Q65 WeakPolarHBondContact O-CG 3.5Å; Q61-Q65 PolarHBondContact O-N 2.92Å; Q61-Q65 VanDerWaalsContact O-N 3.09Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 2.86Å; Q65-E68 PolarHBondContact O-N 3.36Å; Q65-E69 WeakPolarHBondContact O-CB 3.45Å; Q65-E69 PolarHBondContact O-N 3.03Å
66	M	77.9	Confident	75.1	Confident	63 Å²	63	82.4 Å²	82.4	31%	0.31	42%	0.415	S	S	.	.	H	α-helix	trans	-65.5	-37.9	177.7	-71	-163.1	-57.8	0	0	112.6	R62 L63 Q64 G70 I721	R62-M66 WeakPolarHBondContact O-CG 3.44Å; R62-M66 PolarHBondContact O-N 3.46Å; R62-M66 VanDerWaalsContact O-N 3.11Å; L63-M66 HydrophobicContact CD2-CE 3.59Å; L63-M66 PolarHBondContact O-N 3.46Å; L63-M66 VanDerWaalsContact O-N 3.09Å; Q64-M66 PolarHBondContact O-N 3.49Å; M66-G70 PolarHBondContact O-N 3.48Å; M66-I721 HydrophobicContact CE-CG2 4.08Å; M66-I721 HydrophobicContact SD-CG2 4.26Å
67	E	78.4	Confident	74.3	Confident	146 Å²	146	89 Å²	89	68%	0.682	44%	0.444	S	S	*	.	H	α-helix	trans	-67.6	-42.7	175.6	-69.9	-171.5	-176.6	0	0	111.7	L63 Q64 G70 S71	L63-E67 PolarHBondContact O-N 3.05Å; Q64-E67 PolarHBondContact O-N 3.31Å; E67-G70 PolarHBondContact O-N 3.32Å; E67-S71 PolarHBondContact O-N 2.99Å
68	E	76.3	Confident	73.6	Confident	134 Å²	134	92.2 Å²	92.2	63%	0.626	45%	0.448	S	S	*	.	H	α-helix	trans	-60.5	-49.9	173.9	-74.9	-170.2	163.4	0	0	112	Q64 Q65 G70 S71 V72	Q64-E68 WeakPolarHBondContact O-CG 3.37Å; Q64-E68 PolarHBondContact O-N 3.42Å; Q65-E68 PolarHBondContact O-N 3.36Å; E68-G70 VanDerWaalsContact C-N 3.33Å; E68-G70 PolarHBondContact O-N 3.1Å; E68-S71 WeakPolarHBondContact O-CA 3.33Å; E68-S71 WeakPolarHBondContact O-CB 3.48Å; E68-S71 PolarHBondContact O-N 3.12Å; E68-S71 VanDerWaalsContact O-N 3.08Å; E68-S71 PolarHBondContact O-OG 2.83Å; E68-V72 WeakPolarHBondContact O-CG2 3.16Å; E68-V72 PolarHBondContact O-N 2.91Å
69	E	72.1	Confident	73.1	Confident	94 Å²	94	92.6 Å²	92.6	44%	0.439	45%	0.449	S	S	.	.	H	α-helix	trans	-57.2	-44.3	174.6	-86.2	-160	-126.1	0	0	111.9	Q65 S71 V72 K73	Q65-E69 WeakPolarHBondContact O-CB 3.45Å; Q65-E69 PolarHBondContact O-N 3.03Å; E69-S71 VanDerWaalsContact C-N 3.31Å; E69-S71 PolarHBondContact O-N 3.33Å; E69-V72 PolarHBondContact O-N 3.25Å; E69-K73 WeakPolarHBondContact O-CB 3.27Å; E69-K73 WeakPolarHBondContact O-CD 3.32Å; E69-K73 WeakPolarHBondContact O-CG 3.3Å; E69-K73 PolarHBondContact O-N 3.32Å; E69-K73 WeakPolarHBondContact OE2-CE 3.23Å; E69-K73 IonicContact OE2-NZ 2.99Å; E69-K73 PolarHBondContact OE2-NZ 3.42Å
70	G	67.4	Low	72.4	Confident	38 Å²	38	100.3 Å²	100.3	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-58.3	-43.9	173.6	0	0	0	0	0	111.7	M66 E67 E68 K73 S74	M66-G70 PolarHBondContact O-N 3.48Å; E67-G70 PolarHBondContact O-N 3.32Å; E68-G70 VanDerWaalsContact C-N 3.33Å; E68-G70 PolarHBondContact O-N 3.1Å; G70-K73 PolarHBondContact O-N 2.94Å; G70-S74 WeakPolarHBondContact O-CB 3.41Å; G70-S74 PolarHBondContact O-N 2.96Å
71	S	65.7	Low	71.5	Confident	38 Å²	38	104.7 Å²	104.7	27%	0.266	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-46.1	175.6	99.8	0	0	0	0	111.3	E67 E68 E69 S74 K75	E67-S71 PolarHBondContact O-N 2.99Å; E68-S71 WeakPolarHBondContact O-CA 3.33Å; E68-S71 WeakPolarHBondContact O-CB 3.48Å; E68-S71 PolarHBondContact O-N 3.12Å; E68-S71 VanDerWaalsContact O-N 3.08Å; E68-S71 PolarHBondContact O-OG 2.83Å; E69-S71 VanDerWaalsContact C-N 3.31Å; E69-S71 PolarHBondContact O-N 3.33Å; S71-S74 PolarHBondContact O-N 3.06Å; S71-S74 PolarHBondContact O-OG 2.63Å; S71-K75 WeakPolarHBondContact O-CD 3.1Å; S71-K75 VanDerWaalsContact O-CG 3.25Å; S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 2.68Å; S71-K75 PolarHBondContact OG-NZ 2.79Å
72	V	64.9	Low	70.7	Confident	85 Å²	85	102.2 Å²	102.2	52%	0.515	49%	0.494	S	S	.	.	H	α-helix	trans	-67.5	-44	-178.9	172.8	0	0	0	0	110.9	E68 E69 S74 K75 K76	E68-V72 WeakPolarHBondContact O-CG2 3.16Å; E68-V72 PolarHBondContact O-N 2.91Å; E69-V72 PolarHBondContact O-N 3.25Å; V72-S74 VanDerWaalsContact C-N 3.3Å; V72-S74 PolarHBondContact O-N 3.03Å; V72-K75 PolarHBondContact O-N 3.08Å; V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 2.92Å
73	K	63.3	Low	70.1	Confident	127 Å²	127	104.6 Å²	104.6	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-39.8	174.1	-70.3	164.3	-170.3	170.3	0	110.9	E69 G70 K77	E69-K73 WeakPolarHBondContact O-CB 3.27Å; E69-K73 WeakPolarHBondContact O-CD 3.32Å; E69-K73 WeakPolarHBondContact O-CG 3.3Å; E69-K73 PolarHBondContact O-N 3.32Å; E69-K73 WeakPolarHBondContact OE2-CE 3.23Å; E69-K73 IonicContact OE2-NZ 2.99Å; E69-K73 PolarHBondContact OE2-NZ 3.42Å; G70-K73 PolarHBondContact O-N 2.94Å; K73-K77 VanDerWaalsContact O-CB 3.28Å; K73-K77 WeakPolarHBondContact O-CB 3.49Å; K73-K77 PolarHBondContact O-N 3.28Å
74	S	61.2	Low	69.4	Low	69 Å²	69	111.1 Å²	111.1	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-67.6	-44.7	176	82.2	0	0	0	0	113	G70 S71 V72 K76 K77 K78	G70-S74 WeakPolarHBondContact O-CB 3.41Å; G70-S74 PolarHBondContact O-N 2.96Å; S71-S74 PolarHBondContact O-N 3.06Å; S71-S74 PolarHBondContact O-OG 2.63Å; V72-S74 VanDerWaalsContact C-N 3.3Å; V72-S74 PolarHBondContact O-N 3.03Å; S74-K76 PolarHBondContact O-N 3.36Å; S74-K77 PolarHBondContact O-N 3.15Å; S74-K78 WeakPolarHBondContact O-CB 3.43Å; S74-K78 PolarHBondContact O-N 2.92Å
75	K	67.6	Low	68.8	Low	132 Å²	132	114.8 Å²	114.8	57%	0.574	55%	0.549	S	S	*	.	H	α-helix	trans	-57.1	-50.6	175.4	-71.2	158.9	-176.5	160.5	0	110.5	S71 V72 K77 K78 E79	S71-K75 WeakPolarHBondContact O-CD 3.1Å; S71-K75 VanDerWaalsContact O-CG 3.25Å; S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 2.68Å; S71-K75 PolarHBondContact OG-NZ 2.79Å; V72-K75 PolarHBondContact O-N 3.08Å; K75-K77 VanDerWaalsContact C-N 3.35Å; K75-K77 PolarHBondContact O-N 2.91Å; K75-K78 WeakPolarHBondContact O-CB 3.45Å; K75-K78 PolarHBondContact O-N 2.82Å; K75-E79 PolarHBondContact O-N 2.89Å
76	K	64.7	Low	68.3	Low	155 Å²	155	119.1 Å²	119.1	67%	0.674	57%	0.566	S	S	*	*	H	α-helix	trans	-62.6	-35.7	177.5	-161.4	169.1	-173.2	171.8	0	112.7	V72 S74 K80	V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 2.92Å; S74-K76 PolarHBondContact O-N 3.36Å; K76-K80 WeakPolarHBondContact O-CB 3.44Å; K76-K80 PolarHBondContact O-N 2.89Å
77	K	65.2	Low	67.7	Low	154 Å²	154	122.6 Å²	122.6	67%	0.67	58%	0.582	S	S	*	*	H	α-helix	trans	-69.8	-39.2	174.5	-167.3	177	-173.5	178.4	0	112.3	K73 S74 K75 K80 K81	K73-K77 VanDerWaalsContact O-CB 3.28Å; K73-K77 WeakPolarHBondContact O-CB 3.49Å; K73-K77 PolarHBondContact O-N 3.28Å; S74-K77 PolarHBondContact O-N 3.15Å; K75-K77 VanDerWaalsContact C-N 3.35Å; K75-K77 PolarHBondContact O-N 2.91Å; K77-K80 PolarHBondContact O-N 3.5Å; K77-K81 PolarHBondContact O-N 2.9Å
78	K	66.8	Low	67.2	Low	167 Å²	167	123.2 Å²	123.2	73%	0.726	58%	0.582	S	S	*	*	H	α-helix	trans	-63.7	-43	174.4	-168.5	174.2	-177.9	177.2	0	111	S74 K75 K81 S82	S74-K78 WeakPolarHBondContact O-CB 3.43Å; S74-K78 PolarHBondContact O-N 2.92Å; K75-K78 WeakPolarHBondContact O-CB 3.45Å; K75-K78 PolarHBondContact O-N 2.82Å; K78-K81 PolarHBondContact O-N 3.49Å; K78-S82 PolarHBondContact O-N 3.41Å
79	E	67.1	Low	66.8	Low	92 Å²	92	124.8 Å²	124.8	43%	0.43	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-42.4	175.9	-159.2	-151.7	141.3	0	0	112.9	K75 K81 S82 K83	K75-E79 PolarHBondContact O-N 2.89Å; E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.87Å; E79-S82 PolarHBondContact O-N 3.4Å; E79-S82 PolarHBondContact O-OG 3.04Å; E79-K83 WeakPolarHBondContact O-CB 3.39Å; E79-K83 PolarHBondContact O-N 3.07Å; E79-K83 WeakPolarHBondContact OE1-CE 3.47Å; E79-K83 IonicContact OE1-NZ 3.12Å; E79-K83 PolarHBondContact OE1-NZ 2.76Å
80	K	67.9	Low	66.6	Low	168 Å²	168	127.9 Å²	127.9	73%	0.73	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-34.7	175.3	-162.4	169.3	-175.6	175.3	0	112	K76 K77 K84	K76-K80 WeakPolarHBondContact O-CB 3.44Å; K76-K80 PolarHBondContact O-N 2.89Å; K77-K80 PolarHBondContact O-N 3.5Å; K80-K84 WeakPolarHBondContact O-CB 3.28Å; K80-K84 PolarHBondContact O-N 3.47Å; K80-K84 VanDerWaalsContact O-N 3.12Å
81	K	63.9	Low	66.4	Low	160 Å²	160	132.5 Å²	132.5	70%	0.696	61%	0.609	S	S	*	*	H	α-helix	trans	-64.5	-43.9	169.5	-89.3	-169	173	-172.6	0	112.1	K77 K78 E79 K84 K85	K77-K81 PolarHBondContact O-N 2.9Å; K78-K81 PolarHBondContact O-N 3.49Å; E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.87Å; K81-K84 PolarHBondContact O-N 3.18Å; K81-K85 PolarHBondContact O-N 2.86Å
82	S	65.8	Low	66.4	Low	67 Å²	67	135.6 Å²	135.6	47%	0.469	62%	0.621	S	S	.	*	H	α-helix	trans	-68.3	-41.3	-179.5	72.5	0	0	0	0	112.3	K78 E79 K85 K86	K78-S82 PolarHBondContact O-N 3.41Å; E79-S82 PolarHBondContact O-N 3.4Å; E79-S82 PolarHBondContact O-OG 3.04Å; S82-K85 PolarHBondContact O-N 2.84Å; S82-K86 WeakPolarHBondContact O-CB 3.38Å; S82-K86 PolarHBondContact O-N 2.88Å
83	K	70.4	Confident	66.2	Low	129 Å²	129	139.4 Å²	139.4	56%	0.561	63%	0.631	S	S	*	*	H	α-helix	trans	-56.5	-51.4	171.3	-79.1	173.7	167.4	169.4	0	111.4	E79 K85 K86 E87	E79-K83 WeakPolarHBondContact O-CB 3.39Å; E79-K83 PolarHBondContact O-N 3.07Å; E79-K83 WeakPolarHBondContact OE1-CE 3.47Å; E79-K83 IonicContact OE1-NZ 3.12Å; E79-K83 PolarHBondContact OE1-NZ 2.76Å; K83-K85 VanDerWaalsContact C-N 3.33Å; K83-K85 PolarHBondContact O-N 2.94Å; K83-K86 PolarHBondContact O-N 2.73Å; K83-K86 VanDerWaalsContact O-N 3.15Å; K83-E87 WeakPolarHBondContact O-CB 3.41Å; K83-E87 PolarHBondContact O-N 3.45Å
84	K	68	Low	65.9	Low	151 Å²	151	141.2 Å²	141.2	66%	0.657	64%	0.638	S	S	*	*	H	α-helix	trans	-63.2	-32.4	177.8	-166.2	168.3	-175.8	173.2	0	113.5	K80 K81 K88	K80-K84 WeakPolarHBondContact O-CB 3.28Å; K80-K84 PolarHBondContact O-N 3.47Å; K80-K84 VanDerWaalsContact O-N 3.12Å; K81-K84 PolarHBondContact O-N 3.18Å; K84-K88 PolarHBondContact O-N 2.91Å
85	K	69.6	Low	65.4	Low	172 Å²	172	142.6 Å²	142.6	75%	0.748	64%	0.637	S	S	*	*	H	α-helix	trans	-70.1	-40.9	173.2	-167.9	173.7	-177.7	177.9	0	111.9	K81 S82 K83 E87 K89	K81-K85 PolarHBondContact O-N 2.86Å; S82-K85 PolarHBondContact O-N 2.84Å; K83-K85 VanDerWaalsContact C-N 3.33Å; K83-K85 PolarHBondContact O-N 2.94Å; K85-E87 VanDerWaalsContact C-N 3.32Å; K85-K89 PolarHBondContact O-N 3.24Å
86	K	69.1	Low	64.7	Low	160 Å²	160	144.2 Å²	144.2	70%	0.696	64%	0.644	S	S	*	*	H	α-helix	trans	-65.1	-36.4	175.6	-165.4	170.6	-174.7	174.2	0	111.7	S82 K83 K90	S82-K86 WeakPolarHBondContact O-CB 3.38Å; S82-K86 PolarHBondContact O-N 2.88Å; K83-K86 PolarHBondContact O-N 2.73Å; K83-K86 VanDerWaalsContact O-N 3.15Å; K86-K90 PolarHBondContact O-N 2.96Å
87	E	67.1	Low	63.9	Low	136 Å²	136	145.4 Å²	145.4	64%	0.636	65%	0.65	S	S	*	*	H	α-helix	trans	-69.4	-48.3	176.6	-169.3	169.3	-121.6	0	0	112.7	K83 K85 K89 K90 K91	K83-E87 WeakPolarHBondContact O-CB 3.41Å; K83-E87 PolarHBondContact O-N 3.45Å; K85-E87 VanDerWaalsContact C-N 3.32Å; E87-K89 VanDerWaalsContact C-N 3.31Å; E87-K89 PolarHBondContact O-N 2.93Å; E87-K90 WeakPolarHBondContact O-CB 3.39Å; E87-K90 PolarHBondContact O-N 3.48Å; E87-K90 VanDerWaalsContact O-N 3.12Å; E87-K91 PolarHBondContact O-N 3.25Å
88	K	66.5	Low	62.8	Low	159 Å²	159	142.5 Å²	142.5	69%	0.691	65%	0.654	S	S	*	*	H	α-helix	trans	-56	-43.7	170.6	-105.3	-161.7	172.6	-164.1	0	111.9	K84 K90 K91 I92	K84-K88 PolarHBondContact O-N 2.91Å; K88-K90 VanDerWaalsContact C-N 3.33Å; K88-K90 PolarHBondContact O-N 3Å; K88-K91 PolarHBondContact O-N 2.99Å; K88-I92 WeakPolarHBondContact O-CG1 3.4Å; K88-I92 PolarHBondContact O-N 2.88Å; K88-I92 VanDerWaalsContact O-N 3.14Å
89	K	68.3	Low	61.5	Low	167 Å²	167	143 Å²	143	73%	0.726	66%	0.659	S	S	*	*	H	α-helix	trans	-66.9	-31.5	178.2	-161.3	171.9	-175.1	178.9	0	112.5	K85 E87 K93	K85-K89 PolarHBondContact O-N 3.24Å; E87-K89 VanDerWaalsContact C-N 3.31Å; E87-K89 PolarHBondContact O-N 2.93Å; K89-K93 WeakPolarHBondContact O-CB 3.46Å; K89-K93 PolarHBondContact O-N 3Å
90	K	68.4	Low	60.1	Low	160 Å²	160	147.1 Å²	147.1	70%	0.696	68%	0.678	S	S	*	*	H	α-helix	trans	-66.8	-40.9	169.5	-91.3	-165.8	171.8	-168.5	0	112.6	K86 E87 K88 K93 K94	K86-K90 PolarHBondContact O-N 2.96Å; E87-K90 WeakPolarHBondContact O-CB 3.39Å; E87-K90 PolarHBondContact O-N 3.48Å; E87-K90 VanDerWaalsContact O-N 3.12Å; K88-K90 VanDerWaalsContact C-N 3.33Å; K88-K90 PolarHBondContact O-N 3Å; K90-K93 CarbonylContact O-C 3.58Å; K90-K93 PolarHBondContact O-N 2.93Å; K90-K94 PolarHBondContact O-N 3.42Å
91	K	63.3	Low	58.3	Low	135 Å²	135	142.7 Å²	142.7	59%	0.587	68%	0.68	S	S	*	*	H	α-helix	trans	-65.5	-48.3	-178.4	-152	-169.2	-179.4	-121.9	0	111.8	E87 K88 K93 K94 E95	E87-K91 PolarHBondContact O-N 3.25Å; K88-K91 PolarHBondContact O-N 2.99Å; K91-K93 VanDerWaalsContact C-N 3.29Å; K91-K93 PolarHBondContact O-N 3.49Å; K91-K94 WeakPolarHBondContact O-CA 3.18Å; K91-K94 WeakPolarHBondContact O-CB 3.31Å; K91-K94 PolarHBondContact O-N 3.01Å; K91-E95 WeakPolarHBondContact CD-OE1 3.36Å; K91-E95 VanDerWaalsContact CE-OE1 3.25Å; K91-E95 WeakPolarHBondContact CE-OE1 3.3Å; K91-E95 IonicContact NZ-OE1 3.91Å; K91-E95 PolarHBondContact NZ-OE1 2.62Å; K91-E95 PolarHBondContact O-N 2.85Å
92	I	66.1	Low	56.6	Low	102 Å²	102	143.2 Å²	143.2	52%	0.523	69%	0.691	S	S	.	*	H	α-helix	trans	-58.3	-40.2	175.1	-62.9	164.1	0	0	0	111.2	K88 K94 E95 K96	K88-I92 WeakPolarHBondContact O-CG1 3.4Å; K88-I92 PolarHBondContact O-N 2.88Å; K88-I92 VanDerWaalsContact O-N 3.14Å; I92-K94 VanDerWaalsContact C-N 3.27Å; I92-K94 PolarHBondContact O-N 2.72Å; I92-E95 PolarHBondContact O-N 2.81Å; I92-K96 WeakPolarHBondContact O-CB 3.44Å; I92-K96 PolarHBondContact O-N 3.14Å
93	K	60.8	Low	54.8	Low	166 Å²	166	143 Å²	143	72%	0.722	70%	0.699	S	S	*	*	H	α-helix	trans	-76	-6.5	175.8	-164.1	167	-176.6	176.8	0	114	K89 K90 K91	K89-K93 WeakPolarHBondContact O-CB 3.46Å; K89-K93 PolarHBondContact O-N 3Å; K90-K93 CarbonylContact O-C 3.58Å; K90-K93 PolarHBondContact O-N 2.93Å; K91-K93 VanDerWaalsContact C-N 3.29Å; K91-K93 PolarHBondContact O-N 3.49Å
94	K	55.9	Low	52.7	Low	164 Å²	164	143.1 Å²	143.1	71%	0.713	72%	0.716	S	S	*	*	H	α-helix	trans	-93.4	-39.9	168.5	-166.4	-178.2	-179.5	-172.6	0	111.2	K90 K91 I92 K97	K90-K94 PolarHBondContact O-N 3.42Å; K91-K94 WeakPolarHBondContact O-CA 3.18Å; K91-K94 WeakPolarHBondContact O-CB 3.31Å; K91-K94 PolarHBondContact O-N 3.01Å; I92-K94 VanDerWaalsContact C-N 3.27Å; I92-K94 PolarHBondContact O-N 2.72Å; K94-K97 PolarHBondContact O-N 2.99Å
95	E	50.3	Low	50.7	Low	98 Å²	98	140.9 Å²	140.9	46%	0.458	72%	0.719	S	S	.	*	H	α-helix	trans	-59.6	-50.7	172.9	-72.5	150.6	176.6	0	0	109.7	K91 I92 K97 A98	K91-E95 WeakPolarHBondContact CD-OE1 3.36Å; K91-E95 VanDerWaalsContact CE-OE1 3.25Å; K91-E95 WeakPolarHBondContact CE-OE1 3.3Å; K91-E95 IonicContact NZ-OE1 3.91Å; K91-E95 PolarHBondContact NZ-OE1 2.62Å; K91-E95 PolarHBondContact O-N 2.85Å; I92-E95 PolarHBondContact O-N 2.81Å; E95-K97 PolarHBondContact O-N 3.35Å; E95-A98 PolarHBondContact O-N 3.11Å
96	K	53.7	Low	48.6	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	4.3	170.5	-88.2	-144.5	170.2	-149.2	0	116.4	I92	I92-K96 WeakPolarHBondContact O-CB 3.44Å; I92-K96 PolarHBondContact O-N 3.14Å
97	K	48	Very low	46.4	Very low	180 Å²	180	138.4 Å²	138.4	78%	0.783	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	18	178.2	-138.7	-164.6	-175.4	-152	0	113.6	K94 E95	K94-K97 PolarHBondContact O-N 2.99Å; E95-K97 PolarHBondContact O-N 3.35Å
98	A	41.8	Very low	44.3	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	72%	0.724	S	S	*	*	S	Bend	trans	-111.2	-0.6	174.9	0	0	0	0	0	113.2	E95	E95-A98 PolarHBondContact O-N 3.11Å
99	E	39.6	Very low	42.3	Very low	176 Å²	176	136.8 Å²	136.8	82%	0.822	73%	0.73	S	S	*	*	S	Bend	trans	-118.9	-5.3	-166.3	-157.1	162.4	-137.6	0	0	113.5
100	E	37.4	Very low	40.2	Very low	179 Å²	179	135 Å²	135	84%	0.836	73%	0.729	S	S	*	*			trans	-119.4	116.8	175.3	-70.1	176.7	150.6	0	0	109.6
101	G	31	Very low	38.2	Very low	75 Å²	75	131.7 Å²	131.7	77%	0.773	73%	0.725	S	S	*	*			trans	-155.5	22.2	-165	0	0	0	0	0	117.1
102	N	28.3	Very low	36.4	Very low	172 Å²	172	133.5 Å²	133.5	92%	0.92	74%	0.736	S	S	*	*			trans	-173.2	137.6	161.5	-114	-5	0	0	0	108.9
103	G	27.8	Very low	34.7	Very low	62 Å²	62	135.6 Å²	135.6	64%	0.639	74%	0.743	S	S	*	*			cis	165.6	121	-11	0	0	0	0	0	111.8
104	S	26.6	Very low	33.1	Very low	132 Å²	132	132.9 Å²	132.9	92%	0.923	73%	0.733	S	S	*	*			trans	62.2	159.8	-177.3	-68.7	0	0	0	0	115
105	S	26.1	Very low	31.8	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	74%	0.743	S	S	*	*			cis	-155.5	160.3	-27.4	-159.6	0	0	0	0	103.8
106	E	24.2	Very low	30.8	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.794	75%	0.753	S	S	*	*			cis	-176.2	167.6	41.4	56.3	-153.6	118.3	0	0	111.7
107	S	23.4	Very low	29.8	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	76%	0.762	S	S	*	*			trans	66.2	128.6	153.5	-145.8	0	0	0	0	123.6
108	S	23.7	Very low	29	Very low	88 Å²	88	134.3 Å²	134.3	62%	0.615	76%	0.761	S	S	*	*			trans	55.2	140.8	149.9	-113.5	0	0	0	0	124.5
109	Q	24.3	Very low	28.4	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	77%	0.765	S	S	*	*			trans	40.4	158.3	132.6	-69.5	177.1	-81.3	0	0	122.2
110	D	23.8	Very low	28.1	Very low	131 Å²	131	135.2 Å²	135.2	70%	0.701	76%	0.758	S	S	*	*			cis	178.3	157.6	-22	-169.3	20	0	0	0	106.3
111	S	25.7	Very low	27.8	Very low	89 Å²	89	135.4 Å²	135.4	62%	0.622	76%	0.759	S	S	*	*			trans	60.7	157.7	174.5	-60.9	0	0	0	0	116.8
112	E	25.1	Very low	28.5	Very low	173 Å²	173	136.8 Å²	136.8	81%	0.808	76%	0.755	S	S	*	*			cis	86	141.3	22.1	-64.5	-177.1	165	0	0	116.9
113	E	31.7	Very low	28.4	Very low	146 Å²	146	135.4 Å²	135.4	68%	0.682	75%	0.752	S	S	*	*			cis	-85.2	-106.4	-22.6	-80.1	-145.4	82.7	0	0	110.1	K503	E113-K503 IonicContact OE2-NZ 3.78Å; E113-K503 PolarHBondContact OE2-NZ 2.76Å
114	E	25.8	Very low	28.6	Very low	110 Å²	110	141.6 Å²	141.6	51%	0.514	76%	0.761	S	S	.	*			cis	-159.6	-170.7	-22.7	-161.4	63.6	-71.9	0	0	106.3	K503	E114-K503 VanDerWaalsContact CD-NZ 3.34Å; E114-K503 IonicContact OE1-NZ 3.59Å; E114-K503 PolarHBondContact OE1-NZ 2.75Å; E114-K503 IonicContact OE2-NZ 2.67Å; E114-K503 PolarHBondContact OE2-NZ 3.44Å
115	W	28.6	Very low	28.7	Very low	240 Å²	240	139.9 Å²	139.9	91%	0.909	76%	0.755	S	S	*	*			trans	-137.7	126.6	173.1	-98.7	64.1	0	0	0	111
116	V	29.3	Very low	28.7	Very low	113 Å²	113	147.3 Å²	147.3	69%	0.685	77%	0.767	S	S	*	*			trans	-106.1	129.5	169.7	178	0	0	0	0	109
117	E	33.9	Very low	28.9	Very low	195 Å²	195	148.9 Å²	148.9	91%	0.911	77%	0.772	S	S	*	*			trans	-87.4	127.9	177.7	-168.9	150.5	-139	0	0	110.6
118	A	31	Very low	29.2	Very low	91 Å²	91	151.6 Å²	151.6	75%	0.752	78%	0.777	S	S	*	*			trans	-130.4	119	-169.5	0	0	0	0	0	113
119	Q	29.8	Very low	29.7	Very low	181 Å²	181	153.2 Å²	153.2	85%	0.846	79%	0.785	S	S	*	*			trans	-62.6	149.6	174.5	-76.4	-88.1	-8.1	0	0	112.8
120	P	33.4	Very low	29.9	Very low	106 Å²	106	149.8 Å²	149.8	69%	0.688	79%	0.786	S	S	*	*			trans	-82.1	138.3	-177.6	32.7	-34.4	0	0	0	113.6
121	Q	29.8	Very low	30.2	Very low	183 Å²	183	152.2 Å²	152.2	86%	0.855	79%	0.793	S	S	*	*			trans	-129.9	150.4	161.6	-81.1	-67.8	-40.3	0	0	111.2
122	P	45.1	Very low	31	Very low	105 Å²	105	153.5 Å²	153.5	68%	0.682	80%	0.8	S	S	*	*			trans	-110.7	141.9	-155.7	38.5	-31.6	0	0	0	115.8
123	V	28.1	Very low	31.2	Very low	142 Å²	142	154.9 Å²	154.9	86%	0.861	80%	0.803	S	S	*	*			trans	-139.9	99.7	163.4	-89.7	0	0	0	0	114.5
124	K	30.7	Very low	31.2	Very low	192 Å²	192	152.5 Å²	152.5	84%	0.835	81%	0.808	S	S	*	*			trans	31.4	100.4	137.8	-65.6	171.7	-177.9	169	0	119.5
125	A	29.3	Very low	31.2	Very low	96 Å²	96	152.4 Å²	152.4	79%	0.793	82%	0.82	S	S	*	*				44.4	113.7	115.9	0	0	0	0	0	120.1
126	W	25.9	Very low	31.1	Very low	259 Å²	259	150.6 Å²	150.6	98%	0.981	82%	0.821	S	S	*	*			trans	-117	147.8	156	-79.6	65.6	0	0	0	110.3
127	K	29	Very low	31.1	Very low	203 Å²	203	149 Å²	149	88%	0.883	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-102.2	150.8	-169.9	-64.5	179	-179.8	177.8	0	112.4
128	L	29.3	Very low	30.8	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75.3	152.3	162.4	-72	169.1	0	0	0	111
129	P	33.9	Very low	30.8	Very low	122 Å²	122	148 Å²	148	79%	0.792	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.1	164.3	-177.6	32.3	-36.3	0	0	0	113.4
130	A	28.9	Very low	30.8	Very low	101 Å²	101	144.8 Å²	144.8	84%	0.835	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-96.7	157.7	-173.3	0	0	0	0	0	114.4
131	Q	29.6	Very low	31.1	Very low	181 Å²	181	145.7 Å²	145.7	85%	0.846	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-100.5	156.8	163.8	-75.5	-77.7	9.2	0	0	110.4
132	P	41.8	Very low	31.1	Very low	116 Å²	116	141.2 Å²	141.2	75%	0.753	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-84	170.2	178.4	34.3	-33.1	0	0	0	114.1
133	K	30.1	Very low	30.6	Very low	203 Å²	203	144.6 Å²	144.6	88%	0.883	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-87.8	172.4	-179.1	-62.8	175.5	-178.1	179.4	0	111.9
134	A	30.9	Very low	31.1	Very low	95 Å²	95	145.6 Å²	145.6	79%	0.785	83%	0.828	S	S	*	*			cis	175.3	153.7	-32.4	0	0	0	0	0	108.2
135	S	26.4	Very low	31.5	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	83%	0.826	S	S	*	*			trans	-166.1	122.4	164.9	56.1	0	0	0	0	114.1
136	E	27.7	Very low	32.1	Very low	202 Å²	202	146.7 Å²	146.7	94%	0.944	83%	0.828	S	S	*	*			trans	45	149.9	138.9	-54	-176.9	175.7	0	0	123.1
137	G	29	Very low	33.2	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	82%	0.816	S	S	*	*			trans	133.6	78.5	159.2	0	0	0	0	0	118.2
138	S	28.1	Very low	34.4	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	80%	0.799	S	S	*	*			trans	-49.3	146.3	174.1	53.6	0	0	0	0	118.5
139	L	29.3	Very low	35.4	Very low	160 Å²	160	138.4 Å²	138.4	84%	0.838	79%	0.794	S	S	*	*				150.2	107.7	123.6	-80.4	175.7	0	0	0	115.6
140	S	29.7	Very low	36.4	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	79%	0.789	S	S	*	*			trans	63.1	168.3	142.1	105.5	0	0	0	0	118.8
141	P	39.9	Very low	37.1	Very low	125 Å²	125	141 Å²	141	81%	0.812	77%	0.772	S	S	*	*				-114.1	143.2	-123.2	38.6	-28.1	0	0	0	115.8
142	A	29.8	Very low	38.3	Very low	89 Å²	89	137.4 Å²	137.4	74%	0.736	76%	0.763	S	S	*	*			trans	-142.3	148.6	170.6	0	0	0	0	0	111.7
143	E	36	Very low	38.3	Very low	175 Å²	175	138.8 Å²	138.8	82%	0.818	76%	0.757	S	S	*	*			trans	61.6	81	158	-66.6	170.6	-155.3	0	0	118.3	V145	E143-V145 PolarHBondContact O-N 2.63Å; E143-V145 VanDerWaalsContact O-N 3.13Å
144	D	36.8	Very low	39.1	Very low	164 Å²	164	134.4 Å²	134.4	88%	0.877	74%	0.743	S	S	*	*			trans	-59.3	106.7	144.9	-97.5	-40.9	0	0	0	109	Q146	D144-Q146 VanDerWaalsContact C-N 3.31Å; D144-Q146 PolarHBondContact O-N 3.4Å
145	V	40.9	Very low	39.9	Very low	131 Å²	131	137.9 Å²	137.9	79%	0.794	74%	0.741	S	S	*	*			trans	-72.4	89.5	170.5	-179.2	0	0	0	0	108.4	E143 R147	E143-V145 PolarHBondContact O-N 2.63Å; E143-V145 VanDerWaalsContact O-N 3.13Å; V145-R147 PolarHBondContact O-N 2.77Å
146	Q	41.8	Very low	41.2	Very low	179 Å²	179	140.6 Å²	140.6	84%	0.836	75%	0.746	S	S	*	*			trans	-57.5	111.7	171.3	-76.1	-166.8	-37.3	0	0	109.7	D144 D148	D144-Q146 VanDerWaalsContact C-N 3.31Å; D144-Q146 PolarHBondContact O-N 3.4Å; Q146-D148 PolarHBondContact O-N 2.65Å
147	R	48.5	Very low	42.6	Very low	189 Å²	189	134.7 Å²	134.7	71%	0.713	73%	0.732	S	S	*	*			trans	-70.4	125.8	174.7	-164.3	-177	-158.9	91.2	-2.6	108.4	V145 M151	V145-R147 PolarHBondContact O-N 2.77Å; R147-M151 HydrophobicContact CG-CE 3.92Å
148	D	53.8	Low	43.4	Very low	98 Å²	98	136.6 Å²	136.6	52%	0.524	72%	0.721	S	S	.	*			trans	-46.1	137.8	-169.7	-54.7	-39.1	0	0	0	114.4	Q146 W150 M151	Q146-D148 PolarHBondContact O-N 2.65Å; D148-W150 HydrophobicContact CB-CG 4.29Å; D148-W150 PolarHBondContact O-N 3.14Å; D148-W150 PolarHBondContact OD2-NE1 2.88Å; D148-M151 PolarHBondContact O-N 3.24Å
149	E	50.2	Low	44.4	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-12.3	-177	-58	-177	134.2	0	0	114.8	M151 T152	E149-M151 VanDerWaalsContact C-N 3.31Å; E149-T152 WeakPolarHBondContact CA-OG1 3.34Å; E149-T152 PolarHBondContact O-N 2.71Å; E149-T152 PolarHBondContact O-OG1 3.41Å
150	W	54.9	Low	45.3	Very low	181 Å²	181	139.7 Å²	139.7	69%	0.686	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-18.9	174.2	74.2	-92.1	0	0	0	113.3	D148	D148-W150 HydrophobicContact CB-CG 4.29Å; D148-W150 PolarHBondContact O-N 3.14Å; D148-W150 PolarHBondContact OD2-NE1 2.88Å
151	M	44.7	Very low	46.7	Very low	97 Å²	97	138 Å²	138	48%	0.478	71%	0.712	S	S	.	*	S	Bend	trans	-90.9	-7.1	172.3	-80.8	-163.7	-83.7	0	0	113.9	R147 D148 E149	R147-M151 HydrophobicContact CG-CE 3.92Å; D148-M151 PolarHBondContact O-N 3.24Å; E149-M151 VanDerWaalsContact C-N 3.31Å
152	T	53	Low	48.1	Very low	106 Å²	106	134.5 Å²	134.5	65%	0.65	69%	0.69	S	S	*	*	S	Bend	trans	-101.9	16	169.9	50	0	0	0	0	112.6	E149 D154	E149-T152 WeakPolarHBondContact CA-OG1 3.34Å; E149-T152 PolarHBondContact O-N 2.71Å; E149-T152 PolarHBondContact O-OG1 3.41Å; T152-D154 PolarHBondContact O-N 3.09Å; T152-D154 VanDerWaalsContact O-N 3.14Å
153	F	43.2	Very low	49.7	Very low	144 Å²	144	135.7 Å²	135.7	63%	0.632	69%	0.688	S	S	*	*			trans	-77.2	100.9	177.6	-139.5	-84	0	0	0	110.9	F155	F153-F155 PolarHBondContact O-N 3.23Å
154	D	47.3	Very low	51.2	Low	111 Å²	111	130.4 Å²	130.4	59%	0.594	68%	0.675	S	S	*	*			trans	-71.1	90.5	-171.7	-156.1	-6.8	0	0	0	111.8	T152 L156 A157	T152-D154 PolarHBondContact O-N 3.09Å; T152-D154 VanDerWaalsContact O-N 3.14Å; D154-L156 PolarHBondContact O-N 2.84Å; D154-A157 WeakPolarHBondContact O-CB 3.35Å; D154-A157 PolarHBondContact O-N 2.9Å
155	F	46.2	Very low	52.6	Low	169 Å²	169	127.8 Å²	127.8	74%	0.741	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-57.5	-24.5	-173.5	-103.9	-99	0	0	0	113.5	F153 A157 M158	F153-F155 PolarHBondContact O-N 3.23Å; F155-A157 VanDerWaalsContact C-N 3.27Å; F155-A157 PolarHBondContact O-N 2.85Å; F155-M158 PolarHBondContact O-N 3.42Å
156	L	54.2	Low	53.8	Low	166 Å²	166	130.1 Å²	130.1	87%	0.869	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-70.7	-18.7	176.7	-72.4	166.3	0	0	0	113.5	D154 M158	D154-L156 PolarHBondContact O-N 2.84Å; L156-M158 VanDerWaalsContact C-N 3.29Å; L156-M158 PolarHBondContact O-N 3.45Å
157	A	56.7	Low	55.3	Low	78 Å²	78	128.3 Å²	128.3	65%	0.645	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-75.4	-16.1	175.4	0	0	0	0	0	113.3	D154 F155 K159	D154-A157 WeakPolarHBondContact O-CB 3.35Å; D154-A157 PolarHBondContact O-N 2.9Å; F155-A157 VanDerWaalsContact C-N 3.27Å; F155-A157 PolarHBondContact O-N 2.85Å; A157-K159 PolarHBondContact O-N 3.46Å; A157-K159 VanDerWaalsContact O-N 3.09Å
158	M	46.2	Very low	56.7	Low	118 Å²	118	122.2 Å²	122.2	58%	0.581	63%	0.632	S	S	*	*	S	Bend	trans	-78.1	92.4	177.4	-77.1	-167	61	0	0	112	F155 L156 T160	F155-M158 PolarHBondContact O-N 3.42Å; L156-M158 VanDerWaalsContact C-N 3.29Å; L156-M158 PolarHBondContact O-N 3.45Å; M158-T160 PolarHBondContact O-N 3.17Å; M158-T160 VanDerWaalsContact O-N 3.14Å
159	K	48.6	Very low	57.8	Low	187 Å²	187	121 Å²	121	81%	0.813	62%	0.623	S	S	*	*			trans	-51.2	120.5	169.6	-66.5	-175.2	179.2	-177.9	0	110.8	A157 T161	A157-K159 PolarHBondContact O-N 3.46Å; A157-K159 VanDerWaalsContact O-N 3.09Å; K159-T161 PolarHBondContact O-N 3.39Å
160	T	48.9	Very low	59.1	Low	143 Å²	143	119.3 Å²	119.3	88%	0.877	61%	0.613	S	S	*	*			trans	-75.7	58.8	-172.1	46	0	0	0	0	113.3	M158 S162	M158-T160 PolarHBondContact O-N 3.17Å; M158-T160 VanDerWaalsContact O-N 3.14Å; T160-S162 PolarHBondContact O-N 3.31Å
161	T	58.9	Low	60.2	Low	80 Å²	80	114.4 Å²	114.4	49%	0.491	60%	0.6	S	S	.	*			trans	-57.5	126.7	174.2	57.2	0	0	0	0	110.9	K159	K159-T161 PolarHBondContact O-N 3.39Å
162	S	69.4	Low	61.9	Low	50 Å²	50	115.3 Å²	115.3	35%	0.35	60%	0.598	S	S	.	*			trans	-64	160.8	-176.9	66.2	0	0	0	0	112.4	T160 A164 E165 R166	T160-S162 PolarHBondContact O-N 3.31Å; S162-A164 PolarHBondContact O-N 2.94Å; S162-A164 VanDerWaalsContact O-N 3.15Å; S162-E165 VanDerWaalsContact CB-OE2 3.24Å; S162-E165 WeakPolarHBondContact CB-OE2 3.32Å; S162-E165 PolarHBondContact N-OE2 3.05Å; S162-E165 PolarHBondContact O-N 2.81Å; S162-E165 VanDerWaalsContact O-N 3.15Å; S162-E165 WeakPolarHBondContact OG-CG 3.38Å; S162-E165 PolarHBondContact OG-N 3.01Å; S162-E165 VanDerWaalsContact OG-N 3.11Å; S162-E165 PolarHBondContact OG-OE2 3.04Å; S162-R166 PolarHBondContact O-N 3.46Å
163	T	63.2	Low	63.2	Low	114 Å²	114	115.1 Å²	115.1	70%	0.699	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-14.7	174.4	64.8	0	0	0	0	113.2	K167	T163-K167 WeakPolarHBondContact O-CD 3.37Å; T163-K167 VanDerWaalsContact O-CG 3.29Å; T163-K167 WeakPolarHBondContact O-CG 3.45Å
164	A	67.5	Low	65.1	Low	65 Å²	65	112 Å²	112	54%	0.537	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-49.1	169.7	0	0	0	0	0	111.2	S162 R166 K167 A168	S162-A164 PolarHBondContact O-N 2.94Å; S162-A164 VanDerWaalsContact O-N 3.15Å; A164-R166 PolarHBondContact O-N 2.86Å; A164-K167 WeakPolarHBondContact O-CB 3.5Å; A164-K167 PolarHBondContact O-N 3.31Å; A164-A168 PolarHBondContact O-N 2.75Å
165	E	65.6	Low	66.9	Low	108 Å²	108	112.7 Å²	112.7	51%	0.505	58%	0.576	S	S	.	*	H	α-helix	trans	-61.9	-41.6	176.2	-71	160.2	119.2	0	0	111.7	S162 K167 A168 E169	S162-E165 VanDerWaalsContact CB-OE2 3.24Å; S162-E165 WeakPolarHBondContact CB-OE2 3.32Å; S162-E165 PolarHBondContact N-OE2 3.05Å; S162-E165 PolarHBondContact O-N 2.81Å; S162-E165 VanDerWaalsContact O-N 3.15Å; S162-E165 WeakPolarHBondContact OG-CG 3.38Å; S162-E165 PolarHBondContact OG-N 3.01Å; S162-E165 VanDerWaalsContact OG-N 3.11Å; S162-E165 PolarHBondContact OG-OE2 3.04Å; E165-K167 PolarHBondContact O-N 2.63Å; E165-A168 PolarHBondContact O-N 2.91Å; E165-A168 VanDerWaalsContact O-N 3.13Å; E165-E169 VanDerWaalsContact O-CB 3.3Å; E165-E169 WeakPolarHBondContact O-CB 3.44Å; E165-E169 PolarHBondContact O-N 3.48Å
166	R	66.3	Low	68.8	Low	181 Å²	181	108 Å²	108	68%	0.683	56%	0.556	S	S	*	*	H	α-helix	trans	-62.2	-23.2	174.1	-111.1	179.9	171.4	-173.5	-1.3	113.9	S162 A164 K170	S162-R166 PolarHBondContact O-N 3.46Å; A164-R166 PolarHBondContact O-N 2.86Å; R166-K170 WeakPolarHBondContact O-CB 3.43Å
167	K	73.6	Confident	70	Confident	140 Å²	140	106.8 Å²	106.8	61%	0.609	55%	0.546	S	S	*	.	H	α-helix	trans	-82.3	-45.3	170.5	-73	167.9	-174.8	167.7	0	111	T163 A164 E165 E169 K170 D171	T163-K167 WeakPolarHBondContact O-CD 3.37Å; T163-K167 VanDerWaalsContact O-CG 3.29Å; T163-K167 WeakPolarHBondContact O-CG 3.45Å; A164-K167 WeakPolarHBondContact O-CB 3.5Å; A164-K167 PolarHBondContact O-N 3.31Å; E165-K167 PolarHBondContact O-N 2.63Å; K167-E169 PolarHBondContact O-N 3.15Å; K167-K170 PolarHBondContact O-N 3.43Å; K167-D171 PolarHBondContact O-N 3.42Å
168	A	78.2	Confident	71.3	Confident	62 Å²	62	110.5 Å²	110.5	51%	0.512	54%	0.543	S	S	.	.	H	α-helix	trans	-59.5	-45	177.4	0	0	0	0	0	112.3	A164 E165 D171 R172	A164-A168 PolarHBondContact O-N 2.75Å; E165-A168 PolarHBondContact O-N 2.91Å; E165-A168 VanDerWaalsContact O-N 3.13Å; A168-D171 PolarHBondContact O-N 3.03Å; A168-R172 WeakPolarHBondContact O-CB 3.44Å; A168-R172 PolarHBondContact O-N 2.92Å
169	E	76.9	Confident	73	Confident	73 Å²	73	107.4 Å²	107.4	34%	0.341	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-46.1	173.9	-179.1	59.4	-141.6	0	0	111.3	E165 K167 D171 R172 Q173	E165-E169 VanDerWaalsContact O-CB 3.3Å; E165-E169 WeakPolarHBondContact O-CB 3.44Å; E165-E169 PolarHBondContact O-N 3.48Å; K167-E169 PolarHBondContact O-N 3.15Å; E169-D171 VanDerWaalsContact C-N 3.32Å; E169-D171 PolarHBondContact O-N 2.99Å; E169-R172 VanDerWaalsContact CD-NH2 3.32Å; E169-R172 PolarHBondContact O-N 2.86Å; E169-R172 IonicContact OE1-CZ 2.67Å; E169-R172 IonicContact OE1-NH1 2.68Å; E169-R172 IonicContact OE1-NH2 2.66Å; E169-R172 PolarHBondContact OE1-NH2 3.46Å; E169-R172 IonicContact OE2-CZ 3.17Å; E169-R172 VanDerWaalsContact OE2-CZ 3.3Å; E169-R172 IonicContact OE2-NH1 3.76Å; E169-R172 PolarHBondContact OE2-NH1 3.12Å; E169-R172 IonicContact OE2-NH2 3.82Å; E169-R172 PolarHBondContact OE2-NH2 2.68Å; E169-R172 VanDerWaalsContact OE2-NH2 3.16Å; E169-Q173 WeakPolarHBondContact O-CB 3.13Å; E169-Q173 VanDerWaalsContact O-CG 3.27Å; E169-Q173 WeakPolarHBondContact O-CG 3.48Å; E169-Q173 PolarHBondContact O-N 3.25Å; E169-Q173 PolarHBondContact OE1-NE2 3.47Å
170	K	77.4	Confident	74.7	Confident	133 Å²	133	104.4 Å²	104.4	58%	0.578	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-30.1	178.5	-174.6	170	-174.9	172.2	0	113.2	R166 K167 K174	R166-K170 WeakPolarHBondContact O-CB 3.43Å; K167-K170 PolarHBondContact O-N 3.43Å; K170-K174 WeakPolarHBondContact O-CG 3.19Å; K170-K174 PolarHBondContact O-N 3.12Å
171	D	78.2	Confident	76.1	Confident	77 Å²	77	100.3 Å²	100.3	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-81.4	-36.1	174.6	-74	-25.8	0	0	0	111.7	K167 A168 E169 Q173 K174 E175	K167-D171 PolarHBondContact O-N 3.42Å; A168-D171 PolarHBondContact O-N 3.03Å; E169-D171 VanDerWaalsContact C-N 3.32Å; E169-D171 PolarHBondContact O-N 2.99Å; D171-Q173 VanDerWaalsContact C-N 3.35Å; D171-Q173 PolarHBondContact O-N 3.22Å; D171-K174 WeakPolarHBondContact O-CB 3.37Å; D171-K174 PolarHBondContact O-N 3.4Å; D171-K174 VanDerWaalsContact O-N 3.16Å; D171-K174 WeakPolarHBondContact OD1-CE 3.21Å; D171-K174 IonicContact OD1-NZ 2.89Å; D171-K174 PolarHBondContact OD1-NZ 3.48Å; D171-E175 WeakPolarHBondContact O-CG 3.5Å; D171-E175 PolarHBondContact O-N 3.06Å
172	R	80.9	Confident	77	Confident	117 Å²	117	101.6 Å²	101.6	44%	0.442	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-43.5	170	-160	-171	74.7	-112.4	-15.5	111.2	A168 E169 K174 E175 E176	A168-R172 WeakPolarHBondContact O-CB 3.44Å; A168-R172 PolarHBondContact O-N 2.92Å; E169-R172 VanDerWaalsContact CD-NH2 3.32Å; E169-R172 PolarHBondContact O-N 2.86Å; E169-R172 IonicContact OE1-CZ 2.67Å; E169-R172 IonicContact OE1-NH1 2.68Å; E169-R172 IonicContact OE1-NH2 2.66Å; E169-R172 PolarHBondContact OE1-NH2 3.46Å; E169-R172 IonicContact OE2-CZ 3.17Å; E169-R172 VanDerWaalsContact OE2-CZ 3.3Å; E169-R172 IonicContact OE2-NH1 3.76Å; E169-R172 PolarHBondContact OE2-NH1 3.12Å; E169-R172 IonicContact OE2-NH2 3.82Å; E169-R172 PolarHBondContact OE2-NH2 2.68Å; E169-R172 VanDerWaalsContact OE2-NH2 3.16Å; R172-K174 VanDerWaalsContact C-N 3.31Å; R172-K174 PolarHBondContact O-N 2.96Å; R172-E175 CarbonylContact O-C 3.48Å; R172-E175 PolarHBondContact O-N 3.1Å; R172-E176 IonicContact CZ-OE1 2.81Å; R172-E176 IonicContact NE-OE1 2.77Å; R172-E176 PolarHBondContact NE-OE1 3.14Å; R172-E176 IonicContact NH2-OE1 3.39Å; R172-E176 PolarHBondContact NH2-OE1 2.96Å; R172-E176 WeakPolarHBondContact O-CG 3.34Å; R172-E176 PolarHBondContact O-N 2.86Å
173	Q	80.8	Confident	77.2	Confident	101 Å²	101	101.8 Å²	101.8	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-36.1	174.9	-72.8	173.2	13.8	0	0	112.9	E169 D171 E177	E169-Q173 WeakPolarHBondContact O-CB 3.13Å; E169-Q173 VanDerWaalsContact O-CG 3.27Å; E169-Q173 WeakPolarHBondContact O-CG 3.48Å; E169-Q173 PolarHBondContact O-N 3.25Å; E169-Q173 PolarHBondContact OE1-NE2 3.47Å; D171-Q173 VanDerWaalsContact C-N 3.35Å; D171-Q173 PolarHBondContact O-N 3.22Å; Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 PolarHBondContact O-N 2.93Å
174	K	82.3	Confident	77.8	Confident	78 Å²	78	102.5 Å²	102.5	34%	0.339	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-33.8	172.1	-68.6	168.5	-161.8	160.3	0	112.7	K170 D171 R172 R178	K170-K174 WeakPolarHBondContact O-CG 3.19Å; K170-K174 PolarHBondContact O-N 3.12Å; D171-K174 WeakPolarHBondContact O-CB 3.37Å; D171-K174 PolarHBondContact O-N 3.4Å; D171-K174 VanDerWaalsContact O-N 3.16Å; D171-K174 WeakPolarHBondContact OD1-CE 3.21Å; D171-K174 IonicContact OD1-NZ 2.89Å; D171-K174 PolarHBondContact OD1-NZ 3.48Å; R172-K174 VanDerWaalsContact C-N 3.31Å; R172-K174 PolarHBondContact O-N 2.96Å; K174-R178 WeakPolarHBondContact O-CB 3.26Å; K174-R178 WeakPolarHBondContact O-CD 3.49Å; K174-R178 WeakPolarHBondContact O-CG 3.29Å; K174-R178 PolarHBondContact O-N 2.88Å
175	E	85.8	Confident	78	Confident	127 Å²	127	105.4 Å²	105.4	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-71.6	-39.5	176.5	-72.1	179	163.8	0	0	110.5	D171 R172 R178 A179	D171-E175 WeakPolarHBondContact O-CG 3.5Å; D171-E175 PolarHBondContact O-N 3.06Å; R172-E175 CarbonylContact O-C 3.48Å; R172-E175 PolarHBondContact O-N 3.1Å; E175-R178 PolarHBondContact O-N 2.75Å; E175-A179 WeakPolarHBondContact O-CB 3.44Å; E175-A179 PolarHBondContact O-N 2.97Å
176	E	85	Confident	78	Confident	70 Å²	70	106.7 Å²	106.7	33%	0.327	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-42.2	168.7	-69.5	174.6	-141.1	0	0	112.7	R172 A179 K180	R172-E176 IonicContact CZ-OE1 2.81Å; R172-E176 IonicContact NE-OE1 2.77Å; R172-E176 PolarHBondContact NE-OE1 3.14Å; R172-E176 IonicContact NH2-OE1 3.39Å; R172-E176 PolarHBondContact NH2-OE1 2.96Å; R172-E176 WeakPolarHBondContact O-CG 3.34Å; R172-E176 PolarHBondContact O-N 2.86Å; E176-A179 PolarHBondContact O-N 2.77Å; E176-K180 WeakPolarHBondContact O-CB 3.45Å; E176-K180 VanDerWaalsContact O-CD 3.31Å; E176-K180 WeakPolarHBondContact O-CD 3.21Å; E176-K180 WeakPolarHBondContact O-CG 3.33Å; E176-K180 PolarHBondContact O-N 2.85Å; E176-K180 IonicContact OE2-NZ 2.85Å
177	E	79.1	Confident	78	Confident	140 Å²	140	100.1 Å²	100.1	65%	0.654	50%	0.5	S	S	*	.	H	α-helix	trans	-66.2	-39.7	176.6	-173.4	172.5	-139.5	0	0	111.7	Q173 K180 A181	Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 PolarHBondContact O-N 2.93Å; E177-K180 PolarHBondContact O-N 2.95Å; E177-A181 PolarHBondContact O-N 2.99Å
178	R	84.3	Confident	77.7	Confident	157 Å²	157	94.9 Å²	94.9	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-66.9	-42.1	173.4	-75.1	165.9	177.2	166.4	-0.8	112.4	K174 E175 K180 A181 Q182	K174-R178 WeakPolarHBondContact O-CB 3.26Å; K174-R178 WeakPolarHBondContact O-CD 3.49Å; K174-R178 WeakPolarHBondContact O-CG 3.29Å; K174-R178 PolarHBondContact O-N 2.88Å; E175-R178 PolarHBondContact O-N 2.75Å; R178-K180 VanDerWaalsContact C-N 3.32Å; R178-K180 PolarHBondContact O-N 2.64Å; R178-A181 PolarHBondContact O-N 3.1Å; R178-Q182 WeakPolarHBondContact O-CB 2.72Å; R178-Q182 WeakPolarHBondContact O-CG 3.4Å; R178-Q182 PolarHBondContact O-N 3.48Å
179	A	82.8	Confident	76.9	Confident	53 Å²	53	96.5 Å²	96.5	44%	0.438	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-41.2	174.9	0	0	0	0	0	111.3	E175 E176 Q182 A183	E175-A179 WeakPolarHBondContact O-CB 3.44Å; E175-A179 PolarHBondContact O-N 2.97Å; E176-A179 PolarHBondContact O-N 2.77Å; A179-Q182 PolarHBondContact O-N 3.41Å; A179-A183 WeakPolarHBondContact O-CB 3.42Å; A179-A183 PolarHBondContact O-N 2.69Å
180	K	82.9	Confident	76.2	Confident	124 Å²	124	97.3 Å²	97.3	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.2	-72.6	159.3	-171.5	157.1	0	111.6	E176 E177 R178 A183 I184	E176-K180 WeakPolarHBondContact O-CB 3.45Å; E176-K180 VanDerWaalsContact O-CD 3.31Å; E176-K180 WeakPolarHBondContact O-CD 3.21Å; E176-K180 WeakPolarHBondContact O-CG 3.33Å; E176-K180 PolarHBondContact O-N 2.85Å; E176-K180 IonicContact OE2-NZ 2.85Å; E177-K180 PolarHBondContact O-N 2.95Å; R178-K180 VanDerWaalsContact C-N 3.32Å; R178-K180 PolarHBondContact O-N 2.64Å; K180-A183 PolarHBondContact O-N 2.64Å; K180-I184 WeakPolarHBondContact O-CD1 3.3Å; K180-I184 VanDerWaalsContact O-CG1 3.26Å; K180-I184 WeakPolarHBondContact O-CG1 3.26Å; K180-I184 PolarHBondContact O-N 2.73Å
181	A	80.1	Confident	75.4	Confident	56 Å²	56	98.6 Å²	98.6	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-44.6	174.8	0	0	0	0	0	112.5	E177 R178 I184 E185	E177-A181 PolarHBondContact O-N 2.99Å; R178-A181 PolarHBondContact O-N 3.1Å; A181-I184 PolarHBondContact O-N 3.36Å; A181-E185 PolarHBondContact O-N 2.91Å
182	Q	76.6	Confident	74.8	Confident	108 Å²	108	101.9 Å²	101.9	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-67.6	-35.8	178.2	-71.6	179.1	-47.9	0	0	112.6	R178 A179 I184 E185 Q186	R178-Q182 WeakPolarHBondContact O-CB 2.72Å; R178-Q182 WeakPolarHBondContact O-CG 3.4Å; R178-Q182 PolarHBondContact O-N 3.48Å; A179-Q182 PolarHBondContact O-N 3.41Å; Q182-I184 VanDerWaalsContact C-N 3.34Å; Q182-E185 PolarHBondContact O-N 3.28Å; Q182-Q186 WeakPolarHBondContact O-CB 3.46Å; Q182-Q186 WeakPolarHBondContact O-CG 3.24Å; Q182-Q186 PolarHBondContact O-N 3.09Å
183	A	73.6	Confident	74.1	Confident	54 Å²	54	99.4 Å²	99.4	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-37.2	172.5	0	0	0	0	0	112	A179 K180 A187	A179-A183 WeakPolarHBondContact O-CB 3.42Å; A179-A183 PolarHBondContact O-N 2.69Å; K180-A183 PolarHBondContact O-N 2.64Å; A183-A187 WeakPolarHBondContact O-CB 3.22Å; A183-A187 PolarHBondContact O-N 2.87Å
184	I	76.4	Confident	73	Confident	128 Å²	128	102.3 Å²	102.3	66%	0.656	52%	0.523	S	S	*	.	H	α-helix	trans	-67.5	-39.8	173.4	-68.5	163.3	0	0	0	111	K180 A181 Q182 A187 G188	K180-I184 WeakPolarHBondContact O-CD1 3.3Å; K180-I184 VanDerWaalsContact O-CG1 3.26Å; K180-I184 WeakPolarHBondContact O-CG1 3.26Å; K180-I184 PolarHBondContact O-N 2.73Å; A181-I184 PolarHBondContact O-N 3.36Å; Q182-I184 VanDerWaalsContact C-N 3.34Å; I184-A187 CarbonylContact O-C 3.6Å; I184-G188 PolarHBondContact O-N 3.11Å
185	E	71.1	Confident	72.1	Confident	126 Å²	126	101.3 Å²	101.3	59%	0.589	52%	0.521	S	S	*	.	H	α-helix	trans	-64.5	-48.6	176.7	-171.5	172.4	-159.9	0	0	111.5	A181 Q182 G188 L189	A181-E185 PolarHBondContact O-N 2.91Å; Q182-E185 PolarHBondContact O-N 3.28Å; E185-G188 WeakPolarHBondContact O-CA 3.34Å; E185-G188 PolarHBondContact O-N 3.03Å; E185-L189 PolarHBondContact O-N 3.35Å
186	Q	65.8	Low	71.3	Confident	135 Å²	135	99.5 Å²	99.5	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-61.8	-44.3	174.1	-72.6	178.7	-7.3	0	0	112	Q182 G188 L189 H190	Q182-Q186 WeakPolarHBondContact O-CB 3.46Å; Q182-Q186 WeakPolarHBondContact O-CG 3.24Å; Q182-Q186 PolarHBondContact O-N 3.09Å; Q186-G188 PolarHBondContact O-N 3.48Å; Q186-L189 PolarHBondContact O-N 3.09Å; Q186-H190 WeakPolarHBondContact O-CB 3.44Å; Q186-H190 PolarHBondContact O-N 2.76Å
187	A	67.4	Low	70.3	Confident	44 Å²	44	102.1 Å²	102.1	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-71	-4.5	173.7	0	0	0	0	0	114	A183 I184 K191	A183-A187 WeakPolarHBondContact O-CB 3.22Å; A183-A187 PolarHBondContact O-N 2.87Å; I184-A187 CarbonylContact O-C 3.6Å; A187-K191 WeakPolarHBondContact O-CD 3.47Å; A187-K191 WeakPolarHBondContact O-CE 3.43Å; A187-K191 WeakPolarHBondContact O-CG 3.44Å; A187-K191 PolarHBondContact O-NZ 2.63Å
188	G	67.1	Low	69.5	Low	30 Å²	30	101.2 Å²	101.2	31%	0.309	52%	0.519	S	S	.	.	H	α-helix	trans	-88.7	-54.2	167.2	0	0	0	0	0	111.1	I184 E185 Q186 H190 K191 L192	I184-G188 PolarHBondContact O-N 3.11Å; E185-G188 WeakPolarHBondContact O-CA 3.34Å; E185-G188 PolarHBondContact O-N 3.03Å; Q186-G188 PolarHBondContact O-N 3.48Å; G188-H190 VanDerWaalsContact C-N 3.33Å; G188-H190 PolarHBondContact O-N 3.21Å; G188-K191 PolarHBondContact O-N 2.75Å; G188-K191 VanDerWaalsContact O-N 3.08Å; G188-L192 PolarHBondContact O-N 3.49Å
189	L	60.8	Low	68.4	Low	96 Å²	96	97.4 Å²	97.4	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-52	-51.1	175.8	-68.7	167.7	0	0	0	111.3	E185 Q186 K191 L192 E193	E185-L189 PolarHBondContact O-N 3.35Å; Q186-L189 PolarHBondContact O-N 3.09Å; L189-K191 PolarHBondContact O-N 3.49Å; L189-L192 CarbonylContact O-C 3.52Å; L189-L192 WeakPolarHBondContact O-CA 3.44Å; L189-L192 PolarHBondContact O-N 3.43Å; L189-E193 PolarHBondContact O-N 3.46Å
190	H	61.8	Low	67.1	Low	90 Å²	90	102.6 Å²	102.6	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-55.5	-21.7	179.1	-171.8	-73.5	0	0	0	115.1	Q186 G188 K199	Q186-H190 WeakPolarHBondContact O-CB 3.44Å; Q186-H190 PolarHBondContact O-N 2.76Å; G188-H190 VanDerWaalsContact C-N 3.33Å; G188-H190 PolarHBondContact O-N 3.21Å; H190-K199 VanDerWaalsContact NE2-C 3.28Å; H190-K199 PolarHBondContact NE2-O 2.82Å
191	K	61.7	Low	66	Low	160 Å²	160	100 Å²	100	70%	0.696	54%	0.535	S	S	*	.	H	α-helix	trans	-89.8	-19.9	175.5	-67.2	171	-173.8	138.6	0	113.1	A187 G188 L189	A187-K191 WeakPolarHBondContact O-CD 3.47Å; A187-K191 WeakPolarHBondContact O-CE 3.43Å; A187-K191 WeakPolarHBondContact O-CG 3.44Å; A187-K191 PolarHBondContact O-NZ 2.63Å; G188-K191 PolarHBondContact O-N 2.75Å; G188-K191 VanDerWaalsContact O-N 3.08Å; L189-K191 PolarHBondContact O-N 3.49Å
192	L	65	Low	65.3	Low	145 Å²	145	99.2 Å²	99.2	76%	0.759	53%	0.532	S	S	*	.	H	α-helix	trans	-94.6	-23.3	176.4	-62.4	173.2	0	0	0	112	G188 L189 L194	G188-L192 PolarHBondContact O-N 3.49Å; L189-L192 CarbonylContact O-C 3.52Å; L189-L192 WeakPolarHBondContact O-CA 3.44Å; L189-L192 PolarHBondContact O-N 3.43Å; L192-L194 PolarHBondContact O-N 2.81Å
193	E	65.8	Low	64.6	Low	66 Å²	66	100.1 Å²	100.1	31%	0.308	55%	0.545	S	S	.	.			trans	-59.8	123.2	175	-71.7	-51	145.9	0	0	111.9	L189 W198 K199	L189-E193 PolarHBondContact O-N 3.46Å; E193-W198 HydrophobicContact CG-CE3 4.09Å; E193-K199 WeakPolarHBondContact O-CE 3.47Å; E193-K199 PolarHBondContact O-NZ 2.84Å
194	L	57.5	Low	64.2	Low	162 Å²	162	98.2 Å²	98.2	85%	0.848	53%	0.531	S	S	*	.			trans	-84.2	-25.1	179.7	-157.1	72.1	0	0	0	111.8	L192 P196	L192-L194 PolarHBondContact O-N 2.81Å; L194-P196 WeakPolarHBondContact O-CD 3.2Å
195	N	64.5	Low	63.5	Low	57 Å²	57	98.3 Å²	98.3	31%	0.305	53%	0.532	S	S	.	.			trans	-72.1	120.8	-179.1	-173.1	1.3	0	0	0	111.2	Y197 W198 G204	N195-Y197 VanDerWaalsContact C-N 3.28Å; N195-Y197 PolarHBondContact O-N 2.95Å; N195-Y197 WeakPolarHBondContact OD1-CD2 3.42Å; N195-Y197 PolarHBondContact OD1-N 2.96Å; N195-W198 PolarHBondContact O-N 3.46Å; N195-G204 PolarHBondContact ND2-O 3.45Å
196	P	68.4	Low	62.7	Low	88 Å²	88	95.7 Å²	95.7	57%	0.571	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-59	-35.2	179.7	-25.8	35.6	0	0	0	114	L194 W198 K199	L194-P196 WeakPolarHBondContact O-CD 3.2Å; P196-W198 PolarHBondContact O-N 2.98Å; P196-K199 WeakPolarHBondContact O-CB 3.42Å; P196-K199 PolarHBondContact O-N 3.23Å; P196-K199 VanDerWaalsContact O-N 3.09Å
197	Y	63.4	Low	62.2	Low	126 Å²	126	94.7 Å²	94.7	49%	0.494	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-77.9	0.5	-170.6	-56.4	-77.1	0	0	0	114.8	N195 G202 P206	N195-Y197 VanDerWaalsContact C-N 3.28Å; N195-Y197 PolarHBondContact O-N 2.95Å; N195-Y197 WeakPolarHBondContact OD1-CD2 3.42Å; N195-Y197 PolarHBondContact OD1-N 2.96Å; Y197-G202 CarbonylContact O-C 3.53Å; Y197-P206 HydrophobicContact CE1-CB 4.19Å
198	W	62.9	Low	61.4	Low	121 Å²	121	102 Å²	102	46%	0.458	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-100.2	-3.5	168.4	-79.6	-13.7	0	0	0	113.6	E193 N195 P196 D200 G201 G204	E193-W198 HydrophobicContact CG-CE3 4.09Å; N195-W198 PolarHBondContact O-N 3.46Å; P196-W198 PolarHBondContact O-N 2.98Å; W198-D200 VanDerWaalsContact C-N 3.28Å; W198-D200 PolarHBondContact O-N 3.38Å; W198-G201 PolarHBondContact O-N 3.24Å; W198-G204 VanDerWaalsContact CD1-N 3.32Å
199	K	60.9	Low	60.4	Low	76 Å²	76	107.4 Å²	107.4	33%	0.33	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	12.7	-170.7	-61.4	-165.9	175.9	-170.5	0	116.9	H190 E193 P196	H190-K199 VanDerWaalsContact NE2-C 3.28Å; H190-K199 PolarHBondContact NE2-O 2.82Å; E193-K199 WeakPolarHBondContact O-CE 3.47Å; E193-K199 PolarHBondContact O-NZ 2.84Å; P196-K199 WeakPolarHBondContact O-CB 3.42Å; P196-K199 PolarHBondContact O-N 3.23Å; P196-K199 VanDerWaalsContact O-N 3.09Å
200	D	56.4	Low	59.3	Low	163 Å²	163	110.2 Å²	110.2	87%	0.872	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.6	24.6	166	-73	-69.9	0	0	0	111.1	W198 G202	W198-D200 VanDerWaalsContact C-N 3.28Å; W198-D200 PolarHBondContact O-N 3.38Å; D200-G202 VanDerWaalsContact C-N 3.33Å
201	G	59.8	Low	58.3	Low	69 Å²	69	109.6 Å²	109.6	71%	0.711	60%	0.604	S	S	*	*	S	Bend	trans	75.1	18.4	-175.3	0	0	0	0	0	114.8	W198	W198-G201 PolarHBondContact O-N 3.24Å
202	G	63.7	Low	57.3	Low	39 Å²	39	109.9 Å²	109.9	40%	0.402	61%	0.608	S	S	.	*			trans	-66.9	171.2	176.5	0	0	0	0	0	114.1	Y197 D200 G204	Y197-G202 CarbonylContact O-C 3.53Å; D200-G202 VanDerWaalsContact C-N 3.33Å; G202-G204 VanDerWaalsContact C-N 3.28Å; G202-G204 PolarHBondContact O-N 3.05Å
203	T	63.4	Low	56.3	Low	127 Å²	127	110 Å²	110	78%	0.779	62%	0.615	S	S	*	*			trans	-75.5	-8.3	-175.1	46	0	0	0	0	114.7	L205	T203-L205 VanDerWaalsContact C-N 3.3Å; T203-L205 PolarHBondContact O-N 3.4Å
204	G	63.9	Low	54.6	Low	15 Å²	15	111.3 Å²	111.3	16%	0.155	64%	0.637	C	S	.	*	S	Bend	trans	87.8	-9.2	176.5	0	0	0	0	0	115.8	N195 W198 G202	N195-G204 PolarHBondContact ND2-O 3.45Å; W198-G204 VanDerWaalsContact CD1-N 3.32Å; G202-G204 VanDerWaalsContact C-N 3.28Å; G202-G204 PolarHBondContact O-N 3.05Å
205	L	62	Low	53.7	Low	130 Å²	130	108.7 Å²	108.7	68%	0.681	64%	0.639	S	S	*	*	S	Bend	trans	-99.4	147.2	164.8	-63.2	169.4	0	0	0	108.4	T203	T203-L205 VanDerWaalsContact C-N 3.3Å; T203-L205 PolarHBondContact O-N 3.4Å
206	P	55.1	Low	52.3	Low	70 Å²	70	112.3 Å²	112.3	46%	0.455	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-60.9	141.3	162.6	29	-33.7	0	0	0	108.9	Y197 E208	Y197-P206 HydrophobicContact CE1-CB 4.19Å; P206-E208 PolarHBondContact O-N 3.21Å
207	P	54.8	Low	50.9	Low	114 Å²	114	118.4 Å²	118.4	74%	0.74	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-60.2	132.9	171.9	-21.2	33.1	0	0	0	110.3	D209	P207-D209 VanDerWaalsContact C-N 3.33Å
208	E	49.5	Very low	49.6	Very low	199 Å²	199	115.9 Å²	115.9	93%	0.93	69%	0.686	S	S	*	*	S	Bend	trans	-81.8	-12.6	-179	-62	-154.2	134.4	0	0	113.5	P206	P206-E208 PolarHBondContact O-N 3.21Å
209	D	47	Very low	48.6	Very low	142 Å²	142	112.7 Å²	112.7	76%	0.759	69%	0.691	S	S	*	*	S	Bend	trans	-102.7	153.6	-179.8	-77.3	-56	0	0	0	113.8	P207	P207-D209 VanDerWaalsContact C-N 3.33Å
210	I	37.6	Very low	47.7	Very low	155 Å²	155	114.4 Å²	114.4	80%	0.795	71%	0.71	S	S	*	*			trans	75.1	84.8	179.4	-46.3	172.4	0	0	0	114.2
211	A	42.2	Very low	47.1	Very low	78 Å²	78	110.7 Å²	110.7	65%	0.645	69%	0.693	S	S	*	*			trans	-67.5	153.3	149.2	0	0	0	0	0	110.8
212	H	40.3	Very low	46.5	Very low	165 Å²	165	114.3 Å²	114.3	76%	0.764	70%	0.7	S	S	*	*	S	Bend	trans	79.1	134.9	175.9	-49.7	-79.8	0	0	0	117.8
213	T	42.7	Very low	46	Very low	148 Å²	148	119.6 Å²	119.6	91%	0.908	72%	0.72	S	S	*	*			trans	62.5	64.6	166	51.9	0	0	0	0	118.4
214	A	30	Very low	45.9	Very low	94 Å²	94	116 Å²	116	78%	0.777	70%	0.695	S	S	*	*			trans	-134.3	118.2	154.1	0	0	0	0	0	110.6	T216	A214-T216 PolarHBondContact O-N 3.21Å
215	A	40	Very low	46.1	Very low	107 Å²	107	118 Å²	118	88%	0.884	72%	0.717	S	S	*	*			trans	-79.2	109.5	176.5	0	0	0	0	0	110.1	K217	A215-K217 PolarHBondContact O-N 3.14Å
216	T	34.9	Very low	46.8	Very low	132 Å²	132	113.7 Å²	113.7	81%	0.81	70%	0.703	S	S	*	*			trans	-66	121.1	177.7	37.3	0	0	0	0	111.1	A214 A218	A214-T216 PolarHBondContact O-N 3.21Å; T216-A218 PolarHBondContact O-N 3.06Å
217	K	39.1	Very low	48	Very low	216 Å²	216	110.9 Å²	110.9	94%	0.939	68%	0.684	S	S	*	*			trans	-72	79.5	165.3	-78.6	-176.9	176.5	174.6	0	109.3	A215 G219	A215-K217 PolarHBondContact O-N 3.14Å; K217-G219 PolarHBondContact O-N 2.72Å
218	A	34.9	Very low	49.2	Very low	74 Å²	74	107.2 Å²	107.2	61%	0.612	66%	0.661	S	S	*	*			trans	-61.3	134.2	176.9	0	0	0	0	0	111.1	T216 V221	T216-A218 PolarHBondContact O-N 3.06Å; A218-V221 HydrophobicContact CB-CG2 4.48Å
219	G	43.3	Very low	50.6	Low	54 Å²	54	105.2 Å²	105.2	56%	0.557	65%	0.645	S	S	*	*			trans	-61.6	160.8	152.1	0	0	0	0	0	109.7	K217 V221	K217-G219 PolarHBondContact O-N 2.72Å; G219-V221 PolarHBondContact O-N 2.83Å
220	P	42.2	Very low	52.5	Low	112 Å²	112	99.4 Å²	99.4	73%	0.727	61%	0.614	S	S	*	*			trans	-59.5	111	-172.8	24.6	-34	0	0	0	111.5
221	V	43.1	Very low	54.8	Low	85 Å²	85	98 Å²	98	52%	0.515	60%	0.599	S	S	.	*			trans	-77.4	129.3	173.3	176.8	0	0	0	0	107.6	A218 G219 N223	A218-V221 HydrophobicContact CB-CG2 4.48Å; G219-V221 PolarHBondContact O-N 2.83Å; V221-N223 HydrophobicContact CG1-CB 4.3Å; V221-N223 PolarHBondContact O-N 3.1Å
222	V	46.7	Very low	56.9	Low	144 Å²	144	99.9 Å²	99.9	87%	0.873	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	16.7	-170.6	-169.8	0	0	0	0	112.4
223	N	54.4	Low	59.1	Low	151 Å²	151	92.9 Å²	92.9	81%	0.807	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	9.8	-179	-94.5	3.6	0	0	0	114.1	V221 G225	V221-N223 HydrophobicContact CG1-CB 4.3Å; V221-N223 PolarHBondContact O-N 3.1Å; N223-G225 PolarHBondContact O-N 3.32Å
224	D	61	Low	61.3	Low	51 Å²	51	89.9 Å²	89.9	27%	0.273	54%	0.535	S	S	.	.	S	Bend	trans	-68.3	11.4	-179.2	-65.8	-5.3	0	0	0	115.1	G226 L227 S228 V273	D224-G226 PolarHBondContact O-N 2.85Å; D224-L227 VanDerWaalsContact O-CB 3.25Å; D224-L227 WeakPolarHBondContact O-CB 3.25Å; D224-L227 PolarHBondContact O-N 3.35Å; D224-S228 WeakPolarHBondContact OD2-CB 3.44Å; D224-S228 PolarHBondContact OD2-OG 3.42Å; D224-V273 WeakPolarHBondContact O-CG2 2.97Å
225	G	67.1	Low	64.1	Low	58 Å²	58	91.2 Å²	91.2	60%	0.598	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	12.7	-177	0	0	0	0	0	115.7	N223	N223-G225 PolarHBondContact O-N 3.32Å
226	G	76.9	Confident	66.4	Low	38 Å²	38	94.4 Å²	94.4	39%	0.392	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-4.9	-171.3	0	0	0	0	0	115.1	D224 S228 W229 L230	D224-G226 PolarHBondContact O-N 2.85Å; G226-S228 PolarHBondContact O-N 3.28Å; G226-W229 WeakPolarHBondContact O-CB 3.44Å; G226-W229 PolarHBondContact O-N 2.93Å; G226-L230 PolarHBondContact O-N 2.91Å
227	L	80.6	Confident	69	Low	12 Å²	12	88.2 Å²	88.2	6%	0.063	48%	0.476	C	S	.	.	H	α-helix	trans	-55.4	-49.2	-177	175	57	0	0	0	113.1	D224 W229 L230 R231 L266 A269 E270 V273	D224-L227 VanDerWaalsContact O-CB 3.25Å; D224-L227 WeakPolarHBondContact O-CB 3.25Å; D224-L227 PolarHBondContact O-N 3.35Å; L227-W229 PolarHBondContact O-N 3.03Å; L227-L230 PolarHBondContact O-N 2.9Å; L227-R231 HydrophobicContact CD1-CG 4.04Å; L227-R231 PolarHBondContact O-N 3.16Å; L227-L266 HydrophobicContact CD1-CD1 3.97Å; L227-A269 HydrophobicContact CB-CB 4.11Å; L227-A269 HydrophobicContact CD1-CB 4.33Å; L227-E270 HydrophobicContact CD1-CB 4.48Å; L227-E270 HydrophobicContact CD1-CG 3.29Å; L227-E270 HydrophobicContact CD2-CG 3.86Å; L227-E270 HydrophobicContact CG-CG 4.2Å; L227-V273 HydrophobicContact CB-CG2 4.3Å; L227-V273 HydrophobicContact CD2-CB 4.25Å; L227-V273 HydrophobicContact CD2-CG1 4.47Å; L227-V273 HydrophobicContact CD2-CG2 4.13Å
228	S	79.9	Confident	71.4	Confident	37 Å²	37	82.7 Å²	82.7	26%	0.259	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-13.8	-177.6	65.6	0	0	0	0	113.3	D224 G226 K232	D224-S228 WeakPolarHBondContact OD2-CB 3.44Å; D224-S228 PolarHBondContact OD2-OG 3.42Å; G226-S228 PolarHBondContact O-N 3.28Å; S228-K232 WeakPolarHBondContact O-CD 3.45Å; S228-K232 VanDerWaalsContact O-CG 3.27Å; S228-K232 WeakPolarHBondContact O-CG 3.44Å
229	W	78.9	Confident	74	Confident	156 Å²	156	84.1 Å²	84.1	59%	0.591	45%	0.446	S	S	*	.	H	α-helix	trans	-84.8	-46.6	168.4	-176.1	93.9	0	0	0	111.4	G226 L227 R231 K232 S233 Y256	G226-W229 WeakPolarHBondContact O-CB 3.44Å; G226-W229 PolarHBondContact O-N 2.93Å; L227-W229 PolarHBondContact O-N 3.03Å; W229-R231 PolarHBondContact O-N 3.44Å; W229-K232 CarbonylContact O-C 3.56Å; W229-K232 PolarHBondContact O-N 2.58Å; W229-K232 VanDerWaalsContact O-N 3.16Å; W229-S233 PolarHBondContact O-N 3.25Å; W229-Y256 WeakPolarHBondContact CH2-OH 3.32Å; W229-Y256 HydrophobicContact CZ3-CE1 4.4Å; W229-Y256 VanDerWaalsContact CZ3-OH 3.23Å; W229-Y256 WeakPolarHBondContact CZ3-OH 3.22Å
230	L	87.3	Confident	76.1	Confident	20 Å²	20	84 Å²	84	11%	0.105	43%	0.431	C	S	.	.	H	α-helix	trans	-59.2	-47.2	177.7	-73.2	170.8	0	0	0	111.9	G226 L227 K232 S233 Y234 F262 R265 L266 A269	G226-L230 PolarHBondContact O-N 2.91Å; L227-L230 PolarHBondContact O-N 2.9Å; L230-K232 VanDerWaalsContact C-N 3.3Å; L230-K232 PolarHBondContact O-N 3.42Å; L230-S233 PolarHBondContact O-N 3.24Å; L230-S233 VanDerWaalsContact O-N 3.1Å; L230-Y234 PolarHBondContact O-N 3.09Å; L230-F262 HydrophobicContact CD2-CE2 3.83Å; L230-F262 HydrophobicContact CD2-CZ 4.38Å; L230-R265 HydrophobicContact CD1-CB 4.47Å; L230-R265 WeakPolarHBondContact CD1-O 3.48Å; L230-L266 HydrophobicContact CB-CD1 3.68Å; L230-A269 HydrophobicContact CD1-CB 4.12Å
231	R	85.8	Confident	78.5	Confident	125 Å²	125	79.1 Å²	79.1	47%	0.472	40%	0.4	S	S	.	.	H	α-helix	trans	-57.3	-40.4	175.3	-71.8	-176.9	170.8	-178.2	-4.6	112.2	L227 W229 Y234 Q235 L266 E270	L227-R231 HydrophobicContact CD1-CG 4.04Å; L227-R231 PolarHBondContact O-N 3.16Å; W229-R231 PolarHBondContact O-N 3.44Å; R231-Y234 PolarHBondContact O-N 3.4Å; R231-Q235 PolarHBondContact O-N 2.9Å; R231-Q235 VanDerWaalsContact O-N 3.15Å; R231-L266 HydrophobicContact CG-CD1 3.81Å; R231-E270 IonicContact CZ-OE1 2.85Å; R231-E270 IonicContact NE-OE1 2.7Å; R231-E270 PolarHBondContact NE-OE1 2.72Å; R231-E270 IonicContact NH2-OE1 3.25Å; R231-E270 PolarHBondContact NH2-OE1 3.27Å; R231-E270 IonicContact NH2-OE2 2.73Å
232	K	86.3	Confident	80.6	Confident	118 Å²	118	80.7 Å²	80.7	51%	0.513	40%	0.402	S	S	.	.	H	α-helix	trans	-71.7	-34.1	175.7	-71.5	172.7	-170.4	159.4	0	112.9	S228 W229 L230 R236	S228-K232 WeakPolarHBondContact O-CD 3.45Å; S228-K232 VanDerWaalsContact O-CG 3.27Å; S228-K232 WeakPolarHBondContact O-CG 3.44Å; W229-K232 CarbonylContact O-C 3.56Å; W229-K232 PolarHBondContact O-N 2.58Å; W229-K232 VanDerWaalsContact O-N 3.16Å; L230-K232 VanDerWaalsContact C-N 3.3Å; L230-K232 PolarHBondContact O-N 3.42Å; K232-R236 WeakPolarHBondContact O-CG 3.47Å; K232-R236 PolarHBondContact O-N 2.96Å; K232-R236 VanDerWaalsContact O-N 3.1Å
233	S	86.6	Confident	82.5	Confident	19 Å²	19	84.5 Å²	84.5	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-65.8	-41	173	-170.7	0	0	0	0	111.2	W229 L230 R236 M237 Y256	W229-S233 PolarHBondContact O-N 3.25Å; L230-S233 PolarHBondContact O-N 3.24Å; L230-S233 VanDerWaalsContact O-N 3.1Å; S233-R236 PolarHBondContact O-N 2.99Å; S233-M237 VanDerWaalsContact O-CG 3.32Å; S233-M237 WeakPolarHBondContact O-CG 3.29Å; S233-M237 PolarHBondContact O-N 3.14Å; S233-Y256 PolarHBondContact OG-OH 3.42Å
234	Y	88.7	Confident	84.1	Confident	85 Å²	85	81 Å²	81	33%	0.333	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-46.7	176.1	-173.6	-119	0	0	0	111.7	L230 R231 R236 M237 K238 L248 M259 F262	L230-Y234 PolarHBondContact O-N 3.09Å; R231-Y234 PolarHBondContact O-N 3.4Å; Y234-R236 PolarHBondContact O-N 2.99Å; Y234-M237 HydrophobicContact CD2-CE 4.49Å; Y234-M237 PolarHBondContact O-N 3.22Å; Y234-M237 VanDerWaalsContact O-N 3.11Å; Y234-K238 PolarHBondContact O-N 3.1Å; Y234-L248 HydrophobicContact CE2-CD2 3.79Å; Y234-L248 HydrophobicContact CE2-CG 4.35Å; Y234-M259 HydrophobicContact CD2-CE 4.39Å; Y234-M259 HydrophobicContact CE2-CE 3.85Å; Y234-F262 HydrophobicContact CD2-CD1 4.22Å; Y234-F262 AromaticContact CD2-CE1 3.62Å; Y234-F262 HydrophobicContact CD2-CE1 3.62Å; Y234-F262 HydrophobicContact CD2-CZ 4.41Å; Y234-F262 AromaticContact CG-CE1 3.97Å; Y234-F262 HydrophobicContact CG-CE1 3.97Å
235	Q	88.4	Confident	85.2	Confident	121 Å²	121	87.3 Å²	87.3	57%	0.565	41%	0.407	S	S	*	.	H	α-helix	trans	-63.2	-40.1	179.5	-167.9	159.7	-1.7	0	0	112.4	R231 M237 K238 E239	R231-Q235 PolarHBondContact O-N 2.9Å; R231-Q235 VanDerWaalsContact O-N 3.15Å; Q235-M237 PolarHBondContact O-N 3.42Å; Q235-K238 WeakPolarHBondContact O-CB 3.42Å; Q235-K238 PolarHBondContact O-N 2.97Å; Q235-E239 WeakPolarHBondContact O-CG 3.47Å; Q235-E239 PolarHBondContact O-N 3.13Å
236	R	88.1	Confident	86.2	Confident	175 Å²	175	91.2 Å²	91.2	66%	0.66	40%	0.404	S	S	*	.	H	α-helix	trans	-64.9	-35.5	171.4	-72.2	176.7	-177.1	172.1	0.1	113.6	K232 S233 Y234 K238 E239 Q240	K232-R236 WeakPolarHBondContact O-CG 3.47Å; K232-R236 PolarHBondContact O-N 2.96Å; K232-R236 VanDerWaalsContact O-N 3.1Å; S233-R236 PolarHBondContact O-N 2.99Å; Y234-R236 PolarHBondContact O-N 2.99Å; R236-K238 VanDerWaalsContact C-N 3.33Å; R236-E239 PolarHBondContact O-N 2.9Å; R236-Q240 VanDerWaalsContact O-CB 3.32Å; R236-Q240 WeakPolarHBondContact O-CB 3.45Å; R236-Q240 PolarHBondContact O-N 3.38Å
237	M	90.4	Very high	86.8	Confident	2 Å²	2	91.7 Å²	91.7	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-68.6	-33.8	174.8	-72.2	-176.5	-63	0	0	111.5	S233 Y234 Q235 Q240 A241 L248 I251 V252 R255 Y256 F262	S233-M237 VanDerWaalsContact O-CG 3.32Å; S233-M237 WeakPolarHBondContact O-CG 3.29Å; S233-M237 PolarHBondContact O-N 3.14Å; Y234-M237 HydrophobicContact CD2-CE 4.49Å; Y234-M237 PolarHBondContact O-N 3.22Å; Y234-M237 VanDerWaalsContact O-N 3.11Å; Q235-M237 PolarHBondContact O-N 3.42Å; M237-Q240 PolarHBondContact O-N 2.97Å; M237-A241 WeakPolarHBondContact O-CB 3.36Å; M237-A241 PolarHBondContact O-N 3.03Å; M237-L248 HydrophobicContact CB-CD1 3.94Å; M237-L248 WeakPolarHBondContact O-CD1 3.2Å; M237-I251 HydrophobicContact CB-CG2 4.01Å; M237-I251 HydrophobicContact CG-CG2 4.03Å; M237-V252 HydrophobicContact CB-CG2 4.35Å; M237-V252 HydrophobicContact CE-CG2 3.77Å; M237-V252 HydrophobicContact SD-CB 4.36Å; M237-V252 HydrophobicContact SD-CG2 3.8Å; M237-R255 HydrophobicContact SD-CB 4.33Å; M237-Y256 HydrophobicContact CE-CD2 3.87Å; M237-Y256 HydrophobicContact CE-CE2 3.55Å; M237-Y256 HydrophobicContact SD-CD2 3.79Å; M237-Y256 HydrophobicContact SD-CE2 3.61Å; M237-F262 HydrophobicContact CE-CD2 4.15Å; M237-F262 HydrophobicContact CE-CE1 4.17Å; M237-F262 HydrophobicContact CE-CE2 3.71Å; M237-F262 HydrophobicContact CE-CZ 3.72Å
238	K	89.6	Confident	87.2	Confident	99 Å²	99	92.8 Å²	92.8	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-66	-47.4	170.7	-169.2	175	-172.4	-82	0	112	Y234 Q235 R236 Q240 A241 E242 L248	Y234-K238 PolarHBondContact O-N 3.1Å; Q235-K238 WeakPolarHBondContact O-CB 3.42Å; Q235-K238 PolarHBondContact O-N 2.97Å; R236-K238 VanDerWaalsContact C-N 3.33Å; K238-Q240 VanDerWaalsContact C-N 3.28Å; K238-Q240 PolarHBondContact O-N 2.94Å; K238-A241 PolarHBondContact O-N 2.93Å; K238-E242 IonicContact NZ-OE1 3.2Å; K238-E242 PolarHBondContact NZ-OE1 3.35Å; K238-E242 WeakPolarHBondContact O-CB 3.15Å; K238-E242 WeakPolarHBondContact O-CG 3.37Å; K238-E242 PolarHBondContact O-N 3.36Å; K238-L248 HydrophobicContact CB-CD1 4.38Å; K238-L248 HydrophobicContact CB-CD2 4.35Å; K238-L248 HydrophobicContact CG-CD2 4.42Å
239	E	89.7	Confident	87.4	Confident	104 Å²	104	94 Å²	94	49%	0.486	42%	0.415	S	S	.	.	H	α-helix	trans	-60.2	-36.7	173.8	-70.7	164.5	-167.5	0	0	112.1	Q235 R236 R243	Q235-E239 WeakPolarHBondContact O-CG 3.47Å; Q235-E239 PolarHBondContact O-N 3.13Å; R236-E239 PolarHBondContact O-N 2.9Å; E239-R243 VanDerWaalsContact O-CB 3.23Å; E239-R243 WeakPolarHBondContact O-CB 3.06Å; E239-R243 PolarHBondContact O-N 3.42Å
240	Q	87.4	Confident	87.8	Confident	52 Å²	52	90.5 Å²	90.5	24%	0.243	41%	0.408	C	S	.	.	H	α-helix	trans	-69.6	-41.3	174.5	-170.4	175.9	-4.6	0	0	111.7	R236 M237 K238 R243 E244 I251	R236-Q240 VanDerWaalsContact O-CB 3.32Å; R236-Q240 WeakPolarHBondContact O-CB 3.45Å; R236-Q240 PolarHBondContact O-N 3.38Å; M237-Q240 PolarHBondContact O-N 2.97Å; K238-Q240 VanDerWaalsContact C-N 3.28Å; K238-Q240 PolarHBondContact O-N 2.94Å; Q240-R243 PolarHBondContact O-N 3.45Å; Q240-E244 HydrophobicContact CG-CG 4.4Å; Q240-E244 VanDerWaalsContact CG-OE1 3.23Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.18Å; Q240-E244 PolarHBondContact NE2-OE1 3.03Å; Q240-E244 WeakPolarHBondContact O-CB 3.41Å; Q240-E244 PolarHBondContact O-N 3.3Å; Q240-I251 HydrophobicContact CG-CD1 4.28Å
241	A	91.4	Very high	87.8	Confident	9 Å²	9	89.6 Å²	89.6	7%	0.074	40%	0.403	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176	0	0	0	0	0	112.5	M237 K238 R243 Q245 R246 L248 I251	M237-A241 WeakPolarHBondContact O-CB 3.36Å; M237-A241 PolarHBondContact O-N 3.03Å; K238-A241 PolarHBondContact O-N 2.93Å; A241-R243 VanDerWaalsContact C-N 3.31Å; A241-R243 PolarHBondContact O-N 3.32Å; A241-Q245 WeakPolarHBondContact O-CA 3.36Å; A241-Q245 PolarHBondContact O-N 3.35Å; A241-R246 PolarHBondContact O-N 3.13Å; A241-L248 HydrophobicContact CB-CB 4.3Å; A241-L248 HydrophobicContact CB-CD1 4.22Å; A241-I251 VanDerWaalsContact CA-CD1 3.45Å; A241-I251 HydrophobicContact CB-CD1 3.82Å
242	E	86.6	Confident	88	Confident	118 Å²	118	83.6 Å²	83.6	55%	0.551	38%	0.381	S	S	*	.	H	α-helix	trans	-64.5	-34.6	174.7	-71.3	168.7	-175.7	0	0	112	K238	K238-E242 IonicContact NZ-OE1 3.2Å; K238-E242 PolarHBondContact NZ-OE1 3.35Å; K238-E242 WeakPolarHBondContact O-CB 3.15Å; K238-E242 WeakPolarHBondContact O-CG 3.37Å; K238-E242 PolarHBondContact O-N 3.36Å
243	R	87.3	Confident	88	Confident	224 Å²	224	79.9 Å²	79.9	85%	0.845	37%	0.372	S	S	*	.	H	α-helix	trans	-79.1	-32.9	179.3	-162.5	-177.4	-156	95.7	2.1	114	E239 Q240 A241	E239-R243 VanDerWaalsContact O-CB 3.23Å; E239-R243 WeakPolarHBondContact O-CB 3.06Å; E239-R243 PolarHBondContact O-N 3.42Å; Q240-R243 PolarHBondContact O-N 3.45Å; A241-R243 VanDerWaalsContact C-N 3.31Å; A241-R243 PolarHBondContact O-N 3.32Å
244	E	87.3	Confident	88	Confident	77 Å²	77	85.5 Å²	85.5	36%	0.36	40%	0.396	S	S	.	.	H	α-helix	trans	-94.5	-5.1	178.1	-68.1	-178.1	-151.8	0	0	113.5	Q240 R246	Q240-E244 HydrophobicContact CG-CG 4.4Å; Q240-E244 VanDerWaalsContact CG-OE1 3.23Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.18Å; Q240-E244 PolarHBondContact NE2-OE1 3.03Å; Q240-E244 WeakPolarHBondContact O-CB 3.41Å; Q240-E244 PolarHBondContact O-N 3.3Å; E244-R246 HydrophobicContact CB-CB 4.48Å; E244-R246 HydrophobicContact CB-CG 4.25Å; E244-R246 PolarHBondContact O-N 3.28Å; E244-R246 WeakPolarHBondContact OE2-CD 3.44Å; E244-R246 IonicContact OE2-CZ 3.24Å; E244-R246 IonicContact OE2-NE 3.7Å; E244-R246 IonicContact OE2-NH1 2.71Å; E244-R246 PolarHBondContact OE2-NH1 3.36Å
245	Q	85.9	Confident	87.6	Confident	185 Å²	185	88.7 Å²	88.7	86%	0.864	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	38.4	-172.5	-59.8	-170.6	-3.1	0	0	113.6	A241	A241-Q245 WeakPolarHBondContact O-CA 3.36Å; A241-Q245 PolarHBondContact O-N 3.35Å
246	R	87.8	Confident	87.2	Confident	140 Å²	140	85 Å²	85	53%	0.528	39%	0.388	S	S	.	.			trans	-106.9	162.1	177.6	-75.8	174.3	169.1	161.6	-8.1	111	A241 E244 I251	A241-R246 PolarHBondContact O-N 3.13Å; E244-R246 HydrophobicContact CB-CB 4.48Å; E244-R246 HydrophobicContact CB-CG 4.25Å; E244-R246 PolarHBondContact O-N 3.28Å; E244-R246 WeakPolarHBondContact OE2-CD 3.44Å; E244-R246 IonicContact OE2-CZ 3.24Å; E244-R246 IonicContact OE2-NE 3.7Å; E244-R246 IonicContact OE2-NH1 2.71Å; E244-R246 PolarHBondContact OE2-NH1 3.36Å; R246-I251 HydrophobicContact CB-CD1 3.92Å
247	S	89.9	Confident	87.1	Confident	47 Å²	47	79.2 Å²	79.2	33%	0.329	38%	0.384	S	S	.	.			trans	-68.1	142.8	174.7	91.6	0	0	0	0	110.4	S249 D250 I251	S247-S249 PolarHBondContact O-N 2.74Å; S247-S249 PolarHBondContact OG-OG 2.77Å; S247-D250 VanDerWaalsContact CB-OD2 3.29Å; S247-D250 WeakPolarHBondContact CB-OD2 3.39Å; S247-D250 PolarHBondContact O-N 3.49Å; S247-D250 PolarHBondContact OG-N 3.41Å; S247-D250 PolarHBondContact OG-OD1 2.91Å; S247-D250 PolarHBondContact OG-OD2 3.12Å; S247-I251 PolarHBondContact O-N 3.04Å
248	L	87	Confident	87	Confident	36 Å²	36	80.8 Å²	80.8	19%	0.188	40%	0.395	C	S	.	.	H	α-helix	trans	-62.5	-33.3	177.2	-178.5	53.5	0	0	0	111.4	Y234 M237 K238 A241 D250 I251 V252	Y234-L248 HydrophobicContact CE2-CD2 3.79Å; Y234-L248 HydrophobicContact CE2-CG 4.35Å; M237-L248 HydrophobicContact CB-CD1 3.94Å; M237-L248 WeakPolarHBondContact O-CD1 3.2Å; K238-L248 HydrophobicContact CB-CD1 4.38Å; K238-L248 HydrophobicContact CB-CD2 4.35Å; K238-L248 HydrophobicContact CG-CD2 4.42Å; A241-L248 HydrophobicContact CB-CB 4.3Å; A241-L248 HydrophobicContact CB-CD1 4.22Å; L248-D250 PolarHBondContact O-N 3.43Å; L248-I251 PolarHBondContact O-N 3.12Å; L248-V252 HydrophobicContact CD1-CG2 4Å; L248-V252 HydrophobicContact CG-CG2 4.29Å; L248-V252 WeakPolarHBondContact O-CB 3.34Å; L248-V252 VanDerWaalsContact O-CG2 3.22Å; L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 3.26Å
249	S	84.9	Confident	86.7	Confident	62 Å²	62	78 Å²	78	43%	0.434	38%	0.383	S	S	.	.	H	α-helix	trans	-55.1	-45.1	172.6	19.6	0	0	0	0	112.8	S247 V252 A253	S247-S249 PolarHBondContact O-N 2.74Å; S247-S249 PolarHBondContact OG-OG 2.77Å; S249-V252 PolarHBondContact O-N 3.41Å; S249-A253 VanDerWaalsContact O-CB 3.26Å; S249-A253 WeakPolarHBondContact O-CB 3.36Å; S249-A253 PolarHBondContact O-N 3.36Å
250	D	87.7	Confident	86.4	Confident	82 Å²	82	80.5 Å²	80.5	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-67	-43.5	-177.6	-56.1	-44.7	0	0	0	111.7	S247 L248 A253 Q254	S247-D250 VanDerWaalsContact CB-OD2 3.29Å; S247-D250 WeakPolarHBondContact CB-OD2 3.39Å; S247-D250 PolarHBondContact O-N 3.49Å; S247-D250 PolarHBondContact OG-N 3.41Å; S247-D250 PolarHBondContact OG-OD1 2.91Å; S247-D250 PolarHBondContact OG-OD2 3.12Å; L248-D250 PolarHBondContact O-N 3.43Å; D250-A253 PolarHBondContact O-N 3.34Å; D250-Q254 WeakPolarHBondContact O-CB 3.39Å; D250-Q254 VanDerWaalsContact O-CG 3.26Å; D250-Q254 WeakPolarHBondContact O-CG 3.36Å; D250-Q254 PolarHBondContact O-N 3.09Å
251	I	88	Confident	86.1	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.005	40%	0.402	C	S	.	.	H	α-helix	trans	-71.3	-32.8	-179	-73.8	163.3	0	0	0	111.6	M237 Q240 A241 R246 S247 L248	M237-I251 HydrophobicContact CB-CG2 4.01Å; M237-I251 HydrophobicContact CG-CG2 4.03Å; Q240-I251 HydrophobicContact CG-CD1 4.28Å; A241-I251 VanDerWaalsContact CA-CD1 3.45Å; A241-I251 HydrophobicContact CB-CD1 3.82Å; R246-I251 HydrophobicContact CB-CD1 3.92Å; S247-I251 PolarHBondContact O-N 3.04Å; L248-I251 PolarHBondContact O-N 3.12Å
252	V	88.5	Confident	86	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-70.6	-44.5	171.6	176.2	0	0	0	0	110.6	M237 L248 S249 Q254 R255 Y256 M259 F262	M237-V252 HydrophobicContact CB-CG2 4.35Å; M237-V252 HydrophobicContact CE-CG2 3.77Å; M237-V252 HydrophobicContact SD-CB 4.36Å; M237-V252 HydrophobicContact SD-CG2 3.8Å; L248-V252 HydrophobicContact CD1-CG2 4Å; L248-V252 HydrophobicContact CG-CG2 4.29Å; L248-V252 WeakPolarHBondContact O-CB 3.34Å; L248-V252 VanDerWaalsContact O-CG2 3.22Å; L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 3.26Å; S249-V252 PolarHBondContact O-N 3.41Å; V252-Q254 PolarHBondContact O-N 2.78Å; V252-R255 PolarHBondContact O-N 3.45Å; V252-R255 VanDerWaalsContact O-N 3.13Å; V252-Y256 PolarHBondContact O-N 2.79Å; V252-M259 HydrophobicContact CB-CE 4.35Å; V252-M259 HydrophobicContact CB-SD 3.97Å; V252-M259 HydrophobicContact CG1-CE 3.84Å; V252-M259 HydrophobicContact CG1-SD 3.98Å; V252-M259 HydrophobicContact CG2-CE 4.05Å; V252-M259 HydrophobicContact CG2-SD 3.84Å; V252-F262 HydrophobicContact CG1-CB 3.65Å; V252-F262 HydrophobicContact CG1-CD1 4.4Å; V252-F262 HydrophobicContact CG1-CG 3.95Å
253	A	87.6	Confident	86	Confident	39 Å²	39	80.7 Å²	80.7	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-59.7	-44.8	177.5	0	0	0	0	0	112.1	S249 D250 R255 G257	S249-A253 VanDerWaalsContact O-CB 3.26Å; S249-A253 WeakPolarHBondContact O-CB 3.36Å; S249-A253 PolarHBondContact O-N 3.36Å; D250-A253 PolarHBondContact O-N 3.34Å; A253-R255 PolarHBondContact O-N 3.26Å; A253-R255 VanDerWaalsContact O-N 3.13Å; A253-G257 WeakPolarHBondContact CA-O 3.32Å; A253-G257 WeakPolarHBondContact CB-O 3.38Å; A253-G257 CarbonylContact O-C 3.53Å; A253-G257 WeakPolarHBondContact O-CA 3.49Å; A253-G257 PolarHBondContact O-N 2.95Å
254	Q	86.4	Confident	85.9	Confident	138 Å²	138	76.7 Å²	76.7	65%	0.645	38%	0.383	S	S	*	.	H	α-helix	trans	-59.4	-23.1	176.1	-76.2	174.6	18.4	0	0	114.5	D250 V252	D250-Q254 WeakPolarHBondContact O-CB 3.39Å; D250-Q254 VanDerWaalsContact O-CG 3.26Å; D250-Q254 WeakPolarHBondContact O-CG 3.36Å; D250-Q254 PolarHBondContact O-N 3.09Å; V252-Q254 PolarHBondContact O-N 2.78Å
255	R	80.1	Confident	85.8	Confident	151 Å²	151	78.4 Å²	78.4	57%	0.57	39%	0.387	S	S	*	.	H	α-helix	trans	-107.7	-27.7	-177.9	-69.2	-179.3	179.9	-87	8.8	114.4	M237 V252 A253	M237-R255 HydrophobicContact SD-CB 4.33Å; V252-R255 PolarHBondContact O-N 3.45Å; V252-R255 VanDerWaalsContact O-N 3.13Å; A253-R255 PolarHBondContact O-N 3.26Å; A253-R255 VanDerWaalsContact O-N 3.13Å
256	Y	80.3	Confident	85.9	Confident	44 Å²	44	71.2 Å²	71.2	17%	0.173	35%	0.354	C	S	.	.	H	α-helix	trans	-135.3	12.6	-169.2	-66.6	-79.2	0	0	0	114.1	W229 S233 M237 V252 S258 F262 R265	W229-Y256 WeakPolarHBondContact CH2-OH 3.32Å; W229-Y256 HydrophobicContact CZ3-CE1 4.4Å; W229-Y256 VanDerWaalsContact CZ3-OH 3.23Å; W229-Y256 WeakPolarHBondContact CZ3-OH 3.22Å; S233-Y256 PolarHBondContact OG-OH 3.42Å; M237-Y256 HydrophobicContact CE-CD2 3.87Å; M237-Y256 HydrophobicContact CE-CE2 3.55Å; M237-Y256 HydrophobicContact SD-CD2 3.79Å; M237-Y256 HydrophobicContact SD-CE2 3.61Å; V252-Y256 PolarHBondContact O-N 2.79Å; Y256-S258 VanDerWaalsContact C-N 3.26Å; Y256-S258 PolarHBondContact O-N 2.89Å; Y256-F262 AromaticContact CD1-CD2 3.88Å; Y256-F262 HydrophobicContact CD1-CD2 3.88Å; Y256-F262 HydrophobicContact CD1-CE2 4.4Å; Y256-F262 AromaticContact CD2-CD2 3.53Å; Y256-F262 HydrophobicContact CD2-CD2 3.53Å; Y256-F262 AromaticContact CD2-CE2 3.94Å; Y256-F262 HydrophobicContact CD2-CE2 3.94Å; Y256-F262 HydrophobicContact CD2-CG 4.43Å; Y256-F262 HydrophobicContact CE1-CD2 4.1Å; Y256-F262 HydrophobicContact CE1-CE2 4.16Å; Y256-F262 AromaticContact CE2-CD2 3.78Å; Y256-F262 HydrophobicContact CE2-CD2 3.78Å; Y256-F262 AromaticContact CE2-CE2 3.67Å; Y256-F262 HydrophobicContact CE2-CE2 3.67Å; Y256-F262 AromaticContact CG-CD2 3.57Å; Y256-F262 HydrophobicContact CG-CD2 3.57Å; Y256-F262 HydrophobicContact CG-CE2 4.29Å; Y256-F262 HydrophobicContact CG-CG 4.47Å; Y256-F262 AromaticContact CZ-CE2 3.78Å; Y256-R265 PolarHBondContact O-NH1 3.01Å
257	G	86.4	Confident	85.6	Confident	54 Å²	54	67.1 Å²	67.1	56%	0.557	35%	0.35	S	S	*	.	S	Bend	trans	83.6	-59.7	179.5	0	0	0	0	0	112.5	A253	A253-G257 WeakPolarHBondContact CA-O 3.32Å; A253-G257 WeakPolarHBondContact CB-O 3.38Å; A253-G257 CarbonylContact O-C 3.53Å; A253-G257 WeakPolarHBondContact O-CA 3.49Å; A253-G257 PolarHBondContact O-N 2.95Å
258	S	87.3	Confident	85.2	Confident	35 Å²	35	69.1 Å²	69.1	25%	0.245	36%	0.357	C	S	.	.			trans	-146.5	159	178.7	66.4	0	0	0	0	113.1	Y256 E260 E261 F262	Y256-S258 VanDerWaalsContact C-N 3.26Å; Y256-S258 PolarHBondContact O-N 2.89Å; S258-E260 VanDerWaalsContact C-N 3.31Å; S258-E261 VanDerWaalsContact OG-CB 3.29Å; S258-E261 WeakPolarHBondContact OG-CB 3.3Å; S258-E261 WeakPolarHBondContact OG-CG 3.44Å; S258-E261 PolarHBondContact OG-N 2.7Å; S258-E261 VanDerWaalsContact OG-N 3.13Å; S258-E261 PolarHBondContact OG-OE1 3.49Å; S258-F262 PolarHBondContact O-N 3.32Å
259	M	82.9	Confident	84.8	Confident	39 Å²	39	67.9 Å²	67.9	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-63.2	-38.9	174.3	-171.1	70.8	-102.4	0	0	111.4	Y234 V252 F262 Q263	Y234-M259 HydrophobicContact CD2-CE 4.39Å; Y234-M259 HydrophobicContact CE2-CE 3.85Å; V252-M259 HydrophobicContact CB-CE 4.35Å; V252-M259 HydrophobicContact CB-SD 3.97Å; V252-M259 HydrophobicContact CG1-CE 3.84Å; V252-M259 HydrophobicContact CG1-SD 3.98Å; V252-M259 HydrophobicContact CG2-CE 4.05Å; V252-M259 HydrophobicContact CG2-SD 3.84Å; M259-F262 HydrophobicContact CE-CB 4.32Å; M259-F262 HydrophobicContact CE-CD1 3.77Å; M259-F262 HydrophobicContact CE-CG 4.43Å; M259-F262 PolarHBondContact O-N 3.27Å; M259-Q263 HydrophobicContact CE-CG 3.89Å; M259-Q263 WeakPolarHBondContact O-CG 3.3Å; M259-Q263 PolarHBondContact O-N 3.24Å
260	E	82.9	Confident	84.5	Confident	157 Å²	157	67.7 Å²	67.7	73%	0.734	34%	0.344	S	S	*	.	H	α-helix	trans	-69.1	-43	-179.1	-62.4	-177.9	177.9	0	0	112.1	S258 F262 Q263 K264	S258-E260 VanDerWaalsContact C-N 3.31Å; E260-F262 VanDerWaalsContact C-N 3.31Å; E260-F262 PolarHBondContact O-N 2.9Å; E260-Q263 PolarHBondContact O-N 2.86Å; E260-K264 WeakPolarHBondContact O-CB 3.24Å; E260-K264 PolarHBondContact O-N 2.91Å
261	E	82.3	Confident	84	Confident	81 Å²	81	71.3 Å²	71.3	38%	0.379	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-39.4	173	-83.8	-177.1	-114.1	0	0	112.4	S258 K264 R265	S258-E261 VanDerWaalsContact OG-CB 3.29Å; S258-E261 WeakPolarHBondContact OG-CB 3.3Å; S258-E261 WeakPolarHBondContact OG-CG 3.44Å; S258-E261 PolarHBondContact OG-N 2.7Å; S258-E261 VanDerWaalsContact OG-N 3.13Å; S258-E261 PolarHBondContact OG-OE1 3.49Å; E261-K264 PolarHBondContact O-N 3.28Å; E261-R265 WeakPolarHBondContact O-CB 3.43Å; E261-R265 VanDerWaalsContact O-CG 3.32Å; E261-R265 WeakPolarHBondContact O-CG 3.23Å; E261-R265 PolarHBondContact O-N 3.41Å; E261-R265 IonicContact OE2-CZ 3.55Å; E261-R265 IonicContact OE2-NH1 2.91Å; E261-R265 PolarHBondContact OE2-NH1 2.85Å; E261-R265 IonicContact OE2-NH2 3.68Å; E261-R265 PolarHBondContact OE2-NH2 2.85Å
262	F	88.1	Confident	83.3	Confident	1 Å²	1	74.6 Å²	74.6	0%	0.004	38%	0.383	C	S	.	.	H	α-helix	trans	-66.1	-43	176.8	-177.6	-91.8	0	0	0	111.6	L230 Y234 M237 V252 Y256 S258 M259 E260 R265 L266	L230-F262 HydrophobicContact CD2-CE2 3.83Å; L230-F262 HydrophobicContact CD2-CZ 4.38Å; Y234-F262 HydrophobicContact CD2-CD1 4.22Å; Y234-F262 AromaticContact CD2-CE1 3.62Å; Y234-F262 HydrophobicContact CD2-CE1 3.62Å; Y234-F262 HydrophobicContact CD2-CZ 4.41Å; Y234-F262 AromaticContact CG-CE1 3.97Å; Y234-F262 HydrophobicContact CG-CE1 3.97Å; M237-F262 HydrophobicContact CE-CD2 4.15Å; M237-F262 HydrophobicContact CE-CE1 4.17Å; M237-F262 HydrophobicContact CE-CE2 3.71Å; M237-F262 HydrophobicContact CE-CZ 3.72Å; V252-F262 HydrophobicContact CG1-CB 3.65Å; V252-F262 HydrophobicContact CG1-CD1 4.4Å; V252-F262 HydrophobicContact CG1-CG 3.95Å; Y256-F262 AromaticContact CD1-CD2 3.88Å; Y256-F262 HydrophobicContact CD1-CD2 3.88Å; Y256-F262 HydrophobicContact CD1-CE2 4.4Å; Y256-F262 AromaticContact CD2-CD2 3.53Å; Y256-F262 HydrophobicContact CD2-CD2 3.53Å; Y256-F262 AromaticContact CD2-CE2 3.94Å; Y256-F262 HydrophobicContact CD2-CE2 3.94Å; Y256-F262 HydrophobicContact CD2-CG 4.43Å; Y256-F262 HydrophobicContact CE1-CD2 4.1Å; Y256-F262 HydrophobicContact CE1-CE2 4.16Å; Y256-F262 AromaticContact CE2-CD2 3.78Å; Y256-F262 HydrophobicContact CE2-CD2 3.78Å; Y256-F262 AromaticContact CE2-CE2 3.67Å; Y256-F262 HydrophobicContact CE2-CE2 3.67Å; Y256-F262 AromaticContact CG-CD2 3.57Å; Y256-F262 HydrophobicContact CG-CD2 3.57Å; Y256-F262 HydrophobicContact CG-CE2 4.29Å; Y256-F262 HydrophobicContact CG-CG 4.47Å; Y256-F262 AromaticContact CZ-CE2 3.78Å; S258-F262 PolarHBondContact O-N 3.32Å; M259-F262 HydrophobicContact CE-CB 4.32Å; M259-F262 HydrophobicContact CE-CD1 3.77Å; M259-F262 HydrophobicContact CE-CG 4.43Å; M259-F262 PolarHBondContact O-N 3.27Å; E260-F262 VanDerWaalsContact C-N 3.31Å; E260-F262 PolarHBondContact O-N 2.9Å; F262-R265 PolarHBondContact O-N 3.47Å; F262-L266 WeakPolarHBondContact O-CB 3.41Å; F262-L266 PolarHBondContact O-N 3.08Å
263	Q	86.5	Confident	82.3	Confident	102 Å²	102	77.7 Å²	77.7	48%	0.477	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-39.3	174.2	-73.1	175.6	3.9	0	0	112.1	M259 E260 L266 A267	M259-Q263 HydrophobicContact CE-CG 3.89Å; M259-Q263 WeakPolarHBondContact O-CG 3.3Å; M259-Q263 PolarHBondContact O-N 3.24Å; E260-Q263 PolarHBondContact O-N 2.86Å; Q263-L266 WeakPolarHBondContact O-CB 3.47Å; Q263-L266 PolarHBondContact O-N 2.85Å; Q263-A267 WeakPolarHBondContact O-CB 3.27Å; Q263-A267 PolarHBondContact O-N 3.08Å
264	K	86.9	Confident	81.3	Confident	140 Å²	140	82.7 Å²	82.7	61%	0.609	42%	0.418	S	S	*	.	H	α-helix	trans	-62.7	-48.9	174.6	-175.3	176.9	179.1	-178.9	0	111.8	E260 E261 L266 A267 D268	E260-K264 WeakPolarHBondContact O-CB 3.24Å; E260-K264 PolarHBondContact O-N 2.91Å; E261-K264 PolarHBondContact O-N 3.28Å; K264-L266 PolarHBondContact O-N 3.43Å; K264-A267 PolarHBondContact O-N 2.97Å; K264-A267 VanDerWaalsContact O-N 3.14Å; K264-D268 PolarHBondContact O-N 3.32Å
265	R	84.4	Confident	79.8	Confident	113 Å²	113	79 Å²	79	43%	0.426	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-34.6	175.2	-72.6	173.7	-178.3	115.4	11.7	112.3	L230 Y256 E261 F262 A269	L230-R265 HydrophobicContact CD1-CB 4.47Å; L230-R265 WeakPolarHBondContact CD1-O 3.48Å; Y256-R265 PolarHBondContact O-NH1 3.01Å; E261-R265 WeakPolarHBondContact O-CB 3.43Å; E261-R265 VanDerWaalsContact O-CG 3.32Å; E261-R265 WeakPolarHBondContact O-CG 3.23Å; E261-R265 PolarHBondContact O-N 3.41Å; E261-R265 IonicContact OE2-CZ 3.55Å; E261-R265 IonicContact OE2-NH1 2.91Å; E261-R265 PolarHBondContact OE2-NH1 2.85Å; E261-R265 IonicContact OE2-NH2 3.68Å; E261-R265 PolarHBondContact OE2-NH2 2.85Å; F262-R265 PolarHBondContact O-N 3.47Å; R265-A269 WeakPolarHBondContact O-CB 3.38Å; R265-A269 PolarHBondContact O-N 3.21Å
266	L	87.6	Confident	78.4	Confident	34 Å²	34	80.8 Å²	80.8	18%	0.178	43%	0.432	C	S	.	.	H	α-helix	trans	-67.1	-49.8	172.9	-169.1	74	0	0	0	111.5	L227 L230 R231 F262 Q263 K264 D268 A269 E270	L227-L266 HydrophobicContact CD1-CD1 3.97Å; L230-L266 HydrophobicContact CB-CD1 3.68Å; R231-L266 HydrophobicContact CG-CD1 3.81Å; F262-L266 WeakPolarHBondContact O-CB 3.41Å; F262-L266 PolarHBondContact O-N 3.08Å; Q263-L266 WeakPolarHBondContact O-CB 3.47Å; Q263-L266 PolarHBondContact O-N 2.85Å; K264-L266 PolarHBondContact O-N 3.43Å; L266-D268 PolarHBondContact O-N 2.78Å; L266-A269 PolarHBondContact O-N 2.93Å; L266-E270 WeakPolarHBondContact O-CG 3.48Å; L266-E270 PolarHBondContact O-N 3.33Å
267	A	81.9	Confident	76.2	Confident	53 Å²	53	83.9 Å²	83.9	44%	0.438	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-39.8	-178.8	0	0	0	0	0	113.1	Q263 K264 A269 E270 K271	Q263-A267 WeakPolarHBondContact O-CB 3.27Å; Q263-A267 PolarHBondContact O-N 3.08Å; K264-A267 PolarHBondContact O-N 2.97Å; K264-A267 VanDerWaalsContact O-N 3.14Å; A267-A269 VanDerWaalsContact C-N 3.32Å; A267-A269 PolarHBondContact O-N 3.2Å; A267-E270 PolarHBondContact O-N 2.91Å; A267-K271 WeakPolarHBondContact O-CB 3.45Å; A267-K271 PolarHBondContact O-N 3.2Å
268	D	81.1	Confident	73.6	Confident	89 Å²	89	93.3 Å²	93.3	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-38.1	175.1	-72.4	-32.7	0	0	0	111.1	K264 L266 K271 A272	K264-D268 PolarHBondContact O-N 3.32Å; L266-D268 PolarHBondContact O-N 2.78Å; D268-K271 PolarHBondContact O-N 2.71Å; D268-A272 WeakPolarHBondContact O-CB 3.37Å; D268-A272 PolarHBondContact O-N 3.33Å
269	A	79.6	Confident	70.9	Confident	10 Å²	10	95.3 Å²	95.3	8%	0.083	51%	0.505	C	S	.	.	H	α-helix	trans	-70	-36.7	174	0	0	0	0	0	113.1	L227 L230 R265 L266 A267 A272 V273	L227-A269 HydrophobicContact CB-CB 4.11Å; L227-A269 HydrophobicContact CD1-CB 4.33Å; L230-A269 HydrophobicContact CD1-CB 4.12Å; R265-A269 WeakPolarHBondContact O-CB 3.38Å; R265-A269 PolarHBondContact O-N 3.21Å; L266-A269 PolarHBondContact O-N 2.93Å; A267-A269 VanDerWaalsContact C-N 3.32Å; A267-A269 PolarHBondContact O-N 3.2Å; A269-A272 PolarHBondContact O-N 3.29Å; A269-V273 WeakPolarHBondContact O-CG2 3.07Å; A269-V273 PolarHBondContact O-N 2.82Å
270	E	79.2	Confident	68.3	Low	58 Å²	58	101 Å²	101	27%	0.271	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-40.8	172.8	-69.5	-174.6	-179.4	0	0	111.6	L227 R231 L266 A267 V273 H274	L227-E270 HydrophobicContact CD1-CB 4.48Å; L227-E270 HydrophobicContact CD1-CG 3.29Å; L227-E270 HydrophobicContact CD2-CG 3.86Å; L227-E270 HydrophobicContact CG-CG 4.2Å; R231-E270 IonicContact CZ-OE1 2.85Å; R231-E270 IonicContact NE-OE1 2.7Å; R231-E270 PolarHBondContact NE-OE1 2.72Å; R231-E270 IonicContact NH2-OE1 3.25Å; R231-E270 PolarHBondContact NH2-OE1 3.27Å; R231-E270 IonicContact NH2-OE2 2.73Å; L266-E270 WeakPolarHBondContact O-CG 3.48Å; L266-E270 PolarHBondContact O-N 3.33Å; A267-E270 PolarHBondContact O-N 2.91Å; E270-V273 PolarHBondContact O-N 3.05Å; E270-H274 WeakPolarHBondContact O-CB 3.5Å; E270-H274 PolarHBondContact O-CD2 2.84Å; E270-H274 VanDerWaalsContact O-CD2 3.26Å; E270-H274 PolarHBondContact O-N 2.86Å
271	K	76.7	Confident	65.7	Low	159 Å²	159	104 Å²	104	69%	0.691	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-36.5	176.5	-168.9	175.6	-179	-178.8	0	112.5	A267 D268 G275	A267-K271 WeakPolarHBondContact O-CB 3.45Å; A267-K271 PolarHBondContact O-N 3.2Å; D268-K271 PolarHBondContact O-N 2.71Å; K271-G275 PolarHBondContact O-N 2.73Å
272	A	72	Confident	63.1	Low	69 Å²	69	107.5 Å²	107.5	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-64.8	-42.7	174.2	0	0	0	0	0	112.4	D268 A269	D268-A272 WeakPolarHBondContact O-CB 3.37Å; D268-A272 PolarHBondContact O-N 3.33Å; A269-A272 PolarHBondContact O-N 3.29Å
273	V	68.6	Low	60.2	Low	65 Å²	65	118.3 Å²	118.3	39%	0.394	60%	0.598	S	S	.	*	H	α-helix	trans	-74.2	-29.5	-179.3	172.9	0	0	0	0	112.9	D224 L227 A269 E270	D224-V273 WeakPolarHBondContact O-CG2 2.97Å; L227-V273 HydrophobicContact CB-CG2 4.3Å; L227-V273 HydrophobicContact CD2-CB 4.25Å; L227-V273 HydrophobicContact CD2-CG1 4.47Å; L227-V273 HydrophobicContact CD2-CG2 4.13Å; A269-V273 WeakPolarHBondContact O-CG2 3.07Å; A269-V273 PolarHBondContact O-N 2.82Å; E270-V273 PolarHBondContact O-N 3.05Å
274	H	66.1	Low	57.4	Low	145 Å²	145	119 Å²	119	67%	0.671	61%	0.614	S	S	*	*	H	α-helix	trans	-101.5	1.1	-177.6	-66.7	-56.2	0	0	0	115.1	E270	E270-H274 WeakPolarHBondContact O-CB 3.5Å; E270-H274 PolarHBondContact O-CD2 2.84Å; E270-H274 VanDerWaalsContact O-CD2 3.26Å; E270-H274 PolarHBondContact O-N 2.86Å
275	G	54.8	Low	54.9	Low	60 Å²	60	117.2 Å²	117.2	62%	0.619	63%	0.625	S	S	*	*	S	Bend	trans	-76.3	-27.2	-175.3	0	0	0	0	0	115.9	K271	K271-G275 PolarHBondContact O-N 2.73Å
276	E	51.5	Low	52.2	Low	188 Å²	188	121.7 Å²	121.7	88%	0.879	64%	0.642	S	S	*	*	S	Bend	trans	-108.6	83.3	-169.3	-66.1	-167.4	115.1	0	0	113.7
277	S	32.8	Very low	49.2	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	67%	0.671	S	S	*	*			trans	165.6	108.2	132.3	-178.5	0	0	0	0	113.6
278	R	32.8	Very low	46.6	Very low	252 Å²	252	129.1 Å²	129.1	95%	0.951	69%	0.686	S	S	*	*			trans	178.4	101.5	132.5	-100.3	168.2	179.7	-165.8	-1.5	109.8
279	G	30.5	Very low	43.7	Very low	77 Å²	77	135.6 Å²	135.6	79%	0.794	70%	0.704	S	S	*	*	S	Bend	trans	-152.6	29.8	-169.5	0	0	0	0	0	116
280	N	28.1	Very low	41.1	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	74%	0.735	S	S	*	*			trans	67.4	152	177	-156.9	24.3	0	0	0	117.3
281	R	27.7	Very low	38.5	Very low	222 Å²	222	151.2 Å²	151.2	84%	0.838	76%	0.758	S	S	*	*			trans	-143.8	148.7	173.9	175.5	180	175.8	165.4	0.2	106.3
282	E	27.7	Very low	36	Very low	154 Å²	154	146.4 Å²	146.4	72%	0.72	75%	0.753	S	S	*	*			trans	84.9	137	-172.8	-58.6	-162.8	175.8	0	0	114.5
283	R	28.4	Very low	33.7	Very low	228 Å²	228	148.8 Å²	148.8	86%	0.86	75%	0.753	S	S	*	*			cis	-163.8	113.1	-10.5	172.7	-169.4	-143.3	-179.8	8.8	110.5
284	S	26.9	Very low	31.6	Very low	117 Å²	117	154.2 Å²	154.2	82%	0.818	77%	0.774	S	S	*	*			trans	-149.9	124.8	150.8	-169.3	0	0	0	0	110.2
285	A	33.8	Very low	29.8	Very low	102 Å²	102	155.2 Å²	155.2	84%	0.843	78%	0.784	S	S	*	*			trans	-136.8	73.7	175	0	0	0	0	0	108.4
286	R	28.2	Very low	28.5	Very low	206 Å²	206	158.3 Å²	158.3	78%	0.777	79%	0.787	S	S	*	*			trans	-161.5	145.5	163.6	-132.2	176.4	175.5	151.9	3.7	112.8
287	E	25.8	Very low	27.3	Very low	171 Å²	171	159.8 Å²	159.8	80%	0.799	78%	0.784	S	S	*	*			trans	64	159.9	165	-70.8	148.2	-131.5	0	0	116.7
288	G	25.7	Very low	26.9	Very low	72 Å²	72	163 Å²	163	74%	0.742	79%	0.787	S	S	*	*			trans	125	61.3	-177.7	0	0	0	0	0	115.9
289	W	21.5	Very low	26.5	Very low	226 Å²	226	161.9 Å²	161.9	86%	0.856	78%	0.783	S	S	*	*			trans	-61.1	164.7	147	-53.7	71.4	0	0	0	107.9
290	R	24.2	Very low	26.2	Very low	196 Å²	196	168 Å²	168	74%	0.74	78%	0.782	S	S	*	*			cis	-175.7	157.6	26	-146.5	162.5	-157	-116.1	7.3	108.6
291	R	25.1	Very low	26.1	Very low	200 Å²	200	170.6 Å²	170.6	76%	0.755	78%	0.78	S	S	*	*			trans	61.9	158.4	164.1	-87.7	-177.5	141.3	160.4	-1.3	116.7	E293	R291-E293 WeakPolarHBondContact CD-OE2 3.28Å; R291-E293 IonicContact CZ-OE1 3.88Å; R291-E293 IonicContact CZ-OE2 3.78Å; R291-E293 IonicContact NE-OE1 3.2Å; R291-E293 PolarHBondContact NE-OE1 2.85Å; R291-E293 IonicContact NE-OE2 2.88Å; R291-E293 PolarHBondContact NE-OE2 2.81Å; R291-E293 IonicContact NH2-OE1 3.39Å; R291-E293 PolarHBondContact NH2-OE1 3.17Å; R291-E293 IonicContact NH2-OE2 3.75Å
292	G	23.7	Very low	25.9	Very low	57 Å²	57	164.3 Å²	164.3	59%	0.588	78%	0.776	S	S	*	*			cis	158.3	169.2	-6.3	0	0	0	0	0	112.3
293	E	24.9	Very low	25.8	Very low	120 Å²	120	166.6 Å²	166.6	56%	0.561	78%	0.778	S	S	*	*			trans	54.7	99.2	169	-72.6	102.5	178.8	0	0	114.9	R291	R291-E293 WeakPolarHBondContact CD-OE2 3.28Å; R291-E293 IonicContact CZ-OE1 3.88Å; R291-E293 IonicContact CZ-OE2 3.78Å; R291-E293 IonicContact NE-OE1 3.2Å; R291-E293 PolarHBondContact NE-OE1 2.85Å; R291-E293 IonicContact NE-OE2 2.88Å; R291-E293 PolarHBondContact NE-OE2 2.81Å; R291-E293 IonicContact NH2-OE1 3.39Å; R291-E293 PolarHBondContact NH2-OE1 3.17Å; R291-E293 IonicContact NH2-OE2 3.75Å
294	E	24.2	Very low	25.6	Very low	179 Å²	179	162.4 Å²	162.4	84%	0.836	77%	0.768	S	S	*	*				80.3	111.5	89.6	-78.3	171.2	167.9	0	0	113.1
295	D	28.4	Very low	25.5	Very low	166 Å²	166	164.2 Å²	164.2	89%	0.888	77%	0.769	S	S	*	*				-145.8	160.5	124.4	-144.9	-20	0	0	0	109.8
296	D	26.8	Very low	25.2	Very low	125 Å²	125	165.8 Å²	165.8	67%	0.668	76%	0.763	S	S	*	*				-92.5	166.5	-123.9	-139.3	-23.3	0	0	0	118.1
297	R	26.7	Very low	25.3	Very low	218 Å²	218	167.6 Å²	167.6	82%	0.823	77%	0.769	S	S	*	*			trans	-53.3	134.8	156.4	-58.1	148.5	167.3	154.2	-3.9	110
298	E	24.8	Very low	25.3	Very low	178 Å²	178	168.2 Å²	168.2	83%	0.832	77%	0.772	S	S	*	*				-179	138.5	103.9	-102	-164.8	-167.5	0	0	112.1
299	R	24.5	Very low	25.4	Very low	228 Å²	228	171 Å²	171	86%	0.86	77%	0.77	S	S	*	*				167.2	137.6	111.2	178.2	162.6	-88.7	-158.9	-6.5	110.8
300	W	24.3	Very low	25.7	Very low	205 Å²	205	170.4 Å²	170.4	78%	0.777	77%	0.768	S	S	*	*			trans	-84.9	152.9	179.9	-82.4	79.3	0	0	0	113.5
301	R	24.3	Very low	25.9	Very low	212 Å²	212	167 Å²	167	80%	0.8	77%	0.765	S	S	*	*			trans	61	121.1	153.7	-64.9	159	-173.3	149	2.9	118.6
302	A	24.8	Very low	25.9	Very low	91 Å²	91	166.7 Å²	166.7	75%	0.752	76%	0.763	S	S	*	*				-163.7	160.8	114.2	0	0	0	0	0	111.1
303	R	24.3	Very low	26	Very low	202 Å²	202	174.6 Å²	174.6	76%	0.762	78%	0.776	S	S	*	*			trans	20.9	146	138.2	-64.2	179.5	172.6	-94.7	-2.4	118.7
304	E	24.2	Very low	26	Very low	139 Å²	139	179.1 Å²	179.1	65%	0.65	79%	0.788	S	S	*	*			cis	173.3	174.9	1.5	-106.6	157.4	166.5	0	0	104.2
305	D	25.2	Very low	26	Very low	156 Å²	156	181.5 Å²	181.5	83%	0.834	79%	0.789	S	S	*	*			trans	68.2	151.4	163.4	-92	-28.3	0	0	0	122.7
306	D	27.5	Very low	25.9	Very low	134 Å²	134	178 Å²	178	72%	0.717	78%	0.777	S	S	*	*			trans	40.3	107.2	161.7	-84.4	-23.7	0	0	0	121
307	R	30.2	Very low	25.9	Very low	244 Å²	244	178.6 Å²	178.6	92%	0.921	78%	0.776	S	S	*	*				-168.2	159.8	99.7	-100.1	152.9	-162	-160.6	3.4	115.1
308	Q	25.7	Very low	25.9	Very low	184 Å²	184	177.7 Å²	177.7	86%	0.86	77%	0.773	S	S	*	*			trans	-100.7	162.2	176.8	-63.5	174.8	3.4	0	0	112.4
309	D	28.3	Very low	26	Very low	131 Å²	131	174.8 Å²	174.8	70%	0.701	76%	0.763	S	S	*	*			trans	80.3	130.9	156.4	-151	24.7	0	0	0	119.7
310	R	28.1	Very low	26.1	Very low	213 Å²	213	171.4 Å²	171.4	80%	0.804	76%	0.761	S	S	*	*			trans	55.4	133.1	173.3	-62.7	164.6	-163.9	-136.7	-3.6	116.9
311	D	28.2	Very low	26.2	Very low	125 Å²	125	166.5 Å²	166.5	67%	0.668	76%	0.758	S	S	*	*			cis	-163.3	149.9	36.1	-144.3	0.9	0	0	0	113.8
312	R	25.6	Very low	26.9	Very low	194 Å²	194	161.4 Å²	161.4	73%	0.732	75%	0.752	S	S	*	*			trans	66.4	107.1	131.3	-167.3	170.5	-71.6	-136.4	-6.7	124.2
313	W	25.1	Very low	26.9	Very low	222 Å²	222	167 Å²	167	84%	0.841	75%	0.754	S	S	*	*			trans	79.7	128.8	146.1	-77.8	123	0	0	0	123.5
314	R	25.3	Very low	27	Very low	216 Å²	216	162.8 Å²	162.8	82%	0.815	74%	0.743	S	S	*	*			trans	86.6	123.6	145.7	-76.1	-173.9	175.4	-155.1	-0.8	123.2
315	R	24.3	Very low	27	Very low	229 Å²	229	164.9 Å²	164.9	86%	0.864	75%	0.75	S	S	*	*			trans	91.6	130.9	136	-110.4	-172.9	-178.5	-164.5	-1.5	122.3
316	S	25.1	Very low	27	Very low	92 Å²	92	160.3 Å²	160.3	64%	0.643	74%	0.74	S	S	*	*			trans	56.2	117.3	147.6	-74.1	0	0	0	0	123.1
317	E	26.7	Very low	27	Very low	138 Å²	138	159.3 Å²	159.3	65%	0.645	74%	0.743	S	S	*	*				53.9	126.7	127.1	-68.7	-172.4	90.6	0	0	122.7
318	R	27.1	Very low	26.8	Very low	199 Å²	199	153 Å²	153	75%	0.751	73%	0.728	S	S	*	*			trans	71.8	149.9	145	-67.9	175.8	-145.8	-106	-0.3	117.2
319	D	26.7	Very low	26.8	Very low	117 Å²	117	154.5 Å²	154.5	63%	0.626	73%	0.726	S	S	*	*			cis	-150.1	161	-4.5	-126.1	-37.1	0	0	0	112.9
320	L	26.7	Very low	26.8	Very low	156 Å²	156	159.7 Å²	159.7	82%	0.817	74%	0.736	S	S	*	*			trans	64.9	149.5	156.3	-62.8	170	0	0	0	122.3
321	S	26	Very low	26.7	Very low	102 Å²	102	153 Å²	153	71%	0.713	73%	0.733	S	S	*	*			trans	-86.3	-177.7	176.7	66.6	0	0	0	0	110.6
322	P	39.9	Very low	26.8	Very low	105 Å²	105	154.6 Å²	154.6	68%	0.682	74%	0.741	S	S	*	*			cis	-156.9	171.8	35.3	44.2	-21.5	0	0	0	122
323	R	24.4	Very low	26.9	Very low	208 Å²	208	150.1 Å²	150.1	79%	0.785	74%	0.735	S	S	*	*			trans	69.6	134	140.4	-84.4	173.2	89.4	160.1	4.4	123.5
324	E	26.2	Very low	27.1	Very low	115 Å²	115	147.7 Å²	147.7	54%	0.537	73%	0.731	S	S	.	*			trans	68.4	149.4	144.8	-68.8	-179.7	-157.6	0	0	118.1
325	K	25	Very low	27.2	Very low	182 Å²	182	145.2 Å²	145.2	79%	0.791	73%	0.728	S	S	*	*			cis	-151.6	158.1	-6.4	-107.6	152.4	178.3	152.7	0	105
326	G	24.8	Very low	27.3	Very low	61 Å²	61	145.6 Å²	145.6	63%	0.629	73%	0.73	S	S	*	*			cis	144.7	162.8	5.3	0	0	0	0	0	110.1
327	S	27.7	Very low	27.4	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	73%	0.732	S	S	*	*			trans	76.3	151.8	172.6	98.1	0	0	0	0	116.3
328	N	25.8	Very low	27.4	Very low	112 Å²	112	150.9 Å²	150.9	60%	0.599	74%	0.74	S	S	*	*			cis	-165.4	135.8	-7.2	-125.1	-9.2	0	0	0	113.8
329	R	26.4	Very low	27.3	Very low	216 Å²	216	145 Å²	145	82%	0.815	74%	0.741	S	S	*	*			trans	60.4	156.8	141	-63.4	164.4	-174.8	-172.6	-4.5	118.8
330	R	27.6	Very low	27.3	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	75%	0.75	S	S	*	*			cis	-126.5	163.2	3.7	-57.6	171.9	-174.9	-155.8	-0.6	107.5
331	G	26.2	Very low	27.3	Very low	72 Å²	72	149.5 Å²	149.5	74%	0.742	74%	0.744	S	S	*	*			cis	88.2	132.2	28.6	0	0	0	0	0	110.4
332	D	30.1	Very low	27.4	Very low	158 Å²	158	152.6 Å²	152.6	85%	0.845	75%	0.753	S	S	*	*			cis	-159.4	-174.1	-7.4	-157.1	22.6	0	0	0	106.5
333	T	27.5	Very low	26.9	Very low	100 Å²	100	153.9 Å²	153.9	61%	0.613	75%	0.754	S	S	*	*			cis	-158.7	158	23.1	62.4	0	0	0	0	111.9
334	K	29.1	Very low	26.9	Very low	172 Å²	172	155.3 Å²	155.3	75%	0.748	76%	0.759	S	S	*	*			trans	65.1	153.7	140.1	-86.7	-173.6	165.4	-141.4	0	121.3
335	E	27.3	Very low	26.9	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	76%	0.764	S	S	*	*			cis	-128.5	-168.3	-0	-74.1	-143.3	136.6	0	0	113.2
336	R	26.4	Very low	27	Very low	238 Å²	238	154.9 Å²	154.9	90%	0.898	77%	0.767	S	S	*	*			trans	-98.6	152.5	-177.4	-57.8	164.4	167.2	160.6	-7.9	112.1
337	D	27.6	Very low	27.1	Very low	128 Å²	128	159.6 Å²	159.6	68%	0.684	78%	0.778	S	S	*	*				-155.2	-171.2	111.2	-142.5	-71.5	0	0	0	110.9
338	R	26.3	Very low	27.1	Very low	213 Å²	213	157.4 Å²	157.4	80%	0.804	77%	0.773	S	S	*	*			trans	-96.3	148.4	-162.8	-53.2	147.5	-178.7	95.7	-8.9	111.7
339	G	26	Very low	27.2	Very low	75 Å²	75	161.7 Å²	161.7	77%	0.773	79%	0.79	S	S	*	*			trans	171.8	77.9	169.5	0	0	0	0	0	116.9
340	R	26.3	Very low	27.3	Very low	219 Å²	219	162.4 Å²	162.4	83%	0.826	79%	0.792	S	S	*	*			trans	47.1	123.7	136.6	-160	166.4	-162.5	-178.4	2.9	121.4
341	E	27.1	Very low	27.3	Very low	149 Å²	149	158.3 Å²	158.3	70%	0.696	79%	0.788	S	S	*	*			trans	19.4	120	138.8	-48.8	160.7	148.2	0	0	118.3
342	D	27.5	Very low	27.4	Very low	166 Å²	166	165.5 Å²	165.5	89%	0.888	79%	0.793	S	S	*	*				-163.4	174.7	102.5	-136.8	-27.1	0	0	0	114
343	D	28.9	Very low	27.3	Very low	132 Å²	132	161.4 Å²	161.4	71%	0.706	79%	0.788	S	S	*	*			trans	-76.5	164.6	-163.7	-151.8	-75.4	0	0	0	116.9	G345	D343-G345 PolarHBondContact OD1-N 3.01Å
344	R	25.3	Very low	27.3	Very low	239 Å²	239	162.8 Å²	162.8	90%	0.902	80%	0.802	S	S	*	*			trans	-146.5	46.5	171.5	-77.7	-163.7	175	168.5	-0.4	115
345	G	27.2	Very low	27.3	Very low	62 Å²	62	159.4 Å²	159.4	64%	0.639	81%	0.806	S	S	*	*			trans	-81.6	119.4	142.7	0	0	0	0	0	108.9	D343	D343-G345 PolarHBondContact OD1-N 3.01Å
346	R	25.3	Very low	27.4	Very low	226 Å²	226	162.5 Å²	162.5	85%	0.853	81%	0.811	S	S	*	*			cis	61.3	76.6	31.5	-157.9	-168.1	-163.9	-170	6.5	114
347	D	28.2	Very low	27.5	Very low	159 Å²	159	157.7 Å²	157.7	85%	0.85	80%	0.803	S	S	*	*				-159.9	159.9	113.6	-93.4	-26.4	0	0	0	109.9
348	G	27.4	Very low	27.4	Very low	66 Å²	66	163.6 Å²	163.6	68%	0.68	82%	0.815	S	S	*	*			cis	157.4	-21.1	-2	0	0	0	0	0	113.4
349	E	28.3	Very low	27.5	Very low	203 Å²	203	161.4 Å²	161.4	95%	0.949	82%	0.82	S	S	*	*			trans	-86.5	142	-175.1	-62.1	-146.5	122.3	0	0	114
350	R	27.7	Very low	27.6	Very low	231 Å²	231	161.2 Å²	161.2	87%	0.872	82%	0.818	S	S	*	*			trans	-127.7	100.8	-172.6	172.8	-154.1	-75.9	-178	-5.5	108.2
351	D	27.5	Very low	27.7	Very low	154 Å²	154	159.8 Å²	159.8	82%	0.824	82%	0.821	S	S	*	*			trans	-123.9	133.9	165.6	-149.2	-28.1	0	0	0	112.2
352	R	29.3	Very low	27.7	Very low	222 Å²	222	162.8 Å²	162.8	84%	0.838	83%	0.831	S	S	*	*			trans	-127.2	109.8	168.4	-68	177.2	180	146.7	-0.8	104.1
353	G	27.8	Very low	27.8	Very low	73 Å²	73	162.7 Å²	162.7	75%	0.753	83%	0.831	S	S	*	*			cis	87.1	75.5	42.7	0	0	0	0	0	109.4
354	S	27.5	Very low	27.8	Very low	129 Å²	129	164.6 Å²	164.6	90%	0.902	83%	0.833	S	S	*	*			trans	-152.9	97	167.4	-173.5	0	0	0	0	108.8
355	A	28.9	Very low	27.9	Very low	100 Å²	100	160.7 Å²	160.7	83%	0.826	83%	0.83	S	S	*	*			trans	-104	135.6	176.7	0	0	0	0	0	110.2
356	R	29.2	Very low	28.1	Very low	229 Å²	229	169.7 Å²	169.7	86%	0.864	84%	0.844	S	S	*	*			trans	-146.5	133.1	155	-97.5	-170.6	-171.5	150.3	10.1	112.1
357	D	28.2	Very low	28.2	Very low	137 Å²	137	165.2 Å²	165.2	73%	0.733	84%	0.842	S	S	*	*			trans	51.4	89	142.1	-45.6	-31.9	0	0	0	118.4
358	R	26.1	Very low	28.1	Very low	251 Å²	251	168.3 Å²	168.3	95%	0.947	84%	0.842	S	S	*	*			trans	-149	103.1	145.4	-116.3	174.2	-156.7	169.8	10.4	113.2
359	D	26.8	Very low	28.1	Very low	167 Å²	167	174.4 Å²	174.4	89%	0.893	85%	0.852	S	S	*	*			trans	-66.6	149.2	155.1	-77.4	-62	0	0	0	110.9
360	G	29.7	Very low	28	Very low	71 Å²	71	176.2 Å²	176.2	73%	0.732	85%	0.851	S	S	*	*			trans	99.4	142.3	149.5	0	0	0	0	0	118.1
361	E	27.7	Very low	27.9	Very low	190 Å²	190	174.1 Å²	174.1	89%	0.888	85%	0.851	S	S	*	*			trans	58.6	84.3	157.8	-55.9	-166.4	146.8	0	0	118.7
362	K	28.1	Very low	27.9	Very low	212 Å²	212	178 Å²	178	92%	0.922	85%	0.854	S	S	*	*			trans	-166.2	101.4	131.9	-109.1	160.5	-173.2	177.1	0	112.9
363	D	28.6	Very low	27.8	Very low	163 Å²	163	175 Å²	175	87%	0.872	85%	0.854	S	S	*	*			trans	-153.4	58.3	151.6	-147.2	-6.7	0	0	0	112.3
364	K	29	Very low	27.7	Very low	173 Å²	173	182.7 Å²	182.7	75%	0.752	86%	0.86	S	S	*	*			trans	-146.8	81.8	170.9	-76.2	-166.3	178.4	-178.6	0	111
365	N	27.6	Very low	27.6	Very low	157 Å²	157	184.2 Å²	184.2	84%	0.84	85%	0.853	S	S	*	*			trans	-176.4	101.5	141.7	-102.2	-6.4	0	0	0	112
366	R	31.9	Very low	27.5	Very low	250 Å²	250	191 Å²	191	94%	0.943	86%	0.857	S	S	*	*			trans	-154.2	30	160.5	-131	177.3	-171.7	-173.3	2.2	115.3
367	V	26.3	Very low	27.4	Very low	132 Å²	132	185.8 Å²	185.8	80%	0.8	85%	0.847	S	S	*	*			trans	-142.9	127.8	168.2	-166.8	0	0	0	0	110.6
368	R	26.9	Very low	27.3	Very low	224 Å²	224	187.5 Å²	187.5	85%	0.845	85%	0.848	S	S	*	*			trans	113.5	74.4	167.9	-67	-172.6	169.4	155.9	-1.4	116.8
369	E	26.8	Very low	27.3	Very low	194 Å²	194	181.3 Å²	181.3	91%	0.907	83%	0.83	S	S	*	*			trans	-124.3	110.6	132.5	-74.6	-171.4	153.2	0	0	108.5
370	R	26.2	Very low	27.3	Very low	242 Å²	242	180.5 Å²	180.5	91%	0.913	82%	0.818	S	S	*	*			trans	-175.2	149.6	159.2	-108.5	174	-170.6	-156	-0.5	108.9
371	E	26.5	Very low	27	Very low	186 Å²	186	183.2 Å²	183.2	87%	0.869	82%	0.816	S	S	*	*			trans	69.7	70.1	172.4	-62	-180	-151.5	0	0	117.5
372	R	26.7	Very low	26.8	Very low	237 Å²	237	183 Å²	183	89%	0.894	81%	0.812	S	S	*	*				-149	118.6	102.3	-101.4	-177.6	-174.1	-168.2	0.6	110.4
373	D	27.8	Very low	26.6	Very low	158 Å²	158	176.7 Å²	176.7	85%	0.845	80%	0.795	S	S	*	*				-172.6	133.1	119	-91.8	-13.3	0	0	0	111.7
374	R	25.7	Very low	26.4	Very low	234 Å²	234	174.8 Å²	174.8	88%	0.883	79%	0.789	S	S	*	*			trans	-126.6	139.8	155.6	-51.9	176.6	-176.9	166.1	-0.9	103.2
375	H	25.8	Very low	26.2	Very low	161 Å²	161	177.7 Å²	177.7	75%	0.745	80%	0.795	S	S	*	*			cis	-144.8	146.5	26.4	-114.1	-106	0	0	0	109.5	D377	H375-D377 IonicContact ND1-OD1 2.85Å
376	R	26.1	Very low	25.9	Very low	242 Å²	242	174.2 Å²	174.2	91%	0.913	79%	0.788	S	S	*	*			trans	-155.9	153.7	139.3	-148.1	167.2	-173.9	171.3	2.1	110.6
377	D	26.3	Very low	25.6	Very low	121 Å²	121	167.1 Å²	167.1	65%	0.647	78%	0.777	S	S	*	*			trans	-100.3	174.3	-150.8	-46.2	-81.5	0	0	0	115.7	H375	H375-D377 IonicContact ND1-OD1 2.85Å
378	K	26.7	Very low	25.5	Very low	172 Å²	172	166.3 Å²	166.3	75%	0.748	78%	0.778	S	S	*	*			trans	89.4	112.1	160	-73.6	-171.8	168.8	-104.7	0	119.9
379	E	25.3	Very low	25.4	Very low	122 Å²	122	160.5 Å²	160.5	57%	0.57	77%	0.771	S	S	*	*				54.2	132.7	112.6	-61.8	-175.5	107.8	0	0	118.4
380	K	26.8	Very low	25.3	Very low	149 Å²	149	155.9 Å²	155.9	65%	0.648	76%	0.76	S	S	*	*			cis	-165.7	159	11.8	-120	175.8	169.1	140.3	0	112.7
381	D	24.6	Very low	25.3	Very low	128 Å²	128	150.3 Å²	150.3	68%	0.684	76%	0.758	S	S	*	*			trans	37	154.9	133.3	-56.9	-6.6	0	0	0	122.9
382	F	22.3	Very low	25.2	Very low	187 Å²	187	145.1 Å²	145.1	82%	0.82	76%	0.755	S	S	*	*			cis	-169.6	160	-31.7	-154	-121.1	0	0	0	109.4
383	S	24.5	Very low	25.2	Very low	79 Å²	79	142.9 Å²	142.9	55%	0.552	75%	0.754	S	S	*	*			trans	45.2	126.8	152.4	62.5	0	0	0	0	124.3
384	T	24.3	Very low	25	Very low	123 Å²	123	139.6 Å²	139.6	76%	0.755	74%	0.744	S	S	*	*				34.5	152.2	124.6	73.7	0	0	0	0	121.7
385	R	24.4	Very low	24.9	Very low	233 Å²	233	139.7 Å²	139.7	88%	0.879	74%	0.744	S	S	*	*			cis	-172.8	160.5	46.2	-158.8	163.1	169.7	169.9	-6.4	113.2
386	A	22.8	Very low	24.9	Very low	84 Å²	84	138.8 Å²	138.8	69%	0.694	75%	0.745	S	S	*	*			trans	-7	152.5	164.7	0	0	0	0	0	120.4
387	S	24.4	Very low	25	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	75%	0.745	S	S	*	*				-177.4	167.5	66	-57.1	0	0	0	0	113.7
388	S	25.1	Very low	24.9	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	76%	0.757	S	S	*	*			trans	61.5	152.6	159.2	44.9	0	0	0	0	119.2
389	S	23.8	Very low	25	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	76%	0.758	S	S	*	*			cis	-166.1	172.8	-19.2	52.6	0	0	0	0	111
390	S	25.1	Very low	25	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	77%	0.765	S	S	*	*			trans	62.3	116.5	148.6	59.6	0	0	0	0	121.4
391	S	26.2	Very low	25.1	Very low	125 Å²	125	136 Å²	136	87%	0.874	77%	0.768	S	S	*	*			trans	58.2	147.8	130.3	65.8	0	0	0	0	122.2
392	G	25.2	Very low	25.4	Very low	77 Å²	77	138.4 Å²	138.4	79%	0.794	78%	0.78	S	S	*	*			trans	143.3	98.8	155.9	0	0	0	0	0	113.5
393	E	25.4	Very low	25.6	Very low	190 Å²	190	133.2 Å²	133.2	89%	0.888	78%	0.78	S	S	*	*			trans	-71.9	153.6	176.6	-64.6	153	91	0	0	112.7
394	S	24.4	Very low	26	Very low	90 Å²	90	134.4 Å²	134.4	63%	0.629	79%	0.788	S	S	*	*			trans	50.4	124.9	144.3	-164.9	0	0	0	0	119.6
395	W	24.1	Very low	26.3	Very low	235 Å²	235	135.1 Å²	135.1	89%	0.89	79%	0.786	S	S	*	*				-174.7	152.2	94.7	-103.6	87.8	0	0	0	111.1
396	N	24.6	Very low	26.6	Very low	142 Å²	142	132.5 Å²	132.5	76%	0.759	78%	0.781	S	S	*	*			trans	-73.8	137.4	171.7	-74.5	-61	0	0	0	111
397	Q	29	Very low	27	Very low	193 Å²	193	133.4 Å²	133.4	90%	0.902	78%	0.782	S	S	*	*				-161.4	165.2	125.2	-113.8	163.5	102	0	0	115.2
398	R	24.7	Very low	27.3	Very low	241 Å²	241	139 Å²	139	91%	0.909	79%	0.788	S	S	*	*			trans	-82.6	147.6	-174.8	-55.8	162.7	167	-174.1	-5.7	111.2
399	S	28.9	Very low	27.4	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	79%	0.786	S	S	*	*				-165.5	150.6	119.8	61.1	0	0	0	0	114.1
400	S	25.4	Very low	27.7	Very low	104 Å²	104	144.1 Å²	144.1	73%	0.727	79%	0.79	S	S	*	*			trans	-27.7	157.1	146.5	35.7	0	0	0	0	116.4
401	S	28.4	Very low	28.1	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	80%	0.797	S	S	*	*			cis	-170.7	159.7	3.7	38.4	0	0	0	0	113.8
402	L	29.7	Very low	28.5	Very low	178 Å²	178	148.7 Å²	148.7	93%	0.932	79%	0.794	S	S	*	*			trans	24.5	118.2	141.9	-59.8	172.1	0	0	0	120.1
403	G	27.9	Very low	28.6	Very low	79 Å²	79	149.3 Å²	149.3	81%	0.814	79%	0.786	S	S	*	*			trans	135.8	164.2	138.4	0	0	0	0	0	115.9
404	S	31.7	Very low	28.7	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	78%	0.78	S	S	*	*			cis	-178	118.4	-27.8	167.3	0	0	0	0	108.9
405	L	31.6	Very low	28.8	Very low	137 Å²	137	150.6 Å²	150.6	72%	0.717	79%	0.787	S	S	*	*			trans	56	114.8	151.9	-60.1	173.6	0	0	0	121
406	K	31.2	Very low	29	Very low	178 Å²	178	147.3 Å²	147.3	77%	0.774	79%	0.787	S	S	*	*				64.1	112.7	124.8	-65.9	-177.5	178.6	177.8	0	120.8
407	S	30.3	Very low	29.1	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	79%	0.789	S	S	*	*				103.8	131.6	111.5	73.8	0	0	0	0	120.9
408	R	31.6	Very low	29.2	Very low	219 Å²	219	142.7 Å²	142.7	83%	0.826	78%	0.776	S	S	*	*			trans	44.3	121	147.1	-61.2	172.3	163	-177.4	-7.2	118.5
409	F	26.5	Very low	29.4	Very low	176 Å²	176	137 Å²	137	77%	0.772	77%	0.767	S	S	*	*				-167.9	167.4	89.4	-117.7	-98.4	0	0	0	112.4
410	L	30	Very low	29.5	Very low	150 Å²	150	140.1 Å²	140.1	79%	0.785	77%	0.77	S	S	*	*			trans	3.6	151	170.4	-73.5	165.9	0	0	0	124.1
411	K	34.3	Very low	29.7	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.835	76%	0.757	S	S	*	*			trans	-66.5	150.2	154.9	-79.9	-169.2	172.9	-166.3	0	111.8
412	P	34.4	Very low	29.7	Very low	124 Å²	124	141.5 Å²	141.5	81%	0.805	76%	0.763	S	S	*	*				-108.3	-168.5	119.9	-18.1	35.2	0	0	0	115.8
413	S	26.8	Very low	29.9	Very low	90 Å²	90	141.8 Å²	141.8	63%	0.629	76%	0.759	S	S	*	*			trans	-104.3	-165.6	-176.3	39	0	0	0	0	112.6
414	E	26.4	Very low	29.9	Very low	160 Å²	160	149.1 Å²	149.1	75%	0.748	76%	0.762	S	S	*	*			trans	76.1	145.5	165.6	-65.3	140.5	-123.8	0	0	117.1
415	D	27.2	Very low	30.7	Very low	148 Å²	148	149.2 Å²	149.2	79%	0.791	76%	0.76	S	S	*	*			cis	-166.4	-162.6	-36.5	-113.1	-45.7	0	0	0	107.5
416	D	28.7	Very low	31.5	Very low	166 Å²	166	148.1 Å²	148.1	89%	0.888	76%	0.762	S	S	*	*			trans	82.9	144.3	172	-103.7	-88.2	0	0	0	118.7
417	D	27.6	Very low	32.4	Very low	149 Å²	149	145 Å²	145	80%	0.797	76%	0.759	S	S	*	*			trans	-114.1	-170.4	-143	-153.7	-140.9	0	0	0	110.9
418	S	29.4	Very low	32.5	Very low	89 Å²	89	147.3 Å²	147.3	62%	0.622	77%	0.769	S	S	*	*			cis	-161.8	176.9	20.6	53.2	0	0	0	0	109.4
419	V	30	Very low	32.5	Very low	121 Å²	121	148 Å²	148	73%	0.733	77%	0.772	S	S	*	*			cis	-147.3	170.8	23.1	-87.3	0	0	0	0	109.7
420	E	29.6	Very low	33.7	Very low	175 Å²	175	145 Å²	145	82%	0.818	77%	0.77	S	S	*	*			cis	-152	179	6.4	-137.7	-168	118.6	0	0	113.4
421	A	29.6	Very low	34.6	Very low	54 Å²	54	144.2 Å²	144.2	45%	0.446	77%	0.774	S	S	.	*			trans	-32.5	152.1	148.8	0	0	0	0	0	117.6
422	H	30.3	Very low	34.5	Very low	180 Å²	180	139.8 Å²	139.8	83%	0.833	77%	0.773	S	S	*	*			cis	-156.4	-173.8	-6	-89.1	-24.1	0	0	0	106
423	Q	33.3	Very low	34.2	Very low	184 Å²	184	137.5 Å²	137.5	86%	0.86	77%	0.772	S	S	*	*			cis	-138.2	-161.5	14.4	-63.1	178.1	0.6	0	0	111.2
424	R	27.9	Very low	34.3	Very low	233 Å²	233	142.8 Å²	142.8	88%	0.879	78%	0.784	S	S	*	*			trans	-167.9	176.8	-170.4	-113.2	-174.1	175.6	-170	2.1	108.6
425	P	49.1	Very low	34.6	Very low	106 Å²	106	141.6 Å²	141.6	69%	0.688	78%	0.782	S	S	*	*				-128.9	-129.7	-63.8	33.8	-9.4	0	0	0	107.5
426	P	47.3	Very low	34.8	Very low	114 Å²	114	144 Å²	144	74%	0.74	79%	0.785	S	S	*	*			cis	-125.5	-133	-29.7	42.1	-20.8	0	0	0	112
427	P	50.8	Low	35.1	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	78%	0.781	S	S	*	*			trans	-131.7	-170.1	-138.9	36	-9.4	0	0	0	116
428	T	32.4	Very low	35	Very low	152 Å²	152	139.8 Å²	139.8	93%	0.933	78%	0.778	S	S	*	*			trans	-157.1	176.7	154.7	-5.7	0	0	0	0	113.4
429	R	30.8	Very low	35.1	Very low	234 Å²	234	140 Å²	140	88%	0.883	78%	0.777	S	S	*	*			trans	-94	161.2	-163.5	-90.1	177.8	162	-179.6	-5.9	115.8
430	P	51.2	Low	35.1	Very low	113 Å²	113	142 Å²	142	73%	0.734	78%	0.783	S	S	*	*			trans	-84.9	168.8	163.7	38	-36.5	0	0	0	112.9
431	P	49	Very low	35.1	Very low	133 Å²	133	140.2 Å²	140.2	86%	0.864	78%	0.779	S	S	*	*			trans	-133.1	-172.1	132.9	38.5	-27.1	0	0	0	112.7
432	A	31.7	Very low	35.1	Very low	99 Å²	99	146.6 Å²	146.6	82%	0.818	80%	0.8	S	S	*	*			trans	-123.4	147.9	-164.5	0	0	0	0	0	115.6
433	G	30	Very low	35	Very low	75 Å²	75	142.9 Å²	142.9	77%	0.773	79%	0.787	S	S	*	*			trans	58.6	123.5	135.9	0	0	0	0	0	122.2
434	F	28.8	Very low	34.9	Very low	202 Å²	202	138.5 Å²	138.5	89%	0.886	78%	0.776	S	S	*	*			trans	-148.6	-169.3	140.5	-141.3	-114.5	0	0	0	112.2
435	L	32.1	Very low	35.2	Very low	135 Å²	135	133.3 Å²	133.3	71%	0.707	77%	0.772	S	S	*	*			trans	-99.7	156.2	-150.4	-65.4	166.6	0	0	0	117.4
436	K	30.6	Very low	34.3	Very low	197 Å²	197	136.9 Å²	136.9	86%	0.857	78%	0.78	S	S	*	*			trans	5.5	142.4	147.1	-85.3	-174.7	176.3	-173.4	0	119
437	P	34.8	Very low	33.6	Very low	123 Å²	123	138.4 Å²	138.4	80%	0.799	78%	0.775	S	S	*	*				-145.4	174.7	68.5	41.5	-24.7	0	0	0	118.2
438	S	26.8	Very low	32.5	Very low	104 Å²	104	141 Å²	141	73%	0.727	78%	0.778	S	S	*	*			trans	39.5	135.4	165.2	-131.3	0	0	0	0	122.7
439	P	31.8	Very low	32.2	Very low	93 Å²	93	139.3 Å²	139.3	60%	0.604	77%	0.772	S	S	*	*			trans	-78.8	166.8	141.5	37.7	-31.8	0	0	0	110.6
440	D	28.6	Very low	32.1	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	76%	0.762	S	S	*	*			trans	-107.9	131.6	154.5	-74.5	-49.1	0	0	0	108
441	D	30	Very low	31	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	76%	0.763	S	S	*	*			trans	-93.8	157.5	172	-67.2	-72.5	0	0	0	109.9
442	E	29.8	Very low	30.1	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	76%	0.762	S	S	*	*			trans	-129.7	128.5	152	-99.2	-60.7	158	0	0	109.6
443	D	28.6	Very low	29.9	Very low	103 Å²	103	135 Å²	135	55%	0.551	75%	0.748	S	S	*	*			trans	-71.6	146.5	-158.6	-101.2	-21.4	0	0	0	112.4	K447	D443-K447 IonicContact OD2-NZ 3.83Å
444	S	31.5	Very low	29.7	Very low	92 Å²	92	143.3 Å²	143.3	64%	0.643	76%	0.756	S	S	*	*				73.5	142.3	55.4	-47.8	0	0	0	0	115.6
445	P	32.7	Very low	29.7	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	75%	0.753	S	S	*	*	S	Bend	trans	-78.8	156.5	170.4	33.8	-35.2	0	0	0	112.6
446	Q	31.7	Very low	29.5	Very low	181 Å²	181	145.2 Å²	145.2	85%	0.846	76%	0.758	S	S	*	*			trans	-66.8	129.5	175.7	-67.7	170.9	-13.1	0	0	110.4
447	K	31.8	Very low	29.3	Very low	146 Å²	146	147 Å²	147	64%	0.635	76%	0.76	S	S	*	*				62.1	134.2	70.9	-68.6	175.4	176.2	150.1	0	111.7	D443	D443-K447 IonicContact OD2-NZ 3.83Å
448	Q	28.7	Very low	28.9	Very low	168 Å²	168	144.8 Å²	144.8	79%	0.785	76%	0.759	S	S	*	*			cis	-168	177.8	1.6	-120.7	164.3	-8.9	0	0	107.9
449	S	26.1	Very low	29	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	76%	0.762	S	S	*	*			cis	-156.1	-176.7	2	51.5	0	0	0	0	110.2
450	S	27.2	Very low	28.8	Very low	98 Å²	98	146 Å²	146	69%	0.685	78%	0.775	S	S	*	*			trans	-130.9	151.2	-174.6	60.4	0	0	0	0	113.9
451	I	29.5	Very low	28.7	Very low	147 Å²	147	141.7 Å²	141.7	75%	0.754	77%	0.77	S	S	*	*			trans	46.5	120.8	136.3	-58.7	166.9	0	0	0	116.7
452	Q	29.2	Very low	28.6	Very low	179 Å²	179	144.6 Å²	144.6	84%	0.836	78%	0.779	S	S	*	*				-177.9	140.7	81.3	-144	156.8	40.8	0	0	115.5
453	A	26.8	Very low	28.5	Very low	63 Å²	63	143.9 Å²	143.9	52%	0.521	78%	0.776	S	S	.	*			trans	54.3	120.5	141.6	0	0	0	0	0	126.7
454	W	26.4	Very low	29.5	Very low	251 Å²	251	144 Å²	144	95%	0.951	78%	0.782	S	S	*	*			trans	71.7	148.6	146.5	-44.2	-34.5	0	0	0	118.6
455	K	28	Very low	29.3	Very low	189 Å²	189	144.7 Å²	144.7	82%	0.822	78%	0.778	S	S	*	*			cis	-162.4	154.1	8.4	-150.3	170.6	-175.3	167.6	0	111.9
456	K	29.2	Very low	29.2	Very low	187 Å²	187	148.1 Å²	148.1	81%	0.813	78%	0.775	S	S	*	*			trans	68.5	153.7	172.9	-72.6	175.4	176.9	174.8	0	115.7
457	R	25.5	Very low	29.1	Very low	236 Å²	236	146.1 Å²	146.1	89%	0.891	78%	0.776	S	S	*	*			cis	-137.3	-178.3	6.9	-120.4	173.2	-161.9	-90.6	9.6	110.2
458	G	26.4	Very low	28.7	Very low	76 Å²	76	143 Å²	143	78%	0.784	78%	0.784	S	S	*	*			trans	-82.4	-161.9	-174.5	0	0	0	0	0	116.6
459	A	28.8	Very low	28.5	Very low	95 Å²	95	141.7 Å²	141.7	79%	0.785	79%	0.788	S	S	*	*			cis	-161.8	-179.5	19.4	0	0	0	0	0	114.9
460	S	28.2	Very low	29.1	Very low	126 Å²	126	141 Å²	141	88%	0.881	78%	0.781	S	S	*	*			trans	75.4	133.9	172.7	69.3	0	0	0	0	117.7
461	G	27.1	Very low	29.1	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	79%	0.785	S	S	*	*			cis	-173	142.7	-6	0	0	0	0	0	117.7
462	Q	27.8	Very low	29	Very low	200 Å²	200	143.2 Å²	143.2	94%	0.935	78%	0.778	S	S	*	*			trans	72	129.4	158	-72.1	-179.4	-27.9	0	0	123.4
463	E	26.8	Very low	28.9	Very low	173 Å²	173	139.6 Å²	139.6	81%	0.808	76%	0.764	S	S	*	*			trans	168.4	176.8	-167.8	-104	-86.3	157.8	0	0	103.1
464	P	50.9	Low	29	Very low	104 Å²	104	144.2 Å²	144.2	68%	0.675	77%	0.772	S	S	*	*			cis	-141.8	-172.4	-1.8	46.9	-28.8	0	0	0	116.6
465	D	27.2	Very low	28.9	Very low	108 Å²	108	137.3 Å²	137.3	58%	0.578	76%	0.758	S	S	*	*			trans	40.2	128.9	137.8	-96.1	-14.7	0	0	0	126.5
466	R	30.8	Very low	29	Very low	195 Å²	195	135.6 Å²	135.6	74%	0.736	75%	0.753	S	S	*	*				79	133.4	122	-78.6	174.1	-147.5	-165.3	16.5	127.7
467	T	27.9	Very low	29.9	Very low	139 Å²	139	131.9 Å²	131.9	85%	0.853	75%	0.748	S	S	*	*			trans	70	134	137.4	53.6	0	0	0	0	122.5
468	G	24.1	Very low	30.1	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	74%	0.743	S	S	*	*			trans	159	137.6	156.9	0	0	0	0	0	117
469	T	24.3	Very low	30.4	Very low	142 Å²	142	128.8 Å²	128.8	87%	0.871	74%	0.736	S	S	*	*			trans	-139.3	168.9	166.4	28.4	0	0	0	0	108.1
470	P	39.7	Very low	30.4	Very low	102 Å²	102	131.3 Å²	131.3	66%	0.662	74%	0.742	S	S	*	*			cis	-133.6	-178.2	-18	38.9	-21.1	0	0	0	114.7
471	Q	26.7	Very low	30.5	Very low	164 Å²	164	129 Å²	129	77%	0.766	74%	0.737	S	S	*	*			trans	45	147.3	143.1	-88	176	-60.6	0	0	122.9
472	E	26.7	Very low	30.4	Very low	127 Å²	127	133.5 Å²	133.5	59%	0.593	74%	0.744	S	S	*	*			cis	-167	170.1	-3.7	-155.3	178	-110.8	0	0	111.7
473	N	27.1	Very low	30.6	Very low	103 Å²	103	128.1 Å²	128.1	55%	0.551	73%	0.734	S	S	*	*			trans	77.9	143.4	157.3	-63.7	-44.8	0	0	0	118.9
474	K	28.6	Very low	32.1	Very low	159 Å²	159	125 Å²	125	69%	0.691	73%	0.728	S	S	*	*			cis	-165.9	177.1	-5.7	-115.8	166.6	176.1	97.8	0	107.4
475	T	25.9	Very low	30.9	Very low	106 Å²	106	128 Å²	128	65%	0.65	73%	0.733	S	S	*	*			cis	-164.7	152.4	10.7	-1.4	0	0	0	0	110.5
476	Q	30.1	Very low	30.9	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	74%	0.744	S	S	*	*			trans	66.7	160.2	144	-65.8	-84	-17.8	0	0	120.5
477	P	47.6	Very low	30.7	Very low	108 Å²	108	124.5 Å²	124.5	70%	0.701	75%	0.747	S	S	*	*			cis	-128.4	162	-4.6	16.1	9.7	0	0	0	118.5
478	E	29.5	Very low	30.7	Very low	172 Å²	172	123.1 Å²	123.1	80%	0.804	74%	0.743	S	S	*	*			trans	72.5	126.5	144.1	-68.4	-66.2	97.2	0	0	126.9
479	A	32.6	Very low	31	Very low	76 Å²	76	125.3 Å²	125.3	63%	0.628	75%	0.746	S	S	*	*			trans	91.5	101.3	132.7	0	0	0	0	0	126.4
480	T	29.6	Very low	31.1	Very low	148 Å²	148	123.5 Å²	123.5	91%	0.908	75%	0.745	S	S	*	*			trans	65.4	128.9	132.5	58.5	0	0	0	0	125.8
481	G	28.8	Very low	30.6	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	76%	0.755	S	S	*	*			trans	142.8	111.6	142.5	0	0	0	0	0	120.6
482	D	25.8	Very low	30.5	Very low	169 Å²	169	127.5 Å²	127.5	90%	0.904	75%	0.754	S	S	*	*			trans	-20.6	168.4	164.1	-73.2	-68.8	0	0	0	123.1
483	A	31.1	Very low	30.5	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	77%	0.765	S	S	*	*			cis	-165	173.7	-4.9	0	0	0	0	0	112.1
484	P	58.5	Low	30.4	Very low	106 Å²	106	132.2 Å²	132.2	69%	0.688	78%	0.777	S	S	*	*			trans	-127.1	-179.8	-161.5	44.4	-32.3	0	0	0	118.3
485	H	27	Very low	30.1	Very low	168 Å²	168	132.2 Å²	132.2	78%	0.778	79%	0.785	S	S	*	*			trans	167.6	124.7	133.4	-93.9	-74.2	0	0	0	111.6
486	V	25.9	Very low	30.2	Very low	132 Å²	132	131.6 Å²	131.6	80%	0.8	79%	0.785	S	S	*	*				72.3	130.4	80.3	177.5	0	0	0	0	115.6
487	A	27.2	Very low	30	Very low	98 Å²	98	132.8 Å²	132.8	81%	0.81	79%	0.791	S	S	*	*			trans	-145.1	154.2	-178.9	0	0	0	0	0	113.8
488	S	27.8	Very low	29.1	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	80%	0.801	S	S	*	*			trans	-163.9	148.4	-179.6	58	0	0	0	0	115
489	S	30.3	Very low	29	Very low	124 Å²	124	137.8 Å²	137.8	87%	0.867	81%	0.805	S	S	*	*			trans	63.6	162.7	164.5	-63.6	0	0	0	0	117.3
490	A	26.5	Very low	29.5	Very low	104 Å²	104	143.5 Å²	143.5	86%	0.86	82%	0.818	S	S	*	*			cis	-145.4	-141.5	24.3	0	0	0	0	0	115.6
491	R	28.5	Very low	29.4	Very low	230 Å²	230	143.8 Å²	143.8	87%	0.868	81%	0.81	S	S	*	*			trans	-127.1	-170.1	-161.9	-85.4	178.9	158.2	-168.8	-5.2	113.1
492	T	25.3	Very low	29.6	Very low	121 Å²	121	143.9 Å²	143.9	74%	0.742	80%	0.803	S	S	*	*			trans	76.8	154.9	162.7	57.6	0	0	0	0	117
493	E	26.5	Very low	30.4	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	78%	0.783	S	S	*	*			cis	-164.1	-172.6	-40	-117.3	159.5	-149.2	0	0	107.9
494	N	25	Very low	30.4	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	79%	0.791	S	S	*	*			trans	-54.1	158.7	-169.3	-52.8	-16.5	0	0	0	117.6
495	D	23.5	Very low	29.8	Very low	160 Å²	160	147.1 Å²	147.1	86%	0.856	79%	0.787	S	S	*	*				-160.5	178	116.3	-121.4	-7.9	0	0	0	115.1
496	S	26.8	Very low	31.1	Very low	93 Å²	93	144.4 Å²	144.4	65%	0.65	78%	0.777	S	S	*	*			trans	-74	-172	-174.4	45.7	0	0	0	0	115.1
497	E	25.9	Very low	32.6	Very low	179 Å²	179	143.5 Å²	143.5	84%	0.836	77%	0.774	S	S	*	*			cis	-147.4	-175.9	28.3	-62.6	172.6	139.5	0	0	112.2
498	E	29.6	Very low	34.6	Very low	198 Å²	198	143.1 Å²	143.1	93%	0.925	76%	0.758	S	S	*	*			trans	-109.2	-148.1	-179.5	-58.5	-170.3	74.9	0	0	110.7
499	E	27.8	Very low	37	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.874	74%	0.74	S	S	*	*			cis	-144.3	-151	14.1	-65.1	174.3	128.7	0	0	109.4
500	E	41.6	Very low	39.3	Very low	195 Å²	195	138.1 Å²	138.1	91%	0.911	72%	0.716	S	S	*	*			trans	-131.3	156.1	178	-73.7	-164.4	166.7	0	0	114
501	E	28.1	Very low	41.8	Very low	155 Å²	155	139.1 Å²	139.1	72%	0.724	70%	0.703	S	S	*	*			trans	-161.8	165.1	147.3	-125.6	177.2	-153.2	0	0	113.3
502	A	32.5	Very low	44.3	Very low	78 Å²	78	134.1 Å²	134.1	65%	0.645	69%	0.69	S	S	*	*			trans	-154.6	171.8	-178	0	0	0	0	0	110.3
503	K	42.5	Very low	47.1	Very low	110 Å²	110	132.4 Å²	132.4	48%	0.478	67%	0.673	S	S	.	*			cis	-152.8	166.3	21.4	-30.5	168.5	-166	91.9	0	111.9	E113 E114	E113-K503 IonicContact OE2-NZ 3.78Å; E113-K503 PolarHBondContact OE2-NZ 2.76Å; E114-K503 VanDerWaalsContact CD-NZ 3.34Å; E114-K503 IonicContact OE1-NZ 3.59Å; E114-K503 PolarHBondContact OE1-NZ 2.75Å; E114-K503 IonicContact OE2-NZ 2.67Å; E114-K503 PolarHBondContact OE2-NZ 3.44Å
504	E	31.8	Very low	49.7	Very low	193 Å²	193	125.2 Å²	125.2	90%	0.902	64%	0.64	S	S	*	*			trans	-133.8	125.9	133.9	-81.2	-165.7	153.2	0	0	107.7
505	E	45.6	Very low	52.6	Low	127 Å²	127	123.6 Å²	123.6	59%	0.593	63%	0.631	S	S	*	*			trans	-102.8	114.5	177.7	-68.1	-152.5	154.7	0	0	112.3	R553	E505-R553 IonicContact OE1-CZ 3.16Å; E505-R553 VanDerWaalsContact OE1-CZ 3.25Å; E505-R553 IonicContact OE1-NH1 3.39Å; E505-R553 PolarHBondContact OE1-NH1 3.4Å; E505-R553 IonicContact OE1-NH2 3.61Å; E505-R553 PolarHBondContact OE1-NH2 2.86Å; E505-R553 IonicContact OE2-NH1 3.3Å
506	I	53.7	Low	55.8	Low	111 Å²	111	120.8 Å²	120.8	57%	0.569	61%	0.611	S	S	*	*			trans	-77.6	130.1	-179.2	-58.3	174.7	0	0	0	110.7
507	P	57.4	Low	58.6	Low	113 Å²	113	117.7 Å²	117.7	73%	0.734	59%	0.587	S	S	*	*			trans	-58.1	139.5	177.6	-27.7	35.9	0	0	0	114.8	L509	P507-L509 PolarHBondContact O-N 3.15Å
508	L	71.1	Confident	61.5	Low	90 Å²	90	110 Å²	110	47%	0.471	56%	0.557	S	S	.	*			trans	-78.5	112.8	-177.2	-64.9	172.2	0	0	0	112.4	A546 H550	L508-A546 HydrophobicContact CD2-CB 3.82Å; L508-A546 WeakPolarHBondContact CD2-O 3.33Å; L508-H550 HydrophobicContact CD1-CB 3.81Å; L508-H550 VanDerWaalsContact CD1-CG 3.47Å; L508-H550 HydrophobicContact CD2-CB 4.16Å
509	L	76.4	Confident	64.3	Low	76 Å²	76	104 Å²	104	40%	0.398	54%	0.536	S	S	.	.			trans	-74.2	147	175.1	-71.9	164	0	0	0	112.6	P507 E513 L517 A543	P507-L509 PolarHBondContact O-N 3.15Å; L509-E513 HydrophobicContact CD2-CB 4.29Å; L509-L517 HydrophobicContact CD1-CD1 4.29Å; L509-A543 HydrophobicContact CD1-CB 3.92Å
510	S	79.9	Confident	67.1	Low	52 Å²	52	101 Å²	101	36%	0.364	52%	0.52	S	S	.	.			trans	-75.6	162.6	177.8	70.9	0	0	0	0	113	E512 E513 M514	S510-E512 VanDerWaalsContact C-N 3.29Å; S510-E512 PolarHBondContact O-N 2.78Å; S510-E513 VanDerWaalsContact CB-OE2 3.22Å; S510-E513 WeakPolarHBondContact CB-OE2 3.45Å; S510-E513 PolarHBondContact N-OE2 3.31Å; S510-E513 PolarHBondContact O-N 3.37Å; S510-E513 VanDerWaalsContact O-N 3.09Å; S510-E513 VanDerWaalsContact OG-CG 3.31Å; S510-E513 WeakPolarHBondContact OG-CG 3.43Å; S510-E513 PolarHBondContact OG-N 2.82Å; S510-E513 PolarHBondContact OG-OE2 3.03Å; S510-M514 PolarHBondContact O-N 2.88Å
511	E	78.3	Confident	69.5	Low	125 Å²	125	92.6 Å²	92.6	58%	0.584	48%	0.481	S	S	*	.	H	α-helix	trans	-64	-34.3	178	-65	-178	170.5	0	0	112.3	E513 M514 N515 K547	E511-E513 VanDerWaalsContact C-N 3.33Å; E511-E513 PolarHBondContact O-N 3.28Å; E511-M514 HydrophobicContact CG-CE 4.33Å; E511-N515 WeakPolarHBondContact O-CB 3.44Å; E511-N515 PolarHBondContact O-N 3.25Å; E511-N515 PolarHBondContact O-ND2 3.34Å; E511-K547 VanDerWaalsContact CG-NZ 3.35Å; E511-K547 IonicContact OE1-NZ 3.61Å; E511-K547 PolarHBondContact OE1-NZ 2.81Å
512	E	81.3	Confident	72.3	Confident	126 Å²	126	89.9 Å²	89.9	59%	0.589	47%	0.471	S	S	*	.	H	α-helix	trans	-64.4	-37.7	171.9	-67.9	-169	-158	0	0	112.4	S510 N515 K516	S510-E512 VanDerWaalsContact C-N 3.29Å; S510-E512 PolarHBondContact O-N 2.78Å; E512-N515 PolarHBondContact O-N 3.07Å; E512-K516 WeakPolarHBondContact O-CB 3.41Å; E512-K516 VanDerWaalsContact O-CD 3.24Å; E512-K516 WeakPolarHBondContact O-CD 3.45Å; E512-K516 WeakPolarHBondContact O-CG 3.34Å; E512-K516 PolarHBondContact O-N 3.1Å; E512-K516 IonicContact OE2-NZ 3.12Å; E512-K516 PolarHBondContact OE2-NZ 3.27Å
513	E	84.6	Confident	75	Confident	85 Å²	85	93 Å²	93	40%	0.397	47%	0.47	S	S	.	.	H	α-helix	trans	-72.7	-40.2	-179.8	-72.2	159.8	142.9	0	0	111.5	L509 S510 E511 N515 K516 L517	L509-E513 HydrophobicContact CD2-CB 4.29Å; S510-E513 VanDerWaalsContact CB-OE2 3.22Å; S510-E513 WeakPolarHBondContact CB-OE2 3.45Å; S510-E513 PolarHBondContact N-OE2 3.31Å; S510-E513 PolarHBondContact O-N 3.37Å; S510-E513 VanDerWaalsContact O-N 3.09Å; S510-E513 VanDerWaalsContact OG-CG 3.31Å; S510-E513 WeakPolarHBondContact OG-CG 3.43Å; S510-E513 PolarHBondContact OG-N 2.82Å; S510-E513 PolarHBondContact OG-OE2 3.03Å; E511-E513 VanDerWaalsContact C-N 3.33Å; E511-E513 PolarHBondContact O-N 3.28Å; E513-N515 VanDerWaalsContact C-N 3.32Å; E513-N515 PolarHBondContact O-N 2.79Å; E513-K516 CarbonylContact O-C 3.45Å; E513-K516 PolarHBondContact O-N 3.29Å; E513-L517 WeakPolarHBondContact O-CG 3.45Å; E513-L517 PolarHBondContact O-N 3.3Å
514	M	80.1	Confident	77	Confident	24 Å²	24	88.1 Å²	88.1	12%	0.118	45%	0.45	C	S	.	.	H	α-helix	trans	-59.9	-41.2	169	-67.5	-163.7	-63.1	0	0	111.7	S510 E511 K516 L517 G518 L540 A543 Q544 K547	S510-M514 PolarHBondContact O-N 2.88Å; E511-M514 HydrophobicContact CG-CE 4.33Å; M514-K516 PolarHBondContact O-N 3.44Å; M514-L517 PolarHBondContact O-N 3.41Å; M514-G518 PolarHBondContact O-N 2.63Å; M514-L540 HydrophobicContact CB-CD2 4.18Å; M514-L540 HydrophobicContact CG-CD2 4.47Å; M514-A543 HydrophobicContact CG-CB 4.35Å; M514-A543 HydrophobicContact SD-CB 4.15Å; M514-Q544 HydrophobicContact SD-CG 4.23Å; M514-K547 HydrophobicContact CE-CD 3.91Å
515	N	86.1	Confident	79.6	Confident	118 Å²	118	83.6 Å²	83.6	63%	0.631	43%	0.429	S	S	*	.	H	α-helix	trans	-68.3	-33.5	175.3	-69.2	-20.5	0	0	0	112.7	E511 E512 E513 L517 S519	E511-N515 WeakPolarHBondContact O-CB 3.44Å; E511-N515 PolarHBondContact O-N 3.25Å; E511-N515 PolarHBondContact O-ND2 3.34Å; E512-N515 PolarHBondContact O-N 3.07Å; E513-N515 VanDerWaalsContact C-N 3.32Å; E513-N515 PolarHBondContact O-N 2.79Å; N515-L517 VanDerWaalsContact C-N 3.35Å; N515-S519 PolarHBondContact O-N 3.48Å; N515-S519 PolarHBondContact O-OG 2.87Å
516	K	90.4	Very high	81.6	Confident	102 Å²	102	84.3 Å²	84.3	44%	0.443	44%	0.435	S	S	.	.	H	α-helix	trans	-69.7	-29.9	172.2	-70.9	156.9	-163.3	165.6	0	111.9	E512 E513 M514 S519 K520	E512-K516 WeakPolarHBondContact O-CB 3.41Å; E512-K516 VanDerWaalsContact O-CD 3.24Å; E512-K516 WeakPolarHBondContact O-CD 3.45Å; E512-K516 WeakPolarHBondContact O-CG 3.34Å; E512-K516 PolarHBondContact O-N 3.1Å; E512-K516 IonicContact OE2-NZ 3.12Å; E512-K516 PolarHBondContact OE2-NZ 3.27Å; E513-K516 CarbonylContact O-C 3.45Å; E513-K516 PolarHBondContact O-N 3.29Å; M514-K516 PolarHBondContact O-N 3.44Å; K516-S519 PolarHBondContact O-OG 3.27Å; K516-K520 WeakPolarHBondContact O-CD 3.42Å; K516-K520 VanDerWaalsContact O-CG 3.24Å; K516-K520 WeakPolarHBondContact O-CG 3.3Å; K516-K520 PolarHBondContact O-N 2.97Å
517	L	86.8	Confident	83	Confident	27 Å²	27	84.9 Å²	84.9	14%	0.141	44%	0.437	C	S	.	.	H	α-helix	trans	-75.7	-43.5	171.5	-72	170.7	0	0	0	111.6	L509 E513 M514 N515 S519 K520 L521 L536 L540	L509-L517 HydrophobicContact CD1-CD1 4.29Å; E513-L517 WeakPolarHBondContact O-CG 3.45Å; E513-L517 PolarHBondContact O-N 3.3Å; M514-L517 PolarHBondContact O-N 3.41Å; N515-L517 VanDerWaalsContact C-N 3.35Å; L517-S519 PolarHBondContact O-N 3.43Å; L517-K520 WeakPolarHBondContact O-CB 3.49Å; L517-K520 PolarHBondContact O-N 3.2Å; L517-L521 WeakPolarHBondContact O-CB 3.44Å; L517-L521 PolarHBondContact O-N 3.27Å; L517-L536 HydrophobicContact CD2-CD2 3.99Å; L517-L540 HydrophobicContact CB-CD1 4.37Å; L517-L540 HydrophobicContact CB-CD2 3.77Å; L517-L540 HydrophobicContact CB-CG 4.01Å; L517-L540 HydrophobicContact CD1-CD2 4.36Å
518	G	87.1	Confident	84.1	Confident	19 Å²	19	82.1 Å²	82.1	20%	0.196	43%	0.429	C	S	.	.	H	α-helix	trans	-61.4	-40.5	176.4	0	0	0	0	0	113.7	M514 L521 I522	M514-G518 PolarHBondContact O-N 2.63Å; G518-L521 WeakPolarHBondContact O-CB 3.38Å; G518-L521 PolarHBondContact O-N 3.35Å; G518-I522 WeakPolarHBondContact O-CG1 3.34Å; G518-I522 PolarHBondContact O-N 3.38Å
519	S	86.6	Confident	84.9	Confident	70 Å²	70	82 Å²	82	49%	0.49	43%	0.429	S	S	.	.	H	α-helix	trans	-68.2	-34.2	174.2	51.5	0	0	0	0	113.2	N515 K516 L517 K523	N515-S519 PolarHBondContact O-N 3.48Å; N515-S519 PolarHBondContact O-OG 2.87Å; K516-S519 PolarHBondContact O-OG 3.27Å; L517-S519 PolarHBondContact O-N 3.43Å; S519-K523 WeakPolarHBondContact O-CB 3.43Å; S519-K523 PolarHBondContact O-N 2.98Å; S519-K523 VanDerWaalsContact O-N 3.14Å
520	K	87.8	Confident	85.1	Confident	124 Å²	124	83 Å²	83	54%	0.539	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-39.3	170	-73.1	169.9	-176.2	178.3	0	111.9	K516 L517 K523 A524 L536	K516-K520 WeakPolarHBondContact O-CD 3.42Å; K516-K520 VanDerWaalsContact O-CG 3.24Å; K516-K520 WeakPolarHBondContact O-CG 3.3Å; K516-K520 PolarHBondContact O-N 2.97Å; L517-K520 WeakPolarHBondContact O-CB 3.49Å; L517-K520 PolarHBondContact O-N 3.2Å; K520-K523 PolarHBondContact O-N 3.23Å; K520-A524 WeakPolarHBondContact O-CB 3.36Å; K520-A524 PolarHBondContact O-N 2.66Å; K520-L536 HydrophobicContact CB-CD1 4.1Å
521	L	91.4	Very high	85.4	Confident	19 Å²	19	83.4 Å²	83.4	10%	0.099	45%	0.445	C	S	.	.	H	α-helix	trans	-61.4	-53.8	177.6	176.1	61.2	0	0	0	111.3	L517 G518 K523 A524 E525 V533 L536 K537 L540	L517-L521 WeakPolarHBondContact O-CB 3.44Å; L517-L521 PolarHBondContact O-N 3.27Å; G518-L521 WeakPolarHBondContact O-CB 3.38Å; G518-L521 PolarHBondContact O-N 3.35Å; L521-K523 VanDerWaalsContact C-N 3.26Å; L521-K523 PolarHBondContact O-N 2.73Å; L521-A524 PolarHBondContact O-N 3.04Å; L521-A524 VanDerWaalsContact O-N 3.07Å; L521-E525 WeakPolarHBondContact O-CB 3.42Å; L521-E525 PolarHBondContact O-N 2.88Å; L521-V533 HydrophobicContact CD1-CB 4.08Å; L521-V533 HydrophobicContact CD1-CG1 3.79Å; L521-V533 HydrophobicContact CD1-CG2 4.28Å; L521-V533 VanDerWaalsContact CD1-O 3.31Å; L521-V533 WeakPolarHBondContact CD1-O 3.25Å; L521-L536 HydrophobicContact CB-CB 4.28Å; L521-L536 HydrophobicContact CD1-CB 3.94Å; L521-K537 HydrophobicContact CD1-CD 4.32Å; L521-K537 HydrophobicContact CD1-CG 3.82Å; L521-K537 HydrophobicContact CD2-CD 4.48Å; L521-K537 HydrophobicContact CD2-CG 3.64Å; L521-K537 HydrophobicContact CG-CG 4.39Å; L521-L540 HydrophobicContact CD2-CD1 3.9Å
522	I	87.8	Confident	85.4	Confident	99 Å²	99	82.6 Å²	82.6	51%	0.508	44%	0.442	S	S	.	.	H	α-helix	trans	-57.9	-40.7	177.9	-66.3	165.7	0	0	0	110.7	G518 E525 I526	G518-I522 WeakPolarHBondContact O-CG1 3.34Å; G518-I522 PolarHBondContact O-N 3.38Å; I522-E525 PolarHBondContact O-N 3.31Å; I522-I526 HydrophobicContact CG2-CD1 3.82Å; I522-I526 WeakPolarHBondContact O-CG1 3.47Å; I522-I526 PolarHBondContact O-N 2.82Å
523	K	87.8	Confident	85.5	Confident	144 Å²	144	77.1 Å²	77.1	63%	0.626	42%	0.417	S	S	*	.	H	α-helix	trans	-64.4	-40.8	176	-173.5	174.8	-180	178.6	0	112.7	S519 K520 L521 E525 M527	S519-K523 WeakPolarHBondContact O-CB 3.43Å; S519-K523 PolarHBondContact O-N 2.98Å; S519-K523 VanDerWaalsContact O-N 3.14Å; K520-K523 PolarHBondContact O-N 3.23Å; L521-K523 VanDerWaalsContact C-N 3.26Å; L521-K523 PolarHBondContact O-N 2.73Å; K523-E525 VanDerWaalsContact C-N 3.33Å; K523-M527 HydrophobicContact CG-SD 4.2Å; K523-M527 WeakPolarHBondContact O-CB 3.42Å; K523-M527 VanDerWaalsContact O-CG 3.27Å; K523-M527 WeakPolarHBondContact O-CG 2.97Å; K523-M527 PolarHBondContact O-N 2.93Å; K523-M527 VanDerWaalsContact O-N 3.14Å
524	A	86.1	Confident	85.7	Confident	7 Å²	7	79.1 Å²	79.1	6%	0.058	43%	0.427	C	S	.	.	H	α-helix	trans	-67.7	-33.8	176.9	0	0	0	0	0	112.4	K520 L521 M527 G528 N529 M532 V533 L536	K520-A524 WeakPolarHBondContact O-CB 3.36Å; K520-A524 PolarHBondContact O-N 2.66Å; L521-A524 PolarHBondContact O-N 3.04Å; L521-A524 VanDerWaalsContact O-N 3.07Å; A524-M527 CarbonylContact O-C 3.46Å; A524-M527 PolarHBondContact O-N 3.14Å; A524-G528 PolarHBondContact O-N 3.46Å; A524-G528 VanDerWaalsContact O-N 3.14Å; A524-N529 PolarHBondContact O-N 3Å; A524-M532 HydrophobicContact CB-CG 4.49Å; A524-M532 HydrophobicContact CB-SD 4.5Å; A524-V533 HydrophobicContact CB-CG2 3.8Å; A524-L536 HydrophobicContact CB-CD1 4.47Å
525	E	86.4	Confident	86	Confident	97 Å²	97	84.9 Å²	84.9	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-44.3	178.7	-160.6	156.2	-122.5	0	0	111.6	L521 I522 K523 M527 G528 V533 K537	L521-E525 WeakPolarHBondContact O-CB 3.42Å; L521-E525 PolarHBondContact O-N 2.88Å; I522-E525 PolarHBondContact O-N 3.31Å; K523-E525 VanDerWaalsContact C-N 3.33Å; E525-M527 PolarHBondContact O-N 3.26Å; E525-G528 PolarHBondContact O-N 3.09Å; E525-V533 HydrophobicContact CB-CG2 3.9Å; E525-V533 HydrophobicContact CG-CG2 4.42Å; E525-K537 IonicContact OE1-NZ 3.69Å; E525-K537 PolarHBondContact OE1-NZ 2.98Å
526	I	87.1	Confident	86.2	Confident	142 Å²	142	79.9 Å²	79.9	73%	0.728	42%	0.424	S	S	*	.	H	α-helix	trans	-62.1	-29.6	171	-67.4	168	0	0	0	111.9	I522	I522-I526 HydrophobicContact CG2-CD1 3.82Å; I522-I526 WeakPolarHBondContact O-CG1 3.47Å; I522-I526 PolarHBondContact O-N 2.82Å
527	M	81.6	Confident	86	Confident	123 Å²	123	78.7 Å²	78.7	61%	0.606	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	5.1	175.3	-67	-178.5	71.2	0	0	114	K523 A524 E525 N529	K523-M527 HydrophobicContact CG-SD 4.2Å; K523-M527 WeakPolarHBondContact O-CB 3.42Å; K523-M527 VanDerWaalsContact O-CG 3.27Å; K523-M527 WeakPolarHBondContact O-CG 2.97Å; K523-M527 PolarHBondContact O-N 2.93Å; K523-M527 VanDerWaalsContact O-N 3.14Å; A524-M527 CarbonylContact O-C 3.46Å; A524-M527 PolarHBondContact O-N 3.14Å; E525-M527 PolarHBondContact O-N 3.26Å; M527-N529 VanDerWaalsContact C-N 3.29Å; M527-N529 PolarHBondContact O-N 3.22Å
528	G	80.6	Confident	86.1	Confident	55 Å²	55	80.7 Å²	80.7	57%	0.567	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	8.6	173.9	0	0	0	0	0	116.7	A524 E525 T530	A524-G528 PolarHBondContact O-N 3.46Å; A524-G528 VanDerWaalsContact O-N 3.14Å; E525-G528 PolarHBondContact O-N 3.09Å; G528-T530 PolarHBondContact O-N 3.12Å
529	N	87.8	Confident	86	Confident	89 Å²	89	84.9 Å²	84.9	48%	0.476	45%	0.45	S	S	.	.			trans	-84.9	73.7	-173.7	-82.1	-44.7	0	0	0	112.6	A524 M527 A531 M532 V533	A524-N529 PolarHBondContact O-N 3Å; M527-N529 VanDerWaalsContact C-N 3.29Å; M527-N529 PolarHBondContact O-N 3.22Å; N529-A531 PolarHBondContact O-N 2.61Å; N529-M532 HydrophobicContact CB-CB 4.28Å; N529-M532 PolarHBondContact O-N 2.96Å; N529-V533 WeakPolarHBondContact O-CG2 3.3Å; N529-V533 PolarHBondContact O-N 2.62Å
530	T	82.2	Confident	85.9	Confident	96 Å²	96	82.5 Å²	82.5	59%	0.589	43%	0.431	S	S	*	.	H	α-helix	trans	-47.2	-51.3	-176.3	53.7	0	0	0	0	114.3	G528 M532 V533 E534	G528-T530 PolarHBondContact O-N 3.12Å; T530-M532 PolarHBondContact O-N 2.91Å; T530-M532 VanDerWaalsContact O-N 3.11Å; T530-V533 WeakPolarHBondContact O-CA 3.32Å; T530-V533 WeakPolarHBondContact O-CB 3.16Å; T530-V533 PolarHBondContact O-N 3.19Å; T530-E534 PolarHBondContact O-N 3.43Å
531	A	84.8	Confident	85.7	Confident	60 Å²	60	81.3 Å²	81.3	50%	0.496	43%	0.428	S	S	.	.	H	α-helix	trans	-66.3	-14.5	-178.7	0	0	0	0	0	114.6	N529 K535	N529-A531 PolarHBondContact O-N 2.61Å; A531-K535 WeakPolarHBondContact O-CG 3.48Å
532	M	78.4	Confident	85.5	Confident	109 Å²	109	82.2 Å²	82.2	54%	0.537	44%	0.438	S	S	.	.	H	α-helix	trans	-92.6	-35.6	170.5	-168.2	176	-169.9	0	0	111.5	A524 N529 T530 E534 K535 L536	A524-M532 HydrophobicContact CB-CG 4.49Å; A524-M532 HydrophobicContact CB-SD 4.5Å; N529-M532 HydrophobicContact CB-CB 4.28Å; N529-M532 PolarHBondContact O-N 2.96Å; T530-M532 PolarHBondContact O-N 2.91Å; T530-M532 VanDerWaalsContact O-N 3.11Å; M532-E534 VanDerWaalsContact C-N 3.35Å; M532-K535 PolarHBondContact O-N 3.4Å; M532-L536 HydrophobicContact CE-CD1 4.46Å; M532-L536 HydrophobicContact CG-CD1 4.2Å; M532-L536 WeakPolarHBondContact O-CG 3.47Å; M532-L536 PolarHBondContact O-N 2.96Å
533	V	84.4	Confident	85.2	Confident	11 Å²	11	78 Å²	78	7%	0.067	42%	0.418	C	S	.	.	H	α-helix	trans	-58.4	-45	173	165.4	0	0	0	0	110.9	L521 A524 E525 N529 T530 L536 K537	L521-V533 HydrophobicContact CD1-CB 4.08Å; L521-V533 HydrophobicContact CD1-CG1 3.79Å; L521-V533 HydrophobicContact CD1-CG2 4.28Å; L521-V533 VanDerWaalsContact CD1-O 3.31Å; L521-V533 WeakPolarHBondContact CD1-O 3.25Å; A524-V533 HydrophobicContact CB-CG2 3.8Å; E525-V533 HydrophobicContact CB-CG2 3.9Å; E525-V533 HydrophobicContact CG-CG2 4.42Å; N529-V533 WeakPolarHBondContact O-CG2 3.3Å; N529-V533 PolarHBondContact O-N 2.62Å; T530-V533 WeakPolarHBondContact O-CA 3.32Å; T530-V533 WeakPolarHBondContact O-CB 3.16Å; T530-V533 PolarHBondContact O-N 3.19Å; V533-L536 PolarHBondContact O-N 2.98Å; V533-K537 HydrophobicContact CG1-CD 3.93Å; V533-K537 VanDerWaalsContact CG1-NZ 3.31Å; V533-K537 WeakPolarHBondContact O-CB 3.28Å; V533-K537 WeakPolarHBondContact O-CG 3.39Å; V533-K537 PolarHBondContact O-N 3.39Å
534	E	88.1	Confident	85	Confident	126 Å²	126	76.4 Å²	76.4	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-61.9	-45.5	177.4	-71.9	161.9	-167.8	0	0	112.7	T530 M532 L536 K537 S538	T530-E534 PolarHBondContact O-N 3.43Å; M532-E534 VanDerWaalsContact C-N 3.35Å; E534-L536 VanDerWaalsContact C-N 3.33Å; E534-L536 PolarHBondContact O-N 3.2Å; E534-K537 PolarHBondContact O-N 3.23Å; E534-S538 PolarHBondContact O-N 3.01Å; E534-S538 PolarHBondContact O-OG 2.94Å
535	K	87.8	Confident	84.9	Confident	145 Å²	145	81.7 Å²	81.7	63%	0.63	43%	0.434	S	S	*	.	H	α-helix	trans	-67.4	-30.9	179.1	-68.8	178.5	-178.1	-179.2	0	113.2	A531 M532 S538 Q539	A531-K535 WeakPolarHBondContact O-CG 3.48Å; M532-K535 PolarHBondContact O-N 3.4Å; K535-S538 PolarHBondContact O-OG 3.49Å; K535-Q539 VanDerWaalsContact O-CG 3.28Å; K535-Q539 WeakPolarHBondContact O-CG 3.21Å; K535-Q539 PolarHBondContact O-N 2.93Å
536	L	88.4	Confident	84.6	Confident	14 Å²	14	78 Å²	78	7%	0.073	42%	0.42	C	S	.	.	H	α-helix	trans	-79.9	-31.3	174.6	-71.3	172.5	0	0	0	112.2	L517 K520 L521 A524 M532 V533 E534 L540	L517-L536 HydrophobicContact CD2-CD2 3.99Å; K520-L536 HydrophobicContact CB-CD1 4.1Å; L521-L536 HydrophobicContact CB-CB 4.28Å; L521-L536 HydrophobicContact CD1-CB 3.94Å; A524-L536 HydrophobicContact CB-CD1 4.47Å; M532-L536 HydrophobicContact CE-CD1 4.46Å; M532-L536 HydrophobicContact CG-CD1 4.2Å; M532-L536 WeakPolarHBondContact O-CG 3.47Å; M532-L536 PolarHBondContact O-N 2.96Å; V533-L536 PolarHBondContact O-N 2.98Å; E534-L536 VanDerWaalsContact C-N 3.33Å; E534-L536 PolarHBondContact O-N 3.2Å; L536-L540 WeakPolarHBondContact O-CG 3.25Å; L536-L540 PolarHBondContact O-N 2.89Å; L536-L540 VanDerWaalsContact O-N 3.14Å
537	K	88	Confident	84.4	Confident	77 Å²	77	74.9 Å²	74.9	34%	0.335	40%	0.402	S	S	.	.	H	α-helix	trans	-64.8	-49.7	171.5	-79.5	169	179.7	167.8	0	111.3	L521 E525 V533 E534 Q539 L540 E541	L521-K537 HydrophobicContact CD1-CD 4.32Å; L521-K537 HydrophobicContact CD1-CG 3.82Å; L521-K537 HydrophobicContact CD2-CD 4.48Å; L521-K537 HydrophobicContact CD2-CG 3.64Å; L521-K537 HydrophobicContact CG-CG 4.39Å; E525-K537 IonicContact OE1-NZ 3.69Å; E525-K537 PolarHBondContact OE1-NZ 2.98Å; V533-K537 HydrophobicContact CG1-CD 3.93Å; V533-K537 VanDerWaalsContact CG1-NZ 3.31Å; V533-K537 WeakPolarHBondContact O-CB 3.28Å; V533-K537 WeakPolarHBondContact O-CG 3.39Å; V533-K537 PolarHBondContact O-N 3.39Å; E534-K537 PolarHBondContact O-N 3.23Å; K537-Q539 VanDerWaalsContact C-N 3.34Å; K537-Q539 PolarHBondContact O-N 2.76Å; K537-L540 PolarHBondContact O-N 3.01Å; K537-L540 VanDerWaalsContact O-N 3.13Å; K537-E541 PolarHBondContact O-N 3.01Å
538	S	88.2	Confident	84.3	Confident	68 Å²	68	75.6 Å²	75.6	48%	0.476	40%	0.403	S	S	.	.	H	α-helix	trans	-62.7	-36.8	179	63.5	0	0	0	0	113.4	E534 K535 E541 A542	E534-S538 PolarHBondContact O-N 3.01Å; E534-S538 PolarHBondContact O-OG 2.94Å; K535-S538 PolarHBondContact O-OG 3.49Å; S538-E541 PolarHBondContact O-N 3.5Å; S538-A542 WeakPolarHBondContact O-CB 3.38Å; S538-A542 PolarHBondContact O-N 3.41Å
539	Q	84.1	Confident	84.3	Confident	108 Å²	108	77.7 Å²	77.7	51%	0.505	40%	0.4	S	S	.	.	H	α-helix	trans	-65	-38.8	173.4	-75.9	177.8	-7.6	0	0	113	K535 K537 A543	K535-Q539 VanDerWaalsContact O-CG 3.28Å; K535-Q539 WeakPolarHBondContact O-CG 3.21Å; K535-Q539 PolarHBondContact O-N 2.93Å; K537-Q539 VanDerWaalsContact C-N 3.34Å; K537-Q539 PolarHBondContact O-N 2.76Å; Q539-A543 WeakPolarHBondContact O-CB 3.28Å; Q539-A543 PolarHBondContact O-N 3.28Å; Q539-A543 VanDerWaalsContact O-N 3.12Å
540	L	84.4	Confident	83.8	Confident	20 Å²	20	78.1 Å²	78.1	11%	0.105	40%	0.399	C	S	.	.	H	α-helix	trans	-68.8	-42.1	174.9	-81.7	167.7	0	0	0	112.3	M514 L517 L521 L536 K537 A543 Q544	M514-L540 HydrophobicContact CB-CD2 4.18Å; M514-L540 HydrophobicContact CG-CD2 4.47Å; L517-L540 HydrophobicContact CB-CD1 4.37Å; L517-L540 HydrophobicContact CB-CD2 3.77Å; L517-L540 HydrophobicContact CB-CG 4.01Å; L517-L540 HydrophobicContact CD1-CD2 4.36Å; L521-L540 HydrophobicContact CD2-CD1 3.9Å; L536-L540 WeakPolarHBondContact O-CG 3.25Å; L536-L540 PolarHBondContact O-N 2.89Å; L536-L540 VanDerWaalsContact O-N 3.14Å; K537-L540 PolarHBondContact O-N 3.01Å; K537-L540 VanDerWaalsContact O-N 3.13Å; L540-A543 PolarHBondContact O-N 2.71Å; L540-Q544 WeakPolarHBondContact O-CB 3.26Å; L540-Q544 VanDerWaalsContact O-CG 3.31Å; L540-Q544 WeakPolarHBondContact O-CG 3.32Å; L540-Q544 PolarHBondContact O-N 2.88Å
541	E	84.9	Confident	83.6	Confident	98 Å²	98	75.5 Å²	75.5	46%	0.458	39%	0.387	S	S	.	.	H	α-helix	trans	-64.8	-40.5	177.3	-73.3	178.9	-146	0	0	112.4	K537 S538 Q544 K545	K537-E541 PolarHBondContact O-N 3.01Å; S538-E541 PolarHBondContact O-N 3.5Å; E541-Q544 PolarHBondContact O-N 2.96Å; E541-K545 WeakPolarHBondContact O-CB 3.38Å; E541-K545 WeakPolarHBondContact O-CD 3.38Å; E541-K545 VanDerWaalsContact O-CG 3.27Å; E541-K545 WeakPolarHBondContact O-CG 3.5Å; E541-K545 PolarHBondContact O-N 2.82Å; E541-K545 IonicContact OE2-NZ 2.88Å
542	A	85.7	Confident	83.3	Confident	38 Å²	38	75.9 Å²	75.9	31%	0.314	38%	0.384	S	S	.	.	H	α-helix	trans	-62	-45.3	173.8	0	0	0	0	0	111.5	S538 Q544 K545 A546	S538-A542 WeakPolarHBondContact O-CB 3.38Å; S538-A542 PolarHBondContact O-N 3.41Å; A542-Q544 PolarHBondContact O-N 3.33Å; A542-K545 PolarHBondContact O-N 3.35Å; A542-A546 WeakPolarHBondContact O-CB 3.25Å; A542-A546 PolarHBondContact O-N 3.44Å
543	A	83	Confident	83.3	Confident	10 Å²	10	77 Å²	77	8%	0.083	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-40.7	177	0	0	0	0	0	112.7	L509 M514 Q539 L540 K547	L509-A543 HydrophobicContact CD1-CB 3.92Å; M514-A543 HydrophobicContact CG-CB 4.35Å; M514-A543 HydrophobicContact SD-CB 4.15Å; Q539-A543 WeakPolarHBondContact O-CB 3.28Å; Q539-A543 PolarHBondContact O-N 3.28Å; Q539-A543 VanDerWaalsContact O-N 3.12Å; L540-A543 PolarHBondContact O-N 2.71Å; A543-K547 WeakPolarHBondContact O-CB 3.35Å; A543-K547 PolarHBondContact O-N 2.7Å; A543-K547 VanDerWaalsContact O-N 3.09Å
544	Q	83	Confident	82.7	Confident	111 Å²	111	82 Å²	82	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-47	176.9	-73.6	176.2	9.3	0	0	111.8	M514 L540 E541 A542 A546 K547 E548	M514-Q544 HydrophobicContact SD-CG 4.23Å; L540-Q544 WeakPolarHBondContact O-CB 3.26Å; L540-Q544 VanDerWaalsContact O-CG 3.31Å; L540-Q544 WeakPolarHBondContact O-CG 3.32Å; L540-Q544 PolarHBondContact O-N 2.88Å; E541-Q544 PolarHBondContact O-N 2.96Å; A542-Q544 PolarHBondContact O-N 3.33Å; Q544-A546 PolarHBondContact O-N 2.82Å; Q544-K547 PolarHBondContact O-N 3.24Å; Q544-E548 PolarHBondContact O-N 3.29Å
545	K	83.6	Confident	81.9	Confident	118 Å²	118	83 Å²	83	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-59.1	-45.2	177	-73.1	164	-176.9	162.3	0	111.7	E541 A542 K547 E548 I549	E541-K545 WeakPolarHBondContact O-CB 3.38Å; E541-K545 WeakPolarHBondContact O-CD 3.38Å; E541-K545 VanDerWaalsContact O-CG 3.27Å; E541-K545 WeakPolarHBondContact O-CG 3.5Å; E541-K545 PolarHBondContact O-N 2.82Å; E541-K545 IonicContact OE2-NZ 2.88Å; A542-K545 PolarHBondContact O-N 3.35Å; K545-K547 PolarHBondContact O-N 2.91Å; K545-E548 PolarHBondContact O-N 2.8Å; K545-I549 WeakPolarHBondContact O-CG1 3.15Å; K545-I549 PolarHBondContact O-N 3.21Å
546	A	81	Confident	81	Confident	19 Å²	19	81.9 Å²	81.9	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-61	-43.1	175.8	0	0	0	0	0	112.3	L508 A542 Q544 E548 I549 H550	L508-A546 HydrophobicContact CD2-CB 3.82Å; L508-A546 WeakPolarHBondContact CD2-O 3.33Å; A542-A546 WeakPolarHBondContact O-CB 3.25Å; A542-A546 PolarHBondContact O-N 3.44Å; Q544-A546 PolarHBondContact O-N 2.82Å; A546-E548 VanDerWaalsContact C-N 3.34Å; A546-E548 PolarHBondContact O-N 2.69Å; A546-I549 PolarHBondContact O-N 3.06Å; A546-H550 WeakPolarHBondContact O-CB 3.5Å; A546-H550 PolarHBondContact O-N 2.88Å
547	K	81.7	Confident	79.6	Confident	78 Å²	78	87.6 Å²	87.6	34%	0.339	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-35.3	176.9	-169.3	-179.3	-179.6	-171.6	0	112.7	E511 M514 A543 Q544 K545 A551	E511-K547 VanDerWaalsContact CG-NZ 3.35Å; E511-K547 IonicContact OE1-NZ 3.61Å; E511-K547 PolarHBondContact OE1-NZ 2.81Å; M514-K547 HydrophobicContact CE-CD 3.91Å; A543-K547 WeakPolarHBondContact O-CB 3.35Å; A543-K547 PolarHBondContact O-N 2.7Å; A543-K547 VanDerWaalsContact O-N 3.09Å; Q544-K547 PolarHBondContact O-N 3.24Å; K545-K547 PolarHBondContact O-N 2.91Å; K547-A551 WeakPolarHBondContact O-CB 3.48Å; K547-A551 PolarHBondContact O-N 3.46Å
548	E	79.5	Confident	78.3	Confident	138 Å²	138	88.5 Å²	88.5	65%	0.645	43%	0.433	S	S	*	.	H	α-helix	trans	-69.4	-47.2	176.6	-174.5	161.1	-143.1	0	0	111.9	Q544 K545 A546 H550 A551 V552	Q544-E548 PolarHBondContact O-N 3.29Å; K545-E548 PolarHBondContact O-N 2.8Å; A546-E548 VanDerWaalsContact C-N 3.34Å; A546-E548 PolarHBondContact O-N 2.69Å; E548-H550 VanDerWaalsContact C-N 3.31Å; E548-H550 PolarHBondContact O-N 3.37Å; E548-A551 CarbonylContact O-C 3.59Å; E548-A551 WeakPolarHBondContact O-CA 3.47Å; E548-A551 WeakPolarHBondContact O-CB 3.44Å; E548-A551 PolarHBondContact O-N 2.92Å; E548-V552 WeakPolarHBondContact O-CG2 3.33Å; E548-V552 PolarHBondContact O-N 3.29Å
549	I	81.3	Confident	76.8	Confident	98 Å²	98	87.6 Å²	87.6	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-56.3	-45.7	174.1	-67.2	164.6	0	0	0	110.7	K545 A546 A551 V552 R553	K545-I549 WeakPolarHBondContact O-CG1 3.15Å; K545-I549 PolarHBondContact O-N 3.21Å; A546-I549 PolarHBondContact O-N 3.06Å; I549-A551 VanDerWaalsContact C-N 3.34Å; I549-A551 PolarHBondContact O-N 2.8Å; I549-V552 PolarHBondContact O-N 3.49Å; I549-R553 PolarHBondContact O-N 3.41Å
550	H	77.1	Confident	75.5	Confident	98 Å²	98	85 Å²	85	45%	0.454	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-35.4	175.7	179.3	-105.7	0	0	0	112.8	L508 A546 E548 K554	L508-H550 HydrophobicContact CD1-CB 3.81Å; L508-H550 VanDerWaalsContact CD1-CG 3.47Å; L508-H550 HydrophobicContact CD2-CB 4.16Å; A546-H550 WeakPolarHBondContact O-CB 3.5Å; A546-H550 PolarHBondContact O-N 2.88Å; E548-H550 VanDerWaalsContact C-N 3.31Å; E548-H550 PolarHBondContact O-N 3.37Å; H550-K554 VanDerWaalsContact O-CB 3.26Å; H550-K554 WeakPolarHBondContact O-CB 3.25Å; H550-K554 PolarHBondContact O-N 2.84Å
551	A	78.8	Confident	73.8	Confident	41 Å²	41	90 Å²	90	34%	0.339	45%	0.448	S	S	.	.	H	α-helix	trans	-69.6	-33	175.4	0	0	0	0	0	113	K547 E548 I549 K555	K547-A551 WeakPolarHBondContact O-CB 3.48Å; K547-A551 PolarHBondContact O-N 3.46Å; E548-A551 CarbonylContact O-C 3.59Å; E548-A551 WeakPolarHBondContact O-CA 3.47Å; E548-A551 WeakPolarHBondContact O-CB 3.44Å; E548-A551 PolarHBondContact O-N 2.92Å; I549-A551 VanDerWaalsContact C-N 3.34Å; I549-A551 PolarHBondContact O-N 2.8Å; A551-K555 WeakPolarHBondContact O-CG 3.47Å; A551-K555 PolarHBondContact O-N 2.88Å; A551-K555 VanDerWaalsContact O-N 3.11Å
552	V	78.2	Confident	72.2	Confident	69 Å²	69	91.8 Å²	91.8	42%	0.418	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-56.9	171.9	174	0	0	0	0	110.2	E548 I549 K554 K555 E556	E548-V552 WeakPolarHBondContact O-CG2 3.33Å; E548-V552 PolarHBondContact O-N 3.29Å; I549-V552 PolarHBondContact O-N 3.49Å; V552-K554 PolarHBondContact O-N 3.16Å; V552-K554 VanDerWaalsContact O-N 3.12Å; V552-K555 WeakPolarHBondContact O-CB 3.49Å; V552-K555 PolarHBondContact O-N 3.47Å; V552-E556 WeakPolarHBondContact O-CG 3.41Å; V552-E556 PolarHBondContact O-N 3.24Å
553	R	77.4	Confident	70.4	Confident	133 Å²	133	98.4 Å²	98.4	50%	0.502	48%	0.481	S	S	.	.	H	α-helix	trans	-51.5	-39.7	176.2	-73.5	-178.4	176.1	173.2	0.1	112	E505 I549 H557	E505-R553 IonicContact OE1-CZ 3.16Å; E505-R553 VanDerWaalsContact OE1-CZ 3.25Å; E505-R553 IonicContact OE1-NH1 3.39Å; E505-R553 PolarHBondContact OE1-NH1 3.4Å; E505-R553 IonicContact OE1-NH2 3.61Å; E505-R553 PolarHBondContact OE1-NH2 2.86Å; E505-R553 IonicContact OE2-NH1 3.3Å; I549-R553 PolarHBondContact O-N 3.41Å; R553-H557 WeakPolarHBondContact O-CB 3.49Å; R553-H557 PolarHBondContact O-N 3.12Å
554	K	73.3	Confident	68.5	Low	115 Å²	115	105.1 Å²	105.1	50%	0.5	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-44.3	176.1	-175.8	179.1	172.2	-173.4	0	113.1	H550 V552 E556 H557 E558	H550-K554 VanDerWaalsContact O-CB 3.26Å; H550-K554 WeakPolarHBondContact O-CB 3.25Å; H550-K554 PolarHBondContact O-N 2.84Å; V552-K554 PolarHBondContact O-N 3.16Å; V552-K554 VanDerWaalsContact O-N 3.12Å; K554-E556 VanDerWaalsContact C-N 3.32Å; K554-E556 PolarHBondContact O-N 3.45Å; K554-H557 PolarHBondContact O-N 2.97Å; K554-E558 WeakPolarHBondContact CE-OE1 3.29Å; K554-E558 IonicContact NZ-OE1 2.71Å; K554-E558 WeakPolarHBondContact O-CB 3.43Å; K554-E558 WeakPolarHBondContact O-CG 3.4Å; K554-E558 PolarHBondContact O-N 3.46Å
555	K	71.1	Confident	66.7	Low	148 Å²	148	105.2 Å²	105.2	64%	0.643	52%	0.519	S	S	*	.	H	α-helix	trans	-62.4	-40.1	177	-76.8	169.7	-179.5	173.4	0	111.6	A551 V552 E558 A559	A551-K555 WeakPolarHBondContact O-CG 3.47Å; A551-K555 PolarHBondContact O-N 2.88Å; A551-K555 VanDerWaalsContact O-N 3.11Å; V552-K555 WeakPolarHBondContact O-CB 3.49Å; V552-K555 PolarHBondContact O-N 3.47Å; K555-E558 PolarHBondContact O-N 2.74Å; K555-A559 WeakPolarHBondContact O-CB 3.28Å; K555-A559 PolarHBondContact O-N 3.35Å
556	E	67.9	Low	64.4	Low	120 Å²	120	103.2 Å²	103.2	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-65.5	-44.5	176.5	-66.9	171	146.6	0	0	111.2	V552 K554 E558 A559 A560	V552-E556 WeakPolarHBondContact O-CG 3.41Å; V552-E556 PolarHBondContact O-N 3.24Å; K554-E556 VanDerWaalsContact C-N 3.32Å; K554-E556 PolarHBondContact O-N 3.45Å; E556-E558 VanDerWaalsContact C-N 3.32Å; E556-E558 PolarHBondContact O-N 3.14Å; E556-A559 PolarHBondContact O-N 2.94Å; E556-A560 WeakPolarHBondContact O-CB 3.21Å; E556-A560 PolarHBondContact O-N 3.12Å
557	H	60	Low	62.4	Low	134 Å²	134	105.5 Å²	105.5	62%	0.62	55%	0.547	S	S	*	.	H	α-helix	trans	-64.4	-33.8	174.5	-166.9	-53.2	0	0	0	112.4	R553 K554 K561	R553-H557 WeakPolarHBondContact O-CB 3.49Å; R553-H557 PolarHBondContact O-N 3.12Å; K554-H557 PolarHBondContact O-N 2.97Å; H557-K561 WeakPolarHBondContact O-CB 3.3Å; H557-K561 PolarHBondContact O-N 3.07Å
558	E	59.4	Low	60.3	Low	96 Å²	96	108.3 Å²	108.3	45%	0.449	56%	0.561	S	S	.	*	H	α-helix	trans	-72.5	-37.4	173.6	-75.9	176.7	173.9	0	0	112.1	K554 K555 E556 K561 L562	K554-E558 WeakPolarHBondContact CE-OE1 3.29Å; K554-E558 IonicContact NZ-OE1 2.71Å; K554-E558 WeakPolarHBondContact O-CB 3.43Å; K554-E558 WeakPolarHBondContact O-CG 3.4Å; K554-E558 PolarHBondContact O-N 3.46Å; K555-E558 PolarHBondContact O-N 2.74Å; E556-E558 VanDerWaalsContact C-N 3.32Å; E556-E558 PolarHBondContact O-N 3.14Å; E558-K561 PolarHBondContact O-N 2.78Å; E558-L562 WeakPolarHBondContact O-CG 3.41Å; E558-L562 PolarHBondContact O-N 2.85Å
559	A	57.7	Low	58.2	Low	49 Å²	49	107.7 Å²	107.7	41%	0.405	57%	0.572	S	S	.	*	H	α-helix	trans	-66.1	-38.6	172.8	0	0	0	0	0	112.7	K555 E556 K563	K555-A559 WeakPolarHBondContact O-CB 3.28Å; K555-A559 PolarHBondContact O-N 3.35Å; E556-A559 PolarHBondContact O-N 2.94Å; A559-K563 WeakPolarHBondContact O-CG 3.43Å; A559-K563 PolarHBondContact O-N 2.96Å
560	A	56.5	Low	56.4	Low	53 Å²	53	113 Å²	113	44%	0.438	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-42.9	171.8	0	0	0	0	0	111.7	E556 L562 K563 Q564	E556-A560 WeakPolarHBondContact O-CB 3.21Å; E556-A560 PolarHBondContact O-N 3.12Å; A560-L562 PolarHBondContact O-N 2.69Å; A560-K563 WeakPolarHBondContact O-CB 3.5Å; A560-K563 PolarHBondContact O-N 2.88Å; A560-K563 VanDerWaalsContact O-N 3.16Å; A560-Q564 PolarHBondContact O-N 3.17Å
561	K	49.8	Very low	54.8	Low	127 Å²	127	114.8 Å²	114.8	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-64	-39.2	177.9	-169.7	174.7	-176.1	179.2	0	112.5	H557 E558 K563 Q564 V565	H557-K561 WeakPolarHBondContact O-CB 3.3Å; H557-K561 PolarHBondContact O-N 3.07Å; E558-K561 PolarHBondContact O-N 2.78Å; K561-K563 VanDerWaalsContact C-N 3.33Å; K561-K563 PolarHBondContact O-N 2.98Å; K561-Q564 PolarHBondContact O-N 3.36Å; K561-V565 VanDerWaalsContact O-CG2 3.32Å; K561-V565 WeakPolarHBondContact O-CG2 3.38Å; K561-V565 PolarHBondContact O-N 3.07Å
562	L	50.1	Low	53.4	Low	134 Å²	134	121.1 Å²	121.1	70%	0.702	62%	0.623	S	S	*	*	H	α-helix	trans	-63.6	-36.6	172.8	-77.6	166.2	0	0	0	112.4	E558 A560	E558-L562 WeakPolarHBondContact O-CG 3.41Å; E558-L562 PolarHBondContact O-N 2.85Å; A560-L562 PolarHBondContact O-N 2.69Å
563	K	48.1	Very low	52.6	Low	177 Å²	177	125.5 Å²	125.5	77%	0.77	64%	0.639	S	S	*	*	H	α-helix	trans	-68.7	-31.2	173.5	-71.7	174.7	-179.8	175.5	0	113	A559 A560 K561	A559-K563 WeakPolarHBondContact O-CG 3.43Å; A559-K563 PolarHBondContact O-N 2.96Å; A560-K563 WeakPolarHBondContact O-CB 3.5Å; A560-K563 PolarHBondContact O-N 2.88Å; A560-K563 VanDerWaalsContact O-N 3.16Å; K561-K563 VanDerWaalsContact C-N 3.33Å; K561-K563 PolarHBondContact O-N 2.98Å
564	Q	44.1	Very low	52.5	Low	151 Å²	151	127.9 Å²	127.9	71%	0.706	66%	0.655	S	S	*	*	H	α-helix	trans	-73.3	-40.4	172.7	-77.4	-173.6	-20.8	0	0	113.4	A560 K561 G566 S567	A560-Q564 PolarHBondContact O-N 3.17Å; K561-Q564 PolarHBondContact O-N 3.36Å; Q564-G566 PolarHBondContact O-N 3.33Å; Q564-S567 PolarHBondContact O-N 2.93Å; Q564-S567 VanDerWaalsContact O-N 3.15Å
565	V	45.1	Very low	52.7	Low	113 Å²	113	126 Å²	126	69%	0.685	65%	0.654	S	S	*	*	H	α-helix	trans	-68.1	-19.9	-173.3	168.9	0	0	0	0	113.5	K561 S567	K561-V565 VanDerWaalsContact O-CG2 3.32Å; K561-V565 WeakPolarHBondContact O-CG2 3.38Å; K561-V565 PolarHBondContact O-N 3.07Å; V565-S567 VanDerWaalsContact C-N 3.27Å; V565-S567 PolarHBondContact O-N 3.14Å
566	G	34.6	Very low	53.3	Low	77 Å²	77	125.5 Å²	125.5	79%	0.794	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-3	173.7	0	0	0	0	0	115.7	Q564	Q564-G566 PolarHBondContact O-N 3.33Å
567	S	38.4	Very low	54.2	Low	66 Å²	66	122 Å²	122	46%	0.462	64%	0.642	S	S	.	*	S	Bend	trans	-131.3	135.8	-168.2	-165.3	0	0	0	0	113.6	Q564 V565 S569	Q564-S567 PolarHBondContact O-N 2.93Å; Q564-S567 VanDerWaalsContact O-N 3.15Å; V565-S567 VanDerWaalsContact C-N 3.27Å; V565-S567 PolarHBondContact O-N 3.14Å; S567-S569 PolarHBondContact O-N 2.86Å
568	Q	38.1	Very low	55.5	Low	138 Å²	138	119 Å²	119	65%	0.645	63%	0.627	S	S	*	*			trans	66.6	20.6	158.6	-65.8	172.8	-68.5	0	0	120.5	R570 E571	Q568-R570 PolarHBondContact O-N 3.37Å; Q568-E571 WeakPolarHBondContact CG-OE2 3.42Å; Q568-E571 PolarHBondContact NE2-OE2 3.41Å
569	S	35.8	Very low	56.6	Low	124 Å²	124	115.3 Å²	115.3	87%	0.867	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	23.2	168.9	58.8	0	0	0	0	115.6	S567	S567-S569 PolarHBondContact O-N 2.86Å
570	R	43.5	Very low	57.8	Low	210 Å²	210	114.3 Å²	114.3	79%	0.792	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.9	9.3	-176.4	-145.5	174.6	179.6	-168.6	-5.4	115.6	Q568 E702	Q568-R570 PolarHBondContact O-N 3.37Å; R570-E702 IonicContact NH2-OE1 3.95Å; R570-E702 PolarHBondContact NH2-OE1 3.1Å
571	E	42.2	Very low	59	Low	136 Å²	136	112.7 Å²	112.7	64%	0.636	58%	0.582	S	S	*	*	S	Bend	trans	-104.9	-24.1	-177	-61.9	-165.7	134.8	0	0	114.8	Q568 Q573	Q568-E571 WeakPolarHBondContact CG-OE2 3.42Å; Q568-E571 PolarHBondContact NE2-OE2 3.41Å; E571-Q573 PolarHBondContact O-N 2.92Å
572	D	49.4	Very low	60.3	Low	174 Å²	174	110.8 Å²	110.8	93%	0.93	58%	0.575	S	S	*	*			trans	-78.1	34.8	179.9	-84.7	-12.1	0	0	0	114.9	E574	D572-E574 PolarHBondContact O-N 2.87Å
573	Q	61	Low	61.5	Low	161 Å²	161	105.4 Å²	105.4	75%	0.752	55%	0.549	S	S	*	.			trans	-89.7	98.6	169.2	-167	166.8	7.4	0	0	110.2	E571 V575	E571-Q573 PolarHBondContact O-N 2.92Å; Q573-V575 VanDerWaalsContact C-N 3.33Å; Q573-V575 HydrophobicContact CG-CG2 4.18Å; Q573-V575 PolarHBondContact O-N 2.84Å
574	E	76.4	Confident	62.9	Low	183 Å²	183	99.5 Å²	99.5	86%	0.855	54%	0.538	S	S	*	.			trans	-63.8	86.5	174.9	-171.3	-175.6	-171.3	0	0	111	D572 L576	D572-E574 PolarHBondContact O-N 2.87Å; E574-L576 PolarHBondContact O-N 3.48Å
575	V	77.1	Confident	64.8	Low	76 Å²	76	99 Å²	99	46%	0.461	53%	0.53	S	S	.	.			trans	-84.6	111.5	176	178.8	0	0	0	0	109.7	Q573 L577	Q573-V575 VanDerWaalsContact C-N 3.33Å; Q573-V575 HydrophobicContact CG-CG2 4.18Å; Q573-V575 PolarHBondContact O-N 2.84Å; V575-L577 PolarHBondContact O-N 3.42Å
576	L	84.3	Confident	66.7	Low	136 Å²	136	96.6 Å²	96.6	71%	0.712	52%	0.521	S	S	*	.			trans	-62.9	115.7	167.9	-66.4	175.3	0	0	0	109.4	E574 F578	E574-L576 PolarHBondContact O-N 3.48Å; L576-F578 WeakPolarHBondContact O-CD1 3.38Å; L576-F578 PolarHBondContact O-N 2.86Å
577	L	86.6	Confident	69.1	Low	46 Å²	46	97.3 Å²	97.3	24%	0.241	50%	0.5	C	S	.	.			trans	-71.6	102.7	176.3	-66.4	179.3	0	0	0	109.9	V575 V589 R687 I691	V575-L577 PolarHBondContact O-N 3.42Å; L577-V589 PolarHBondContact O-N 3.33Å; L577-R687 HydrophobicContact CD1-CG 4.07Å; L577-I691 HydrophobicContact CD1-CD1 4.22Å; L577-I691 HydrophobicContact CD1-CG1 3.81Å; L577-I691 HydrophobicContact CD2-CG1 3.73Å; L577-I691 HydrophobicContact CG-CG1 4.46Å
578	F	86.9	Confident	71.5	Confident	72 Å²	72	98.9 Å²	98.9	32%	0.316	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	158	167.4	67	-88.9	0	0	0	110.8	L576 T580 A586 W587 L697	L576-F578 WeakPolarHBondContact O-CD1 3.38Å; L576-F578 PolarHBondContact O-N 2.86Å; F578-T580 HydrophobicContact CD2-CG2 4.26Å; F578-T580 HydrophobicContact CE2-CG2 4.05Å; F578-A586 HydrophobicContact CB-CB 4.36Å; F578-A586 HydrophobicContact CD2-CB 3.74Å; F578-A586 HydrophobicContact CE2-CB 4.4Å; F578-A586 HydrophobicContact CG-CB 4.26Å; F578-W587 CarbonylContact C-O 3.54Å; F578-W587 VanDerWaalsContact CA-O 3.25Å; F578-W587 WeakPolarHBondContact CA-O 3.47Å; F578-L697 HydrophobicContact CE2-CD2 4.47Å; F578-L697 HydrophobicContact CZ-CD2 3.94Å
579	R	83.6	Confident	73.7	Confident	19 Å²	19	94.2 Å²	94.2	7%	0.072	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140.8	172.5	-178.5	-172.1	171.7	179.6	1.6	108.8	A586 W587 V589 S639 D642 R689 A690	R579-A586 CarbonylContact O-C 3.56Å; R579-A586 WeakPolarHBondContact O-CA 3.44Å; R579-W587 PolarHBondContact N-O 2.98Å; R579-W587 PolarHBondContact O-N 2.92Å; R579-V589 HydrophobicContact CB-CG2 4.03Å; R579-S639 PolarHBondContact NH2-OG 3.11Å; R579-D642 IonicContact CZ-OD1 3.32Å; R579-D642 IonicContact CZ-OD2 2.75Å; R579-D642 VanDerWaalsContact NH1-CG 3.28Å; R579-D642 IonicContact NH1-OD1 3.21Å; R579-D642 PolarHBondContact NH1-OD1 3.35Å; R579-D642 VanDerWaalsContact NH1-OD1 3.17Å; R579-D642 IonicContact NH1-OD2 3.34Å; R579-D642 PolarHBondContact NH1-OD2 2.72Å; R579-D642 IonicContact NH2-OD1 3.84Å; R579-D642 PolarHBondContact NH2-OD1 3.46Å; R579-D642 IonicContact NH2-OD2 2.7Å; R579-D642 PolarHBondContact NH2-OD2 2.94Å; R579-R689 VanDerWaalsContact NH2-NH1 3.16Å; R579-A690 HydrophobicContact CB-CB 4.46Å
580	T	82.9	Confident	75.8	Confident	28 Å²	28	94.8 Å²	94.8	17%	0.172	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.1	172	51.9	0	0	0	0	111.7	F578 R585 K792	F578-T580 HydrophobicContact CD2-CG2 4.26Å; F578-T580 HydrophobicContact CE2-CG2 4.05Å; T580-R585 WeakPolarHBondContact CA-O 3.49Å; T580-K792 PolarHBondContact OG1-NZ 2.89Å
581	D	81.1	Confident	77.2	Confident	19 Å²	19	87.2 Å²	87.2	10%	0.102	46%	0.464	C	S	.	.			trans	-78.3	175.8	163.9	77.2	19.2	0	0	0	112.1	S583 G584 R585	D581-S583 VanDerWaalsContact C-N 3.28Å; D581-S583 PolarHBondContact O-N 3.25Å; D581-S583 WeakPolarHBondContact OD1-CA 3.28Å; D581-S583 WeakPolarHBondContact OD1-CB 3.39Å; D581-S583 PolarHBondContact OD1-N 2.94Å; D581-S583 PolarHBondContact OD1-OG 3.32Å; D581-S583 PolarHBondContact OD2-OG 3.09Å; D581-G584 PolarHBondContact O-N 2.84Å; D581-G584 PolarHBondContact OD1-N 2.8Å; D581-G584 VanDerWaalsContact OD1-N 3.13Å; D581-R585 PolarHBondContact N-O 2.96Å; D581-R585 PolarHBondContact OD1-N 3.18Å; D581-R585 IonicContact OD1-NE 3.29Å; D581-R585 IonicContact OD1-NH2 2.79Å; D581-R585 IonicContact OD2-CZ 2.63Å; D581-R585 IonicContact OD2-NE 2.72Å; D581-R585 PolarHBondContact OD2-NE 3.44Å; D581-R585 IonicContact OD2-NH2 2.68Å; D581-R585 PolarHBondContact OD2-NH2 3.12Å
582	E	76.8	Confident	78.5	Confident	86 Å²	86	83.8 Å²	83.8	40%	0.402	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.8	-177	-71	168.1	160	0	0	112.2	G584 Q641 G846	E582-G584 PolarHBondContact O-N 3.13Å; E582-Q641 VanDerWaalsContact OE1-CG 3.3Å; E582-Q641 WeakPolarHBondContact OE1-CG 3.35Å; E582-Q641 PolarHBondContact OE1-NE2 3Å; E582-G846 WeakPolarHBondContact O-CA 3.23Å
583	S	75.4	Confident	79.2	Confident	22 Å²	22	80.4 Å²	80.4	15%	0.154	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	3.2	175.1	74.8	0	0	0	0	114.3	D581 R585	D581-S583 VanDerWaalsContact C-N 3.28Å; D581-S583 PolarHBondContact O-N 3.25Å; D581-S583 WeakPolarHBondContact OD1-CA 3.28Å; D581-S583 WeakPolarHBondContact OD1-CB 3.39Å; D581-S583 PolarHBondContact OD1-N 2.94Å; D581-S583 PolarHBondContact OD1-OG 3.32Å; D581-S583 PolarHBondContact OD2-OG 3.09Å; S583-R585 PolarHBondContact OG-NE 3.05Å; S583-R585 VanDerWaalsContact OG-NE 3.09Å; S583-R585 PolarHBondContact OG-NH1 2.97Å; S583-R585 PolarHBondContact OG-NH2 3.36Å
584	G	76.9	Confident	79.4	Confident	52 Å²	52	74.9 Å²	74.9	54%	0.536	43%	0.43	S	S	.	.			trans	85.4	3.3	178.7	0	0	0	0	0	115.3	D581 E582	D581-G584 PolarHBondContact O-N 2.84Å; D581-G584 PolarHBondContact OD1-N 2.8Å; D581-G584 VanDerWaalsContact OD1-N 3.13Å; E582-G584 PolarHBondContact O-N 3.13Å
585	R	84.1	Confident	78.6	Confident	142 Å²	142	72.5 Å²	72.5	54%	0.536	43%	0.43	S	S	.	.			trans	-72.9	134.1	-179.9	-61	174.7	-64.5	-126.4	-5.1	110.3	T580 D581 S583	T580-R585 WeakPolarHBondContact CA-O 3.49Å; D581-R585 PolarHBondContact N-O 2.96Å; D581-R585 PolarHBondContact OD1-N 3.18Å; D581-R585 IonicContact OD1-NE 3.29Å; D581-R585 IonicContact OD1-NH2 2.79Å; D581-R585 IonicContact OD2-CZ 2.63Å; D581-R585 IonicContact OD2-NE 2.72Å; D581-R585 PolarHBondContact OD2-NE 3.44Å; D581-R585 IonicContact OD2-NH2 2.68Å; D581-R585 PolarHBondContact OD2-NH2 3.12Å; S583-R585 PolarHBondContact OG-NE 3.05Å; S583-R585 VanDerWaalsContact OG-NE 3.09Å; S583-R585 PolarHBondContact OG-NH1 2.97Å; S583-R585 PolarHBondContact OG-NH2 3.36Å
586	A	85.4	Confident	77.8	Confident	62 Å²	62	74.4 Å²	74.4	51%	0.512	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.6	-178.9	0	0	0	0	0	111.7	F578 R579	F578-A586 HydrophobicContact CB-CB 4.36Å; F578-A586 HydrophobicContact CD2-CB 3.74Å; F578-A586 HydrophobicContact CE2-CB 4.4Å; F578-A586 HydrophobicContact CG-CB 4.26Å; R579-A586 CarbonylContact O-C 3.56Å; R579-A586 WeakPolarHBondContact O-CA 3.44Å
587	W	85.3	Confident	76.9	Confident	91 Å²	91	71.6 Å²	71.6	35%	0.345	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.9	176.5	-66.7	102.9	0	0	0	110.9	F578 R579 K636 M637	F578-W587 CarbonylContact C-O 3.54Å; F578-W587 VanDerWaalsContact CA-O 3.25Å; F578-W587 WeakPolarHBondContact CA-O 3.47Å; R579-W587 PolarHBondContact N-O 2.98Å; R579-W587 PolarHBondContact O-N 2.92Å; W587-K636 HydrophobicContact CZ2-CB 4.5Å; W587-K636 WeakPolarHBondContact CZ2-O 3.17Å; W587-K636 PolarHBondContact NE1-O 2.66Å; W587-M637 HydrophobicContact CD2-CG 3.95Å; W587-M637 HydrophobicContact CE3-CG 4.12Å; W587-M637 HydrophobicContact CG-CG 4.13Å
588	P	88.1	Confident	75.7	Confident	100 Å²	100	75 Å²	75	65%	0.649	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.3	177	29.7	-33.9	0	0	0	111.1
589	V	84.9	Confident	74.2	Confident	40 Å²	40	80.7 Å²	80.7	24%	0.242	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-86.4	125.5	176.2	-176.7	0	0	0	0	109.1	L577 R579 R687 A690	L577-V589 PolarHBondContact O-N 3.33Å; R579-V589 HydrophobicContact CB-CG2 4.03Å; V589-R687 HydrophobicContact CG1-CB 4.39Å; V589-A690 HydrophobicContact CG2-CB 3.75Å
590	K	80.2	Confident	72.5	Confident	136 Å²	136	83.1 Å²	83.1	59%	0.591	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-67.6	157.6	176.1	-65.9	-177.7	180	177.6	0	110.7
591	G	72.6	Confident	71.3	Confident	51 Å²	51	85 Å²	85	53%	0.526	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-65.5	162.9	162.2	0	0	0	0	0	111.4
592	P	69.8	Low	70.1	Confident	64 Å²	64	96.6 Å²	96.6	42%	0.416	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-59.2	137.5	178.3	26.3	-34.6	0	0	0	110.7	E683	P592-E683 VanDerWaalsContact CA-OE2 3.31Å; P592-E683 WeakPolarHBondContact CA-OE2 3.42Å
593	S	64.2	Low	69.4	Low	103 Å²	103	103 Å²	103	72%	0.72	59%	0.588	S	S	*	*	S	Bend	trans	-85.2	-11.8	-171.7	55.1	0	0	0	0	114.8	E683	S593-E683 WeakPolarHBondContact CB-OE1 3.15Å; S593-E683 PolarHBondContact N-OE2 3.27Å; S593-E683 PolarHBondContact OG-OE1 2.89Å; S593-E683 PolarHBondContact OG-OE2 3.45Å; S593-E683 VanDerWaalsContact OG-OE2 3.06Å
594	G	64	Low	69	Low	45 Å²	45	111.4 Å²	111.4	46%	0.464	62%	0.621	S	S	.	*	S	Bend	trans	-159.2	-176.1	179.2	0	0	0	0	0	114.1	Q596	G594-Q596 PolarHBondContact O-N 3.15Å
595	P	60.3	Low	68.7	Low	132 Å²	132	112.2 Å²	112.2	86%	0.857	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-63	124	179.2	-21.2	33.8	0	0	0	112.2
596	Q	59.9	Low	68.3	Low	116 Å²	116	113.1 Å²	113.1	54%	0.542	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-75.2	131.9	-179.3	-169.9	-176.9	30.3	0	0	111.3	G594 D684	G594-Q596 PolarHBondContact O-N 3.15Å; Q596-D684 PolarHBondContact NE2-OD1 3.08Å; Q596-D684 VanDerWaalsContact NE2-OD1 3.1Å; Q596-D684 PolarHBondContact NE2-OD2 3.38Å
597	E	64.8	Low	68	Low	78 Å²	78	115.2 Å²	115.2	36%	0.364	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-59.5	136	170.4	-80.1	-161.6	138	0	0	111.3	H599 G678 R681	E597-H599 PolarHBondContact O-N 2.92Å; E597-G678 WeakPolarHBondContact OE2-CA 3.47Å; E597-R681 IonicContact OE2-CZ 2.63Å; E597-R681 IonicContact OE2-NE 2.79Å; E597-R681 IonicContact OE2-NH2 3.58Å; E597-R681 PolarHBondContact OE2-NH2 2.96Å
598	P	61.7	Low	68	Low	116 Å²	116	112.3 Å²	112.3	75%	0.753	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-62.4	125.6	-177	23.6	-33.3	0	0	0	112.4	G600	P598-G600 PolarHBondContact O-N 2.72Å
599	H	55.4	Low	67.8	Low	192 Å²	192	114.9 Å²	114.9	89%	0.889	62%	0.621	S	S	*	*	S	Bend	trans	-78	89	-170.4	-173.3	-65.3	0	0	0	113.3	E597	E597-H599 PolarHBondContact O-N 2.92Å
600	G	49.5	Very low	67.9	Low	71 Å²	71	113.8 Å²	113.8	73%	0.732	61%	0.614	S	S	*	*			trans	154.1	130.4	160.1	0	0	0	0	0	115.3	P598	P598-G600 PolarHBondContact O-N 2.72Å
601	G	57.7	Low	68.3	Low	67 Å²	67	111.6 Å²	111.6	69%	0.691	61%	0.606	S	S	*	*			trans	147.7	148.9	171	0	0	0	0	0	113	R603	G601-R603 PolarHBondContact O-N 3.21Å
602	R	55.5	Low	69.1	Low	262 Å²	262	112.6 Å²	112.6	99%	0.989	60%	0.602	S	S	*	*			trans	-77.8	49.3	172.4	-72.2	-173	175.9	178.7	1	111.9	K604	R602-K604 PolarHBondContact O-N 2.98Å
603	R	62.2	Low	69.9	Low	220 Å²	220	117.6 Å²	117.6	83%	0.83	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-70	120.1	167.6	-73.8	-175.8	172.7	-178.6	-2.9	107.9	G601 K605	G601-R603 PolarHBondContact O-N 3.21Å; R603-K605 PolarHBondContact O-N 3.34Å
604	K	65.6	Low	70.9	Confident	199 Å²	199	116 Å²	116	87%	0.865	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-59.4	128.8	169.2	-72.1	-175.4	177.7	-178.7	0	107.9	R602 K606	R602-K604 PolarHBondContact O-N 2.98Å; K604-K606 PolarHBondContact O-N 2.72Å
605	K	70.6	Confident	72.2	Confident	69 Å²	69	121.3 Å²	121.3	30%	0.3	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-60.7	131.5	169.9	-71	162.8	138.1	-95.8	0	108.1	R603 Q675 R676 E677	R603-K605 PolarHBondContact O-N 3.34Å; K605-Q675 HydrophobicContact CB-CB 4.42Å; K605-Q675 HydrophobicContact CD-CB 4.23Å; K605-Q675 PolarHBondContact NZ-O 2.97Å; K605-R676 WeakPolarHBondContact CE-O 3.42Å; K605-R676 WeakPolarHBondContact CG-O 3.13Å; K605-R676 VanDerWaalsContact NZ-C 3.31Å; K605-R676 PolarHBondContact NZ-O 3.36Å; K605-E677 VanDerWaalsContact CE-OE1 3.31Å; K605-E677 WeakPolarHBondContact CE-OE1 3.49Å; K605-E677 IonicContact NZ-OE1 3.19Å; K605-E677 PolarHBondContact NZ-OE1 3.32Å
606	K	76.6	Confident	73.4	Confident	162 Å²	162	119.2 Å²	119.2	70%	0.704	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-74.1	143	166.8	-66.5	-171.8	176.8	-172.7	0	108.7	K604 R676	K604-K606 PolarHBondContact O-N 2.72Å; K606-R676 VanDerWaalsContact O-CB 3.31Å; K606-R676 WeakPolarHBondContact O-CB 3.26Å; K606-R676 PolarHBondContact O-N 3.22Å; K606-R676 VanDerWaalsContact O-N 3.1Å
607	P	80	Confident	74.8	Confident	106 Å²	106	117.8 Å²	117.8	69%	0.688	61%	0.611	S	S	*	*	B	Isolated β-bridge	trans	-65.5	158.2	164.5	30.9	-34.2	0	0	0	110.2	A674	P607-A674 CarbonylContact C-O 3.56Å; P607-A674 VanDerWaalsContact CA-O 3.31Å; P607-A674 WeakPolarHBondContact CA-O 3.47Å
608	I	83.5	Confident	75.9	Confident	29 Å²	29	116.8 Å²	116.8	15%	0.149	60%	0.604	C	S	.	*	P	Polyproline II helix	trans	-94.2	145.3	173.9	-57.2	156.4	0	0	0	108.3	T610 Q621 A674 R676	I608-T610 PolarHBondContact O-N 2.83Å; I608-Q621 HydrophobicContact CD1-CB 3.69Å; I608-Q621 HydrophobicContact CD1-CG 4.12Å; I608-Q621 HydrophobicContact CG1-CG 4.46Å; I608-A674 PolarHBondContact N-O 3.5Å; I608-R676 HydrophobicContact CD1-CB 4.48Å; I608-R676 HydrophobicContact CG1-CB 4.03Å; I608-R676 HydrophobicContact CG1-CG 4.45Å
609	E	84.7	Confident	77.1	Confident	154 Å²	154	116.7 Å²	116.7	72%	0.72	59%	0.59	S	S	*	*			trans	-67.2	97.8	170.8	-71.5	164.8	-169.9	0	0	109.7	R618	E609-R618 PolarHBondContact O-NE 2.82Å; E609-R618 PolarHBondContact O-NH2 2.95Å
610	T	86.4	Confident	78.5	Confident	18 Å²	18	110.7 Å²	110.7	11%	0.11	56%	0.561	C	S	.	*			trans	-95.2	-16.4	-174.8	39.9	0	0	0	0	113.8	I608 V617 R618 A674	I608-T610 PolarHBondContact O-N 2.83Å; T610-V617 PolarHBondContact O-N 3.27Å; T610-R618 WeakPolarHBondContact CB-O 3.49Å; T610-R618 WeakPolarHBondContact CG2-O 3.47Å; T610-R618 PolarHBondContact O-N 3.44Å; T610-A674 HydrophobicContact CG2-CB 3.86Å
611	H	88.7	Confident	80	Confident	89 Å²	89	110 Å²	110	41%	0.412	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.5	-177.5	-54.2	76.2	0	0	0	110.8	E615 R616	H611-E615 CarbonylContact C-O 3.58Å; H611-E615 WeakPolarHBondContact CA-O 3.37Å; H611-E615 VanDerWaalsContact CB-O 3.29Å; H611-E615 WeakPolarHBondContact CB-O 3.01Å; H611-R616 VanDerWaalsContact CE1-CZ 3.46Å; H611-R616 PolarHBondContact CE1-NH2 2.8Å; H611-R616 PolarHBondContact NE2-NE 2.91Å; H611-R616 PolarHBondContact NE2-NH2 3.09Å
612	V	90.3	Very high	81.1	Confident	73 Å²	73	109.6 Å²	109.6	44%	0.442	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133.5	172	-178.1	0	0	0	0	106.6	G614 E615 V617	V612-G614 PolarHBondContact O-N 2.93Å; V612-E615 PolarHBondContact N-O 3.42Å; V612-E615 PolarHBondContact O-N 2.92Å; V612-V617 HydrophobicContact CB-CG2 3.87Å; V612-V617 HydrophobicContact CG2-CG2 3.81Å
613	D	86.6	Confident	82.4	Confident	169 Å²	169	100.6 Å²	100.6	90%	0.904	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	21.9	-179.7	-55	-30.7	0	0	0	116
614	G	86	Confident	83.6	Confident	69 Å²	69	94.5 Å²	94.5	71%	0.711	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	-19.2	-178.1	0	0	0	0	0	114.5	V612	V612-G614 PolarHBondContact O-N 2.93Å
615	E	90.3	Very high	84.4	Confident	156 Å²	156	91.1 Å²	91.1	73%	0.729	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	147.4	176.1	-62.4	-166.3	163.3	0	0	111.6	H611 V612	H611-E615 CarbonylContact C-O 3.58Å; H611-E615 WeakPolarHBondContact CA-O 3.37Å; H611-E615 VanDerWaalsContact CB-O 3.29Å; H611-E615 WeakPolarHBondContact CB-O 3.01Å; V612-E615 PolarHBondContact N-O 3.42Å; V612-E615 PolarHBondContact O-N 2.92Å
616	R	85.9	Confident	85	Confident	88 Å²	88	89 Å²	89	33%	0.332	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.9	176.9	-179.5	177	-72.7	-98.5	7.7	110.3	H611 Y619	H611-R616 VanDerWaalsContact CE1-CZ 3.46Å; H611-R616 PolarHBondContact CE1-NH2 2.8Å; H611-R616 PolarHBondContact NE2-NE 2.91Å; H611-R616 PolarHBondContact NE2-NH2 3.09Å; R616-Y619 HydrophobicContact CG-CE2 4.37Å
617	V	89.4	Confident	85.7	Confident	86 Å²	86	83.6 Å²	83.6	52%	0.521	45%	0.451	S	S	.	.			trans	-92.5	-32.3	-179.5	-177.2	0	0	0	0	112	T610 V612	T610-V617 PolarHBondContact O-N 3.27Å; V612-V617 HydrophobicContact CB-CG2 3.87Å; V612-V617 HydrophobicContact CG2-CG2 3.81Å
618	R	88.1	Confident	86.2	Confident	58 Å²	58	84.9 Å²	84.9	22%	0.219	45%	0.451	C	S	.	.			trans	-151.1	161.8	-174.3	55.8	-166	167.5	-149.9	-10.7	114.2	E609 T610 D623 D624	E609-R618 PolarHBondContact O-NE 2.82Å; E609-R618 PolarHBondContact O-NH2 2.95Å; T610-R618 WeakPolarHBondContact CB-O 3.49Å; T610-R618 WeakPolarHBondContact CG2-O 3.47Å; T610-R618 PolarHBondContact O-N 3.44Å; R618-D623 HydrophobicContact CB-CB 4.19Å; R618-D624 WeakPolarHBondContact CD-OD2 3.43Å; R618-D624 IonicContact CZ-OD2 3.41Å; R618-D624 IonicContact NE-OD2 2.69Å; R618-D624 IonicContact NH1-OD2 3.44Å; R618-D624 PolarHBondContact NH1-OD2 2.7Å
619	Y	85.6	Confident	86.6	Confident	113 Å²	113	91.8 Å²	91.8	44%	0.443	48%	0.483	S	S	.	.	S	Bend	trans	-117.1	-36.9	179.3	-72.8	-96.1	0	0	0	112.3	R616 D623 V670 A673	R616-Y619 HydrophobicContact CG-CE2 4.37Å; Y619-D623 PolarHBondContact N-OD2 2.81Å; Y619-V670 HydrophobicContact CD1-CG1 4.05Å; Y619-V670 HydrophobicContact CD1-CG2 4.05Å; Y619-V670 HydrophobicContact CE1-CG1 4.1Å; Y619-V670 HydrophobicContact CE1-CG2 3.87Å; Y619-A673 CarbonylContact O-C 3.54Å; Y619-A673 WeakPolarHBondContact O-CB 3.47Å
620	F	84.4	Confident	86.7	Confident	66 Å²	66	87.2 Å²	87.2	29%	0.289	46%	0.461	S	S	.	.	S	Bend	trans	-112.4	173.6	179.8	-61.6	-86.7	0	0	0	111.6	D623 M650 A673	F620-D623 PolarHBondContact N-OD2 2.88Å; F620-M650 HydrophobicContact CE1-CE 3.63Å; F620-M650 HydrophobicContact CZ-CE 4.17Å; F620-A673 HydrophobicContact CD1-CB 4.07Å; F620-A673 HydrophobicContact CE1-CB 3.78Å; F620-A673 HydrophobicContact CZ-CB 4.14Å
621	Q	81.9	Confident	86.8	Confident	57 Å²	57	91.4 Å²	91.4	27%	0.266	48%	0.481	S	S	.	.	S	Bend	trans	-79.9	-24.9	176.7	-158.5	-168.2	-30.1	0	0	112.5	I608 N625 E677 E679	I608-Q621 HydrophobicContact CD1-CB 3.69Å; I608-Q621 HydrophobicContact CD1-CG 4.12Å; I608-Q621 HydrophobicContact CG1-CG 4.46Å; Q621-N625 PolarHBondContact O-ND2 3.37Å; Q621-E677 PolarHBondContact OE1-O 2.69Å; Q621-E679 PolarHBondContact NE2-OE1 3.19Å
622	D	80.9	Confident	86.9	Confident	59 Å²	59	90.5 Å²	90.5	32%	0.316	48%	0.482	S	S	.	.	S	Bend	trans	-106.8	7.5	-174.1	65.3	-46	0	0	0	114.8	D624 N625 V626 R634	D622-D624 VanDerWaalsContact C-N 3.31Å; D622-D624 PolarHBondContact O-N 3.2Å; D622-N625 HydrophobicContact CB-CB 4.28Å; D622-N625 PolarHBondContact O-N 2.97Å; D622-V626 HydrophobicContact CB-CG2 4.33Å; D622-V626 VanDerWaalsContact O-CG2 3.28Å; D622-V626 WeakPolarHBondContact O-CG2 3.1Å; D622-V626 PolarHBondContact O-N 3.05Å; D622-R634 IonicContact OD2-CZ 2.75Å; D622-R634 IonicContact OD2-NH1 2.64Å; D622-R634 PolarHBondContact OD2-NH1 2.91Å; D622-R634 IonicContact OD2-NH2 2.73Å; D622-R634 PolarHBondContact OD2-NH2 2.85Å; D622-R634 VanDerWaalsContact OD2-NH2 3.09Å
623	D	83.8	Confident	86.7	Confident	72 Å²	72	90.9 Å²	90.9	39%	0.385	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-52	-48.7	174	-70.1	-24.2	0	0	0	111.4	R618 Y619 F620 N625	R618-D623 HydrophobicContact CB-CB 4.19Å; Y619-D623 PolarHBondContact N-OD2 2.81Å; F620-D623 PolarHBondContact N-OD2 2.88Å; D623-N625 VanDerWaalsContact C-N 3.27Å; D623-N625 PolarHBondContact O-N 2.9Å
624	D	86.2	Confident	86.6	Confident	93 Å²	93	87.9 Å²	87.9	50%	0.497	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-72.5	-16.6	178.8	-52.2	-60.5	0	0	0	113.7	R618 D622	R618-D624 WeakPolarHBondContact CD-OD2 3.43Å; R618-D624 IonicContact CZ-OD2 3.41Å; R618-D624 IonicContact NE-OD2 2.69Å; R618-D624 IonicContact NH1-OD2 3.44Å; R618-D624 PolarHBondContact NH1-OD2 2.7Å; D622-D624 VanDerWaalsContact C-N 3.31Å; D622-D624 PolarHBondContact O-N 3.2Å
625	N	82.8	Confident	86.6	Confident	128 Å²	128	90.3 Å²	90.3	68%	0.684	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-99.6	-2.1	-167.9	-70.5	-71.6	0	0	0	113.5	Q621 D622 D623	Q621-N625 PolarHBondContact O-ND2 3.37Å; D622-N625 HydrophobicContact CB-CB 4.28Å; D622-N625 PolarHBondContact O-N 2.97Å; D623-N625 VanDerWaalsContact C-N 3.27Å; D623-N625 PolarHBondContact O-N 2.9Å
626	V	84	Confident	86.4	Confident	24 Å²	24	89.4 Å²	89.4	15%	0.145	44%	0.438	C	S	.	.			trans	-117.7	98.9	-169.3	177.6	0	0	0	0	111.7	D622 E630 M631 R634	D622-V626 HydrophobicContact CB-CG2 4.33Å; D622-V626 VanDerWaalsContact O-CG2 3.28Å; D622-V626 WeakPolarHBondContact O-CG2 3.1Å; D622-V626 PolarHBondContact O-N 3.05Å; V626-E630 HydrophobicContact CG1-CB 4.3Å; V626-E630 HydrophobicContact CG1-CG 4.13Å; V626-M631 HydrophobicContact CG1-CB 4.06Å; V626-R634 VanDerWaalsContact CG2-CZ 3.44Å
627	G	90.9	Very high	86.3	Confident	49 Å²	49	87.2 Å²	87.2	51%	0.505	43%	0.432	S	S	.	.			trans	-63.9	150.1	172	0	0	0	0	0	113.1	Q629 E630 M631	G627-Q629 VanDerWaalsContact C-N 3.27Å; G627-Q629 PolarHBondContact O-N 3.48Å; G627-Q629 VanDerWaalsContact O-N 3.08Å; G627-E630 WeakPolarHBondContact O-CA 3.39Å; G627-E630 WeakPolarHBondContact O-CB 3.43Å; G627-E630 PolarHBondContact O-N 2.85Å; G627-M631 PolarHBondContact O-N 3.47Å
628	L	90.8	Very high	85.9	Confident	132 Å²	132	85 Å²	85	69%	0.691	42%	0.42	S	S	*	.	H	α-helix	trans	-51.3	-37.9	-173.4	-177.3	62.9	0	0	0	114.6	M631 V632	L628-M631 HydrophobicContact CD1-SD 4.47Å; L628-M631 WeakPolarHBondContact O-CB 3.38Å; L628-M631 PolarHBondContact O-N 3.44Å; L628-V632 WeakPolarHBondContact O-CG2 3.46Å; L628-V632 PolarHBondContact O-N 2.85Å
629	Q	91.3	Very high	85.5	Confident	174 Å²	174	82.8 Å²	82.8	81%	0.813	41%	0.414	S	S	*	.	H	α-helix	trans	-66.4	-36.4	176.8	-171.8	-178.5	9.1	0	0	112.6	G627 R633	G627-Q629 VanDerWaalsContact C-N 3.27Å; G627-Q629 PolarHBondContact O-N 3.48Å; G627-Q629 VanDerWaalsContact O-N 3.08Å; Q629-R633 WeakPolarHBondContact O-CB 3.25Å; Q629-R633 PolarHBondContact O-N 2.83Å
630	E	87.1	Confident	85.2	Confident	58 Å²	58	79.1 Å²	79.1	27%	0.271	41%	0.406	S	S	.	.	H	α-helix	trans	-72.4	-36	174.5	176.6	59.1	-159.1	0	0	110.8	V626 G627 R633 R634	V626-E630 HydrophobicContact CG1-CB 4.3Å; V626-E630 HydrophobicContact CG1-CG 4.13Å; G627-E630 WeakPolarHBondContact O-CA 3.39Å; G627-E630 WeakPolarHBondContact O-CB 3.43Å; G627-E630 PolarHBondContact O-N 2.85Å; E630-R633 WeakPolarHBondContact O-CB 3.13Å; E630-R633 PolarHBondContact O-N 3.33Å; E630-R633 IonicContact OE1-CZ 2.74Å; E630-R633 IonicContact OE1-NE 2.57Å; E630-R633 IonicContact OE1-NH2 2.91Å; E630-R633 PolarHBondContact OE1-NH2 3.43Å; E630-R633 IonicContact OE2-CZ 2.83Å; E630-R633 IonicContact OE2-NE 2.72Å; E630-R633 PolarHBondContact OE2-NE 2.85Å; E630-R633 IonicContact OE2-NH2 2.66Å; E630-R633 PolarHBondContact OE2-NH2 3.34Å; E630-R634 HydrophobicContact CG-CG 4.43Å; E630-R634 WeakPolarHBondContact O-CB 3.42Å; E630-R634 VanDerWaalsContact O-CG 3.3Å; E630-R634 WeakPolarHBondContact O-CG 3.41Å; E630-R634 PolarHBondContact O-N 3.43Å; E630-R634 WeakPolarHBondContact OE1-CG 3.43Å; E630-R634 IonicContact OE1-NE 2.68Å; E630-R634 PolarHBondContact OE1-NE 2.72Å
631	M	86.8	Confident	85	Confident	107 Å²	107	79.6 Å²	79.6	53%	0.527	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-49.8	171.2	-171.3	-175.6	-72.5	0	0	111.5	V626 G627 L628 R633 R634 E635	V626-M631 HydrophobicContact CG1-CB 4.06Å; G627-M631 PolarHBondContact O-N 3.47Å; L628-M631 HydrophobicContact CD1-SD 4.47Å; L628-M631 WeakPolarHBondContact O-CB 3.38Å; L628-M631 PolarHBondContact O-N 3.44Å; M631-R633 VanDerWaalsContact C-N 3.27Å; M631-R633 PolarHBondContact O-N 3.04Å; M631-R634 PolarHBondContact O-N 2.75Å; M631-E635 PolarHBondContact O-N 3.3Å
632	V	91.1	Very high	85	Confident	70 Å²	70	78.4 Å²	78.4	42%	0.424	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-32.2	175.5	173	0	0	0	0	112.1	L628 K636	L628-V632 WeakPolarHBondContact O-CG2 3.46Å; L628-V632 PolarHBondContact O-N 2.85Å; V632-K636 HydrophobicContact CG1-CD 4.23Å; V632-K636 WeakPolarHBondContact O-CB 3.43Å; V632-K636 WeakPolarHBondContact O-CG 3.35Å; V632-K636 PolarHBondContact O-N 3.09Å
633	R	86.9	Confident	85	Confident	81 Å²	81	79.1 Å²	79.1	31%	0.306	41%	0.406	S	S	.	.	H	α-helix	trans	-70.8	-43.4	174.1	-167.5	-170.6	73	87.3	4	111.9	Q629 E630 M631 M637	Q629-R633 WeakPolarHBondContact O-CB 3.25Å; Q629-R633 PolarHBondContact O-N 2.83Å; E630-R633 WeakPolarHBondContact O-CB 3.13Å; E630-R633 PolarHBondContact O-N 3.33Å; E630-R633 IonicContact OE1-CZ 2.74Å; E630-R633 IonicContact OE1-NE 2.57Å; E630-R633 IonicContact OE1-NH2 2.91Å; E630-R633 PolarHBondContact OE1-NH2 3.43Å; E630-R633 IonicContact OE2-CZ 2.83Å; E630-R633 IonicContact OE2-NE 2.72Å; E630-R633 PolarHBondContact OE2-NE 2.85Å; E630-R633 IonicContact OE2-NH2 2.66Å; E630-R633 PolarHBondContact OE2-NH2 3.34Å; M631-R633 VanDerWaalsContact C-N 3.27Å; M631-R633 PolarHBondContact O-N 3.04Å; R633-M637 PolarHBondContact NH1-SD 2.94Å; R633-M637 WeakPolarHBondContact O-CG 3.49Å; R633-M637 PolarHBondContact O-N 2.89Å
634	R	83.5	Confident	85.2	Confident	106 Å²	106	81.3 Å²	81.3	40%	0.4	41%	0.414	S	S	.	.	H	α-helix	trans	-60	-49.6	176.2	-76.2	171.9	172.4	-148.7	4.3	110.1	D622 V626 E630 M631 K636 M637 S638	D622-R634 IonicContact OD2-CZ 2.75Å; D622-R634 IonicContact OD2-NH1 2.64Å; D622-R634 PolarHBondContact OD2-NH1 2.91Å; D622-R634 IonicContact OD2-NH2 2.73Å; D622-R634 PolarHBondContact OD2-NH2 2.85Å; D622-R634 VanDerWaalsContact OD2-NH2 3.09Å; V626-R634 VanDerWaalsContact CG2-CZ 3.44Å; E630-R634 HydrophobicContact CG-CG 4.43Å; E630-R634 WeakPolarHBondContact O-CB 3.42Å; E630-R634 VanDerWaalsContact O-CG 3.3Å; E630-R634 WeakPolarHBondContact O-CG 3.41Å; E630-R634 PolarHBondContact O-N 3.43Å; E630-R634 WeakPolarHBondContact OE1-CG 3.43Å; E630-R634 IonicContact OE1-NE 2.68Å; E630-R634 PolarHBondContact OE1-NE 2.72Å; M631-R634 PolarHBondContact O-N 2.75Å; R634-K636 PolarHBondContact O-N 3.44Å; R634-M637 CarbonylContact O-C 3.6Å; R634-M637 PolarHBondContact O-N 2.8Å; R634-S638 WeakPolarHBondContact O-CB 3.3Å; R634-S638 PolarHBondContact O-N 3.32Å
635	E	86.7	Confident	85.1	Confident	120 Å²	120	79.3 Å²	79.3	56%	0.561	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-41.2	-178.7	-169.3	58.1	-163.9	0	0	112.4	M631 M637 S638	M631-E635 PolarHBondContact O-N 3.3Å; E635-M637 PolarHBondContact O-N 2.83Å; E635-S638 WeakPolarHBondContact O-CB 3.25Å; E635-S638 PolarHBondContact O-N 3.25Å; E635-S638 VanDerWaalsContact O-N 3.14Å
636	K	87.2	Confident	85.1	Confident	137 Å²	137	75.5 Å²	75.5	60%	0.596	39%	0.39	S	S	*	.	H	α-helix	trans	-67.3	-15.9	175.4	-73.2	176.9	179.6	179.1	0	115.1	W587 V632 R634	W587-K636 HydrophobicContact CZ2-CB 4.5Å; W587-K636 WeakPolarHBondContact CZ2-O 3.17Å; W587-K636 PolarHBondContact NE1-O 2.66Å; V632-K636 HydrophobicContact CG1-CD 4.23Å; V632-K636 WeakPolarHBondContact O-CB 3.43Å; V632-K636 WeakPolarHBondContact O-CG 3.35Å; V632-K636 PolarHBondContact O-N 3.09Å; R634-K636 PolarHBondContact O-N 3.44Å
637	M	82.1	Confident	85.1	Confident	42 Å²	42	80.3 Å²	80.3	21%	0.207	41%	0.406	C	S	.	.	H	α-helix	trans	-105.4	-10.2	172.8	-63.4	-173.5	-39.8	0	0	113.3	W587 R633 R634 E635	W587-M637 HydrophobicContact CD2-CG 3.95Å; W587-M637 HydrophobicContact CE3-CG 4.12Å; W587-M637 HydrophobicContact CG-CG 4.13Å; R633-M637 PolarHBondContact NH1-SD 2.94Å; R633-M637 WeakPolarHBondContact O-CG 3.49Å; R633-M637 PolarHBondContact O-N 2.89Å; R634-M637 CarbonylContact O-C 3.6Å; R634-M637 PolarHBondContact O-N 2.8Å; E635-M637 PolarHBondContact O-N 2.83Å
638	S	81.6	Confident	84.8	Confident	39 Å²	39	81.7 Å²	81.7	27%	0.273	41%	0.408	S	S	.	.			trans	-70.4	164.3	179	-166.9	0	0	0	0	109.5	R634 E635	R634-S638 WeakPolarHBondContact O-CB 3.3Å; R634-S638 PolarHBondContact O-N 3.32Å; E635-S638 WeakPolarHBondContact O-CB 3.25Å; E635-S638 PolarHBondContact O-N 3.25Å; E635-S638 VanDerWaalsContact O-N 3.14Å
639	S	79.6	Confident	84.4	Confident	12 Å²	12	78.4 Å²	78.4	8%	0.084	39%	0.387	C	S	.	.			trans	-145.1	155.7	171.9	60.8	0	0	0	0	109.8	R579 Q641 D642 Q643	R579-S639 PolarHBondContact NH2-OG 3.11Å; S639-Q641 PolarHBondContact O-N 3Å; S639-Q641 VanDerWaalsContact O-N 3.15Å; S639-D642 PolarHBondContact N-OD2 3.47Å; S639-D642 PolarHBondContact O-N 3.14Å; S639-D642 PolarHBondContact OG-N 2.91Å; S639-D642 PolarHBondContact OG-OD2 2.9Å; S639-Q643 PolarHBondContact O-N 3.44Å
640	A	79.9	Confident	83.7	Confident	35 Å²	35	70.4 Å²	70.4	29%	0.289	35%	0.349	S	S	.	.	H	α-helix	trans	-53.3	-36.2	172.7	0	0	0	0	0	111.1	D642 Q643 H644	A640-D642 VanDerWaalsContact C-N 3.32Å; A640-D642 PolarHBondContact O-N 3.12Å; A640-Q643 PolarHBondContact O-N 3.39Å; A640-H644 WeakPolarHBondContact O-CB 3.25Å; A640-H644 PolarHBondContact O-CD2 2.78Å; A640-H644 VanDerWaalsContact O-CD2 3.3Å; A640-H644 PolarHBondContact O-N 3.14Å
641	Q	79.4	Confident	83.3	Confident	76 Å²	76	70.1 Å²	70.1	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-59.7	-29	172.1	-77.2	171.5	51.7	0	0	115.9	E582 S639 A645	E582-Q641 VanDerWaalsContact OE1-CG 3.3Å; E582-Q641 WeakPolarHBondContact OE1-CG 3.35Å; E582-Q641 PolarHBondContact OE1-NE2 3Å; S639-Q641 PolarHBondContact O-N 3Å; S639-Q641 VanDerWaalsContact O-N 3.15Å; Q641-A645 WeakPolarHBondContact O-CB 3.39Å; Q641-A645 PolarHBondContact O-N 3.06Å
642	D	81.4	Confident	82.9	Confident	33 Å²	33	69 Å²	69	18%	0.176	36%	0.364	C	S	.	.	H	α-helix	trans	-80	-40.2	174.6	-59.7	-51.1	0	0	0	111.4	R579 S639 A640 A645 L646 R689	R579-D642 IonicContact CZ-OD1 3.32Å; R579-D642 IonicContact CZ-OD2 2.75Å; R579-D642 VanDerWaalsContact NH1-CG 3.28Å; R579-D642 IonicContact NH1-OD1 3.21Å; R579-D642 PolarHBondContact NH1-OD1 3.35Å; R579-D642 VanDerWaalsContact NH1-OD1 3.17Å; R579-D642 IonicContact NH1-OD2 3.34Å; R579-D642 PolarHBondContact NH1-OD2 2.72Å; R579-D642 IonicContact NH2-OD1 3.84Å; R579-D642 PolarHBondContact NH2-OD1 3.46Å; R579-D642 IonicContact NH2-OD2 2.7Å; R579-D642 PolarHBondContact NH2-OD2 2.94Å; S639-D642 PolarHBondContact N-OD2 3.47Å; S639-D642 PolarHBondContact O-N 3.14Å; S639-D642 PolarHBondContact OG-N 2.91Å; S639-D642 PolarHBondContact OG-OD2 2.9Å; A640-D642 VanDerWaalsContact C-N 3.32Å; A640-D642 PolarHBondContact O-N 3.12Å; D642-A645 PolarHBondContact O-N 2.94Å; D642-L646 VanDerWaalsContact O-CB 3.3Å; D642-L646 WeakPolarHBondContact O-CB 3.46Å; D642-L646 PolarHBondContact O-N 3.24Å; D642-R689 IonicContact OD1-CZ 3.66Å; D642-R689 IonicContact OD1-NH1 2.8Å; D642-R689 PolarHBondContact OD1-NH1 3.07Å
643	Q	82.3	Confident	81.8	Confident	73 Å²	73	69 Å²	69	34%	0.341	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-49.6	172.1	-67	168.8	-14.9	0	0	109.6	S639 A640 A645 L646 Y647	S639-Q643 PolarHBondContact O-N 3.44Å; A640-Q643 PolarHBondContact O-N 3.39Å; Q643-A645 VanDerWaalsContact C-N 3.35Å; Q643-A645 PolarHBondContact O-N 3.05Å; Q643-L646 CarbonylContact O-C 3.52Å; Q643-L646 WeakPolarHBondContact O-CA 3.21Å; Q643-L646 WeakPolarHBondContact O-CB 3.4Å; Q643-L646 PolarHBondContact O-N 3.31Å; Q643-Y647 VanDerWaalsContact C-CD2 3.44Å; Q643-Y647 HydrophobicContact CB-CD2 4.42Å; Q643-Y647 HydrophobicContact CB-CE2 3.96Å; Q643-Y647 WeakPolarHBondContact O-CD2 3.33Å; Q643-Y647 PolarHBondContact O-N 3.36Å
644	H	87.1	Confident	80.6	Confident	118 Å²	118	67 Å²	67	55%	0.546	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-38.8	175.1	-65	177.5	0	0	0	113	A640 S648	A640-H644 WeakPolarHBondContact O-CB 3.25Å; A640-H644 PolarHBondContact O-CD2 2.78Å; A640-H644 VanDerWaalsContact O-CD2 3.3Å; A640-H644 PolarHBondContact O-N 3.14Å; H644-S648 VanDerWaalsContact O-CB 3.26Å; H644-S648 WeakPolarHBondContact O-CB 3.37Å; H644-S648 PolarHBondContact O-N 3.2Å; H644-S648 PolarHBondContact O-OG 2.84Å
645	A	85.3	Confident	79.4	Confident	51 Å²	51	71.1 Å²	71.1	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-68.5	-34.1	173.9	0	0	0	0	0	112.2	Q641 D642 Q643 R649	Q641-A645 WeakPolarHBondContact O-CB 3.39Å; Q641-A645 PolarHBondContact O-N 3.06Å; D642-A645 PolarHBondContact O-N 2.94Å; Q643-A645 VanDerWaalsContact C-N 3.35Å; Q643-A645 PolarHBondContact O-N 3.05Å; A645-R649 WeakPolarHBondContact O-CB 3.44Å; A645-R649 PolarHBondContact O-N 3.2Å
646	L	81.6	Confident	78.3	Confident	49 Å²	49	67.8 Å²	67.8	26%	0.257	38%	0.377	S	S	.	.	H	α-helix	trans	-67.6	-51.1	173.7	-176.2	62.9	0	0	0	110.7	D642 Q643 S648 R649 M650	D642-L646 VanDerWaalsContact O-CB 3.3Å; D642-L646 WeakPolarHBondContact O-CB 3.46Å; D642-L646 PolarHBondContact O-N 3.24Å; Q643-L646 CarbonylContact O-C 3.52Å; Q643-L646 WeakPolarHBondContact O-CA 3.21Å; Q643-L646 WeakPolarHBondContact O-CB 3.4Å; Q643-L646 PolarHBondContact O-N 3.31Å; L646-S648 VanDerWaalsContact C-N 3.34Å; L646-S648 PolarHBondContact O-N 3.45Å; L646-R649 CarbonylContact O-C 3.59Å; L646-R649 WeakPolarHBondContact O-CB 3.29Å; L646-R649 PolarHBondContact O-N 2.96Å; L646-R649 VanDerWaalsContact O-N 3.1Å; L646-M650 HydrophobicContact CD1-CE 3.89Å; L646-M650 HydrophobicContact CD1-CG 4.32Å; L646-M650 HydrophobicContact CD2-CE 4.32Å; L646-M650 HydrophobicContact CG-CE 3.98Å; L646-M650 HydrophobicContact CG-CG 4.37Å; L646-M650 WeakPolarHBondContact O-CB 3.43Å; L646-M650 WeakPolarHBondContact O-CG 3.49Å; L646-M650 PolarHBondContact O-N 2.74Å
647	Y	83.6	Confident	77.3	Confident	125 Å²	125	69.4 Å²	69.4	49%	0.49	38%	0.384	S	S	.	.	H	α-helix	trans	-55.9	-47.8	174.8	-65.3	-57.9	0	0	0	111.3	Q643 R649 M650 A651 F669	Q643-Y647 VanDerWaalsContact C-CD2 3.44Å; Q643-Y647 HydrophobicContact CB-CD2 4.42Å; Q643-Y647 HydrophobicContact CB-CE2 3.96Å; Q643-Y647 WeakPolarHBondContact O-CD2 3.33Å; Q643-Y647 PolarHBondContact O-N 3.36Å; Y647-R649 VanDerWaalsContact C-N 3.32Å; Y647-R649 PolarHBondContact O-N 3.07Å; Y647-M650 PolarHBondContact O-N 3.05Å; Y647-M650 VanDerWaalsContact O-N 3.14Å; Y647-A651 PolarHBondContact O-N 2.84Å; Y647-F669 HydrophobicContact CD1-CD2 4.04Å; Y647-F669 AromaticContact CD1-CE2 3.32Å; Y647-F669 HydrophobicContact CD1-CE2 3.32Å; Y647-F669 AromaticContact CD1-CZ 3.79Å; Y647-F669 HydrophobicContact CD1-CZ 3.79Å; Y647-F669 HydrophobicContact CE1-CD2 4.48Å; Y647-F669 HydrophobicContact CE1-CE1 4.4Å; Y647-F669 AromaticContact CE1-CE2 3.65Å; Y647-F669 HydrophobicContact CE1-CE2 3.65Å; Y647-F669 AromaticContact CE1-CZ 3.59Å; Y647-F669 HydrophobicContact CE1-CZ 3.59Å; Y647-F669 HydrophobicContact CG-CE2 4.44Å
648	S	85.6	Confident	76.6	Confident	78 Å²	78	70.6 Å²	70.6	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-59.4	-41.1	175.6	-59.5	0	0	0	0	112.3	H644 L646 M650 A652	H644-S648 VanDerWaalsContact O-CB 3.26Å; H644-S648 WeakPolarHBondContact O-CB 3.37Å; H644-S648 PolarHBondContact O-N 3.2Å; H644-S648 PolarHBondContact O-OG 2.84Å; L646-S648 VanDerWaalsContact C-N 3.34Å; L646-S648 PolarHBondContact O-N 3.45Å; S648-M650 VanDerWaalsContact C-N 3.34Å; S648-A652 WeakPolarHBondContact O-CB 3.08Å; S648-A652 PolarHBondContact O-N 3.06Å
649	R	81.6	Confident	75.8	Confident	62 Å²	62	74.6 Å²	74.6	23%	0.234	41%	0.412	C	S	.	.	H	α-helix	trans	-69.3	-28.7	177.2	178.9	176.8	86.9	-168.8	23.7	113	A645 L646 Y647 K653 E677 D682 R685	A645-R649 WeakPolarHBondContact O-CB 3.44Å; A645-R649 PolarHBondContact O-N 3.2Å; L646-R649 CarbonylContact O-C 3.59Å; L646-R649 WeakPolarHBondContact O-CB 3.29Å; L646-R649 PolarHBondContact O-N 2.96Å; L646-R649 VanDerWaalsContact O-N 3.1Å; Y647-R649 VanDerWaalsContact C-N 3.32Å; Y647-R649 PolarHBondContact O-N 3.07Å; R649-K653 VanDerWaalsContact O-CD 3.22Å; R649-K653 WeakPolarHBondContact O-CD 3.27Å; R649-K653 WeakPolarHBondContact O-CE 3.28Å; R649-K653 WeakPolarHBondContact O-CG 3.15Å; R649-E677 IonicContact CZ-OE2 3.9Å; R649-E677 IonicContact NE-OE2 3.65Å; R649-E677 IonicContact NH2-OE2 2.58Å; R649-E677 PolarHBondContact NH2-OE2 2.77Å; R649-D682 IonicContact CZ-OD1 2.84Å; R649-D682 IonicContact CZ-OD2 3.59Å; R649-D682 IonicContact NH1-OD1 2.65Å; R649-D682 PolarHBondContact NH1-OD1 2.94Å; R649-D682 IonicContact NH1-OD2 2.67Å; R649-D682 IonicContact NH2-OD1 3.77Å; R649-D682 PolarHBondContact NH2-OD1 3.32Å; R649-D682 IonicContact NH2-OD2 3.53Å; R649-D682 PolarHBondContact NH2-OD2 3.08Å; R649-R685 VanDerWaalsContact NH1-NH1 3.19Å; R649-R685 VanDerWaalsContact NH2-NH1 3.14Å
650	M	78	Confident	75.6	Confident	6 Å²	6	76.2 Å²	76.2	3%	0.03	43%	0.431	C	S	.	.	H	α-helix	trans	-77.1	-52.5	177.8	-63.8	-97	-142.6	0	0	109.5	F620 L646 Y647 S648 A652 K653 F669 S672 A673	F620-M650 HydrophobicContact CE1-CE 3.63Å; F620-M650 HydrophobicContact CZ-CE 4.17Å; L646-M650 HydrophobicContact CD1-CE 3.89Å; L646-M650 HydrophobicContact CD1-CG 4.32Å; L646-M650 HydrophobicContact CD2-CE 4.32Å; L646-M650 HydrophobicContact CG-CE 3.98Å; L646-M650 HydrophobicContact CG-CG 4.37Å; L646-M650 WeakPolarHBondContact O-CB 3.43Å; L646-M650 WeakPolarHBondContact O-CG 3.49Å; L646-M650 PolarHBondContact O-N 2.74Å; Y647-M650 PolarHBondContact O-N 3.05Å; Y647-M650 VanDerWaalsContact O-N 3.14Å; S648-M650 VanDerWaalsContact C-N 3.34Å; M650-A652 PolarHBondContact O-N 2.91Å; M650-K653 PolarHBondContact O-N 3.12Å; M650-F669 HydrophobicContact CB-CD2 3.63Å; M650-F669 HydrophobicContact CB-CE2 3.79Å; M650-F669 HydrophobicContact CE-CD2 4.35Å; M650-F669 HydrophobicContact CE-CE1 4.17Å; M650-F669 HydrophobicContact CE-CE2 3.64Å; M650-F669 HydrophobicContact CE-CZ 3.55Å; M650-F669 HydrophobicContact CG-CD2 3.85Å; M650-F669 HydrophobicContact CG-CE2 3.51Å; M650-F669 HydrophobicContact CG-CZ 4.38Å; M650-F669 HydrophobicContact SD-CD2 4.25Å; M650-F669 HydrophobicContact SD-CE2 4.02Å; M650-F669 HydrophobicContact SD-CZ 4.47Å; M650-S672 WeakPolarHBondContact CB-OG 3.4Å; M650-S672 PolarHBondContact SD-OG 2.95Å; M650-A673 HydrophobicContact CE-CB 4.11Å
651	A	78.1	Confident	75.1	Confident	52 Å²	52	81.8 Å²	81.8	43%	0.43	46%	0.456	S	S	.	.	H	α-helix	trans	-57.6	-47.1	175	0	0	0	0	0	112.7	Y647 K653 M654	Y647-A651 PolarHBondContact O-N 2.84Å; A651-K653 PolarHBondContact O-N 3.01Å; A651-K653 VanDerWaalsContact O-N 3.14Å; A651-M654 CarbonylContact O-C 3.59Å; A651-M654 PolarHBondContact O-N 3.17Å
652	A	77.4	Confident	74.9	Confident	83 Å²	83	85.4 Å²	85.4	69%	0.686	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-16.8	-178.1	0	0	0	0	0	114.8	S648 M650	S648-A652 WeakPolarHBondContact O-CB 3.08Å; S648-A652 PolarHBondContact O-N 3.06Å; M650-A652 PolarHBondContact O-N 2.91Å
653	K	69.3	Low	74.7	Confident	72 Å²	72	86.8 Å²	86.8	31%	0.313	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-25.1	172.4	-73.1	163.3	-179.1	176.8	0	112.7	R649 M650 A651 E677	R649-K653 VanDerWaalsContact O-CD 3.22Å; R649-K653 WeakPolarHBondContact O-CD 3.27Å; R649-K653 WeakPolarHBondContact O-CE 3.28Å; R649-K653 WeakPolarHBondContact O-CG 3.15Å; M650-K653 PolarHBondContact O-N 3.12Å; A651-K653 PolarHBondContact O-N 3.01Å; A651-K653 VanDerWaalsContact O-N 3.14Å; K653-E677 IonicContact NZ-OE1 3.97Å; K653-E677 PolarHBondContact NZ-OE1 2.81Å; K653-E677 IonicContact NZ-OE2 3.41Å
654	M	62.5	Low	74.7	Confident	38 Å²	38	85.6 Å²	85.6	19%	0.187	48%	0.479	C	S	.	.			trans	-118.8	75	-167	-64.9	-63.5	-131.2	0	0	111	A651 G656 M668	A651-M654 CarbonylContact O-C 3.59Å; A651-M654 PolarHBondContact O-N 3.17Å; M654-G656 PolarHBondContact O-N 3.03Å; M654-M668 HydrophobicContact CB-CG 3.45Å; M654-M668 VanDerWaalsContact CB-CG 3.45Å; M654-M668 HydrophobicContact CB-SD 3.55Å; M654-M668 VanDerWaalsContact CB-SD 3.55Å; M654-M668 HydrophobicContact CG-CG 3.87Å
655	M	57.8	Low	74.4	Confident	193 Å²	193	85.5 Å²	85.5	95%	0.951	48%	0.481	S	S	*	.			trans	-77	54.2	160.4	-77	-166.9	169.6	0	0	111.2
656	G	63.9	Low	74.2	Confident	49 Å²	49	88.8 Å²	88.8	51%	0.505	49%	0.492	S	S	.	.			trans	-72.7	165.2	156	0	0	0	0	0	109.7	M654	M654-G656 PolarHBondContact O-N 3.03Å
657	K	65.4	Low	74.3	Confident	171 Å²	171	89.8 Å²	89.8	74%	0.743	50%	0.498	S	S	*	.			trans	-88.5	138.3	156	-71	176.1	-177.4	170	0	107.1	D659	K657-D659 PolarHBondContact O-N 3.36Å
658	T	66.9	Low	74.1	Confident	67 Å²	67	84.7 Å²	84.7	41%	0.411	48%	0.479	S	S	.	.			trans	-74	113.5	162.2	48	0	0	0	0	107.2	G660 Y663 L665	T658-G660 PolarHBondContact O-N 2.73Å; T658-Y663 WeakPolarHBondContact CA-O 3.26Å; T658-Y663 WeakPolarHBondContact CB-O 3.48Å; T658-L665 HydrophobicContact CG2-CD2 3.77Å; T658-L665 HydrophobicContact CG2-CG 4.27Å
659	D	66.2	Low	73.9	Confident	124 Å²	124	83.4 Å²	83.4	66%	0.663	46%	0.463	S	S	*	.			trans	-83.3	42.6	-174.8	-68.7	-32.7	0	0	0	111.9	K657	K657-D659 PolarHBondContact O-N 3.36Å
660	G	73.4	Confident	74	Confident	46 Å²	46	82 Å²	82	47%	0.474	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	73.3	-122.5	-169.7	0	0	0	0	0	111.3	T658	T658-G660 PolarHBondContact O-N 2.73Å
661	D	70.8	Confident	74.2	Confident	151 Å²	151	84 Å²	84	81%	0.807	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-84	-21.4	-166	-51	-39.3	0	0	0	113.7
662	N	73.9	Confident	74.2	Confident	152 Å²	152	81.6 Å²	81.6	81%	0.813	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-85	-10.5	-174.8	-73.7	21.5	0	0	0	114.5
663	Y	77.2	Confident	74.4	Confident	62 Å²	62	78.1 Å²	78.1	24%	0.243	43%	0.428	C	S	.	.	S	Bend	trans	-154	88.6	175.2	-170.8	-106.5	0	0	0	109.3	T658 D667 M668	T658-Y663 WeakPolarHBondContact CA-O 3.26Å; T658-Y663 WeakPolarHBondContact CB-O 3.48Å; Y663-D667 HydrophobicContact CD2-CB 3.74Å; Y663-D667 HydrophobicContact CE2-CB 3.97Å; Y663-D667 HydrophobicContact CG-CB 4.43Å; Y663-M668 HydrophobicContact CE1-CB 3.87Å; Y663-M668 HydrophobicContact CE1-CG 4.25Å; Y663-M668 WeakPolarHBondContact OH-CA 3.29Å
664	T	83.4	Confident	74.7	Confident	49 Å²	49	75.4 Å²	75.4	30%	0.301	42%	0.418	S	S	.	.			trans	-79.1	177.2	-175.9	68.9	0	0	0	0	112.1	D666 D667 M668	T664-D666 PolarHBondContact O-N 3.1Å; T664-D666 PolarHBondContact OG1-N 2.86Å; T664-D667 WeakPolarHBondContact CB-OD2 3.22Å; T664-D667 WeakPolarHBondContact CG2-OD2 3.45Å; T664-D667 PolarHBondContact N-OD2 2.81Å; T664-D667 PolarHBondContact OG1-N 2.81Å; T664-D667 VanDerWaalsContact OG1-N 3.17Å; T664-D667 PolarHBondContact OG1-OD2 3.1Å; T664-M668 WeakPolarHBondContact O-CB 3.21Å; T664-M668 PolarHBondContact O-N 3.31Å; T664-M668 VanDerWaalsContact O-N 3.12Å
665	L	79.4	Confident	75.4	Confident	115 Å²	115	76.3 Å²	76.3	60%	0.602	42%	0.422	S	S	*	.	H	α-helix	trans	-63.8	-27.4	170.5	-65	175.7	0	0	0	112.3	T658 M668 F669	T658-L665 HydrophobicContact CG2-CD2 3.77Å; T658-L665 HydrophobicContact CG2-CG 4.27Å; L665-M668 HydrophobicContact CD2-CE 3.6Å; L665-F669 WeakPolarHBondContact O-CB 3.27Å; L665-F669 PolarHBondContact O-N 3.12Å
666	D	82.3	Confident	75.8	Confident	120 Å²	120	72.2 Å²	72.2	64%	0.642	40%	0.396	S	S	*	.	H	α-helix	trans	-78.6	-41.3	179.4	-62.5	-40.9	0	0	0	111.2	T664 M668 F669 V670	T664-D666 PolarHBondContact O-N 3.1Å; T664-D666 PolarHBondContact OG1-N 2.86Å; D666-M668 PolarHBondContact O-N 2.96Å; D666-F669 WeakPolarHBondContact O-CB 3.44Å; D666-F669 PolarHBondContact O-N 2.74Å; D666-F669 VanDerWaalsContact O-N 3.07Å; D666-V670 WeakPolarHBondContact O-CG2 3.44Å; D666-V670 PolarHBondContact O-N 2.82Å
667	D	83.3	Confident	76.1	Confident	71 Å²	71	71.5 Å²	71.5	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-59	-39.6	171	-60.2	-62.5	0	0	0	111.3	Y663 T664 S671	Y663-D667 HydrophobicContact CD2-CB 3.74Å; Y663-D667 HydrophobicContact CE2-CB 3.97Å; Y663-D667 HydrophobicContact CG-CB 4.43Å; T664-D667 WeakPolarHBondContact CB-OD2 3.22Å; T664-D667 WeakPolarHBondContact CG2-OD2 3.45Å; T664-D667 PolarHBondContact N-OD2 2.81Å; T664-D667 PolarHBondContact OG1-N 2.81Å; T664-D667 VanDerWaalsContact OG1-N 3.17Å; T664-D667 PolarHBondContact OG1-OD2 3.1Å; D667-S671 WeakPolarHBondContact O-CB 3.47Å; D667-S671 PolarHBondContact O-N 3.22Å; D667-S671 PolarHBondContact O-OG 2.88Å
668	M	79.3	Confident	76.1	Confident	18 Å²	18	63.6 Å²	63.6	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-39.6	173.9	-175.9	-178.9	71.1	0	0	112.4	M654 Y663 T664 L665 D666 S672	M654-M668 HydrophobicContact CB-CG 3.45Å; M654-M668 VanDerWaalsContact CB-CG 3.45Å; M654-M668 HydrophobicContact CB-SD 3.55Å; M654-M668 VanDerWaalsContact CB-SD 3.55Å; M654-M668 HydrophobicContact CG-CG 3.87Å; Y663-M668 HydrophobicContact CE1-CB 3.87Å; Y663-M668 HydrophobicContact CE1-CG 4.25Å; Y663-M668 WeakPolarHBondContact OH-CA 3.29Å; T664-M668 WeakPolarHBondContact O-CB 3.21Å; T664-M668 PolarHBondContact O-N 3.31Å; T664-M668 VanDerWaalsContact O-N 3.12Å; L665-M668 HydrophobicContact CD2-CE 3.6Å; D666-M668 PolarHBondContact O-N 2.96Å; M668-S672 WeakPolarHBondContact O-CB 3.29Å; M668-S672 PolarHBondContact O-N 3.4Å; M668-S672 PolarHBondContact O-OG 3.31Å
669	F	82.2	Confident	76.2	Confident	50 Å²	50	65.1 Å²	65.1	22%	0.219	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-52.5	175	-173.7	-99.1	0	0	0	110.9	Y647 M650 L665 D666 S671 S672 A673	Y647-F669 HydrophobicContact CD1-CD2 4.04Å; Y647-F669 AromaticContact CD1-CE2 3.32Å; Y647-F669 HydrophobicContact CD1-CE2 3.32Å; Y647-F669 AromaticContact CD1-CZ 3.79Å; Y647-F669 HydrophobicContact CD1-CZ 3.79Å; Y647-F669 HydrophobicContact CE1-CD2 4.48Å; Y647-F669 HydrophobicContact CE1-CE1 4.4Å; Y647-F669 AromaticContact CE1-CE2 3.65Å; Y647-F669 HydrophobicContact CE1-CE2 3.65Å; Y647-F669 AromaticContact CE1-CZ 3.59Å; Y647-F669 HydrophobicContact CE1-CZ 3.59Å; Y647-F669 HydrophobicContact CG-CE2 4.44Å; M650-F669 HydrophobicContact CB-CD2 3.63Å; M650-F669 HydrophobicContact CB-CE2 3.79Å; M650-F669 HydrophobicContact CE-CD2 4.35Å; M650-F669 HydrophobicContact CE-CE1 4.17Å; M650-F669 HydrophobicContact CE-CE2 3.64Å; M650-F669 HydrophobicContact CE-CZ 3.55Å; M650-F669 HydrophobicContact CG-CD2 3.85Å; M650-F669 HydrophobicContact CG-CE2 3.51Å; M650-F669 HydrophobicContact CG-CZ 4.38Å; M650-F669 HydrophobicContact SD-CD2 4.25Å; M650-F669 HydrophobicContact SD-CE2 4.02Å; M650-F669 HydrophobicContact SD-CZ 4.47Å; L665-F669 WeakPolarHBondContact O-CB 3.27Å; L665-F669 PolarHBondContact O-N 3.12Å; D666-F669 WeakPolarHBondContact O-CB 3.44Å; D666-F669 PolarHBondContact O-N 2.74Å; D666-F669 VanDerWaalsContact O-N 3.07Å; F669-S671 VanDerWaalsContact C-N 3.32Å; F669-S671 PolarHBondContact O-N 3.02Å; F669-S672 CarbonylContact O-C 3.56Å; F669-S672 WeakPolarHBondContact O-CA 3.5Å; F669-S672 PolarHBondContact O-N 2.83Å; F669-S672 PolarHBondContact O-OG 3.26Å; F669-A673 PolarHBondContact O-N 3.31Å
670	V	83.8	Confident	76.5	Confident	32 Å²	32	60.5 Å²	60.5	19%	0.194	33%	0.331	C	S	.	.	H	α-helix	trans	-56.4	-44.4	176.6	172.1	0	0	0	0	111.5	Y619 D666 S672 A673 A674	Y619-V670 HydrophobicContact CD1-CG1 4.05Å; Y619-V670 HydrophobicContact CD1-CG2 4.05Å; Y619-V670 HydrophobicContact CE1-CG1 4.1Å; Y619-V670 HydrophobicContact CE1-CG2 3.87Å; D666-V670 WeakPolarHBondContact O-CG2 3.44Å; D666-V670 PolarHBondContact O-N 2.82Å; V670-S672 PolarHBondContact O-N 2.82Å; V670-A673 PolarHBondContact O-N 2.91Å; V670-A674 PolarHBondContact O-N 2.57Å; V670-A674 VanDerWaalsContact O-N 3.09Å
671	S	80.8	Confident	76.8	Confident	49 Å²	49	63.1 Å²	63.1	34%	0.343	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-24.6	177	-61.8	0	0	0	0	113.2	D667 F669	D667-S671 WeakPolarHBondContact O-CB 3.47Å; D667-S671 PolarHBondContact O-N 3.22Å; D667-S671 PolarHBondContact O-OG 2.88Å; F669-S671 VanDerWaalsContact C-N 3.32Å; F669-S671 PolarHBondContact O-N 3.02Å
672	S	78.6	Confident	77	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-90.9	-26.7	176.9	76.6	0	0	0	0	113.9	M650 M668 F669 V670 Q675	M650-S672 WeakPolarHBondContact CB-OG 3.4Å; M650-S672 PolarHBondContact SD-OG 2.95Å; M668-S672 WeakPolarHBondContact O-CB 3.29Å; M668-S672 PolarHBondContact O-N 3.4Å; M668-S672 PolarHBondContact O-OG 3.31Å; F669-S672 CarbonylContact O-C 3.56Å; F669-S672 WeakPolarHBondContact O-CA 3.5Å; F669-S672 PolarHBondContact O-N 2.83Å; F669-S672 PolarHBondContact O-OG 3.26Å; V670-S672 PolarHBondContact O-N 2.82Å; S672-Q675 PolarHBondContact O-N 3.27Å
673	A	81.1	Confident	77.4	Confident	11 Å²	11	54.7 Å²	54.7	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-42	169.2	0	0	0	0	0	111.2	Y619 F620 M650 F669 V670 Q675	Y619-A673 CarbonylContact O-C 3.54Å; Y619-A673 WeakPolarHBondContact O-CB 3.47Å; F620-A673 HydrophobicContact CD1-CB 4.07Å; F620-A673 HydrophobicContact CE1-CB 3.78Å; F620-A673 HydrophobicContact CZ-CB 4.14Å; M650-A673 HydrophobicContact CE-CB 4.11Å; F669-A673 PolarHBondContact O-N 3.31Å; V670-A673 PolarHBondContact O-N 2.91Å; A673-Q675 PolarHBondContact O-N 2.95Å
674	A	76.5	Confident	77.6	Confident	14 Å²	14	52.8 Å²	52.8	12%	0.116	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-6.2	175.8	0	0	0	0	0	114.8	P607 I608 T610 V670	P607-A674 CarbonylContact C-O 3.56Å; P607-A674 VanDerWaalsContact CA-O 3.31Å; P607-A674 WeakPolarHBondContact CA-O 3.47Å; I608-A674 PolarHBondContact N-O 3.5Å; T610-A674 HydrophobicContact CG2-CB 3.86Å; V670-A674 PolarHBondContact O-N 2.57Å; V670-A674 VanDerWaalsContact O-N 3.09Å
675	Q	76.9	Confident	77.6	Confident	57 Å²	57	54.4 Å²	54.4	27%	0.266	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-90.1	109	176.1	-67.1	-174.6	11.4	0	0	111.9	K605 S672 A673 E677	K605-Q675 HydrophobicContact CB-CB 4.42Å; K605-Q675 HydrophobicContact CD-CB 4.23Å; K605-Q675 PolarHBondContact NZ-O 2.97Å; S672-Q675 PolarHBondContact O-N 3.27Å; A673-Q675 PolarHBondContact O-N 2.95Å; Q675-E677 PolarHBondContact O-N 3.44Å
676	R	67.2	Low	77.7	Confident	108 Å²	108	52.9 Å²	52.9	41%	0.408	27%	0.265	S	S	.	.			trans	-43.1	112.9	-179.8	-159.6	-179.5	174.2	176.2	-5	112	K605 K606 I608 E679	K605-R676 WeakPolarHBondContact CE-O 3.42Å; K605-R676 WeakPolarHBondContact CG-O 3.13Å; K605-R676 VanDerWaalsContact NZ-C 3.31Å; K605-R676 PolarHBondContact NZ-O 3.36Å; K606-R676 VanDerWaalsContact O-CB 3.31Å; K606-R676 WeakPolarHBondContact O-CB 3.26Å; K606-R676 PolarHBondContact O-N 3.22Å; K606-R676 VanDerWaalsContact O-N 3.1Å; I608-R676 HydrophobicContact CD1-CB 4.48Å; I608-R676 HydrophobicContact CG1-CB 4.03Å; I608-R676 HydrophobicContact CG1-CG 4.45Å; R676-E679 IonicContact CZ-OE1 3.72Å; R676-E679 IonicContact NE-OE1 2.7Å; R676-E679 PolarHBondContact NE-OE1 3.27Å; R676-E679 IonicContact NH2-OE1 3.54Å; R676-E679 PolarHBondContact NH2-OE1 3.44Å; R676-E679 IonicContact NH2-OE2 2.92Å; R676-E679 PolarHBondContact NH2-OE2 3.35Å
677	E	68.4	Low	77.9	Confident	33 Å²	33	52 Å²	52	15%	0.154	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-78	150.1	161.7	-58.7	-94.8	101	0	0	106.6	K605 Q621 R649 K653 Q675 R685	K605-E677 VanDerWaalsContact CE-OE1 3.31Å; K605-E677 WeakPolarHBondContact CE-OE1 3.49Å; K605-E677 IonicContact NZ-OE1 3.19Å; K605-E677 PolarHBondContact NZ-OE1 3.32Å; Q621-E677 PolarHBondContact OE1-O 2.69Å; R649-E677 IonicContact CZ-OE2 3.9Å; R649-E677 IonicContact NE-OE2 3.65Å; R649-E677 IonicContact NH2-OE2 2.58Å; R649-E677 PolarHBondContact NH2-OE2 2.77Å; K653-E677 IonicContact NZ-OE1 3.97Å; K653-E677 PolarHBondContact NZ-OE1 2.81Å; K653-E677 IonicContact NZ-OE2 3.41Å; Q675-E677 PolarHBondContact O-N 3.44Å; E677-R685 IonicContact OE2-CZ 3.79Å; E677-R685 IonicContact OE2-NH1 2.87Å; E677-R685 PolarHBondContact OE2-NH1 3.33Å; E677-R685 IonicContact OE2-NH2 2.71Å; E677-R685 PolarHBondContact OE2-NH2 3.35Å
678	G	67.3	Low	78	Confident	6 Å²	6	53.5 Å²	53.5	6%	0.062	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-66.3	142.6	171.6	0	0	0	0	0	110.6	E597 R681	E597-G678 WeakPolarHBondContact OE2-CA 3.47Å; G678-R681 VanDerWaalsContact CA-NE 3.32Å; G678-R681 WeakPolarHBondContact O-CB 3.45Å; G678-R681 WeakPolarHBondContact O-CG 3.31Å; G678-R681 PolarHBondContact O-N 3.11Å
679	E	68.2	Low	78.4	Confident	98 Å²	98	55.4 Å²	55.4	46%	0.458	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	152.7	172.8	-77.4	110	-108.1	0	0	111.8	Q621 R676 R681	Q621-E679 PolarHBondContact NE2-OE1 3.19Å; R676-E679 IonicContact CZ-OE1 3.72Å; R676-E679 IonicContact NE-OE1 2.7Å; R676-E679 PolarHBondContact NE-OE1 3.27Å; R676-E679 IonicContact NH2-OE1 3.54Å; R676-E679 PolarHBondContact NH2-OE1 3.44Å; R676-E679 IonicContact NH2-OE2 2.92Å; R676-E679 PolarHBondContact NH2-OE2 3.35Å; E679-R681 PolarHBondContact O-N 2.67Å
680	G	72.6	Confident	78.6	Confident	28 Å²	28	53 Å²	53	29%	0.289	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	-21.9	-175.4	0	0	0	0	0	115.6	D682 E683 D684	G680-D682 VanDerWaalsContact C-N 3.3Å; G680-D682 PolarHBondContact O-N 2.81Å; G680-D682 VanDerWaalsContact O-N 3.12Å; G680-E683 WeakPolarHBondContact O-CA 3.21Å; G680-E683 WeakPolarHBondContact O-CB 3.34Å; G680-E683 PolarHBondContact O-N 2.94Å; G680-D684 PolarHBondContact O-N 3.43Å
681	R	78.5	Confident	78.9	Confident	100 Å²	100	54.9 Å²	54.9	38%	0.377	27%	0.265	S	S	.	.	H	α-helix	trans	-60.1	-31.1	-170.7	-68.6	-177	-164.4	-167.9	11.8	115.1	E597 G678 E679 R685	E597-R681 IonicContact OE2-CZ 2.63Å; E597-R681 IonicContact OE2-NE 2.79Å; E597-R681 IonicContact OE2-NH2 3.58Å; E597-R681 PolarHBondContact OE2-NH2 2.96Å; G678-R681 VanDerWaalsContact CA-NE 3.32Å; G678-R681 WeakPolarHBondContact O-CB 3.45Å; G678-R681 WeakPolarHBondContact O-CG 3.31Å; G678-R681 PolarHBondContact O-N 3.11Å; E679-R681 PolarHBondContact O-N 2.67Å; R681-R685 VanDerWaalsContact O-CD 3.22Å; R681-R685 WeakPolarHBondContact O-CD 3.45Å; R681-R685 WeakPolarHBondContact O-CG 3.45Å; R681-R685 PolarHBondContact O-N 3.2Å
682	D	76.8	Confident	79.4	Confident	59 Å²	59	53.7 Å²	53.7	32%	0.316	26%	0.26	S	S	.	.	H	α-helix	trans	-78.9	-30.7	173.9	-83.7	-53.4	0	0	0	113.2	R649 G680 R685 M686	R649-D682 IonicContact CZ-OD1 2.84Å; R649-D682 IonicContact CZ-OD2 3.59Å; R649-D682 IonicContact NH1-OD1 2.65Å; R649-D682 PolarHBondContact NH1-OD1 2.94Å; R649-D682 IonicContact NH1-OD2 2.67Å; R649-D682 IonicContact NH2-OD1 3.77Å; R649-D682 PolarHBondContact NH2-OD1 3.32Å; R649-D682 IonicContact NH2-OD2 3.53Å; R649-D682 PolarHBondContact NH2-OD2 3.08Å; G680-D682 VanDerWaalsContact C-N 3.3Å; G680-D682 PolarHBondContact O-N 2.81Å; G680-D682 VanDerWaalsContact O-N 3.12Å; D682-R685 PolarHBondContact O-N 2.97Å; D682-R685 WeakPolarHBondContact OD1-CD 3.31Å; D682-R685 IonicContact OD1-CZ 3.62Å; D682-R685 IonicContact OD1-NE 2.71Å; D682-R685 IonicContact OD1-NH1 3.19Å; D682-R685 PolarHBondContact OD1-NH1 3.29Å; D682-R685 IonicContact OD2-NH1 3.32Å; D682-R685 PolarHBondContact OD2-NH1 2.81Å; D682-M686 VanDerWaalsContact O-CG 3.29Å; D682-M686 WeakPolarHBondContact O-CG 3.31Å; D682-M686 PolarHBondContact O-N 2.84Å
683	E	80.5	Confident	79.8	Confident	67 Å²	67	54.9 Å²	54.9	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-44.1	167.3	-58	-173.3	151.2	0	0	110.7	P592 S593 G680 R685 M686 R687	P592-E683 VanDerWaalsContact CA-OE2 3.31Å; P592-E683 WeakPolarHBondContact CA-OE2 3.42Å; S593-E683 WeakPolarHBondContact CB-OE1 3.15Å; S593-E683 PolarHBondContact N-OE2 3.27Å; S593-E683 PolarHBondContact OG-OE1 2.89Å; S593-E683 PolarHBondContact OG-OE2 3.45Å; S593-E683 VanDerWaalsContact OG-OE2 3.06Å; G680-E683 WeakPolarHBondContact O-CA 3.21Å; G680-E683 WeakPolarHBondContact O-CB 3.34Å; G680-E683 PolarHBondContact O-N 2.94Å; E683-R685 VanDerWaalsContact C-N 3.35Å; E683-R685 PolarHBondContact O-N 2.95Å; E683-M686 PolarHBondContact O-N 3.01Å; E683-R687 WeakPolarHBondContact O-CB 3.22Å; E683-R687 PolarHBondContact O-N 3.31Å
684	D	82.7	Confident	80.1	Confident	23 Å²	23	55.4 Å²	55.4	12%	0.123	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-40.7	175	-73.8	-47.1	0	0	0	112.6	Q596 G680 R687 N688	Q596-D684 PolarHBondContact NE2-OD1 3.08Å; Q596-D684 VanDerWaalsContact NE2-OD1 3.1Å; Q596-D684 PolarHBondContact NE2-OD2 3.38Å; G680-D684 PolarHBondContact O-N 3.43Å; D684-R687 PolarHBondContact O-N 3Å; D684-N688 VanDerWaalsContact O-CB 3.27Å; D684-N688 WeakPolarHBondContact O-CB 3.41Å; D684-N688 VanDerWaalsContact O-CG 3.31Å; D684-N688 PolarHBondContact O-N 2.85Å; D684-N688 PolarHBondContact O-ND2 3.46Å
685	R	82.5	Confident	80.8	Confident	83 Å²	83	64 Å²	64	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175.9	-72.7	157.3	-174	153.7	-5.1	111	R649 E677 R681 D682 E683 R687 N688 R689	R649-R685 VanDerWaalsContact NH1-NH1 3.19Å; R649-R685 VanDerWaalsContact NH2-NH1 3.14Å; E677-R685 IonicContact OE2-CZ 3.79Å; E677-R685 IonicContact OE2-NH1 2.87Å; E677-R685 PolarHBondContact OE2-NH1 3.33Å; E677-R685 IonicContact OE2-NH2 2.71Å; E677-R685 PolarHBondContact OE2-NH2 3.35Å; R681-R685 VanDerWaalsContact O-CD 3.22Å; R681-R685 WeakPolarHBondContact O-CD 3.45Å; R681-R685 WeakPolarHBondContact O-CG 3.45Å; R681-R685 PolarHBondContact O-N 3.2Å; D682-R685 PolarHBondContact O-N 2.97Å; D682-R685 WeakPolarHBondContact OD1-CD 3.31Å; D682-R685 IonicContact OD1-CZ 3.62Å; D682-R685 IonicContact OD1-NE 2.71Å; D682-R685 IonicContact OD1-NH1 3.19Å; D682-R685 PolarHBondContact OD1-NH1 3.29Å; D682-R685 IonicContact OD2-NH1 3.32Å; D682-R685 PolarHBondContact OD2-NH1 2.81Å; E683-R685 VanDerWaalsContact C-N 3.35Å; E683-R685 PolarHBondContact O-N 2.95Å; R685-R687 VanDerWaalsContact C-N 3.35Å; R685-N688 PolarHBondContact O-N 3.5Å; R685-R689 WeakPolarHBondContact O-CB 3.36Å; R685-R689 PolarHBondContact O-N 3.3Å
686	M	82	Confident	81.4	Confident	83 Å²	83	68.3 Å²	68.3	41%	0.409	31%	0.312	S	S	.	.	H	α-helix	trans	-62.5	-41.4	175.2	-68.9	178.7	-163	0	0	111.7	D682 E683 R689 A690	D682-M686 VanDerWaalsContact O-CG 3.29Å; D682-M686 WeakPolarHBondContact O-CG 3.31Å; D682-M686 PolarHBondContact O-N 2.84Å; E683-M686 PolarHBondContact O-N 3.01Å; M686-R689 PolarHBondContact O-N 3.34Å; M686-A690 WeakPolarHBondContact O-CB 3.5Å; M686-A690 PolarHBondContact O-N 2.71Å
687	R	85.7	Confident	82.3	Confident	100 Å²	100	64.4 Å²	64.4	38%	0.377	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-47.8	176.5	-170.8	179.7	-175.7	-176.3	2.7	112.1	L577 V589 E683 D684 R685 R689 A690 I691	L577-R687 HydrophobicContact CD1-CG 4.07Å; V589-R687 HydrophobicContact CG1-CB 4.39Å; E683-R687 WeakPolarHBondContact O-CB 3.22Å; E683-R687 PolarHBondContact O-N 3.31Å; D684-R687 PolarHBondContact O-N 3Å; R685-R687 VanDerWaalsContact C-N 3.35Å; R687-R689 VanDerWaalsContact C-N 3.32Å; R687-R689 PolarHBondContact O-N 3.38Å; R687-A690 PolarHBondContact O-N 2.84Å; R687-I691 HydrophobicContact CG-CD1 4.04Å; R687-I691 VanDerWaalsContact O-CG1 3.28Å; R687-I691 WeakPolarHBondContact O-CG1 3.31Å; R687-I691 PolarHBondContact O-N 2.91Å
688	N	87.3	Confident	83.3	Confident	104 Å²	104	65.4 Å²	65.4	56%	0.556	31%	0.313	S	S	*	.	H	α-helix	trans	-65.2	-35.8	176.7	-75.6	-52.6	0	0	0	112	D684 R685 G692	D684-N688 VanDerWaalsContact O-CB 3.27Å; D684-N688 WeakPolarHBondContact O-CB 3.41Å; D684-N688 VanDerWaalsContact O-CG 3.31Å; D684-N688 PolarHBondContact O-N 2.85Å; D684-N688 PolarHBondContact O-ND2 3.46Å; R685-N688 PolarHBondContact O-N 3.5Å; N688-G692 PolarHBondContact O-N 3.4Å
689	R	86.2	Confident	84.3	Confident	58 Å²	58	68.2 Å²	68.2	22%	0.219	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-49	170.7	-179.4	175.4	-177.8	150.3	12.8	111	R579 D642 R685 M686 R687 G692 E693	R579-R689 VanDerWaalsContact NH2-NH1 3.16Å; D642-R689 IonicContact OD1-CZ 3.66Å; D642-R689 IonicContact OD1-NH1 2.8Å; D642-R689 PolarHBondContact OD1-NH1 3.07Å; R685-R689 WeakPolarHBondContact O-CB 3.36Å; R685-R689 PolarHBondContact O-N 3.3Å; M686-R689 PolarHBondContact O-N 3.34Å; R687-R689 VanDerWaalsContact C-N 3.32Å; R687-R689 PolarHBondContact O-N 3.38Å; R689-G692 CarbonylContact O-C 3.59Å; R689-G692 PolarHBondContact O-N 2.98Å; R689-E693 VanDerWaalsContact CG-OE1 3.28Å; R689-E693 WeakPolarHBondContact CG-OE1 3.22Å; R689-E693 IonicContact CZ-OE1 3.71Å; R689-E693 IonicContact NE-OE1 3.72Å; R689-E693 PolarHBondContact NE-OE1 3.24Å; R689-E693 IonicContact NH2-OE1 2.72Å; R689-E693 WeakPolarHBondContact O-CB 3.12Å; R689-E693 WeakPolarHBondContact O-CG 3.37Å; R689-E693 PolarHBondContact O-N 2.98Å
690	A	87.9	Confident	85.3	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-40.6	177.8	0	0	0	0	0	113.1	R579 V589 M686 R687 G692 E693 S694	R579-A690 HydrophobicContact CB-CB 4.46Å; V589-A690 HydrophobicContact CG2-CB 3.75Å; M686-A690 WeakPolarHBondContact O-CB 3.5Å; M686-A690 PolarHBondContact O-N 2.71Å; R687-A690 PolarHBondContact O-N 2.84Å; A690-G692 VanDerWaalsContact C-N 3.32Å; A690-G692 PolarHBondContact O-N 2.93Å; A690-E693 PolarHBondContact O-N 2.92Å; A690-S694 VanDerWaalsContact O-CB 3.3Å; A690-S694 WeakPolarHBondContact O-CB 3.32Å; A690-S694 PolarHBondContact O-N 3.15Å
691	I	89.7	Confident	86	Confident	70 Å²	70	67 Å²	67	36%	0.359	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-44.6	171.6	-68.7	163.7	0	0	0	110.2	L577 R687 R695	L577-I691 HydrophobicContact CD1-CD1 4.22Å; L577-I691 HydrophobicContact CD1-CG1 3.81Å; L577-I691 HydrophobicContact CD2-CG1 3.73Å; L577-I691 HydrophobicContact CG-CG1 4.46Å; R687-I691 HydrophobicContact CG-CD1 4.04Å; R687-I691 VanDerWaalsContact O-CG1 3.28Å; R687-I691 WeakPolarHBondContact O-CG1 3.31Å; R687-I691 PolarHBondContact O-N 2.91Å; I691-R695 VanDerWaalsContact O-CB 3.26Å; I691-R695 WeakPolarHBondContact O-CB 3.43Å; I691-R695 PolarHBondContact O-N 2.95Å
692	G	90.1	Very high	86.4	Confident	25 Å²	25	67.4 Å²	67.4	26%	0.258	33%	0.326	S	S	.	.	H	α-helix	trans	-66.6	-35.9	176.5	0	0	0	0	0	113.9	N688 R689 A690 R696	N688-G692 PolarHBondContact O-N 3.4Å; R689-G692 CarbonylContact O-C 3.59Å; R689-G692 PolarHBondContact O-N 2.98Å; A690-G692 VanDerWaalsContact C-N 3.32Å; A690-G692 PolarHBondContact O-N 2.93Å; G692-R696 WeakPolarHBondContact O-CB 3.34Å; G692-R696 VanDerWaalsContact O-CG 3.28Å; G692-R696 WeakPolarHBondContact O-CG 3.33Å; G692-R696 PolarHBondContact O-N 3.22Å; G692-R696 VanDerWaalsContact O-N 3.16Å; G692-R696 PolarHBondContact O-NE 2.94Å
693	E	87.3	Confident	87	Confident	25 Å²	25	70.4 Å²	70.4	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-47.4	173.2	-73.9	175	-162.8	0	0	111.4	R689 A690 R695 R696 L697	R689-E693 VanDerWaalsContact CG-OE1 3.28Å; R689-E693 WeakPolarHBondContact CG-OE1 3.22Å; R689-E693 IonicContact CZ-OE1 3.71Å; R689-E693 IonicContact NE-OE1 3.72Å; R689-E693 PolarHBondContact NE-OE1 3.24Å; R689-E693 IonicContact NH2-OE1 2.72Å; R689-E693 WeakPolarHBondContact O-CB 3.12Å; R689-E693 WeakPolarHBondContact O-CG 3.37Å; R689-E693 PolarHBondContact O-N 2.98Å; A690-E693 PolarHBondContact O-N 2.92Å; E693-R695 PolarHBondContact O-N 3.43Å; E693-R696 VanDerWaalsContact CG-NH2 3.27Å; E693-R696 PolarHBondContact O-N 3Å; E693-L697 WeakPolarHBondContact O-CB 3.46Å; E693-L697 PolarHBondContact O-N 3.49Å
694	S	88.8	Confident	87.5	Confident	23 Å²	23	67.5 Å²	67.5	16%	0.161	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-42.8	176.7	-170.4	0	0	0	0	112.2	A690 L697 A698	A690-S694 VanDerWaalsContact O-CB 3.3Å; A690-S694 WeakPolarHBondContact O-CB 3.32Å; A690-S694 PolarHBondContact O-N 3.15Å; S694-L697 PolarHBondContact O-N 3.01Å; S694-A698 WeakPolarHBondContact O-CB 3.44Å; S694-A698 PolarHBondContact O-N 3.36Å
695	R	90	Very high	87.8	Confident	195 Å²	195	69.3 Å²	69.3	74%	0.736	34%	0.336	S	S	*	.	H	α-helix	trans	-65.5	-39.7	176.7	-173.4	178.4	-178.8	-170.9	1.3	112	I691 E693 V699	I691-R695 VanDerWaalsContact O-CB 3.26Å; I691-R695 WeakPolarHBondContact O-CB 3.43Å; I691-R695 PolarHBondContact O-N 2.95Å; E693-R695 PolarHBondContact O-N 3.43Å; R695-V699 WeakPolarHBondContact O-CG2 3.13Å; R695-V699 PolarHBondContact O-N 3.4Å; R695-V699 VanDerWaalsContact O-N 3.14Å
696	R	88.9	Confident	88.2	Confident	146 Å²	146	67.7 Å²	67.7	55%	0.551	33%	0.332	S	S	*	.	H	α-helix	trans	-66.3	-41.4	174.7	-78.4	176.5	-69.8	176.1	0.6	111.8	G692 E693 V699 S700	G692-R696 WeakPolarHBondContact O-CB 3.34Å; G692-R696 VanDerWaalsContact O-CG 3.28Å; G692-R696 WeakPolarHBondContact O-CG 3.33Å; G692-R696 PolarHBondContact O-N 3.22Å; G692-R696 VanDerWaalsContact O-N 3.16Å; G692-R696 PolarHBondContact O-NE 2.94Å; E693-R696 VanDerWaalsContact CG-NH2 3.27Å; E693-R696 PolarHBondContact O-N 3Å; R696-V699 PolarHBondContact O-N 3.21Å; R696-S700 WeakPolarHBondContact O-CB 3.38Å; R696-S700 PolarHBondContact O-N 3.48Å
697	L	87.7	Confident	88.6	Confident	26 Å²	26	63.9 Å²	63.9	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-45.9	176.8	-177.7	60.1	0	0	0	111.7	F578 E693 S694 V699 S700 M701 K792	F578-L697 HydrophobicContact CE2-CD2 4.47Å; F578-L697 HydrophobicContact CZ-CD2 3.94Å; E693-L697 WeakPolarHBondContact O-CB 3.46Å; E693-L697 PolarHBondContact O-N 3.49Å; S694-L697 PolarHBondContact O-N 3.01Å; L697-V699 PolarHBondContact O-N 3.39Å; L697-S700 WeakPolarHBondContact O-CB 3.32Å; L697-S700 PolarHBondContact O-N 2.94Å; L697-S700 VanDerWaalsContact O-N 3.1Å; L697-M701 HydrophobicContact CD1-CE 4.1Å; L697-M701 HydrophobicContact CD1-CG 4.38Å; L697-M701 HydrophobicContact CD1-SD 4.38Å; L697-M701 HydrophobicContact CD2-CE 4.25Å; L697-M701 HydrophobicContact CG-CE 4.05Å; L697-M701 HydrophobicContact CG-SD 4.03Å; L697-M701 WeakPolarHBondContact O-CG 3.26Å; L697-M701 PolarHBondContact O-N 2.79Å; L697-K792 HydrophobicContact CD1-CD 4.23Å
698	A	89.3	Confident	88.6	Confident	54 Å²	54	61.6 Å²	61.6	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-44	176.9	0	0	0	0	0	112.5	S694 S700 M701 E702	S694-A698 WeakPolarHBondContact O-CB 3.44Å; S694-A698 PolarHBondContact O-N 3.36Å; A698-S700 VanDerWaalsContact C-N 3.31Å; A698-S700 PolarHBondContact O-N 2.96Å; A698-M701 PolarHBondContact O-N 3.3Å; A698-E702 WeakPolarHBondContact O-CB 3.43Å; A698-E702 PolarHBondContact O-N 3.05Å
699	V	88.8	Confident	88.4	Confident	66 Å²	66	61.6 Å²	61.6	40%	0.4	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-31.8	175	172	0	0	0	0	112.2	R695 R696 L697 K703	R695-V699 WeakPolarHBondContact O-CG2 3.13Å; R695-V699 PolarHBondContact O-N 3.4Å; R695-V699 VanDerWaalsContact O-N 3.14Å; R696-V699 PolarHBondContact O-N 3.21Å; L697-V699 PolarHBondContact O-N 3.39Å; V699-K703 HydrophobicContact CG1-CD 4.36Å; V699-K703 WeakPolarHBondContact O-CG 3.39Å; V699-K703 PolarHBondContact O-N 2.83Å
700	S	87.5	Confident	88.3	Confident	31 Å²	31	59.3 Å²	59.3	22%	0.217	31%	0.308	C	S	.	.	H	α-helix	trans	-68.6	-44.9	173.7	-164	0	0	0	0	111.3	R696 L697 A698 K703 C704 R791 K792	R696-S700 WeakPolarHBondContact O-CB 3.38Å; R696-S700 PolarHBondContact O-N 3.48Å; L697-S700 WeakPolarHBondContact O-CB 3.32Å; L697-S700 PolarHBondContact O-N 2.94Å; L697-S700 VanDerWaalsContact O-N 3.1Å; A698-S700 VanDerWaalsContact C-N 3.31Å; A698-S700 PolarHBondContact O-N 2.96Å; S700-K703 CarbonylContact O-C 3.59Å; S700-K703 PolarHBondContact O-N 2.82Å; S700-C704 WeakPolarHBondContact O-CA 3.49Å; S700-C704 VanDerWaalsContact O-CB 3.25Å; S700-C704 WeakPolarHBondContact O-CB 3.42Å; S700-C704 PolarHBondContact O-N 3.06Å; S700-R791 PolarHBondContact OG-O 3.3Å; S700-K792 PolarHBondContact OG-O 2.92Å
701	M	87.8	Confident	88	Confident	68 Å²	68	68.8 Å²	68.8	34%	0.335	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-44.3	178.2	-72.7	169	157.6	0	0	112.9	L697 A698 K703 C704 H747	L697-M701 HydrophobicContact CD1-CE 4.1Å; L697-M701 HydrophobicContact CD1-CG 4.38Å; L697-M701 HydrophobicContact CD1-SD 4.38Å; L697-M701 HydrophobicContact CD2-CE 4.25Å; L697-M701 HydrophobicContact CG-CE 4.05Å; L697-M701 HydrophobicContact CG-SD 4.03Å; L697-M701 WeakPolarHBondContact O-CG 3.26Å; L697-M701 PolarHBondContact O-N 2.79Å; A698-M701 PolarHBondContact O-N 3.3Å; M701-K703 PolarHBondContact O-N 3.03Å; M701-C704 PolarHBondContact O-N 3.37Å; M701-H747 HydrophobicContact CE-CB 3.66Å; M701-H747 HydrophobicContact CG-CB 4.11Å
702	E	88.1	Confident	87.7	Confident	109 Å²	109	70.8 Å²	70.8	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-31.6	179.3	-169.8	174.9	-136.2	0	0	111.6	R570 A698	R570-E702 IonicContact NH2-OE1 3.95Å; R570-E702 PolarHBondContact NH2-OE1 3.1Å; A698-E702 WeakPolarHBondContact O-CB 3.43Å; A698-E702 PolarHBondContact O-N 3.05Å
703	K	89.3	Confident	87.5	Confident	122 Å²	122	70.3 Å²	70.3	53%	0.53	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	18.2	-178.9	-56.7	-176.8	179.2	-175.1	0	113.9	V699 S700 M701 P705	V699-K703 HydrophobicContact CG1-CD 4.36Å; V699-K703 WeakPolarHBondContact O-CG 3.39Å; V699-K703 PolarHBondContact O-N 2.83Å; S700-K703 CarbonylContact O-C 3.59Å; S700-K703 PolarHBondContact O-N 2.82Å; M701-K703 PolarHBondContact O-N 3.03Å; K703-P705 WeakPolarHBondContact O-CD 3.46Å
704	C	90.3	Very high	87.4	Confident	7 Å²	7	70.8 Å²	70.8	5%	0.047	36%	0.357	C	S	.	.			trans	-84.5	121.4	-179.5	176.5	0	0	0	0	110	S700 M701 H706 C707 S710 H794	S700-C704 WeakPolarHBondContact O-CA 3.49Å; S700-C704 VanDerWaalsContact O-CB 3.25Å; S700-C704 WeakPolarHBondContact O-CB 3.42Å; S700-C704 PolarHBondContact O-N 3.06Å; M701-C704 PolarHBondContact O-N 3.37Å; C704-H706 PolarHBondContact O-N 3.24Å; C704-H706 VanDerWaalsContact O-N 3.09Å; C704-H706 PolarHBondContact SG-N 2.87Å; C704-C707 HydrophobicContact CB-CB 3.78Å; C704-C707 PolarHBondContact SG-N 2.93Å; C704-S710 WeakPolarHBondContact O-CB 3.25Å; C704-S710 PolarHBondContact O-OG 3.49Å; C704-H794 WeakPolarHBondContact SG-CB 3.25Å; C704-H794 PolarHBondContact SG-ND1 2.58Å; C704-H794 VanDerWaalsContact SG-ND1 3.42Å
705	P	89	Confident	87.4	Confident	60 Å²	60	74 Å²	74	39%	0.39	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	1.2	177.8	30.9	-36.4	0	0	0	114.1	K703 L713	K703-P705 WeakPolarHBondContact O-CD 3.46Å; P705-L713 VanDerWaalsContact O-CD1 3.27Å; P705-L713 WeakPolarHBondContact O-CD1 3.4Å
706	H	90.9	Very high	87.2	Confident	49 Å²	49	65.9 Å²	65.9	23%	0.227	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-7.1	-177.6	-53.2	-51.7	0	0	0	114	C704 Y726 H794	C704-H706 PolarHBondContact O-N 3.24Å; C704-H706 VanDerWaalsContact O-N 3.09Å; C704-H706 PolarHBondContact SG-N 2.87Å; H706-Y726 WeakPolarHBondContact CA-OH 3.18Å; H706-Y726 PolarHBondContact O-OH 3.46Å; H706-Y726 VanDerWaalsContact O-OH 3.05Å; H706-H794 HydrophobicContact CB-CB 4.12Å; H706-H794 PolarHBondContact O-CE1 3.49Å
707	C	90.1	Very high	87.3	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.02	31%	0.313	C	S	.	.			trans	-75.8	127.2	173.5	-89	0	0	0	0	110.4	C704 S709 S710 H747 H794	C704-C707 HydrophobicContact CB-CB 3.78Å; C704-C707 PolarHBondContact SG-N 2.93Å; C707-S709 PolarHBondContact O-N 3.23Å; C707-S709 VanDerWaalsContact O-N 3.13Å; C707-S710 PolarHBondContact O-N 3.07Å; C707-S710 PolarHBondContact O-OG 3.47Å; C707-H747 PolarHBondContact SG-ND1 3.13Å; C707-H794 PolarHBondContact SG-ND1 3.33Å; C707-H794 VanDerWaalsContact SG-ND1 3.35Å
708	F	85.6	Confident	87.5	Confident	52 Å²	52	58 Å²	58	23%	0.228	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.7	176.7	-164.8	-94	0	0	0	113.4	L63 L713 I718 I721 L745	L63-F708 HydrophobicContact CD1-CZ 4.05Å; L63-F708 HydrophobicContact CD2-CE1 4.21Å; L63-F708 HydrophobicContact CD2-CE2 3.78Å; L63-F708 HydrophobicContact CD2-CZ 3.31Å; L63-F708 HydrophobicContact CG-CZ 4.31Å; F708-L713 HydrophobicContact CD2-CD2 3.96Å; F708-I718 HydrophobicContact CD2-CD1 4.43Å; F708-I718 HydrophobicContact CE2-CD1 4.13Å; F708-I721 HydrophobicContact CE2-CD1 4.46Å; F708-L745 HydrophobicContact CB-CD2 3.93Å; F708-L745 HydrophobicContact CD2-CD2 4Å; F708-L745 HydrophobicContact CG-CD2 4.01Å
709	S	82.4	Confident	87.7	Confident	105 Å²	105	55.8 Å²	55.8	73%	0.734	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-2.3	176	60.4	0	0	0	0	115.3	C707	C707-S709 PolarHBondContact O-N 3.23Å; C707-S709 VanDerWaalsContact O-N 3.13Å
710	S	84.8	Confident	87.9	Confident	10 Å²	10	52.8 Å²	52.8	7%	0.07	27%	0.271	C	S	.	.			trans	-87.4	162.2	-179.9	89.3	0	0	0	0	112	C704 C707 E712 L713	C704-S710 WeakPolarHBondContact O-CB 3.25Å; C704-S710 PolarHBondContact O-OG 3.49Å; C707-S710 PolarHBondContact O-N 3.07Å; C707-S710 PolarHBondContact O-OG 3.47Å; S710-E712 PolarHBondContact OG-N 3.44Å; S710-L713 PolarHBondContact OG-N 3.18Å
711	Q	80.7	Confident	88.1	Confident	199 Å²	199	51.5 Å²	51.5	93%	0.93	26%	0.261	S	S	*	.	S	Bend	trans	-92.1	-7	171.2	-61.6	-178.1	8.6	0	0	112.4
712	E	83.6	Confident	88.2	Confident	112 Å²	112	48.6 Å²	48.6	52%	0.523	25%	0.248	S	C	.	.	S	Bend	trans	-92.4	-11.3	-179.2	-64.6	-166.5	-153.7	0	0	113.2	S710 P714	S710-E712 PolarHBondContact OG-N 3.44Å; E712-P714 VanDerWaalsContact O-CD 3.24Å; E712-P714 WeakPolarHBondContact O-CD 3.21Å
713	L	86.6	Confident	88.2	Confident	14 Å²	14	47.4 Å²	47.4	7%	0.073	25%	0.252	C	S	.	.	S	Bend	trans	-67.2	117.6	176.1	172.6	63.2	0	0	0	111.7	P705 F708 S710 K715 I718	P705-L713 VanDerWaalsContact O-CD1 3.27Å; P705-L713 WeakPolarHBondContact O-CD1 3.4Å; F708-L713 HydrophobicContact CD2-CD2 3.96Å; S710-L713 PolarHBondContact OG-N 3.18Å; L713-K715 PolarHBondContact O-N 2.93Å; L713-I718 HydrophobicContact CD2-CD1 4.28Å
714	P	85.9	Confident	88.3	Confident	36 Å²	36	44.9 Å²	44.9	23%	0.234	24%	0.241	C	C	.	.			trans	-70.4	86.8	171.2	29.1	-36.7	0	0	0	111.6	E712 H716 L717 A731	E712-P714 VanDerWaalsContact O-CD 3.24Å; E712-P714 WeakPolarHBondContact O-CD 3.21Å; P714-H716 VanDerWaalsContact CB-CE1 3.43Å; P714-H716 WeakPolarHBondContact CB-CE1 3.14Å; P714-H716 PolarHBondContact O-N 2.87Å; P714-H716 VanDerWaalsContact O-N 3.12Å; P714-L717 HydrophobicContact CB-CD1 3.8Å; P714-L717 HydrophobicContact CB-CG 4.08Å; P714-L717 HydrophobicContact CG-CD1 3.62Å; P714-L717 HydrophobicContact CG-CG 4.3Å; P714-L717 PolarHBondContact O-N 3.19Å; P714-A731 HydrophobicContact CG-CB 4.18Å
715	K	87.4	Confident	88.5	Confident	91 Å²	91	44.6 Å²	44.6	40%	0.396	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-55.4	-30.1	-177.7	-64	-174.3	178.4	-175.2	0	113.9	I55 L713 L717 I718	I55-K715 HydrophobicContact CD1-CB 3.83Å; I55-K715 HydrophobicContact CD1-CD 4.12Å; I55-K715 HydrophobicContact CG1-CB 4.2Å; L713-K715 PolarHBondContact O-N 2.93Å; K715-L717 PolarHBondContact O-N 2.49Å; K715-I718 WeakPolarHBondContact O-CB 3.45Å; K715-I718 WeakPolarHBondContact O-CG1 3.23Å; K715-I718 PolarHBondContact O-N 3.25Å
716	H	86.9	Confident	88.7	Confident	23 Å²	23	41.7 Å²	41.7	11%	0.106	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-65.8	-15.3	179	67.8	-75.8	0	0	0	114.3	W54 P714 F898 Q901 V905	W54-H716 HydrophobicContact CE3-CB 3.95Å; W54-H716 HydrophobicContact CZ3-CB 4.21Å; W54-H716 WeakPolarHBondContact O-CB 3.45Å; P714-H716 VanDerWaalsContact CB-CE1 3.43Å; P714-H716 WeakPolarHBondContact CB-CE1 3.14Å; P714-H716 PolarHBondContact O-N 2.87Å; P714-H716 VanDerWaalsContact O-N 3.12Å; H716-F898 HydrophobicContact CB-CE2 4Å; H716-F898 HydrophobicContact CB-CZ 4.24Å; H716-F898 AromaticContact CD2-CD2 3.85Å; H716-F898 AromaticContact CD2-CE2 3.36Å; H716-F898 WeakPolarHBondContact CD2-CE2 2.87Å; H716-F898 AromaticContact CE1-CE2 4Å; H716-F898 AromaticContact CG-CE2 3.55Å; H716-F898 AromaticContact ND1-CE2 3.98Å; H716-F898 AromaticContact NE2-CD2 3.74Å; H716-F898 AromaticContact NE2-CE2 3.67Å; H716-Q901 PolarHBondContact NE2-OE1 2.74Å; H716-V905 WeakPolarHBondContact O-CG2 3.43Å
717	L	90.9	Very high	88.9	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-91.5	-2.3	177.5	-59.3	178.7	0	0	0	113.8	P714 K715 S728 L729 A731 Q901 V905	P714-L717 HydrophobicContact CB-CD1 3.8Å; P714-L717 HydrophobicContact CB-CG 4.08Å; P714-L717 HydrophobicContact CG-CD1 3.62Å; P714-L717 HydrophobicContact CG-CG 4.3Å; P714-L717 PolarHBondContact O-N 3.19Å; K715-L717 PolarHBondContact O-N 2.49Å; L717-S728 CarbonylContact O-C 3.48Å; L717-S728 WeakPolarHBondContact O-CA 3.35Å; L717-S728 WeakPolarHBondContact O-CB 3.45Å; L717-L729 WeakPolarHBondContact CD1-O 3.41Å; L717-L729 PolarHBondContact O-N 3.48Å; L717-A731 VanDerWaalsContact CD1-CA 3.44Å; L717-A731 HydrophobicContact CD1-CB 3.6Å; L717-Q901 HydrophobicContact CD2-CB 3.88Å; L717-Q901 HydrophobicContact CD2-CG 4.23Å; L717-V905 HydrophobicContact CD2-CG2 3.89Å
718	I	92.5	Very high	89.1	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.3	178.5	-57.6	172.7	0	0	0	109	V59 F708 L713 K715 I721 Y726	V59-I718 HydrophobicContact CG1-CB 4.37Å; V59-I718 HydrophobicContact CG1-CG2 3.99Å; F708-I718 HydrophobicContact CD2-CD1 4.43Å; F708-I718 HydrophobicContact CE2-CD1 4.13Å; L713-I718 HydrophobicContact CD2-CD1 4.28Å; K715-I718 WeakPolarHBondContact O-CB 3.45Å; K715-I718 WeakPolarHBondContact O-CG1 3.23Å; K715-I718 PolarHBondContact O-N 3.25Å; I718-I721 HydrophobicContact CG2-CD1 3.99Å; I718-I721 HydrophobicContact CG2-CG1 3.64Å; I718-Y726 HydrophobicContact CD1-CD2 4.49Å; I718-Y726 HydrophobicContact CG1-CD2 4.13Å; I718-Y726 HydrophobicContact CG1-CE2 4.2Å; I718-Y726 HydrophobicContact CG2-CD2 4.16Å
719	V	92.7	Very high	89.5	Confident	9 Å²	9	37.9 Å²	37.9	6%	0.055	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-45.8	-179.7	178.5	0	0	0	0	111.2	V59 L727 L729 F908 W912	V59-V719 WeakPolarHBondContact CG2-O 3.39Å; V719-L727 HydrophobicContact CB-CD2 4.42Å; V719-L727 HydrophobicContact CB-CG 4.41Å; V719-L727 HydrophobicContact CG1-CD2 4.43Å; V719-L727 PolarHBondContact N-O 3.13Å; V719-L729 HydrophobicContact CG2-CD2 4.49Å; V719-L729 HydrophobicContact CG2-CG 4.15Å; V719-F908 HydrophobicContact CB-CD1 4.28Å; V719-F908 HydrophobicContact CB-CE1 4.44Å; V719-F908 HydrophobicContact CG1-CD1 3.73Å; V719-F908 HydrophobicContact CG1-CE1 3.96Å; V719-F908 HydrophobicContact CG2-CD1 3.71Å; V719-F908 HydrophobicContact CG2-CE1 4.16Å; V719-W912 HydrophobicContact CG1-CB 4.23Å; V719-W912 HydrophobicContact CG1-CG 4.11Å
720	A	92	Very high	89.9	Confident	3 Å²	3	33.7 Å²	33.7	3%	0.025	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	149.8	-176.2	0	0	0	0	0	111.1	Y726 L727 F765 T918	A720-Y726 WeakPolarHBondContact O-CA 3.4Å; A720-Y726 WeakPolarHBondContact O-CB 3.14Å; A720-L727 HydrophobicContact CB-CB 4.35Å; A720-L727 PolarHBondContact N-O 3.13Å; A720-L727 PolarHBondContact O-N 3.09Å; A720-F765 HydrophobicContact CB-CE1 4.3Å; A720-T918 HydrophobicContact CB-CG2 4.05Å
721	I	92.1	Very high	90.1	Very high	3 Å²	3	35 Å²	35	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	116.6	-178	-63.3	-177.7	0	0	0	109.5	V59 R62 L63 M66 F708 I718 L745	V59-I721 HydrophobicContact CG1-CD1 3.66Å; V59-I721 HydrophobicContact CG1-CG1 4.18Å; R62-I721 HydrophobicContact CG-CB 4.33Å; R62-I721 HydrophobicContact CG-CG2 4.48Å; L63-I721 HydrophobicContact CD2-CD1 3.36Å; L63-I721 HydrophobicContact CG-CD1 4.25Å; M66-I721 HydrophobicContact CE-CG2 4.08Å; M66-I721 HydrophobicContact SD-CG2 4.26Å; F708-I721 HydrophobicContact CE2-CD1 4.46Å; I718-I721 HydrophobicContact CG2-CD1 3.99Å; I718-I721 HydrophobicContact CG2-CG1 3.64Å; I721-L745 HydrophobicContact CG2-CD1 4.5Å
722	G	89.7	Confident	90.3	Very high	7 Å²	7	25.5 Å²	25.5	7%	0.072	14%	0.142	C	C	.	.			trans	-85.1	-156.5	170.7	0	0	0	0	0	112.3	V725	G722-V725 VanDerWaalsContact CA-O 3.32Å; G722-V725 WeakPolarHBondContact CA-O 3.49Å; G722-V725 PolarHBondContact N-O 3.18Å
723	S	89.2	Confident	90.6	Very high	85 Å²	85	21.9 Å²	21.9	59%	0.594	13%	0.127	S	C	*	.	S	Bend	trans	-84.3	-31.4	-178.2	68.5	0	0	0	0	113.9	E761	S723-E761 WeakPolarHBondContact CB-OE1 3.4Å; S723-E761 PolarHBondContact N-OE1 3.35Å; S723-E761 PolarHBondContact N-OE2 3.46Å; S723-E761 VanDerWaalsContact OG-CD 3.32Å; S723-E761 PolarHBondContact OG-OE1 3.16Å; S723-E761 PolarHBondContact OG-OE2 2.93Å
724	K	91.7	Very high	90.7	Very high	69 Å²	69	22.2 Å²	22.2	30%	0.3	13%	0.131	S	C	.	.	S	Bend	trans	-136.7	-16.2	-179.7	-54.8	-171.5	-169.7	-169.8	0	113	L745 D757 V758 E761	K724-L745 WeakPolarHBondContact O-CB 3.32Å; K724-L745 PolarHBondContact O-N 3.21Å; K724-D757 HydrophobicContact CD-CB 4.22Å; K724-D757 IonicContact NZ-OD2 2.7Å; K724-D757 PolarHBondContact NZ-OD2 3.36Å; K724-V758 HydrophobicContact CB-CG2 4.2Å; K724-V758 HydrophobicContact CD-CG2 3.65Å; K724-E761 WeakPolarHBondContact CA-OE2 3.26Å; K724-E761 PolarHBondContact N-OE2 2.92Å
725	V	94.2	Very high	90.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.5	-174.8	179.6	0	0	0	0	110.1	G722 I742 C743 V758 E761 M762 F765	G722-V725 VanDerWaalsContact CA-O 3.32Å; G722-V725 WeakPolarHBondContact CA-O 3.49Å; G722-V725 PolarHBondContact N-O 3.18Å; V725-I742 HydrophobicContact CG1-CG2 3.44Å; V725-I742 VanDerWaalsContact CG1-CG2 3.44Å; V725-C743 CarbonylContact C-O 3.55Å; V725-C743 WeakPolarHBondContact CA-O 3.39Å; V725-C743 WeakPolarHBondContact CG1-O 3.22Å; V725-V758 HydrophobicContact CG2-CG1 3.84Å; V725-E761 HydrophobicContact CB-CG 4.09Å; V725-E761 WeakPolarHBondContact CB-OE2 3.44Å; V725-E761 HydrophobicContact CG2-CB 4.04Å; V725-E761 HydrophobicContact CG2-CG 4.15Å; V725-E761 WeakPolarHBondContact CG2-OE2 3.21Å; V725-E761 PolarHBondContact N-OE2 2.95Å; V725-M762 HydrophobicContact CB-CG 4.43Å; V725-M762 HydrophobicContact CG1-CG 3.9Å; V725-M762 HydrophobicContact CG2-CG 3.58Å; V725-F765 HydrophobicContact CB-CD2 4.16Å; V725-F765 HydrophobicContact CB-CE2 3.92Å; V725-F765 HydrophobicContact CG1-CD2 3.69Å; V725-F765 HydrophobicContact CG1-CE2 3.81Å
726	Y	93.9	Very high	90.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.2	172.9	74.4	-82.9	0	0	0	111.7	H706 I718 A720 S728 C743 L745	H706-Y726 WeakPolarHBondContact CA-OH 3.18Å; H706-Y726 PolarHBondContact O-OH 3.46Å; H706-Y726 VanDerWaalsContact O-OH 3.05Å; I718-Y726 HydrophobicContact CD1-CD2 4.49Å; I718-Y726 HydrophobicContact CG1-CD2 4.13Å; I718-Y726 HydrophobicContact CG1-CE2 4.2Å; I718-Y726 HydrophobicContact CG2-CD2 4.16Å; A720-Y726 WeakPolarHBondContact O-CA 3.4Å; A720-Y726 WeakPolarHBondContact O-CB 3.14Å; Y726-S728 WeakPolarHBondContact CE2-OG 3.38Å; Y726-C743 HydrophobicContact CD1-CB 4Å; Y726-C743 WeakPolarHBondContact CD1-O 3.26Å; Y726-C743 HydrophobicContact CE1-CB 3.37Å; Y726-C743 HydrophobicContact CE2-CB 4.13Å; Y726-C743 VanDerWaalsContact CZ-CB 3.44Å; Y726-C743 PolarHBondContact N-O 3.32Å; Y726-C743 PolarHBondContact O-N 3.34Å; Y726-L745 HydrophobicContact CD1-CD2 3.6Å; Y726-L745 HydrophobicContact CD1-CG 4.1Å; Y726-L745 HydrophobicContact CE1-CD2 4.4Å; Y726-L745 HydrophobicContact CG-CD2 4.14Å
727	L	94.6	Very high	91	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.8	177.5	-177	65	0	0	0	109.5	V719 A720 C740 I742 F765 L769 F908 W912	V719-L727 HydrophobicContact CB-CD2 4.42Å; V719-L727 HydrophobicContact CB-CG 4.41Å; V719-L727 HydrophobicContact CG1-CD2 4.43Å; V719-L727 PolarHBondContact N-O 3.13Å; A720-L727 HydrophobicContact CB-CB 4.35Å; A720-L727 PolarHBondContact N-O 3.13Å; A720-L727 PolarHBondContact O-N 3.09Å; L727-C740 HydrophobicContact CD1-CB 4.08Å; L727-I742 HydrophobicContact CD1-CG1 4.11Å; L727-F765 HydrophobicContact CB-CD1 4.22Å; L727-F765 HydrophobicContact CB-CE1 4.04Å; L727-L769 HydrophobicContact CD1-CD1 4.04Å; L727-L769 HydrophobicContact CD2-CD2 4.26Å; L727-F908 HydrophobicContact CD2-CE1 3.89Å; L727-F908 HydrophobicContact CD2-CZ 4.36Å; L727-W912 HydrophobicContact CD2-CD2 3.94Å; L727-W912 HydrophobicContact CD2-CE3 4.1Å; L727-W912 HydrophobicContact CD2-CH2 4.09Å; L727-W912 HydrophobicContact CD2-CZ2 3.94Å; L727-W912 HydrophobicContact CD2-CZ3 4.19Å
728	S	93.6	Very high	90.9	Very high	6 Å²	6	22.9 Å²	22.9	4%	0.042	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	159.7	-179	55.6	0	0	0	0	113.8	L717 Y726 C740 L741	L717-S728 CarbonylContact O-C 3.48Å; L717-S728 WeakPolarHBondContact O-CA 3.35Å; L717-S728 WeakPolarHBondContact O-CB 3.45Å; Y726-S728 WeakPolarHBondContact CE2-OG 3.38Å; S728-C740 CarbonylContact O-C 3.55Å; S728-L741 PolarHBondContact N-O 2.83Å; S728-L741 PolarHBondContact O-N 3.48Å
729	L	93.5	Very high	91	Very high	17 Å²	17	23.2 Å²	23.2	9%	0.089	14%	0.138	C	C	.	.			trans	-93.3	153.8	172.2	-60.6	-171.5	0	0	0	111.7	L717 V719 C740 K904 V905 F908	L717-L729 WeakPolarHBondContact CD1-O 3.41Å; L717-L729 PolarHBondContact O-N 3.48Å; V719-L729 HydrophobicContact CG2-CD2 4.49Å; V719-L729 HydrophobicContact CG2-CG 4.15Å; L729-C740 HydrophobicContact CD2-CB 3.83Å; L729-K904 HydrophobicContact CD1-CB 4.06Å; L729-V905 HydrophobicContact CD1-CB 4.43Å; L729-V905 HydrophobicContact CD1-CG2 3.85Å; L729-V905 HydrophobicContact CG-CG2 4.45Å; L729-F908 HydrophobicContact CD1-CB 4.1Å; L729-F908 HydrophobicContact CD2-CB 4.44Å; L729-F908 HydrophobicContact CD2-CD1 4.31Å; L729-F908 HydrophobicContact CD2-CD2 4.06Å; L729-F908 HydrophobicContact CD2-CE2 4.37Å; L729-F908 HydrophobicContact CD2-CG 4Å
730	P	92.2	Very high	91.1	Very high	18 Å²	18	22.8 Å²	22.8	12%	0.117	14%	0.135	C	C	.	.			trans	-66.1	143.9	175.9	29.4	-38.3	0	0	0	112.6	G732 H739 L741	P730-G732 PolarHBondContact O-N 3.45Å; P730-H739 WeakPolarHBondContact CD-O 3.43Å; P730-L741 HydrophobicContact CB-CD1 4.29Å
731	A	87.4	Confident	91.3	Very high	37 Å²	37	23.1 Å²	23.1	31%	0.306	14%	0.137	S	C	.	.	S	Bend	trans	-79	28.7	-175.7	0	0	0	0	0	115.4	P714 L717 Q901	P714-A731 HydrophobicContact CG-CB 4.18Å; L717-A731 VanDerWaalsContact CD1-CA 3.44Å; L717-A731 HydrophobicContact CD1-CB 3.6Å; A731-Q901 PolarHBondContact O-NE2 2.93Å; A731-Q901 VanDerWaalsContact O-NE2 3.16Å
732	G	86.7	Confident	91.5	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-176	-173.7	-176.5	0	0	0	0	0	111.3	P730 S734 I894	P730-G732 PolarHBondContact O-N 3.45Å; G732-S734 PolarHBondContact O-N 3.22Å; G732-I894 CarbonylContact C-O 3.57Å; G732-I894 WeakPolarHBondContact CA-O 3.27Å
733	V	89.1	Confident	91.7	Very high	35 Å²	35	22.7 Å²	22.7	21%	0.212	13%	0.133	C	C	.	.			trans	-51.8	112.7	-171.3	179.6	0	0	0	0	111	R889 I894 E896	V733-R889 HydrophobicContact CG1-CG 4.39Å; V733-I894 HydrophobicContact CB-CB 4.14Å; V733-I894 HydrophobicContact CG2-CB 3.68Å; V733-I894 HydrophobicContact CG2-CG2 3.71Å; V733-I894 PolarHBondContact N-O 2.82Å; V733-E896 WeakPolarHBondContact CA-OE1 3.46Å; V733-E896 HydrophobicContact CG2-CG 3.67Å
734	S	88.6	Confident	92	Very high	21 Å²	21	18.7 Å²	18.7	15%	0.147	11%	0.105	C	C	.	.			trans	-68	141.6	177.3	45.1	0	0	0	0	110.2	G732 T736 K904	G732-S734 PolarHBondContact O-N 3.22Å; S734-T736 VanDerWaalsContact C-N 3.31Å; S734-T736 WeakPolarHBondContact CB-O 3.42Å; S734-T736 PolarHBondContact O-N 3.16Å; S734-K904 PolarHBondContact OG-NZ 3Å
735	M	87.8	Confident	92	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.025	10%	0.097	C	C	.	.	S	Bend	trans	-60.1	-46.7	177.7	-68.7	-70.4	-74.3	0	0	110.9	K876 L885 R889 W890	M735-K876 HydrophobicContact CE-CB 4.27Å; M735-K876 VanDerWaalsContact CE-O 3.31Å; M735-K876 WeakPolarHBondContact CE-O 3.46Å; M735-L885 HydrophobicContact CB-CD1 4.41Å; M735-L885 HydrophobicContact CE-CD1 4.02Å; M735-L885 VanDerWaalsContact O-CD1 3.3Å; M735-L885 WeakPolarHBondContact O-CD1 3.46Å; M735-R889 PolarHBondContact O-NH1 3.47Å; M735-R889 HydrophobicContact SD-CB 3.74Å; M735-W890 HydrophobicContact CE-CB 4.31Å; M735-W890 HydrophobicContact CE-CD2 4.35Å; M735-W890 HydrophobicContact CE-CE3 3.68Å; M735-W890 HydrophobicContact CE-CZ3 4.3Å; M735-W890 HydrophobicContact SD-CB 3.99Å; M735-W890 HydrophobicContact SD-CE3 4.06Å
736	T	89	Confident	91.8	Very high	22 Å²	22	23.3 Å²	23.3	14%	0.135	13%	0.128	C	C	.	.	S	Bend	trans	-136.7	164.4	-173.7	-179.5	0	0	0	0	108.4	S734 H739 I800 P801	S734-T736 VanDerWaalsContact C-N 3.31Å; S734-T736 WeakPolarHBondContact CB-O 3.42Å; S734-T736 PolarHBondContact O-N 3.16Å; T736-H739 HydrophobicContact CG2-CB 3.89Å; T736-I800 HydrophobicContact CG2-CG2 3.57Å; T736-P801 HydrophobicContact CG2-CG 3.84Å; T736-P801 VanDerWaalsContact CG2-O 3.26Å; T736-P801 WeakPolarHBondContact CG2-O 3.34Å; T736-P801 PolarHBondContact OG1-O 2.95Å
737	E	89.2	Confident	91.6	Very high	130 Å²	130	24.6 Å²	24.6	61%	0.607	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	137	172.3	-64.4	-166.5	-156.5	0	0	109.9	H739 P801 Q907	E737-H739 VanDerWaalsContact C-N 3.34Å; E737-H739 PolarHBondContact O-N 3.24Å; E737-P801 WeakPolarHBondContact O-CG 3.28Å; E737-Q907 PolarHBondContact OE2-NE2 3.07Å
738	G	89.8	Confident	91.4	Very high	11 Å²	11	26.2 Å²	26.2	11%	0.113	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	2.5	-174.1	0	0	0	0	0	116.5	C740 F773 F908	G738-C740 PolarHBondContact O-N 3.36Å; G738-C740 VanDerWaalsContact O-N 3.07Å; G738-C740 PolarHBondContact O-SG 2.59Å; G738-C740 VanDerWaalsContact O-SG 3.4Å; G738-F773 WeakPolarHBondContact O-CZ 2.95Å; G738-F908 WeakPolarHBondContact O-CE2 3.46Å
739	H	94.5	Very high	91.2	Very high	9 Å²	9	28.2 Å²	28.2	4%	0.042	15%	0.154	C	C	.	.			trans	-54.6	115.8	169.8	176	-153.3	0	0	0	110.8	P730 T736 E737 C799	P730-H739 WeakPolarHBondContact CD-O 3.43Å; T736-H739 HydrophobicContact CG2-CB 3.89Å; E737-H739 VanDerWaalsContact C-N 3.34Å; E737-H739 PolarHBondContact O-N 3.24Å; H739-C799 WeakPolarHBondContact CA-O 3.35Å; H739-C799 PolarHBondContact CD2-O 3.12Å
740	C	94.8	Very high	91	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	166.3	-175.4	53.9	0	0	0	0	111.7	L727 S728 L729 G738 C799 F908	L727-C740 HydrophobicContact CD1-CB 4.08Å; S728-C740 CarbonylContact O-C 3.55Å; L729-C740 HydrophobicContact CD2-CB 3.83Å; G738-C740 PolarHBondContact O-N 3.36Å; G738-C740 VanDerWaalsContact O-N 3.07Å; G738-C740 PolarHBondContact O-SG 2.59Å; G738-C740 VanDerWaalsContact O-SG 3.4Å; C740-C799 PolarHBondContact N-O 2.98Å; C740-C799 PolarHBondContact O-N 3.48Å; C740-F908 HydrophobicContact CB-CE2 4.13Å; C740-F908 HydrophobicContact CB-CZ 3.93Å
741	L	95.3	Very high	91	Very high	11 Å²	11	26.9 Å²	26.9	6%	0.058	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.5	-170.4	-49.2	174.9	0	0	0	108.9	S728 P730 V796 E798	S728-L741 PolarHBondContact N-O 2.83Å; S728-L741 PolarHBondContact O-N 3.48Å; P730-L741 HydrophobicContact CB-CD1 4.29Å; L741-V796 HydrophobicContact CB-CG1 4.05Å; L741-V796 HydrophobicContact CD2-CG1 4Å; L741-V796 HydrophobicContact CG-CG1 4.43Å; L741-E798 HydrophobicContact CD2-CB 4.12Å; L741-E798 HydrophobicContact CD2-CG 3.75Å
742	I	96.1	Very high	91.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.5	172.1	-50.7	171.8	0	0	0	107.6	V725 L727 M762 F765 L769 F782 L797	V725-I742 HydrophobicContact CG1-CG2 3.44Å; V725-I742 VanDerWaalsContact CG1-CG2 3.44Å; L727-I742 HydrophobicContact CD1-CG1 4.11Å; I742-M762 HydrophobicContact CB-CE 4.29Å; I742-M762 HydrophobicContact CG2-CB 4.37Å; I742-M762 HydrophobicContact CG2-CE 3.87Å; I742-M762 HydrophobicContact CG2-CG 4.11Å; I742-F765 HydrophobicContact CD1-CB 4.05Å; I742-F765 HydrophobicContact CG1-CB 4.43Å; I742-F765 HydrophobicContact CG2-CB 4.23Å; I742-L769 HydrophobicContact CD1-CD1 3.85Å; I742-L769 HydrophobicContact CG1-CD1 4.08Å; I742-F782 HydrophobicContact CD1-CD1 4.46Å; I742-F782 HydrophobicContact CD1-CE1 4.19Å; I742-L797 HydrophobicContact CB-CB 4.32Å; I742-L797 HydrophobicContact CD1-CD2 4.17Å; I742-L797 PolarHBondContact N-O 3.22Å; I742-L797 PolarHBondContact O-N 3.06Å
743	C	94.8	Very high	91.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.3	-173.4	-67.5	0	0	0	0	111	V725 Y726	V725-C743 CarbonylContact C-O 3.55Å; V725-C743 WeakPolarHBondContact CA-O 3.39Å; V725-C743 WeakPolarHBondContact CG1-O 3.22Å; Y726-C743 HydrophobicContact CD1-CB 4Å; Y726-C743 WeakPolarHBondContact CD1-O 3.26Å; Y726-C743 HydrophobicContact CE1-CB 3.37Å; Y726-C743 HydrophobicContact CE2-CB 4.13Å; Y726-C743 VanDerWaalsContact CZ-CB 3.44Å; Y726-C743 PolarHBondContact N-O 3.32Å; Y726-C743 PolarHBondContact O-N 3.34Å
744	P	95	Very high	91.3	Very high	1 Å²	1	25 Å²	25	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	144.6	167.2	30	-31.7	0	0	0	110.3	Q746 H748 V758 H794 M795	P744-Q746 VanDerWaalsContact C-N 3.27Å; P744-Q746 PolarHBondContact O-N 3.42Å; P744-H748 HydrophobicContact CG-CB 4.32Å; P744-V758 HydrophobicContact CB-CG1 4.21Å; P744-H794 PolarHBondContact O-CE1 3.38Å; P744-H794 PolarHBondContact O-NE2 2.7Å; P744-M795 WeakPolarHBondContact CD-O 3.36Å; P744-M795 HydrophobicContact CG-CB 4.3Å
745	L	91.6	Very high	91.5	Very high	28 Å²	28	28.7 Å²	28.7	15%	0.147	16%	0.155	C	C	.	.	S	Bend	trans	-65.8	-31.3	175.4	-70.3	168.4	0	0	0	112	F708 I721 K724 Y726	F708-L745 HydrophobicContact CB-CD2 3.93Å; F708-L745 HydrophobicContact CD2-CD2 4Å; F708-L745 HydrophobicContact CG-CD2 4.01Å; I721-L745 HydrophobicContact CG2-CD1 4.5Å; K724-L745 WeakPolarHBondContact O-CB 3.32Å; K724-L745 PolarHBondContact O-N 3.21Å; Y726-L745 HydrophobicContact CD1-CD2 3.6Å; Y726-L745 HydrophobicContact CD1-CG 4.1Å; Y726-L745 HydrophobicContact CE1-CD2 4.4Å; Y726-L745 HydrophobicContact CG-CD2 4.14Å
746	Q	90.3	Very high	91.6	Very high	138 Å²	138	34.2 Å²	34.2	65%	0.645	18%	0.181	S	C	*	.	S	Bend	trans	-93.1	153.7	175.7	-61.2	-171.8	26	0	0	111.5	P744 H748 H794	P744-Q746 VanDerWaalsContact C-N 3.27Å; P744-Q746 PolarHBondContact O-N 3.42Å; Q746-H748 PolarHBondContact O-CD2 2.97Å; Q746-H748 PolarHBondContact O-N 3.42Å; Q746-H794 PolarHBondContact O-CE1 3.09Å
747	H	90.1	Very high	91.8	Very high	27 Å²	27	38.1 Å²	38.1	13%	0.125	20%	0.2	C	C	.	.			trans	-74.8	83.4	179.6	-160.7	120.5	0	0	0	112	M701 C707 K792 H794	M701-H747 HydrophobicContact CE-CB 3.66Å; M701-H747 HydrophobicContact CG-CB 4.11Å; C707-H747 PolarHBondContact SG-ND1 3.13Å; H747-K792 PolarHBondContact CE1-O 2.83Å; H747-K792 PolarHBondContact NE2-O 2.89Å; H747-H794 AromaticContact CG-ND1 3.86Å; H747-H794 AromaticContact ND1-ND1 3.75Å
748	H	89.8	Confident	92.1	Very high	35 Å²	35	32.1 Å²	32.1	16%	0.162	17%	0.173	C	C	.	.			trans	-93.9	155	163.6	-60.4	-93.6	0	0	0	109.9	P744 Q746 L754 M795	P744-H748 HydrophobicContact CG-CB 4.32Å; Q746-H748 PolarHBondContact O-CD2 2.97Å; Q746-H748 PolarHBondContact O-N 3.42Å; H748-L754 HydrophobicContact CB-CD2 3.58Å; H748-L754 VanDerWaalsContact CG-CD2 3.42Å; H748-M795 WeakPolarHBondContact O-CB 3.43Å; H748-M795 PolarHBondContact O-N 2.93Å
749	T	89.3	Confident	92.2	Very high	47 Å²	47	32.2 Å²	32.2	29%	0.288	17%	0.17	S	C	.	.			trans	-99.5	-27.7	-178.3	58.2	0	0	0	0	114.3	H786 K792 Q793	T749-H786 PolarHBondContact O-CD2 2.87Å; T749-K792 HydrophobicContact CG2-CB 3.82Å; T749-K792 HydrophobicContact CG2-CG 4.23Å; T749-Q793 WeakPolarHBondContact CA-O 3.49Å
750	C	90.8	Very high	92.2	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.054	19%	0.191	C	C	.	.			trans	-158.5	154.2	-173.8	56.5	0	0	0	0	113.3	T752 G753 L754 E784 H786 M795 Y849	C750-T752 VanDerWaalsContact C-N 3.31Å; C750-T752 PolarHBondContact O-N 2.87Å; C750-T752 PolarHBondContact SG-OG1 3.23Å; C750-G753 PolarHBondContact O-N 3.3Å; C750-G753 VanDerWaalsContact O-N 3.17Å; C750-G753 PolarHBondContact SG-N 3.5Å; C750-L754 PolarHBondContact O-N 2.89Å; C750-E784 VanDerWaalsContact CA-OE1 3.25Å; C750-E784 WeakPolarHBondContact CA-OE1 3.34Å; C750-H786 HydrophobicContact CB-CB 4.16Å; C750-M795 VanDerWaalsContact C-SD 3.56Å; C750-Y849 HydrophobicContact CB-CE1 4.05Å
751	A	92	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-57.9	-39.9	173.6	0	0	0	0	0	112.9	G753 L754 W759 E784 M795 Y849	A751-G753 PolarHBondContact O-N 3.14Å; A751-L754 WeakPolarHBondContact O-CB 3.46Å; A751-L754 PolarHBondContact O-N 3.31Å; A751-L754 VanDerWaalsContact O-N 3.09Å; A751-W759 HydrophobicContact CB-CE3 4.2Å; A751-W759 HydrophobicContact CB-CH2 4.29Å; A751-W759 HydrophobicContact CB-CZ3 3.66Å; A751-E784 WeakPolarHBondContact CB-OE2 3.37Å; A751-E784 PolarHBondContact N-OE1 3.3Å; A751-M795 HydrophobicContact CB-CE 3.56Å; A751-M795 HydrophobicContact CB-SD 4.49Å; A751-M795 PolarHBondContact N-SD 3.29Å; A751-Y849 WeakPolarHBondContact CB-OH 3.15Å; A751-Y849 PolarHBondContact N-OH 2.9Å
752	T	91	Very high	92.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-60.7	-32.1	179.8	59.4	0	0	0	0	111.8	C750 I839 V843 R845 Y849	C750-T752 VanDerWaalsContact C-N 3.31Å; C750-T752 PolarHBondContact O-N 2.87Å; C750-T752 PolarHBondContact SG-OG1 3.23Å; T752-I839 HydrophobicContact CG2-CG2 4.01Å; T752-V843 HydrophobicContact CG2-CB 4.18Å; T752-V843 HydrophobicContact CG2-CG1 4.43Å; T752-R845 PolarHBondContact O-NE 3.23Å; T752-R845 PolarHBondContact O-NH2 3.41Å; T752-Y849 HydrophobicContact CG2-CD1 4.43Å; T752-Y849 HydrophobicContact CG2-CE1 3.65Å; T752-Y849 PolarHBondContact N-OH 3.49Å
753	G	87.8	Confident	91.9	Very high	29 Å²	29	37.3 Å²	37.3	30%	0.299	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-88.7	3.6	176.9	0	0	0	0	0	116	C750 A751	C750-G753 PolarHBondContact O-N 3.3Å; C750-G753 VanDerWaalsContact O-N 3.17Å; C750-G753 PolarHBondContact SG-N 3.5Å; A751-G753 PolarHBondContact O-N 3.14Å
754	L	90.6	Very high	91.9	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	22%	0.222	C	C	.	.			trans	-75	156.7	176.2	-72.7	-177	0	0	0	113.5	H748 C750 A751 V758 W759 M762 M795 R845	H748-L754 HydrophobicContact CB-CD2 3.58Å; H748-L754 VanDerWaalsContact CG-CD2 3.42Å; C750-L754 PolarHBondContact O-N 2.89Å; A751-L754 WeakPolarHBondContact O-CB 3.46Å; A751-L754 PolarHBondContact O-N 3.31Å; A751-L754 VanDerWaalsContact O-N 3.09Å; L754-V758 HydrophobicContact CD1-CB 4.49Å; L754-V758 HydrophobicContact CD1-CG1 4.13Å; L754-V758 HydrophobicContact CD2-CB 4.28Å; L754-V758 HydrophobicContact CD2-CG1 3.9Å; L754-W759 HydrophobicContact CD1-CE3 4.12Å; L754-M762 HydrophobicContact CD1-SD 3.61Å; L754-M795 HydrophobicContact CD1-CE 3.94Å; L754-M795 HydrophobicContact CD1-SD 3.65Å; L754-M795 HydrophobicContact CD2-SD 4.08Å; L754-M795 HydrophobicContact CG-SD 3.88Å; L754-R845 PolarHBondContact O-NH2 3.22Å; L754-R845 VanDerWaalsContact O-NH2 3.14Å
755	D	91.6	Very high	91.9	Very high	98 Å²	98	41.4 Å²	41.4	52%	0.524	22%	0.222	S	C	.	.			trans	-78.4	153.4	163.1	-62.5	-38.7	0	0	0	111	D757 V758 W759	D755-D757 VanDerWaalsContact C-N 3.34Å; D755-D757 PolarHBondContact O-N 3.03Å; D755-V758 HydrophobicContact CB-CG2 4.33Å; D755-V758 PolarHBondContact O-N 3.46Å; D755-V758 VanDerWaalsContact O-N 3.14Å; D755-W759 PolarHBondContact O-N 2.92Å; D755-W759 VanDerWaalsContact O-N 3.11Å
756	E	90.9	Very high	92	Very high	122 Å²	122	40.6 Å²	40.6	57%	0.57	22%	0.217	S	C	*	.	H	α-helix	trans	-65.1	-34.8	-172.8	-51.9	-142.8	99.2	0	0	113.2	V758 W759 S760 R840	E756-V758 PolarHBondContact O-N 3.47Å; E756-W759 PolarHBondContact O-N 3.26Å; E756-S760 VanDerWaalsContact O-CB 3.3Å; E756-S760 WeakPolarHBondContact O-CB 3.39Å; E756-S760 PolarHBondContact O-N 3.07Å; E756-S760 PolarHBondContact O-OG 3.02Å; E756-R840 IonicContact OE1-CZ 3.28Å; E756-R840 IonicContact OE1-NH1 3.79Å; E756-R840 PolarHBondContact OE1-NH1 3.19Å; E756-R840 IonicContact OE1-NH2 3.18Å
757	D	93.5	Very high	92.2	Very high	103 Å²	103	40.6 Å²	40.6	55%	0.551	21%	0.211	S	C	*	.	H	α-helix	trans	-57.2	-47	172.6	-62.4	4.3	0	0	0	112	K724 D755 S760 E761	K724-D757 HydrophobicContact CD-CB 4.22Å; K724-D757 IonicContact NZ-OD2 2.7Å; K724-D757 PolarHBondContact NZ-OD2 3.36Å; D755-D757 VanDerWaalsContact C-N 3.34Å; D755-D757 PolarHBondContact O-N 3.03Å; D757-S760 PolarHBondContact O-N 2.99Å; D757-E761 PolarHBondContact O-N 2.92Å
758	V	93.7	Very high	92.4	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-68.4	-44.6	-176.1	-173.7	0	0	0	0	109.2	K724 V725 P744 L754 D755 E756 S760 E761 M762	K724-V758 HydrophobicContact CB-CG2 4.2Å; K724-V758 HydrophobicContact CD-CG2 3.65Å; V725-V758 HydrophobicContact CG2-CG1 3.84Å; P744-V758 HydrophobicContact CB-CG1 4.21Å; L754-V758 HydrophobicContact CD1-CB 4.49Å; L754-V758 HydrophobicContact CD1-CG1 4.13Å; L754-V758 HydrophobicContact CD2-CB 4.28Å; L754-V758 HydrophobicContact CD2-CG1 3.9Å; D755-V758 HydrophobicContact CB-CG2 4.33Å; D755-V758 PolarHBondContact O-N 3.46Å; D755-V758 VanDerWaalsContact O-N 3.14Å; E756-V758 PolarHBondContact O-N 3.47Å; V758-S760 VanDerWaalsContact C-N 3.34Å; V758-S760 PolarHBondContact O-N 3.33Å; V758-E761 PolarHBondContact O-N 3.22Å; V758-M762 WeakPolarHBondContact O-CG 3.42Å; V758-M762 PolarHBondContact O-N 3.46Å
759	W	93.3	Very high	92.7	Very high	14 Å²	14	38 Å²	38	5%	0.053	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-43.1	174.8	-176.1	-112.4	0	0	0	112.2	A751 L754 D755 E756 E761 M762 Q763 D838 I839	A751-W759 HydrophobicContact CB-CE3 4.2Å; A751-W759 HydrophobicContact CB-CH2 4.29Å; A751-W759 HydrophobicContact CB-CZ3 3.66Å; L754-W759 HydrophobicContact CD1-CE3 4.12Å; D755-W759 PolarHBondContact O-N 2.92Å; D755-W759 VanDerWaalsContact O-N 3.11Å; E756-W759 PolarHBondContact O-N 3.26Å; W759-E761 VanDerWaalsContact C-N 3.32Å; W759-E761 PolarHBondContact O-N 2.65Å; W759-M762 PolarHBondContact O-N 3.18Å; W759-Q763 HydrophobicContact CD2-CG 4.37Å; W759-Q763 HydrophobicContact CZ2-CG 4.5Å; W759-Q763 WeakPolarHBondContact O-CB 3.17Å; W759-Q763 VanDerWaalsContact O-CG 3.27Å; W759-Q763 WeakPolarHBondContact O-CG 3.34Å; W759-Q763 PolarHBondContact O-N 2.99Å; W759-D838 PolarHBondContact NE1-OD2 3.25Å; W759-I839 HydrophobicContact CH2-CD1 4.21Å
760	S	93.4	Very high	93	Very high	69 Å²	69	36.4 Å²	36.4	48%	0.483	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-40.5	178.6	-59.7	0	0	0	0	111.7	E756 D757 V758 Q763 L764	E756-S760 VanDerWaalsContact O-CB 3.3Å; E756-S760 WeakPolarHBondContact O-CB 3.39Å; E756-S760 PolarHBondContact O-N 3.07Å; E756-S760 PolarHBondContact O-OG 3.02Å; D757-S760 PolarHBondContact O-N 2.99Å; V758-S760 VanDerWaalsContact C-N 3.34Å; V758-S760 PolarHBondContact O-N 3.33Å; S760-Q763 PolarHBondContact O-N 3.16Å; S760-L764 WeakPolarHBondContact O-CG 3.47Å; S760-L764 PolarHBondContact O-N 3.49Å
761	E	94.4	Very high	93.2	Very high	24 Å²	24	43.5 Å²	43.5	11%	0.112	22%	0.217	C	C	.	.	H	α-helix	trans	-68.6	-41.1	174.9	-168	172.2	-114.9	0	0	112.4	S723 K724 V725 D757 V758 W759 Q763 L764 F765	S723-E761 WeakPolarHBondContact CB-OE1 3.4Å; S723-E761 PolarHBondContact N-OE1 3.35Å; S723-E761 PolarHBondContact N-OE2 3.46Å; S723-E761 VanDerWaalsContact OG-CD 3.32Å; S723-E761 PolarHBondContact OG-OE1 3.16Å; S723-E761 PolarHBondContact OG-OE2 2.93Å; K724-E761 WeakPolarHBondContact CA-OE2 3.26Å; K724-E761 PolarHBondContact N-OE2 2.92Å; V725-E761 HydrophobicContact CB-CG 4.09Å; V725-E761 WeakPolarHBondContact CB-OE2 3.44Å; V725-E761 HydrophobicContact CG2-CB 4.04Å; V725-E761 HydrophobicContact CG2-CG 4.15Å; V725-E761 WeakPolarHBondContact CG2-OE2 3.21Å; V725-E761 PolarHBondContact N-OE2 2.95Å; D757-E761 PolarHBondContact O-N 2.92Å; V758-E761 PolarHBondContact O-N 3.22Å; W759-E761 VanDerWaalsContact C-N 3.32Å; W759-E761 PolarHBondContact O-N 2.65Å; E761-Q763 PolarHBondContact O-N 3.05Å; E761-L764 WeakPolarHBondContact O-CB 3.32Å; E761-L764 PolarHBondContact O-N 2.87Å; E761-L764 VanDerWaalsContact O-N 3.08Å; E761-F765 HydrophobicContact CG-CD2 4.22Å; E761-F765 HydrophobicContact CG-CE2 4.02Å; E761-F765 WeakPolarHBondContact O-CD2 3.18Å; E761-F765 PolarHBondContact O-N 3.37Å
762	M	93.8	Very high	93.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.6	-37.1	171.9	-67.7	-172.6	72.5	0	0	112	V725 I742 L754 V758 W759 F765 R766 M795 L797	V725-M762 HydrophobicContact CB-CG 4.43Å; V725-M762 HydrophobicContact CG1-CG 3.9Å; V725-M762 HydrophobicContact CG2-CG 3.58Å; I742-M762 HydrophobicContact CB-CE 4.29Å; I742-M762 HydrophobicContact CG2-CB 4.37Å; I742-M762 HydrophobicContact CG2-CE 3.87Å; I742-M762 HydrophobicContact CG2-CG 4.11Å; L754-M762 HydrophobicContact CD1-SD 3.61Å; V758-M762 WeakPolarHBondContact O-CG 3.42Å; V758-M762 PolarHBondContact O-N 3.46Å; W759-M762 PolarHBondContact O-N 3.18Å; M762-F765 PolarHBondContact O-N 2.81Å; M762-R766 WeakPolarHBondContact O-CB 3.36Å; M762-R766 PolarHBondContact O-N 2.84Å; M762-M795 HydrophobicContact CE-CE 3.69Å; M762-M795 HydrophobicContact SD-CE 3.86Å; M762-M795 HydrophobicContact SD-SD 4.33Å; M762-L797 HydrophobicContact CE-CB 3.55Å; M762-L797 HydrophobicContact CE-CD2 3.81Å; M762-L797 HydrophobicContact CE-CG 4.34Å
763	Q	92.9	Very high	93.5	Very high	33 Å²	33	43.5 Å²	43.5	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-71.4	-28.4	175.9	-69.3	-67.7	-21.6	0	0	113	W759 S760 E761 R767	W759-Q763 HydrophobicContact CD2-CG 4.37Å; W759-Q763 HydrophobicContact CZ2-CG 4.5Å; W759-Q763 WeakPolarHBondContact O-CB 3.17Å; W759-Q763 VanDerWaalsContact O-CG 3.27Å; W759-Q763 WeakPolarHBondContact O-CG 3.34Å; W759-Q763 PolarHBondContact O-N 2.99Å; S760-Q763 PolarHBondContact O-N 3.16Å; E761-Q763 PolarHBondContact O-N 3.05Å; Q763-R767 WeakPolarHBondContact O-CB 3.29Å; Q763-R767 WeakPolarHBondContact O-CD 3.44Å; Q763-R767 WeakPolarHBondContact O-CG 3.46Å; Q763-R767 PolarHBondContact O-N 3.41Å
764	L	94.1	Very high	93.8	Very high	86 Å²	86	48.4 Å²	48.4	45%	0.45	23%	0.231	S	C	.	.	H	α-helix	trans	-67.2	-47.2	169.3	-69.6	173.4	0	0	0	111.2	S760 E761 R766 R767 A768	S760-L764 WeakPolarHBondContact O-CG 3.47Å; S760-L764 PolarHBondContact O-N 3.49Å; E761-L764 WeakPolarHBondContact O-CB 3.32Å; E761-L764 PolarHBondContact O-N 2.87Å; E761-L764 VanDerWaalsContact O-N 3.08Å; L764-R766 PolarHBondContact O-N 3.03Å; L764-R767 PolarHBondContact O-N 3.03Å; L764-A768 PolarHBondContact O-N 2.8Å
765	F	94.5	Very high	94	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-45.9	174.3	-81.6	-74.8	0	0	0	111.9	A720 V725 L727 I742 E761 M762 R767 A768 L769 W912 T918	A720-F765 HydrophobicContact CB-CE1 4.3Å; V725-F765 HydrophobicContact CB-CD2 4.16Å; V725-F765 HydrophobicContact CB-CE2 3.92Å; V725-F765 HydrophobicContact CG1-CD2 3.69Å; V725-F765 HydrophobicContact CG1-CE2 3.81Å; L727-F765 HydrophobicContact CB-CD1 4.22Å; L727-F765 HydrophobicContact CB-CE1 4.04Å; I742-F765 HydrophobicContact CD1-CB 4.05Å; I742-F765 HydrophobicContact CG1-CB 4.43Å; I742-F765 HydrophobicContact CG2-CB 4.23Å; E761-F765 HydrophobicContact CG-CD2 4.22Å; E761-F765 HydrophobicContact CG-CE2 4.02Å; E761-F765 WeakPolarHBondContact O-CD2 3.18Å; E761-F765 PolarHBondContact O-N 3.37Å; M762-F765 PolarHBondContact O-N 2.81Å; F765-R767 PolarHBondContact O-N 3.36Å; F765-A768 PolarHBondContact O-N 3.27Å; F765-L769 WeakPolarHBondContact O-CG 3.33Å; F765-L769 PolarHBondContact O-N 2.58Å; F765-W912 HydrophobicContact CD1-CH2 4.03Å; F765-W912 AromaticContact CD1-CZ2 3.85Å; F765-W912 HydrophobicContact CD1-CZ2 3.85Å; F765-W912 AromaticContact CE1-CZ2 4Å; F765-W912 HydrophobicContact CE1-CZ2 4Å; F765-T918 HydrophobicContact CE1-CG2 3.76Å; F765-T918 HydrophobicContact CZ-CG2 3.47Å; F765-T918 VanDerWaalsContact CZ-CG2 3.47Å
766	R	94.4	Very high	94	Very high	11 Å²	11	50 Å²	50	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-55.3	-48.7	173.8	174.2	171.2	174.4	-171.6	-2.9	112.1	M762 L764 A768 L769 V770 F782 D853 G855 Q857	M762-R766 WeakPolarHBondContact O-CB 3.36Å; M762-R766 PolarHBondContact O-N 2.84Å; L764-R766 PolarHBondContact O-N 3.03Å; R766-A768 VanDerWaalsContact C-N 3.34Å; R766-A768 PolarHBondContact O-N 2.74Å; R766-L769 PolarHBondContact O-N 2.71Å; R766-V770 WeakPolarHBondContact O-CG2 3.42Å; R766-V770 PolarHBondContact O-N 2.73Å; R766-F782 HydrophobicContact CB-CE1 4.18Å; R766-F782 HydrophobicContact CB-CZ 4.3Å; R766-F782 HydrophobicContact CG-CD1 4.26Å; R766-F782 HydrophobicContact CG-CD2 4.13Å; R766-F782 HydrophobicContact CG-CE1 3.91Å; R766-F782 HydrophobicContact CG-CE2 3.78Å; R766-F782 HydrophobicContact CG-CG 4.37Å; R766-F782 HydrophobicContact CG-CZ 3.69Å; R766-D853 IonicContact CZ-OD2 2.62Å; R766-D853 VanDerWaalsContact NH1-CG 3.26Å; R766-D853 IonicContact NH1-OD1 3.42Å; R766-D853 IonicContact NH1-OD2 3.41Å; R766-D853 PolarHBondContact NH1-OD2 3.03Å; R766-D853 IonicContact NH2-OD1 3.78Å; R766-D853 IonicContact NH2-OD2 3.44Å; R766-G855 VanDerWaalsContact CZ-O 3.28Å; R766-G855 PolarHBondContact NE-O 2.97Å; R766-G855 PolarHBondContact NH2-O 3.45Å; R766-Q857 PolarHBondContact NH2-O 3.47Å
767	R	94.7	Very high	94.1	Very high	137 Å²	137	51.7 Å²	51.7	52%	0.517	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-36.3	-179.8	-73.5	165.3	-177	-165.4	-0	113.3	Q763 L764 F765 R771 L856	Q763-R767 WeakPolarHBondContact O-CB 3.29Å; Q763-R767 WeakPolarHBondContact O-CD 3.44Å; Q763-R767 WeakPolarHBondContact O-CG 3.46Å; Q763-R767 PolarHBondContact O-N 3.41Å; L764-R767 PolarHBondContact O-N 3.03Å; F765-R767 PolarHBondContact O-N 3.36Å; R767-R771 WeakPolarHBondContact O-CG 3.46Å; R767-R771 PolarHBondContact O-N 2.87Å; R767-L856 HydrophobicContact CB-CD2 4.34Å; R767-L856 HydrophobicContact CG-CD2 3.69Å
768	A	94.8	Very high	94.1	Very high	9 Å²	9	49.2 Å²	49.2	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-70.5	-42.5	175.6	0	0	0	0	0	112	L764 F765 R766 R771 M772 W912 Y915 C917	L764-A768 PolarHBondContact O-N 2.8Å; F765-A768 PolarHBondContact O-N 3.27Å; R766-A768 VanDerWaalsContact C-N 3.34Å; R766-A768 PolarHBondContact O-N 2.74Å; A768-R771 PolarHBondContact O-N 3.45Å; A768-M772 PolarHBondContact O-N 3.37Å; A768-W912 HydrophobicContact CB-CH2 3.52Å; A768-W912 HydrophobicContact CB-CZ2 4.46Å; A768-W912 HydrophobicContact CB-CZ3 3.92Å; A768-Y915 WeakPolarHBondContact CB-O 3.25Å; A768-C917 HydrophobicContact CB-CB 4.29Å
769	L	95.3	Very high	94.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-46.5	176.1	-73.4	166	0	0	0	112.2	L727 I742 F765 R766 R771 M772 F773 F782 C799 F908 W912	L727-L769 HydrophobicContact CD1-CD1 4.04Å; L727-L769 HydrophobicContact CD2-CD2 4.26Å; I742-L769 HydrophobicContact CD1-CD1 3.85Å; I742-L769 HydrophobicContact CG1-CD1 4.08Å; F765-L769 WeakPolarHBondContact O-CG 3.33Å; F765-L769 PolarHBondContact O-N 2.58Å; R766-L769 PolarHBondContact O-N 2.71Å; L769-R771 VanDerWaalsContact C-N 3.33Å; L769-R771 PolarHBondContact O-N 2.92Å; L769-M772 HydrophobicContact CD2-CE 4.03Å; L769-M772 WeakPolarHBondContact O-CB 3.39Å; L769-M772 PolarHBondContact O-N 3.11Å; L769-M772 VanDerWaalsContact O-N 3.13Å; L769-F773 HydrophobicContact CB-CD2 4.39Å; L769-F773 HydrophobicContact CB-CE2 4.38Å; L769-F773 HydrophobicContact CD2-CE2 4.04Å; L769-F773 WeakPolarHBondContact O-CD2 3.38Å; L769-F773 PolarHBondContact O-N 3.5Å; L769-F782 HydrophobicContact CB-CZ 4.26Å; L769-F782 HydrophobicContact CD1-CE1 4.21Å; L769-C799 HydrophobicContact CD1-CB 4.35Å; L769-F908 HydrophobicContact CD2-CZ 3.92Å; L769-W912 HydrophobicContact CD2-CE3 3.92Å; L769-W912 HydrophobicContact CD2-CH2 4.35Å; L769-W912 HydrophobicContact CD2-CZ3 3.5Å; L769-W912 HydrophobicContact CG-CH2 4.19Å; L769-W912 HydrophobicContact CG-CZ3 3.68Å
770	V	95.2	Very high	94.2	Very high	12 Å²	12	50.1 Å²	50.1	7%	0.073	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-45.6	178.6	177.9	0	0	0	0	111	R766 M772 F773 E774 C780 F782 L856	R766-V770 WeakPolarHBondContact O-CG2 3.42Å; R766-V770 PolarHBondContact O-N 2.73Å; V770-M772 VanDerWaalsContact C-N 3.3Å; V770-M772 PolarHBondContact O-N 2.86Å; V770-F773 PolarHBondContact O-N 3.47Å; V770-E774 WeakPolarHBondContact O-CB 3.22Å; V770-E774 PolarHBondContact O-N 3.47Å; V770-C780 HydrophobicContact CG2-CB 4.26Å; V770-F782 HydrophobicContact CG2-CE2 3.55Å; V770-F782 HydrophobicContact CG2-CZ 3.86Å; V770-L856 HydrophobicContact CB-CD2 4.31Å; V770-L856 HydrophobicContact CB-CG 4.26Å; V770-L856 HydrophobicContact CG1-CG 4.05Å; V770-L856 HydrophobicContact CG2-CD2 4.18Å; V770-L856 HydrophobicContact CG2-CG 4.33Å
771	R	94.6	Very high	94.3	Very high	158 Å²	158	46.8 Å²	46.8	60%	0.596	22%	0.22	S	C	*	.	H	α-helix	trans	-61.9	-35.8	177.1	-71.5	171.7	175.5	-177.9	-3.1	113.3	R767 A768 L769 S775 Y915	R767-R771 WeakPolarHBondContact O-CG 3.46Å; R767-R771 PolarHBondContact O-N 2.87Å; A768-R771 PolarHBondContact O-N 3.45Å; L769-R771 VanDerWaalsContact C-N 3.33Å; L769-R771 PolarHBondContact O-N 2.92Å; R771-S775 PolarHBondContact O-N 2.92Å; R771-Y915 HydrophobicContact CB-CD1 4.18Å; R771-Y915 HydrophobicContact CB-CE1 4.22Å
772	M	94.6	Very high	94.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-50.2	175.6	-177.4	-173.7	76.1	0	0	111	A768 L769 V770 S775 F908 W911 W912 Y915	A768-M772 PolarHBondContact O-N 3.37Å; L769-M772 HydrophobicContact CD2-CE 4.03Å; L769-M772 WeakPolarHBondContact O-CB 3.39Å; L769-M772 PolarHBondContact O-N 3.11Å; L769-M772 VanDerWaalsContact O-N 3.13Å; V770-M772 VanDerWaalsContact C-N 3.3Å; V770-M772 PolarHBondContact O-N 2.86Å; M772-S775 PolarHBondContact O-N 3.43Å; M772-S775 PolarHBondContact O-OG 2.97Å; M772-F908 HydrophobicContact CE-CE2 3.92Å; M772-F908 HydrophobicContact CE-CZ 3.93Å; M772-W911 HydrophobicContact SD-CB 3.92Å; M772-W912 HydrophobicContact SD-CB 4.45Å; M772-W912 HydrophobicContact SD-CE3 3.97Å; M772-Y915 HydrophobicContact CB-CD1 4.45Å; M772-Y915 HydrophobicContact CB-CD2 3.57Å; M772-Y915 HydrophobicContact CB-CE2 3.99Å; M772-Y915 HydrophobicContact CB-CG 3.82Å; M772-Y915 HydrophobicContact CG-CD2 3.58Å; M772-Y915 HydrophobicContact CG-CE2 3.93Å; M772-Y915 HydrophobicContact CG-CG 4.3Å
773	F	95.3	Very high	94.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73	-34.7	-178.3	-70.7	-60.3	0	0	0	113.2	G738 L769 V770 S775 Q776 E777 L778 C780 P801 F908	G738-F773 WeakPolarHBondContact O-CZ 2.95Å; L769-F773 HydrophobicContact CB-CD2 4.39Å; L769-F773 HydrophobicContact CB-CE2 4.38Å; L769-F773 HydrophobicContact CD2-CE2 4.04Å; L769-F773 WeakPolarHBondContact O-CD2 3.38Å; L769-F773 PolarHBondContact O-N 3.5Å; V770-F773 PolarHBondContact O-N 3.47Å; F773-S775 PolarHBondContact O-N 3.43Å; F773-Q776 CarbonylContact O-C 3.58Å; F773-Q776 WeakPolarHBondContact O-CA 3.46Å; F773-Q776 WeakPolarHBondContact O-CB 3.44Å; F773-Q776 PolarHBondContact O-N 3.1Å; F773-E777 PolarHBondContact O-N 3.1Å; F773-L778 CarbonylContact C-O 3.54Å; F773-L778 HydrophobicContact CB-CB 4.08Å; F773-L778 HydrophobicContact CD1-CB 4.37Å; F773-L778 HydrophobicContact CD1-CD1 4.08Å; F773-L778 PolarHBondContact O-N 2.87Å; F773-L778 VanDerWaalsContact O-O 3.07Å; F773-C780 VanDerWaalsContact CB-SG 3.52Å; F773-C780 WeakPolarHBondContact CD2-SG 3.5Å; F773-P801 HydrophobicContact CD1-CB 3.71Å; F773-P801 HydrophobicContact CD1-CG 4.29Å; F773-P801 HydrophobicContact CD2-CB 4.29Å; F773-P801 HydrophobicContact CE1-CB 3.62Å; F773-P801 HydrophobicContact CE1-CG 3.69Å; F773-P801 HydrophobicContact CE2-CB 4.2Å; F773-P801 HydrophobicContact CE2-CG 4.38Å; F773-P801 HydrophobicContact CG-CB 4.04Å; F773-P801 HydrophobicContact CZ-CB 3.87Å; F773-P801 HydrophobicContact CZ-CG 3.72Å; F773-F908 HydrophobicContact CZ-CE2 4.09Å
774	E	94.3	Very high	94.5	Very high	132 Å²	132	44.5 Å²	44.5	62%	0.617	21%	0.21	S	C	*	.	H	α-helix	trans	-56.5	-39.7	170.8	179.6	176.4	-145.2	0	0	111.1	V770 Q776 E777 L778	V770-E774 WeakPolarHBondContact O-CB 3.22Å; V770-E774 PolarHBondContact O-N 3.47Å; E774-Q776 PolarHBondContact O-N 3.15Å; E774-E777 PolarHBondContact O-N 2.82Å; E774-L778 PolarHBondContact N-O 2.99Å
775	S	93.9	Very high	94.5	Very high	70 Å²	70	42.4 Å²	42.4	49%	0.49	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-7.1	173.6	79.5	0	0	0	0	115.1	R771 M772 F773 Y915	R771-S775 PolarHBondContact O-N 2.92Å; M772-S775 PolarHBondContact O-N 3.43Å; M772-S775 PolarHBondContact O-OG 2.97Å; F773-S775 PolarHBondContact O-N 3.43Å; S775-Y915 WeakPolarHBondContact CB-OH 3.49Å; S775-Y915 PolarHBondContact OG-OH 3.27Å
776	Q	92.6	Very high	94.4	Very high	64 Å²	64	42.8 Å²	42.8	30%	0.299	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	9.4	175.5	-62.9	178.5	-16.3	0	0	112.2	F773 E774 L778	F773-Q776 CarbonylContact O-C 3.58Å; F773-Q776 WeakPolarHBondContact O-CA 3.46Å; F773-Q776 WeakPolarHBondContact O-CB 3.44Å; F773-Q776 PolarHBondContact O-N 3.1Å; E774-Q776 PolarHBondContact O-N 3.15Å; Q776-L778 HydrophobicContact CB-CD1 4.3Å; Q776-L778 HydrophobicContact CB-CG 4.29Å; Q776-L778 PolarHBondContact O-N 3.47Å
777	E	92.8	Very high	94.2	Very high	158 Å²	158	42.8 Å²	42.8	74%	0.738	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	25.2	-174.1	-52.2	-170.7	149.2	0	0	114.2	F773 E774 R804	F773-E777 PolarHBondContact O-N 3.1Å; E774-E777 PolarHBondContact O-N 2.82Å; E777-R804 WeakPolarHBondContact O-CB 3.47Å
778	L	94.3	Very high	93.6	Very high	51 Å²	51	38 Å²	38	27%	0.267	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.5	176.2	-60	177.1	0	0	0	111	F773 E774 Q776 P801 L802	F773-L778 CarbonylContact C-O 3.54Å; F773-L778 HydrophobicContact CB-CB 4.08Å; F773-L778 HydrophobicContact CD1-CB 4.37Å; F773-L778 HydrophobicContact CD1-CD1 4.08Å; F773-L778 PolarHBondContact O-N 2.87Å; F773-L778 VanDerWaalsContact O-O 3.07Å; E774-L778 PolarHBondContact N-O 2.99Å; Q776-L778 HydrophobicContact CB-CD1 4.3Å; Q776-L778 HydrophobicContact CB-CG 4.29Å; Q776-L778 PolarHBondContact O-N 3.47Å; L778-P801 HydrophobicContact CD1-CB 4.4Å; L778-L802 CarbonylContact C-O 3.54Å; L778-L802 VanDerWaalsContact CA-O 3.29Å; L778-L802 WeakPolarHBondContact CA-O 3.34Å; L778-L802 WeakPolarHBondContact CB-O 3.28Å
779	D	94.3	Very high	93	Very high	36 Å²	36	40.9 Å²	40.9	19%	0.193	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	167.3	168.4	-175.7	33	0	0	0	110.6	P801 L802 G807	D779-P801 CarbonylContact O-C 3.41Å; D779-P801 VanDerWaalsContact O-CA 3.26Å; D779-P801 WeakPolarHBondContact O-CA 3.48Å; D779-L802 PolarHBondContact N-O 2.86Å; D779-L802 PolarHBondContact O-N 2.99Å; D779-G807 VanDerWaalsContact OD2-CA 3.27Å; D779-G807 WeakPolarHBondContact OD2-CA 3.32Å
780	C	93.7	Very high	92.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.4	-172.2	-60.1	0	0	0	0	112.5	V770 F773 F782 G855	V770-C780 HydrophobicContact CG2-CB 4.26Å; F773-C780 VanDerWaalsContact CB-SG 3.52Å; F773-C780 WeakPolarHBondContact CD2-SG 3.5Å; C780-F782 HydrophobicContact CB-CD2 4.13Å; C780-F782 HydrophobicContact CB-CE2 3.42Å; C780-F782 VanDerWaalsContact CB-CE2 3.42Å; C780-F782 HydrophobicContact CB-CZ 3.92Å; C780-G855 PolarHBondContact O-N 3.37Å
781	V	95.7	Very high	91.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.5	164.1	179.4	0	0	0	0	109.2	I800 L802 A810 F814 V852 F854 V879	V781-I800 PolarHBondContact N-O 3.46Å; V781-I800 PolarHBondContact O-N 2.9Å; V781-L802 HydrophobicContact CG2-CD1 3.55Å; V781-L802 HydrophobicContact CG2-CG 4.24Å; V781-A810 HydrophobicContact CG2-CB 4.14Å; V781-F814 HydrophobicContact CG1-CE2 3.96Å; V781-F814 HydrophobicContact CG1-CZ 4.18Å; V781-V852 HydrophobicContact CG1-CG2 3.58Å; V781-F854 HydrophobicContact CG2-CD1 4.29Å; V781-F854 HydrophobicContact CG2-CE1 4.49Å; V781-V879 HydrophobicContact CG1-CG2 4.5Å
782	F	96.2	Very high	91.4	Very high	1 Å²	1	53.8 Å²	53.8	0%	0.004	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.6	169.2	-63.9	-88.9	0	0	0	109.3	I742 R766 L769 V770 C780 L797 E798 C799 V852 D853	I742-F782 HydrophobicContact CD1-CD1 4.46Å; I742-F782 HydrophobicContact CD1-CE1 4.19Å; R766-F782 HydrophobicContact CB-CE1 4.18Å; R766-F782 HydrophobicContact CB-CZ 4.3Å; R766-F782 HydrophobicContact CG-CD1 4.26Å; R766-F782 HydrophobicContact CG-CD2 4.13Å; R766-F782 HydrophobicContact CG-CE1 3.91Å; R766-F782 HydrophobicContact CG-CE2 3.78Å; R766-F782 HydrophobicContact CG-CG 4.37Å; R766-F782 HydrophobicContact CG-CZ 3.69Å; L769-F782 HydrophobicContact CB-CZ 4.26Å; L769-F782 HydrophobicContact CD1-CE1 4.21Å; V770-F782 HydrophobicContact CG2-CE2 3.55Å; V770-F782 HydrophobicContact CG2-CZ 3.86Å; C780-F782 HydrophobicContact CB-CD2 4.13Å; C780-F782 HydrophobicContact CB-CE2 3.42Å; C780-F782 VanDerWaalsContact CB-CE2 3.42Å; C780-F782 HydrophobicContact CB-CZ 3.92Å; F782-L797 HydrophobicContact CB-CD1 4.22Å; F782-E798 CarbonylContact C-O 3.41Å; F782-E798 VanDerWaalsContact CA-O 3.26Å; F782-E798 WeakPolarHBondContact CA-O 3.35Å; F782-C799 HydrophobicContact CD1-CB 3.8Å; F782-C799 HydrophobicContact CE1-CB 3.58Å; F782-C799 WeakPolarHBondContact CE1-SG 3.47Å; F782-C799 HydrophobicContact CZ-CB 4.42Å; F782-V852 CarbonylContact O-C 3.58Å; F782-V852 WeakPolarHBondContact O-CA 3.47Å; F782-D853 HydrophobicContact CB-CB 4.02Å; F782-D853 PolarHBondContact N-O 2.98Å; F782-D853 PolarHBondContact O-N 2.97Å
783	M	95.6	Very high	91.1	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	141.5	179	51.1	171.5	-85.3	0	0	114.2	E798 I800 F850 A851 K876	M783-E798 HydrophobicContact CG-CB 4.21Å; M783-E798 PolarHBondContact N-O 2.63Å; M783-E798 PolarHBondContact O-N 3.32Å; M783-I800 HydrophobicContact CG-CD1 4.48Å; M783-I800 HydrophobicContact SD-CD1 3.92Å; M783-F850 HydrophobicContact CB-CE2 4.15Å; M783-F850 HydrophobicContact CB-CZ 4.29Å; M783-F850 HydrophobicContact CE-CE2 4.12Å; M783-A851 CarbonylContact C-O 3.53Å; M783-A851 VanDerWaalsContact CA-O 3.27Å; M783-A851 WeakPolarHBondContact CA-O 3.49Å; M783-K876 HydrophobicContact CE-CG 4.08Å
784	E	94.4	Very high	90.9	Very high	5 Å²	5	59.7 Å²	59.7	2%	0.023	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135	173.6	-177.2	-176	-161	0	0	108.9	C750 A751 M795 L797 Y849 F850 A851	C750-E784 VanDerWaalsContact CA-OE1 3.25Å; C750-E784 WeakPolarHBondContact CA-OE1 3.34Å; A751-E784 WeakPolarHBondContact CB-OE2 3.37Å; A751-E784 PolarHBondContact N-OE1 3.3Å; E784-M795 WeakPolarHBondContact OE1-CG 3.39Å; E784-L797 HydrophobicContact CB-CD1 4.35Å; E784-Y849 HydrophobicContact CG-CE2 4.38Å; E784-Y849 PolarHBondContact OE1-OH 2.91Å; E784-Y849 WeakPolarHBondContact OE2-CE2 3.39Å; E784-Y849 VanDerWaalsContact OE2-CZ 3.3Å; E784-Y849 PolarHBondContact OE2-OH 3.39Å; E784-F850 WeakPolarHBondContact O-CD2 3.29Å; E784-A851 PolarHBondContact N-O 2.7Å; E784-A851 PolarHBondContact O-N 2.85Å
785	T	93.8	Very high	90.9	Very high	42 Å²	42	53.6 Å²	53.6	26%	0.258	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	96.7	173.3	-54.2	0	0	0	0	109.5	M787 F850 F870	T785-M787 HydrophobicContact CG2-CE 4Å; T785-F850 WeakPolarHBondContact OG1-CD2 3.33Å; T785-F870 HydrophobicContact CG2-CE1 4.44Å
786	H	92.3	Very high	90.9	Very high	11 Å²	11	51.5 Å²	51.5	5%	0.051	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	107.5	178.2	177.7	-124.8	0	0	0	110.7	T749 C750 L789 L847 P848 Y849	T749-H786 PolarHBondContact O-CD2 2.87Å; C750-H786 HydrophobicContact CB-CB 4.16Å; H786-L789 VanDerWaalsContact CE1-CD2 3.42Å; H786-L789 WeakPolarHBondContact CE1-CD2 3.34Å; H786-L847 PolarHBondContact ND1-O 2.85Å; H786-P848 CarbonylContact O-C 3.44Å; H786-P848 VanDerWaalsContact O-CA 3.26Å; H786-P848 WeakPolarHBondContact O-CA 3.33Å; H786-P848 WeakPolarHBondContact O-CB 3.37Å; H786-Y849 HydrophobicContact CB-CD1 4.13Å; H786-Y849 HydrophobicContact CB-CE1 3.93Å; H786-Y849 HydrophobicContact CB-CE2 4.44Å; H786-Y849 HydrophobicContact CB-CG 4.47Å; H786-Y849 PolarHBondContact N-O 3Å; H786-Y849 AromaticContact ND1-CD1 3.93Å; H786-Y849 AromaticContact ND1-CE1 3.81Å; H786-Y849 PolarHBondContact O-N 3.5Å
787	M	89.4	Confident	91	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.049	22%	0.222	C	C	.	.			trans	-142.4	173.2	176.1	-75	-159.2	-71.4	0	0	111.4	T785 P848 I864 E867 F870 H872	T785-M787 HydrophobicContact CG2-CE 4Å; M787-P848 HydrophobicContact CG-CB 4.35Å; M787-I864 HydrophobicContact CG-CD1 3.66Å; M787-I864 HydrophobicContact SD-CD1 3.86Å; M787-I864 HydrophobicContact SD-CG2 4.13Å; M787-E867 HydrophobicContact SD-CB 4.41Å; M787-E867 HydrophobicContact SD-CG 4.34Å; M787-F870 HydrophobicContact CE-CD1 3.8Å; M787-F870 HydrophobicContact CE-CE1 4.41Å; M787-F870 HydrophobicContact SD-CB 4.42Å; M787-F870 HydrophobicContact SD-CD1 3.87Å; M787-H872 VanDerWaalsContact CE-CA 3.43Å; M787-H872 HydrophobicContact CE-CB 3.71Å
788	N	82.9	Confident	91.1	Very high	38 Å²	38	42.8 Å²	42.8	20%	0.203	19%	0.193	C	C	.	.			trans	58.4	55.7	178.2	-76	-118	0	0	0	111.7	R790 R791 K792 E867	N788-R790 PolarHBondContact O-N 3.42Å; N788-R791 HydrophobicContact CB-CB 4.06Å; N788-R791 HydrophobicContact CB-CG 4.01Å; N788-R791 WeakPolarHBondContact O-CA 3.22Å; N788-R791 WeakPolarHBondContact O-CB 3.42Å; N788-R791 PolarHBondContact O-N 2.96Å; N788-R791 WeakPolarHBondContact OD1-CD 3.33Å; N788-R791 PolarHBondContact OD1-NE 3.41Å; N788-K792 PolarHBondContact O-N 2.67Å; N788-E867 WeakPolarHBondContact CA-OE1 3.32Å; N788-E867 PolarHBondContact N-OE1 3.39Å
789	L	82.3	Confident	91.2	Very high	69 Å²	69	40.4 Å²	40.4	36%	0.361	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-38.4	177.5	-68.7	164	0	0	0	113.5	H786 R791 K792 G846 P848	H786-L789 VanDerWaalsContact CE1-CD2 3.42Å; H786-L789 WeakPolarHBondContact CE1-CD2 3.34Å; L789-R791 PolarHBondContact O-N 3.31Å; L789-K792 VanDerWaalsContact O-CG 3.3Å; L789-K792 WeakPolarHBondContact O-CG 3.31Å; L789-K792 PolarHBondContact O-N 3.34Å; L789-G846 VanDerWaalsContact CD1-O 3.29Å; L789-G846 WeakPolarHBondContact CD1-O 3.41Å; L789-P848 HydrophobicContact CD1-CG 4.04Å; L789-P848 HydrophobicContact CG-CG 4.37Å
790	R	81.6	Confident	91.3	Very high	221 Å²	221	38.7 Å²	38.7	83%	0.834	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.5	179.3	-64.3	-178	178.6	-174.3	1	114.6	N788	N788-R790 PolarHBondContact O-N 3.42Å
791	R	83.6	Confident	91.4	Very high	169 Å²	169	38.7 Å²	38.7	64%	0.638	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-23	176.3	-64.5	-174.5	178.2	178.8	-0.2	112.3	S700 N788 L789 Q793	S700-R791 PolarHBondContact OG-O 3.3Å; N788-R791 HydrophobicContact CB-CB 4.06Å; N788-R791 HydrophobicContact CB-CG 4.01Å; N788-R791 WeakPolarHBondContact O-CA 3.22Å; N788-R791 WeakPolarHBondContact O-CB 3.42Å; N788-R791 PolarHBondContact O-N 2.96Å; N788-R791 WeakPolarHBondContact OD1-CD 3.33Å; N788-R791 PolarHBondContact OD1-NE 3.41Å; L789-R791 PolarHBondContact O-N 3.31Å; R791-Q793 HydrophobicContact CB-CG 4.26Å
792	K	85.6	Confident	91.3	Very high	50 Å²	50	38.7 Å²	38.7	22%	0.217	17%	0.171	C	C	.	.			trans	47.5	62.7	-175.9	-62.3	-172	175.6	-174.4	0	110.8	T580 L697 S700 H747 T749 N788 L789	T580-K792 PolarHBondContact OG1-NZ 2.89Å; L697-K792 HydrophobicContact CD1-CD 4.23Å; S700-K792 PolarHBondContact OG-O 2.92Å; H747-K792 PolarHBondContact CE1-O 2.83Å; H747-K792 PolarHBondContact NE2-O 2.89Å; T749-K792 HydrophobicContact CG2-CB 3.82Å; T749-K792 HydrophobicContact CG2-CG 4.23Å; N788-K792 PolarHBondContact O-N 2.67Å; L789-K792 VanDerWaalsContact O-CG 3.3Å; L789-K792 WeakPolarHBondContact O-CG 3.31Å; L789-K792 PolarHBondContact O-N 3.34Å
793	Q	88.3	Confident	91.2	Very high	108 Å²	108	41.2 Å²	41.2	51%	0.505	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-64.2	158.4	174	-62.6	-174.8	-91.3	0	0	110	T749 R791	T749-Q793 WeakPolarHBondContact CA-O 3.49Å; R791-Q793 HydrophobicContact CB-CG 4.26Å
794	H	92.3	Very high	91.1	Very high	17 Å²	17	49 Å²	49	8%	0.079	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-79.8	136.1	178.2	-163.8	116.4	0	0	0	109.3	C704 H706 C707 P744 Q746 H747 V796	C704-H794 WeakPolarHBondContact SG-CB 3.25Å; C704-H794 PolarHBondContact SG-ND1 2.58Å; C704-H794 VanDerWaalsContact SG-ND1 3.42Å; H706-H794 HydrophobicContact CB-CB 4.12Å; H706-H794 PolarHBondContact O-CE1 3.49Å; C707-H794 PolarHBondContact SG-ND1 3.33Å; C707-H794 VanDerWaalsContact SG-ND1 3.35Å; P744-H794 PolarHBondContact O-CE1 3.38Å; P744-H794 PolarHBondContact O-NE2 2.7Å; Q746-H794 PolarHBondContact O-CE1 3.09Å; H747-H794 AromaticContact CG-ND1 3.86Å; H747-H794 AromaticContact ND1-ND1 3.75Å; H794-V796 PolarHBondContact O-N 3.39Å
795	M	92.8	Very high	91	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.015	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-63.7	126.8	-179.7	-177.6	-168.4	171.2	0	0	111.1	P744 H748 C750 A751 L754 M762 E784	P744-M795 WeakPolarHBondContact CD-O 3.36Å; P744-M795 HydrophobicContact CG-CB 4.3Å; H748-M795 WeakPolarHBondContact O-CB 3.43Å; H748-M795 PolarHBondContact O-N 2.93Å; C750-M795 VanDerWaalsContact C-SD 3.56Å; A751-M795 HydrophobicContact CB-CE 3.56Å; A751-M795 HydrophobicContact CB-SD 4.49Å; A751-M795 PolarHBondContact N-SD 3.29Å; L754-M795 HydrophobicContact CD1-CE 3.94Å; L754-M795 HydrophobicContact CD1-SD 3.65Å; L754-M795 HydrophobicContact CD2-SD 4.08Å; L754-M795 HydrophobicContact CG-SD 3.88Å; M762-M795 HydrophobicContact CE-CE 3.69Å; M762-M795 HydrophobicContact SD-CE 3.86Å; M762-M795 HydrophobicContact SD-SD 4.33Å; E784-M795 WeakPolarHBondContact OE1-CG 3.39Å
796	V	94.4	Very high	90.9	Very high	26 Å²	26	56.6 Å²	56.6	16%	0.158	25%	0.251	C	S	.	.			trans	-128.3	124.3	172.9	-176	0	0	0	0	108.3	L741 H794 E798	L741-V796 HydrophobicContact CB-CG1 4.05Å; L741-V796 HydrophobicContact CD2-CG1 4Å; L741-V796 HydrophobicContact CG-CG1 4.43Å; H794-V796 PolarHBondContact O-N 3.39Å; V796-E798 HydrophobicContact CG1-CG 3.79Å
797	L	95.7	Very high	90.9	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.052	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	107	167.1	178.9	65.1	0	0	0	107.5	I742 M762 F782 E784	I742-L797 HydrophobicContact CB-CB 4.32Å; I742-L797 HydrophobicContact CD1-CD2 4.17Å; I742-L797 PolarHBondContact N-O 3.22Å; I742-L797 PolarHBondContact O-N 3.06Å; M762-L797 HydrophobicContact CE-CB 3.55Å; M762-L797 HydrophobicContact CE-CD2 3.81Å; M762-L797 HydrophobicContact CE-CG 4.34Å; F782-L797 HydrophobicContact CB-CD1 4.22Å; E784-L797 HydrophobicContact CB-CD1 4.35Å
798	E	95.1	Very high	91	Very high	30 Å²	30	61.1 Å²	61.1	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	137.9	-177.6	-52.4	-170.1	127.3	0	0	109.9	L741 F782 M783 V796 K876	L741-E798 HydrophobicContact CD2-CB 4.12Å; L741-E798 HydrophobicContact CD2-CG 3.75Å; F782-E798 CarbonylContact C-O 3.41Å; F782-E798 VanDerWaalsContact CA-O 3.26Å; F782-E798 WeakPolarHBondContact CA-O 3.35Å; M783-E798 HydrophobicContact CG-CB 4.21Å; M783-E798 PolarHBondContact N-O 2.63Å; M783-E798 PolarHBondContact O-N 3.32Å; V796-E798 HydrophobicContact CG1-CG 3.79Å; E798-K876 VanDerWaalsContact CD-NZ 3.29Å; E798-K876 VanDerWaalsContact OE1-CE 3.29Å; E798-K876 WeakPolarHBondContact OE1-CE 3.43Å; E798-K876 IonicContact OE1-NZ 3.38Å; E798-K876 PolarHBondContact OE1-NZ 2.88Å; E798-K876 WeakPolarHBondContact OE2-CE 3.36Å; E798-K876 IonicContact OE2-NZ 3.5Å; E798-K876 PolarHBondContact OE2-NZ 3.35Å; E798-K876 VanDerWaalsContact OE2-NZ 3.12Å
799	C	95.6	Very high	91.5	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	108.7	179.3	174.7	0	0	0	0	108.9	H739 C740 L769 F782 P801	H739-C799 WeakPolarHBondContact CA-O 3.35Å; H739-C799 PolarHBondContact CD2-O 3.12Å; C740-C799 PolarHBondContact N-O 2.98Å; C740-C799 PolarHBondContact O-N 3.48Å; L769-C799 HydrophobicContact CD1-CB 4.35Å; F782-C799 HydrophobicContact CD1-CB 3.8Å; F782-C799 HydrophobicContact CE1-CB 3.58Å; F782-C799 WeakPolarHBondContact CE1-SG 3.47Å; F782-C799 HydrophobicContact CZ-CB 4.42Å; C799-P801 WeakPolarHBondContact O-CD 3.43Å
800	I	95.7	Very high	92.1	Very high	0 Å²	0	60 Å²	60	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	103.1	-175	-50.5	-178.4	0	0	0	108.4	T736 V781 M783 L802 K876 V879	T736-I800 HydrophobicContact CG2-CG2 3.57Å; V781-I800 PolarHBondContact N-O 3.46Å; V781-I800 PolarHBondContact O-N 2.9Å; M783-I800 HydrophobicContact CG-CD1 4.48Å; M783-I800 HydrophobicContact SD-CD1 3.92Å; I800-L802 HydrophobicContact CG2-CD2 4.22Å; I800-K876 HydrophobicContact CD1-CG 4.38Å; I800-V879 HydrophobicContact CG2-CG1 3.99Å
801	P	95.4	Very high	92.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.1	176.8	30.6	-37.4	0	0	0	112.1	T736 E737 F773 L778 D779 C799	T736-P801 HydrophobicContact CG2-CG 3.84Å; T736-P801 VanDerWaalsContact CG2-O 3.26Å; T736-P801 WeakPolarHBondContact CG2-O 3.34Å; T736-P801 PolarHBondContact OG1-O 2.95Å; E737-P801 WeakPolarHBondContact O-CG 3.28Å; F773-P801 HydrophobicContact CD1-CB 3.71Å; F773-P801 HydrophobicContact CD1-CG 4.29Å; F773-P801 HydrophobicContact CD2-CB 4.29Å; F773-P801 HydrophobicContact CE1-CB 3.62Å; F773-P801 HydrophobicContact CE1-CG 3.69Å; F773-P801 HydrophobicContact CE2-CB 4.2Å; F773-P801 HydrophobicContact CE2-CG 4.38Å; F773-P801 HydrophobicContact CG-CB 4.04Å; F773-P801 HydrophobicContact CZ-CB 3.87Å; F773-P801 HydrophobicContact CZ-CG 3.72Å; L778-P801 HydrophobicContact CD1-CB 4.4Å; D779-P801 CarbonylContact O-C 3.41Å; D779-P801 VanDerWaalsContact O-CA 3.26Å; D779-P801 WeakPolarHBondContact O-CA 3.48Å; C799-P801 WeakPolarHBondContact O-CD 3.43Å
802	L	94.4	Very high	93.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	153	-177.8	-55.7	-175.6	0	0	0	110.5	L778 D779 V781 I800 R804 L806 V879 M882 M883	L778-L802 CarbonylContact C-O 3.54Å; L778-L802 VanDerWaalsContact CA-O 3.29Å; L778-L802 WeakPolarHBondContact CA-O 3.34Å; L778-L802 WeakPolarHBondContact CB-O 3.28Å; D779-L802 PolarHBondContact N-O 2.86Å; D779-L802 PolarHBondContact O-N 2.99Å; V781-L802 HydrophobicContact CG2-CD1 3.55Å; V781-L802 HydrophobicContact CG2-CG 4.24Å; I800-L802 HydrophobicContact CG2-CD2 4.22Å; L802-R804 PolarHBondContact O-N 3.42Å; L802-L806 HydrophobicContact CB-CB 4.41Å; L802-V879 HydrophobicContact CD2-CG1 3.64Å; L802-M882 HydrophobicContact CD1-CE 4.03Å; L802-M883 HydrophobicContact CD2-CG 4.15Å; L802-M883 HydrophobicContact CD2-SD 3.51Å; L802-M883 VanDerWaalsContact CD2-SD 3.51Å
803	P	94.6	Very high	93.7	Very high	55 Å²	55	51 Å²	51	36%	0.357	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.7	136.2	160.2	-22.6	33.2	0	0	0	110.1	E805 L806 G807	P803-E805 PolarHBondContact O-N 3.33Å; P803-E805 VanDerWaalsContact O-N 3.13Å; P803-L806 HydrophobicContact CG-CD1 4.36Å; P803-L806 WeakPolarHBondContact O-CA 3.37Å; P803-L806 PolarHBondContact O-N 3.25Å; P803-G807 PolarHBondContact O-N 3.21Å
804	R	92.6	Very high	94.1	Very high	165 Å²	165	45.9 Å²	45.9	62%	0.623	22%	0.222	S	C	*	.	H	α-helix	trans	-50.4	-40.6	-175.5	-178.6	176.2	177.4	169.1	2.5	114.1	E777 L802 L806 G807 D808	E777-R804 WeakPolarHBondContact O-CB 3.47Å; L802-R804 PolarHBondContact O-N 3.42Å; R804-L806 VanDerWaalsContact C-N 3.26Å; R804-L806 PolarHBondContact O-N 2.88Å; R804-G807 WeakPolarHBondContact O-CA 3.42Å; R804-G807 PolarHBondContact O-N 3.13Å; R804-D808 PolarHBondContact O-N 3.48Å
805	E	91.9	Very high	94.2	Very high	162 Å²	162	50.2 Å²	50.2	76%	0.757	24%	0.241	S	C	*	.	H	α-helix	trans	-57.4	-35.5	176.4	-58.6	-179.5	168.9	0	0	113.2	P803 M809	P803-E805 PolarHBondContact O-N 3.33Å; P803-E805 VanDerWaalsContact O-N 3.13Å; E805-M809 WeakPolarHBondContact O-CG 3.26Å
806	L	93	Very high	94.4	Very high	45 Å²	45	55.5 Å²	55.5	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-82.5	-27	174.7	-63.9	-177.8	0	0	0	112.1	L802 P803 R804 M809 A810 M882 M883	L802-L806 HydrophobicContact CB-CB 4.41Å; P803-L806 HydrophobicContact CG-CD1 4.36Å; P803-L806 WeakPolarHBondContact O-CA 3.37Å; P803-L806 PolarHBondContact O-N 3.25Å; R804-L806 VanDerWaalsContact C-N 3.26Å; R804-L806 PolarHBondContact O-N 2.88Å; L806-M809 PolarHBondContact O-N 3.19Å; L806-A810 WeakPolarHBondContact O-CB 3.5Å; L806-A810 PolarHBondContact O-N 2.78Å; L806-M882 HydrophobicContact CB-CE 4.25Å; L806-M882 WeakPolarHBondContact O-CE 3.23Å; L806-M883 HydrophobicContact CD1-CG 4.06Å
807	G	91.9	Very high	94.4	Very high	2 Å²	2	55.2 Å²	55.2	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-53.2	171.4	0	0	0	0	0	112.4	D779 P803 R804 M809 A810 P811	D779-G807 VanDerWaalsContact OD2-CA 3.27Å; D779-G807 WeakPolarHBondContact OD2-CA 3.32Å; P803-G807 PolarHBondContact O-N 3.21Å; R804-G807 WeakPolarHBondContact O-CA 3.42Å; R804-G807 PolarHBondContact O-N 3.13Å; G807-M809 PolarHBondContact O-N 2.9Å; G807-M809 VanDerWaalsContact O-N 3.14Å; G807-A810 VanDerWaalsContact O-CB 3.25Å; G807-A810 WeakPolarHBondContact O-CB 3.32Å; G807-A810 PolarHBondContact O-N 2.86Å; G807-P811 WeakPolarHBondContact O-CD 3.46Å
808	D	91.8	Very high	94.3	Very high	113 Å²	113	54.7 Å²	54.7	60%	0.604	26%	0.262	S	S	*	.	H	α-helix	trans	-56.9	-31.5	176.9	-72.7	-40.9	0	0	0	112.2	R804	R804-D808 PolarHBondContact O-N 3.48Å
809	M	93.5	Very high	94.2	Very high	83 Å²	83	58.1 Å²	58.1	41%	0.409	28%	0.279	S	S	.	.	H	α-helix	trans	-86.1	-18.2	176.2	-65.8	-63.7	-68.8	0	0	114.2	E805 L806 G807 P811 I812 Y813	E805-M809 WeakPolarHBondContact O-CG 3.26Å; L806-M809 PolarHBondContact O-N 3.19Å; G807-M809 PolarHBondContact O-N 2.9Å; G807-M809 VanDerWaalsContact O-N 3.14Å; M809-P811 VanDerWaalsContact C-CD 3.49Å; M809-I812 HydrophobicContact CE-CD1 3.97Å; M809-I812 WeakPolarHBondContact O-CB 3.22Å; M809-I812 PolarHBondContact O-N 2.9Å; M809-I812 HydrophobicContact SD-CD1 3.96Å; M809-Y813 HydrophobicContact CB-CD2 4.2Å; M809-Y813 HydrophobicContact CB-CE2 4.04Å; M809-Y813 WeakPolarHBondContact O-CD2 3.27Å; M809-Y813 PolarHBondContact O-N 3.05Å
810	A	94.4	Very high	94.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.5	-42.2	-174.1	0	0	0	0	0	113.8	V781 L806 G807 I812 Y813 F814 F854 M882	V781-A810 HydrophobicContact CG2-CB 4.14Å; L806-A810 WeakPolarHBondContact O-CB 3.5Å; L806-A810 PolarHBondContact O-N 2.78Å; G807-A810 VanDerWaalsContact O-CB 3.25Å; G807-A810 WeakPolarHBondContact O-CB 3.32Å; G807-A810 PolarHBondContact O-N 2.86Å; A810-I812 PolarHBondContact O-N 3.35Å; A810-Y813 PolarHBondContact O-N 2.82Å; A810-F814 HydrophobicContact CB-CD2 4.49Å; A810-F814 WeakPolarHBondContact O-CD2 3.45Å; A810-F814 PolarHBondContact O-N 3.31Å; A810-F854 HydrophobicContact CB-CD1 3.91Å; A810-F854 HydrophobicContact CB-CE1 3.71Å; A810-M882 HydrophobicContact CB-CE 3.72Å; A810-M882 HydrophobicContact CB-SD 4.48Å
811	P	94.5	Very high	93.7	Very high	42 Å²	42	65 Å²	65	27%	0.273	31%	0.312	S	S	.	.	H	α-helix	trans	-58.4	-31.4	175.8	-24.8	34.8	0	0	0	113.3	G807 M809 K815 F854 F860	G807-P811 WeakPolarHBondContact O-CD 3.46Å; M809-P811 VanDerWaalsContact C-CD 3.49Å; P811-K815 WeakPolarHBondContact O-CB 3.22Å; P811-K815 PolarHBondContact O-N 3.42Å; P811-F854 HydrophobicContact CB-CD2 4.39Å; P811-F854 HydrophobicContact CB-CE2 4.08Å; P811-F854 HydrophobicContact CB-CZ 4.3Å; P811-F854 HydrophobicContact CG-CD1 4.19Å; P811-F854 HydrophobicContact CG-CD2 3.9Å; P811-F854 HydrophobicContact CG-CE1 4.32Å; P811-F854 HydrophobicContact CG-CE2 4.02Å; P811-F854 HydrophobicContact CG-CG 4Å; P811-F854 HydrophobicContact CG-CZ 4.25Å; P811-F860 HydrophobicContact CB-CE2 4.17Å; P811-F860 HydrophobicContact CB-CZ 4.45Å; P811-F860 WeakPolarHBondContact O-CE2 3.39Å
812	I	94.9	Very high	93.2	Very high	102 Å²	102	66.5 Å²	66.5	52%	0.523	32%	0.319	S	S	.	.	H	α-helix	trans	-72.7	-47.5	179.8	-55.9	175.2	0	0	0	110.1	M809 A810 K815 K816	M809-I812 HydrophobicContact CE-CD1 3.97Å; M809-I812 WeakPolarHBondContact O-CB 3.22Å; M809-I812 PolarHBondContact O-N 2.9Å; M809-I812 HydrophobicContact SD-CD1 3.96Å; A810-I812 PolarHBondContact O-N 3.35Å; I812-K815 PolarHBondContact O-N 3.38Å; I812-K816 WeakPolarHBondContact O-CB 3.47Å; I812-K816 PolarHBondContact O-N 2.95Å
813	Y	95.8	Very high	92.8	Very high	108 Å²	108	70 Å²	70	42%	0.424	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-48	176.9	-77.9	-84	0	0	0	112	M809 A810 K816 A817 M882	M809-Y813 HydrophobicContact CB-CD2 4.2Å; M809-Y813 HydrophobicContact CB-CE2 4.04Å; M809-Y813 WeakPolarHBondContact O-CD2 3.27Å; M809-Y813 PolarHBondContact O-N 3.05Å; A810-Y813 PolarHBondContact O-N 2.82Å; Y813-K816 PolarHBondContact O-N 3.4Å; Y813-A817 WeakPolarHBondContact O-CB 3.34Å; Y813-A817 PolarHBondContact O-N 3.41Å; Y813-M882 HydrophobicContact CD1-CG 3.76Å; Y813-M882 HydrophobicContact CD2-CE 4.07Å; Y813-M882 HydrophobicContact CD2-CG 3.69Å; Y813-M882 HydrophobicContact CD2-SD 3.92Å; Y813-M882 HydrophobicContact CE1-CG 4.13Å; Y813-M882 HydrophobicContact CE2-CG 4.08Å; Y813-M882 HydrophobicContact CG-CG 3.52Å; Y813-M882 HydrophobicContact CG-SD 3.82Å
814	F	95.9	Very high	92.2	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.5	-41.5	177.6	-86.1	-75.5	0	0	0	112.7	V781 A810 K816 A817 I818 F850 V852 F854 F860 V878 V879	V781-F814 HydrophobicContact CG1-CE2 3.96Å; V781-F814 HydrophobicContact CG1-CZ 4.18Å; A810-F814 HydrophobicContact CB-CD2 4.49Å; A810-F814 WeakPolarHBondContact O-CD2 3.45Å; A810-F814 PolarHBondContact O-N 3.31Å; F814-K816 PolarHBondContact O-N 3.1Å; F814-A817 PolarHBondContact O-N 2.91Å; F814-I818 WeakPolarHBondContact O-CB 3.47Å; F814-I818 VanDerWaalsContact O-CG1 3.24Å; F814-I818 WeakPolarHBondContact O-CG1 3.43Å; F814-I818 PolarHBondContact O-N 3.09Å; F814-F850 HydrophobicContact CD1-CE1 4.02Å; F814-F850 HydrophobicContact CD1-CZ 4.27Å; F814-F850 AromaticContact CE1-CE1 3.91Å; F814-F850 HydrophobicContact CE1-CE1 3.91Å; F814-F850 AromaticContact CE1-CZ 3.69Å; F814-F850 HydrophobicContact CE1-CZ 3.69Å; F814-V852 HydrophobicContact CB-CG1 4.26Å; F814-V852 HydrophobicContact CD1-CB 4.23Å; F814-V852 HydrophobicContact CD1-CG1 3.92Å; F814-V852 HydrophobicContact CD1-CG2 4.09Å; F814-V852 HydrophobicContact CD2-CG2 4.04Å; F814-V852 HydrophobicContact CE1-CB 4.27Å; F814-V852 HydrophobicContact CE1-CG1 4.45Å; F814-V852 HydrophobicContact CE1-CG2 3.95Å; F814-V852 HydrophobicContact CE2-CG2 3.9Å; F814-V852 HydrophobicContact CG-CG1 4.05Å; F814-V852 HydrophobicContact CG-CG2 4.12Å; F814-V852 HydrophobicContact CZ-CG2 3.84Å; F814-F854 HydrophobicContact CB-CZ 3.97Å; F814-F854 AromaticContact CD2-CE1 3.73Å; F814-F854 HydrophobicContact CD2-CE1 3.73Å; F814-F854 AromaticContact CD2-CZ 3.94Å; F814-F854 HydrophobicContact CD2-CZ 3.94Å; F814-F854 HydrophobicContact CE2-CE1 4.32Å; F814-F854 HydrophobicContact CG-CE1 4.41Å; F814-F854 HydrophobicContact CG-CZ 4.16Å; F814-F860 HydrophobicContact CB-CD2 4.32Å; F814-V878 HydrophobicContact CD1-CB 4.34Å; F814-V878 HydrophobicContact CD1-CG1 4.03Å; F814-V878 HydrophobicContact CD1-CG2 4.37Å; F814-V878 HydrophobicContact CD2-CG1 4.02Å; F814-V878 HydrophobicContact CE1-CB 3.91Å; F814-V878 HydrophobicContact CE1-CG1 3.98Å; F814-V878 HydrophobicContact CE1-CG2 4.17Å; F814-V878 HydrophobicContact CE2-CG1 3.98Å; F814-V878 HydrophobicContact CG-CG1 4.06Å; F814-V878 HydrophobicContact CZ-CB 4.01Å; F814-V878 HydrophobicContact CZ-CG1 3.96Å; F814-V879 HydrophobicContact CE2-CG2 3.82Å; F814-V879 HydrophobicContact CZ-CG2 3.79Å
815	K	95.3	Very high	91.8	Very high	108 Å²	108	78 Å²	78	47%	0.47	37%	0.366	S	S	.	.	H	α-helix	trans	-58.9	-46	174.7	174.4	168.5	-179.5	-179.5	0	111.6	P811 I812 M819 L831 F860	P811-K815 WeakPolarHBondContact O-CB 3.22Å; P811-K815 PolarHBondContact O-N 3.42Å; I812-K815 PolarHBondContact O-N 3.38Å; K815-M819 HydrophobicContact CG-CE 4.05Å; K815-M819 HydrophobicContact CG-SD 4.46Å; K815-M819 WeakPolarHBondContact O-CE 3.46Å; K815-M819 WeakPolarHBondContact O-CG 3.36Å; K815-M819 PolarHBondContact O-N 2.76Å; K815-L831 HydrophobicContact CB-CD1 4.1Å; K815-L831 HydrophobicContact CD-CD1 4.5Å; K815-L831 HydrophobicContact CG-CD1 3.74Å; K815-F860 HydrophobicContact CB-CE2 4.01Å; K815-F860 HydrophobicContact CB-CZ 4.3Å
816	K	95.3	Very high	91.5	Very high	115 Å²	115	71.6 Å²	71.6	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-54.6	175.9	-176.8	179.8	176.2	-174.8	0	110.8	I812 Y813 F814 I818 M819 E820	I812-K816 WeakPolarHBondContact O-CB 3.47Å; I812-K816 PolarHBondContact O-N 2.95Å; Y813-K816 PolarHBondContact O-N 3.4Å; F814-K816 PolarHBondContact O-N 3.1Å; K816-I818 VanDerWaalsContact C-N 3.3Å; K816-I818 PolarHBondContact O-N 2.82Å; K816-M819 PolarHBondContact O-N 2.83Å; K816-M819 VanDerWaalsContact O-N 3.09Å; K816-E820 WeakPolarHBondContact CE-OE1 3.31Å; K816-E820 WeakPolarHBondContact CE-OE2 3.49Å; K816-E820 HydrophobicContact CG-CG 4.44Å; K816-E820 IonicContact NZ-OE1 2.66Å; K816-E820 PolarHBondContact O-N 3.14Å
817	A	95.2	Very high	91.2	Very high	19 Å²	19	78 Å²	78	16%	0.157	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-36.8	-177.5	0	0	0	0	0	113.1	Y813 F814 E820 C821 F874 V878	Y813-A817 WeakPolarHBondContact O-CB 3.34Å; Y813-A817 PolarHBondContact O-N 3.41Å; F814-A817 PolarHBondContact O-N 2.91Å; A817-E820 PolarHBondContact O-N 3.3Å; A817-C821 WeakPolarHBondContact O-CB 3.24Å; A817-C821 PolarHBondContact O-N 3.05Å; A817-F874 HydrophobicContact CB-CE2 4.2Å; A817-F874 HydrophobicContact CB-CZ 3.75Å; A817-V878 HydrophobicContact CB-CG2 3.58Å
818	I	94.5	Very high	91.1	Very high	0 Å²	0	81.5 Å²	81.5	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-73	-27.1	178.4	-70.2	167.8	0	0	0	112.5	F814 K816 C821 K830 L831 F850 V852 F860 H862 F874	F814-I818 WeakPolarHBondContact O-CB 3.47Å; F814-I818 VanDerWaalsContact O-CG1 3.24Å; F814-I818 WeakPolarHBondContact O-CG1 3.43Å; F814-I818 PolarHBondContact O-N 3.09Å; K816-I818 VanDerWaalsContact C-N 3.3Å; K816-I818 PolarHBondContact O-N 2.82Å; I818-C821 PolarHBondContact O-SG 2.96Å; I818-C821 VanDerWaalsContact O-SG 3.36Å; I818-K830 WeakPolarHBondContact CG2-O 3.44Å; I818-L831 HydrophobicContact CG2-CB 4.05Å; I818-L831 HydrophobicContact CG2-CG 4.42Å; I818-F850 HydrophobicContact CD1-CD1 4.3Å; I818-F850 HydrophobicContact CD1-CE1 4.28Å; I818-V852 HydrophobicContact CD1-CG1 4.38Å; I818-F860 HydrophobicContact CD1-CB 3.93Å; I818-H862 HydrophobicContact CG2-CB 3.93Å; I818-F874 HydrophobicContact CG1-CE1 3.92Å; I818-F874 HydrophobicContact CG1-CZ 4.12Å
819	M	92.9	Very high	91	Very high	101 Å²	101	83.4 Å²	83.4	50%	0.498	39%	0.392	S	S	.	.	H	α-helix	trans	-77.8	-38.3	173	-66.2	-177.7	-52.4	0	0	111.4	K815 K816 K830	K815-M819 HydrophobicContact CG-CE 4.05Å; K815-M819 HydrophobicContact CG-SD 4.46Å; K815-M819 WeakPolarHBondContact O-CE 3.46Å; K815-M819 WeakPolarHBondContact O-CG 3.36Å; K815-M819 PolarHBondContact O-N 2.76Å; K816-M819 PolarHBondContact O-N 2.83Å; K816-M819 VanDerWaalsContact O-N 3.09Å; M819-K830 WeakPolarHBondContact O-CD 3.34Å; M819-K830 PolarHBondContact O-NZ 2.87Å
820	E	92.1	Very high	90.9	Very high	131 Å²	131	81 Å²	81	61%	0.612	38%	0.38	S	S	*	.	H	α-helix	trans	-80.7	-16.7	-179.9	-67.7	176.7	169.6	0	0	113.9	K816 A817	K816-E820 WeakPolarHBondContact CE-OE1 3.31Å; K816-E820 WeakPolarHBondContact CE-OE2 3.49Å; K816-E820 HydrophobicContact CG-CG 4.44Å; K816-E820 IonicContact NZ-OE1 2.66Å; K816-E820 PolarHBondContact O-N 3.14Å; A817-E820 PolarHBondContact O-N 3.3Å
821	C	88.3	Confident	90.8	Very high	14 Å²	14	82.2 Å²	82.2	10%	0.095	39%	0.386	C	S	.	.	S	Bend	trans	-80	156.3	-179.6	73.2	0	0	0	0	113.9	A817 I818 K830 F874	A817-C821 WeakPolarHBondContact O-CB 3.24Å; A817-C821 PolarHBondContact O-N 3.05Å; I818-C821 PolarHBondContact O-SG 2.96Å; I818-C821 VanDerWaalsContact O-SG 3.36Å; C821-K830 PolarHBondContact O-NZ 3.19Å; C821-F874 HydrophobicContact CB-CE2 3.71Å; C821-F874 HydrophobicContact CB-CZ 4.04Å
822	E	85.3	Confident	90.7	Very high	31 Å²	31	82 Å²	82	15%	0.145	38%	0.384	C	S	.	.	S	Bend	trans	60.5	-158.4	176.8	-135.3	-153.1	104.9	0	0	114.9	E865 N866 K869	E822-E865 PolarHBondContact OE2-N 2.92Å; E822-N866 HydrophobicContact CG-CB 4.12Å; E822-N866 VanDerWaalsContact OE1-CB 3.24Å; E822-N866 WeakPolarHBondContact OE1-CB 3.26Å; E822-N866 PolarHBondContact OE1-N 3.15Å; E822-N866 PolarHBondContact OE1-ND2 2.92Å; E822-N866 PolarHBondContact OE2-N 3.45Å; E822-N866 VanDerWaalsContact OE2-N 3.1Å; E822-K869 HydrophobicContact CG-CB 3.91Å
823	E	85.9	Confident	90.6	Very high	74 Å²	74	80.8 Å²	80.8	35%	0.346	38%	0.379	S	S	.	.			trans	-62.9	139.6	177.2	-160.5	99.6	-114.5	0	0	111	W825 K830 K869	E823-W825 HydrophobicContact CG-CB 4.46Å; E823-W825 PolarHBondContact O-N 3.2Å; E823-K830 WeakPolarHBondContact O-CE 3.33Å; E823-K830 PolarHBondContact O-NZ 3.27Å; E823-K869 IonicContact OE1-NZ 3.74Å; E823-K869 PolarHBondContact OE1-NZ 2.87Å; E823-K869 IonicContact OE2-NZ 2.74Å; E823-K869 PolarHBondContact OE2-NZ 3.3Å
824	E	81.5	Confident	90.4	Very high	165 Å²	165	76 Å²	76	77%	0.771	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.9	171.4	-65.7	-177.8	164.3	0	0	111.5	A826	E824-A826 PolarHBondContact O-N 2.9Å
825	W	83.8	Confident	90.1	Very high	224 Å²	224	79.9 Å²	79.9	85%	0.848	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	53.9	-176.7	-57.3	96.9	0	0	0	112.6	E823	E823-W825 HydrophobicContact CG-CB 4.46Å; E823-W825 PolarHBondContact O-N 3.2Å
826	A	85.2	Confident	89.6	Confident	27 Å²	27	79.3 Å²	79.3	22%	0.223	40%	0.397	C	S	.	.			trans	-66.9	146	172.1	0	0	0	0	0	111.7	E824 K830 E865	E824-A826 PolarHBondContact O-N 2.9Å; A826-K830 HydrophobicContact CB-CG 4.26Å; A826-E865 WeakPolarHBondContact CA-OE2 3.49Å
827	M	87.8	Confident	89.2	Confident	178 Å²	178	79.7 Å²	79.7	88%	0.877	40%	0.398	S	S	*	.	S	Bend	trans	-74.7	-37.8	177.5	-62.7	-174	71.8	0	0	111.9	E865	M827-E865 PolarHBondContact N-OE1 3.15Å; M827-E865 PolarHBondContact N-OE2 2.93Å
828	N	89.8	Confident	88.8	Confident	76 Å²	76	81.5 Å²	81.5	41%	0.406	41%	0.406	S	S	.	.	S	Bend	trans	-87.2	149.3	175.5	-69.7	-86.6	0	0	0	111	K830 V863 E865	N828-K830 PolarHBondContact O-N 2.91Å; N828-V863 HydrophobicContact CB-CB 4.29Å; N828-E865 VanDerWaalsContact CB-OE1 3.32Å; N828-E865 WeakPolarHBondContact CB-OE1 3.5Å; N828-E865 PolarHBondContact N-OE1 2.64Å; N828-E865 PolarHBondContact ND2-OE1 3.11Å
829	K	89.5	Confident	88.5	Confident	153 Å²	153	81.9 Å²	81.9	67%	0.665	41%	0.407	S	S	*	.			trans	-63.2	110.8	173.9	-173.7	-165.9	179.8	-144.1	0	109.8	L831	K829-L831 VanDerWaalsContact C-N 3.28Å; K829-L831 WeakPolarHBondContact CD-O 3.43Å; K829-L831 WeakPolarHBondContact CE-O 3.27Å; K829-L831 PolarHBondContact NZ-O 3.38Å; K829-L831 PolarHBondContact O-N 3.06Å; K829-L831 VanDerWaalsContact O-N 3.1Å
830	K	90.2	Very high	88.3	Confident	34 Å²	34	79.8 Å²	79.8	15%	0.148	39%	0.394	C	S	.	.	S	Bend	trans	-45.8	-46.1	-175.8	-65.8	-165.1	-178.3	-164.5	0	114.4	I818 M819 C821 E823 A826 N828 H862	I818-K830 WeakPolarHBondContact CG2-O 3.44Å; M819-K830 WeakPolarHBondContact O-CD 3.34Å; M819-K830 PolarHBondContact O-NZ 2.87Å; C821-K830 PolarHBondContact O-NZ 3.19Å; E823-K830 WeakPolarHBondContact O-CE 3.33Å; E823-K830 PolarHBondContact O-NZ 3.27Å; A826-K830 HydrophobicContact CB-CG 4.26Å; N828-K830 PolarHBondContact O-N 2.91Å; K830-H862 WeakPolarHBondContact O-CA 3.41Å; K830-H862 WeakPolarHBondContact O-CB 3.29Å; K830-H862 PolarHBondContact O-ND1 3.46Å
831	L	92.3	Very high	88.2	Confident	25 Å²	25	82.9 Å²	82.9	13%	0.131	40%	0.4	C	S	.	.			trans	-108.9	112	-179.1	-169.7	155.8	0	0	0	111.7	K815 I818 K829 F860	K815-L831 HydrophobicContact CB-CD1 4.1Å; K815-L831 HydrophobicContact CD-CD1 4.5Å; K815-L831 HydrophobicContact CG-CD1 3.74Å; I818-L831 HydrophobicContact CG2-CB 4.05Å; I818-L831 HydrophobicContact CG2-CG 4.42Å; K829-L831 VanDerWaalsContact C-N 3.28Å; K829-L831 WeakPolarHBondContact CD-O 3.43Å; K829-L831 WeakPolarHBondContact CE-O 3.27Å; K829-L831 PolarHBondContact NZ-O 3.38Å; K829-L831 PolarHBondContact O-N 3.06Å; K829-L831 VanDerWaalsContact O-N 3.1Å; L831-F860 HydrophobicContact CD1-CD1 4.16Å; L831-F860 HydrophobicContact CD1-CE1 4.4Å; L831-F860 HydrophobicContact CD1-CG 4.29Å; L831-F860 HydrophobicContact CD2-CD1 3.7Å; L831-F860 HydrophobicContact CD2-CE1 4.06Å; L831-F860 HydrophobicContact CD2-CG 4.47Å; L831-F860 HydrophobicContact CG-CB 4.5Å; L831-F860 HydrophobicContact CG-CD1 4.01Å; L831-F860 HydrophobicContact CG-CG 4.29Å
832	V	93.4	Very high	88.4	Confident	37 Å²	37	83.4 Å²	83.4	22%	0.224	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.5	168	-175.7	0	0	0	0	108.5	A842 F860 A861	V832-A842 HydrophobicContact CG1-CB 4.05Å; V832-F860 CarbonylContact O-C 3.11Å; V832-F860 WeakPolarHBondContact O-CA 3.46Å; V832-A861 HydrophobicContact CB-CB 4.32Å; V832-A861 WeakPolarHBondContact CB-O 3.46Å; V832-A861 PolarHBondContact N-O 2.91Å; V832-A861 PolarHBondContact O-N 3.45Å
833	D	93.6	Very high	88.7	Confident	77 Å²	77	82.2 Å²	82.2	41%	0.412	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.1	178.7	174.6	17.6	0	0	0	110.3	S835	D833-S835 WeakPolarHBondContact OD1-CB 3.49Å; D833-S835 PolarHBondContact OD1-N 2.92Å
834	L	91.7	Very high	88.9	Confident	7 Å²	7	82.6 Å²	82.6	4%	0.037	41%	0.409	C	S	.	.			trans	-99.4	-7.7	179.5	-59.3	175.3	0	0	0	113	S836 K837 I839 A842 G859 A861	L834-S836 PolarHBondContact O-N 2.56Å; L834-K837 WeakPolarHBondContact CA-O 3.38Å; L834-K837 CarbonylContact O-C 3.38Å; L834-K837 PolarHBondContact O-N 3.34Å; L834-K837 VanDerWaalsContact O-O 3.08Å; L834-I839 HydrophobicContact CD1-CD1 4.36Å; L834-I839 HydrophobicContact CD1-CG1 3.61Å; L834-I839 HydrophobicContact CD2-CG1 4.05Å; L834-I839 HydrophobicContact CG-CG1 4.48Å; L834-A842 HydrophobicContact CD2-CB 3.58Å; L834-G859 WeakPolarHBondContact CB-O 3.49Å; L834-G859 PolarHBondContact N-O 3.44Å; L834-A861 HydrophobicContact CD1-CB 4.11Å; L834-A861 HydrophobicContact CD2-CB 3.89Å; L834-A861 HydrophobicContact CG-CB 4.13Å
835	S	89	Confident	89.2	Confident	82 Å²	82	80.8 Å²	80.8	57%	0.573	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-32.6	-176.9	-172.8	0	0	0	0	113.2	D833	D833-S835 WeakPolarHBondContact OD1-CB 3.49Å; D833-S835 PolarHBondContact OD1-N 2.92Å
836	S	84.8	Confident	89.3	Confident	95 Å²	95	70.9 Å²	70.9	66%	0.664	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-5	177.8	59.6	0	0	0	0	115.6	L834	L834-S836 PolarHBondContact O-N 2.56Å
837	K	87.1	Confident	89.5	Confident	123 Å²	123	72.7 Å²	72.7	54%	0.535	37%	0.368	S	S	.	.	S	Bend	trans	-153.3	127.3	-168.6	-64.4	178.2	-173.3	173.3	0	113.3	L834	L834-K837 WeakPolarHBondContact CA-O 3.38Å; L834-K837 CarbonylContact O-C 3.38Å; L834-K837 PolarHBondContact O-N 3.34Å; L834-K837 VanDerWaalsContact O-O 3.08Å
838	D	86.2	Confident	89.8	Confident	58 Å²	58	65 Å²	65	31%	0.31	33%	0.331	S	S	.	.			trans	-43.9	142.1	164.2	-76.9	43.6	0	0	0	112.5	W759 R840 R841 A842	W759-D838 PolarHBondContact NE1-OD2 3.25Å; D838-R840 HydrophobicContact CB-CB 4.31Å; D838-R840 PolarHBondContact O-N 3.19Å; D838-R840 VanDerWaalsContact O-N 3.09Å; D838-R840 IonicContact OD2-CZ 3.04Å; D838-R840 IonicContact OD2-NE 3.73Å; D838-R840 PolarHBondContact OD2-NE 3.46Å; D838-R840 IonicContact OD2-NH2 3.55Å; D838-R840 PolarHBondContact OD2-NH2 3.46Å; D838-R841 HydrophobicContact CB-CG 4.5Å; D838-R841 WeakPolarHBondContact O-CA 3.24Å; D838-R841 PolarHBondContact O-N 2.76Å; D838-A842 PolarHBondContact O-N 3.38Å
839	I	89.1	Confident	90	Very high	7 Å²	7	61.3 Å²	61.3	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-45.3	-42.9	167.2	-59	163.9	0	0	0	111	T752 W759 L834 R841 A842 V843 Y849 A851	T752-I839 HydrophobicContact CG2-CG2 4.01Å; W759-I839 HydrophobicContact CH2-CD1 4.21Å; L834-I839 HydrophobicContact CD1-CD1 4.36Å; L834-I839 HydrophobicContact CD1-CG1 3.61Å; L834-I839 HydrophobicContact CD2-CG1 4.05Å; L834-I839 HydrophobicContact CG-CG1 4.48Å; I839-R841 PolarHBondContact O-N 2.71Å; I839-R841 VanDerWaalsContact O-N 3.12Å; I839-A842 PolarHBondContact O-N 3.45Å; I839-V843 HydrophobicContact CG2-CG2 4.49Å; I839-V843 PolarHBondContact O-N 2.85Å; I839-Y849 HydrophobicContact CG2-CD2 4.37Å; I839-Y849 HydrophobicContact CG2-CE2 3.78Å; I839-A851 HydrophobicContact CD1-CB 3.55Å; I839-A851 HydrophobicContact CG1-CB 4.02Å; I839-A851 HydrophobicContact CG2-CB 4.46Å
840	R	88.5	Confident	90.3	Very high	58 Å²	58	54 Å²	54	22%	0.219	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-18.3	178.5	-55.2	-177.1	-61.7	138.3	3.3	114.9	E756 D838	E756-R840 IonicContact OE1-CZ 3.28Å; E756-R840 IonicContact OE1-NH1 3.79Å; E756-R840 PolarHBondContact OE1-NH1 3.19Å; E756-R840 IonicContact OE1-NH2 3.18Å; D838-R840 HydrophobicContact CB-CB 4.31Å; D838-R840 PolarHBondContact O-N 3.19Å; D838-R840 VanDerWaalsContact O-N 3.09Å; D838-R840 IonicContact OD2-CZ 3.04Å; D838-R840 IonicContact OD2-NE 3.73Å; D838-R840 PolarHBondContact OD2-NE 3.46Å; D838-R840 IonicContact OD2-NH2 3.55Å; D838-R840 PolarHBondContact OD2-NH2 3.46Å
841	R	89.8	Confident	90.5	Very high	195 Å²	195	52.5 Å²	52.5	74%	0.736	27%	0.274	S	S	*	.	H	α-helix	trans	-111.6	-20.8	176.9	-65.1	-178.5	178.2	179.9	0.4	112.9	D838 I839	D838-R841 HydrophobicContact CB-CG 4.5Å; D838-R841 WeakPolarHBondContact O-CA 3.24Å; D838-R841 PolarHBondContact O-N 2.76Å; I839-R841 PolarHBondContact O-N 2.71Å; I839-R841 VanDerWaalsContact O-N 3.12Å
842	A	91.8	Very high	90.7	Very high	26 Å²	26	51.4 Å²	51.4	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-86.3	-36.1	179.3	0	0	0	0	0	112.9	V832 L834 D838 I839	V832-A842 HydrophobicContact CG1-CB 4.05Å; L834-A842 HydrophobicContact CD2-CB 3.58Å; D838-A842 PolarHBondContact O-N 3.38Å; I839-A842 PolarHBondContact O-N 3.45Å
843	V	91.9	Very high	90.7	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.03	26%	0.261	C	S	.	.	S	Bend	trans	-115.4	127.1	-176.1	-178.7	0	0	0	0	110.6	T752 I839 Y849 A861 V863	T752-V843 HydrophobicContact CG2-CB 4.18Å; T752-V843 HydrophobicContact CG2-CG1 4.43Å; I839-V843 HydrophobicContact CG2-CG2 4.49Å; I839-V843 PolarHBondContact O-N 2.85Å; V843-Y849 HydrophobicContact CG1-CD1 3.9Å; V843-Y849 HydrophobicContact CG1-CG 4.1Å; V843-A861 HydrophobicContact CG2-CB 3.83Å; V843-V863 HydrophobicContact CG1-CG2 4.26Å
844	P	89.9	Confident	90.8	Very high	82 Å²	82	47.2 Å²	47.2	53%	0.532	24%	0.244	S	C	.	.			trans	-60	147.2	174.6	-25.3	35.2	0	0	0	113.9	G846 L847	P844-G846 PolarHBondContact O-N 3.2Å; P844-L847 HydrophobicContact CB-CD1 4.35Å; P844-L847 HydrophobicContact CG-CD1 4.38Å
845	R	87.6	Confident	90.7	Very high	128 Å²	128	47 Å²	47	48%	0.483	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	128.4	173.5	-73.3	-176.9	171.2	-158.5	-13.4	110.8	T752 L754	T752-R845 PolarHBondContact O-NE 3.23Å; T752-R845 PolarHBondContact O-NH2 3.41Å; L754-R845 PolarHBondContact O-NH2 3.22Å; L754-R845 VanDerWaalsContact O-NH2 3.14Å
846	G	85.3	Confident	90.7	Very high	15 Å²	15	48 Å²	48	16%	0.155	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.3	-7.6	171.4	0	0	0	0	0	116.2	E582 L789 P844	E582-G846 WeakPolarHBondContact O-CA 3.23Å; L789-G846 VanDerWaalsContact CD1-O 3.29Å; L789-G846 WeakPolarHBondContact CD1-O 3.41Å; P844-G846 PolarHBondContact O-N 3.2Å
847	L	90.4	Very high	90.7	Very high	65 Å²	65	50.4 Å²	50.4	34%	0.34	24%	0.242	S	C	.	.	S	Bend	trans	-89.8	148.9	173.1	-60	176.7	0	0	0	111.2	H786 P844 V863	H786-L847 PolarHBondContact ND1-O 2.85Å; P844-L847 HydrophobicContact CB-CD1 4.35Å; P844-L847 HydrophobicContact CG-CD1 4.38Å; L847-V863 HydrophobicContact CB-CG1 4.21Å; L847-V863 HydrophobicContact CD1-CG1 4Å
848	P	92.9	Very high	90.6	Very high	16 Å²	16	45.7 Å²	45.7	10%	0.104	23%	0.229	C	C	.	.			trans	-65.4	142.9	163.7	-17.2	33.2	0	0	0	110.4	H786 M787 L789 I864 E867	H786-P848 CarbonylContact O-C 3.44Å; H786-P848 VanDerWaalsContact O-CA 3.26Å; H786-P848 WeakPolarHBondContact O-CA 3.33Å; H786-P848 WeakPolarHBondContact O-CB 3.37Å; M787-P848 HydrophobicContact CG-CB 4.35Å; L789-P848 HydrophobicContact CD1-CG 4.04Å; L789-P848 HydrophobicContact CG-CG 4.37Å; P848-I864 HydrophobicContact CB-CB 4.17Å; P848-I864 PolarHBondContact O-N 3.01Å; P848-E867 HydrophobicContact CG-CG 4.41Å
849	Y	94.3	Very high	90.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153.1	177.5	67.3	-93.8	0	0	0	112.6	C750 A751 T752 E784 H786 I839 V843 A851 H862	C750-Y849 HydrophobicContact CB-CE1 4.05Å; A751-Y849 WeakPolarHBondContact CB-OH 3.15Å; A751-Y849 PolarHBondContact N-OH 2.9Å; T752-Y849 HydrophobicContact CG2-CD1 4.43Å; T752-Y849 HydrophobicContact CG2-CE1 3.65Å; T752-Y849 PolarHBondContact N-OH 3.49Å; E784-Y849 HydrophobicContact CG-CE2 4.38Å; E784-Y849 PolarHBondContact OE1-OH 2.91Å; E784-Y849 WeakPolarHBondContact OE2-CE2 3.39Å; E784-Y849 VanDerWaalsContact OE2-CZ 3.3Å; E784-Y849 PolarHBondContact OE2-OH 3.39Å; H786-Y849 HydrophobicContact CB-CD1 4.13Å; H786-Y849 HydrophobicContact CB-CE1 3.93Å; H786-Y849 HydrophobicContact CB-CE2 4.44Å; H786-Y849 HydrophobicContact CB-CG 4.47Å; H786-Y849 PolarHBondContact N-O 3Å; H786-Y849 AromaticContact ND1-CD1 3.93Å; H786-Y849 AromaticContact ND1-CE1 3.81Å; H786-Y849 PolarHBondContact O-N 3.5Å; I839-Y849 HydrophobicContact CG2-CD2 4.37Å; I839-Y849 HydrophobicContact CG2-CE2 3.78Å; V843-Y849 HydrophobicContact CG1-CD1 3.9Å; V843-Y849 HydrophobicContact CG1-CG 4.1Å; Y849-A851 HydrophobicContact CD2-CB 4.07Å; Y849-A851 HydrophobicContact CE2-CB 4.09Å; Y849-H862 CarbonylContact C-O 3.51Å; Y849-H862 VanDerWaalsContact CA-O 3.23Å; Y849-H862 WeakPolarHBondContact CA-O 3.35Å; Y849-H862 WeakPolarHBondContact CB-O 3.5Å
850	F	95.8	Very high	91.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.6	162.5	175.5	-106.4	0	0	0	108.5	M783 E784 T785 F814 I818 V852 A861 H862 I864 F870 F874	M783-F850 HydrophobicContact CB-CE2 4.15Å; M783-F850 HydrophobicContact CB-CZ 4.29Å; M783-F850 HydrophobicContact CE-CE2 4.12Å; E784-F850 WeakPolarHBondContact O-CD2 3.29Å; T785-F850 WeakPolarHBondContact OG1-CD2 3.33Å; F814-F850 HydrophobicContact CD1-CE1 4.02Å; F814-F850 HydrophobicContact CD1-CZ 4.27Å; F814-F850 AromaticContact CE1-CE1 3.91Å; F814-F850 HydrophobicContact CE1-CE1 3.91Å; F814-F850 AromaticContact CE1-CZ 3.69Å; F814-F850 HydrophobicContact CE1-CZ 3.69Å; I818-F850 HydrophobicContact CD1-CD1 4.3Å; I818-F850 HydrophobicContact CD1-CE1 4.28Å; F850-V852 HydrophobicContact CE1-CB 3.86Å; F850-V852 HydrophobicContact CE1-CG1 4.01Å; F850-V852 HydrophobicContact CZ-CB 3.92Å; F850-A861 CarbonylContact O-C 3.56Å; F850-A861 WeakPolarHBondContact O-CA 3.45Å; F850-H862 HydrophobicContact CB-CB 4.43Å; F850-H862 PolarHBondContact N-O 3.02Å; F850-H862 PolarHBondContact O-N 3.11Å; F850-I864 HydrophobicContact CB-CD1 4.1Å; F850-I864 HydrophobicContact CB-CG1 4.5Å; F850-F870 HydrophobicContact CB-CE1 4.21Å; F850-F870 HydrophobicContact CB-CZ 3.67Å; F850-F870 HydrophobicContact CD2-CZ 4.46Å; F850-F870 AromaticContact CG-CZ 3.99Å; F850-F870 HydrophobicContact CG-CZ 3.99Å; F850-F874 AromaticContact CD1-CD1 3.85Å; F850-F874 HydrophobicContact CD1-CD1 3.85Å; F850-F874 AromaticContact CD1-CE1 3.9Å; F850-F874 HydrophobicContact CD1-CE1 3.9Å; F850-F874 HydrophobicContact CD2-CD1 4.29Å; F850-F874 AromaticContact CE1-CD1 3.82Å; F850-F874 HydrophobicContact CE1-CD1 3.82Å; F850-F874 AromaticContact CE1-CE1 3.84Å; F850-F874 HydrophobicContact CE1-CE1 3.84Å; F850-F874 HydrophobicContact CE2-CD1 4.27Å; F850-F874 HydrophobicContact CG-CD1 4.1Å; F850-F874 HydrophobicContact CZ-CD1 4.05Å; F850-F874 HydrophobicContact CZ-CE1 4.45Å
851	A	95.4	Very high	91.5	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.017	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.3	172.8	0	0	0	0	0	110.2	M783 E784 I839 Y849 F860	M783-A851 CarbonylContact C-O 3.53Å; M783-A851 VanDerWaalsContact CA-O 3.27Å; M783-A851 WeakPolarHBondContact CA-O 3.49Å; E784-A851 PolarHBondContact N-O 2.7Å; E784-A851 PolarHBondContact O-N 2.85Å; I839-A851 HydrophobicContact CD1-CB 3.55Å; I839-A851 HydrophobicContact CG1-CB 4.02Å; I839-A851 HydrophobicContact CG2-CB 4.46Å; Y849-A851 HydrophobicContact CD2-CB 4.07Å; Y849-A851 HydrophobicContact CE2-CB 4.09Å; A851-F860 WeakPolarHBondContact CA-O 3.45Å
852	V	95.6	Very high	91.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.6	175.9	63.3	0	0	0	0	109.6	V781 F782 F814 I818 F850 F854 G859 F860	V781-V852 HydrophobicContact CG1-CG2 3.58Å; F782-V852 CarbonylContact O-C 3.58Å; F782-V852 WeakPolarHBondContact O-CA 3.47Å; F814-V852 HydrophobicContact CB-CG1 4.26Å; F814-V852 HydrophobicContact CD1-CB 4.23Å; F814-V852 HydrophobicContact CD1-CG1 3.92Å; F814-V852 HydrophobicContact CD1-CG2 4.09Å; F814-V852 HydrophobicContact CD2-CG2 4.04Å; F814-V852 HydrophobicContact CE1-CB 4.27Å; F814-V852 HydrophobicContact CE1-CG1 4.45Å; F814-V852 HydrophobicContact CE1-CG2 3.95Å; F814-V852 HydrophobicContact CE2-CG2 3.9Å; F814-V852 HydrophobicContact CG-CG1 4.05Å; F814-V852 HydrophobicContact CG-CG2 4.12Å; F814-V852 HydrophobicContact CZ-CG2 3.84Å; I818-V852 HydrophobicContact CD1-CG1 4.38Å; F850-V852 HydrophobicContact CE1-CB 3.86Å; F850-V852 HydrophobicContact CE1-CG1 4.01Å; F850-V852 HydrophobicContact CZ-CB 3.92Å; V852-F854 HydrophobicContact CG1-CE2 4.42Å; V852-F854 HydrophobicContact CG1-CZ 3.98Å; V852-F854 HydrophobicContact CG2-CE1 3.88Å; V852-F854 HydrophobicContact CG2-CZ 3.9Å; V852-G859 CarbonylContact O-C 3.48Å; V852-G859 WeakPolarHBondContact O-CA 3.38Å; V852-F860 HydrophobicContact CG1-CB 4.04Å; V852-F860 HydrophobicContact CG1-CD2 4.38Å; V852-F860 PolarHBondContact N-O 3.28Å; V852-F860 PolarHBondContact O-N 2.95Å
853	D	94.4	Very high	91.8	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	136.5	-172.7	-100.8	-24.2	0	0	0	109.6	R766 F782 G858 G859	R766-D853 IonicContact CZ-OD2 2.62Å; R766-D853 VanDerWaalsContact NH1-CG 3.26Å; R766-D853 IonicContact NH1-OD1 3.42Å; R766-D853 IonicContact NH1-OD2 3.41Å; R766-D853 PolarHBondContact NH1-OD2 3.03Å; R766-D853 IonicContact NH2-OD1 3.78Å; R766-D853 IonicContact NH2-OD2 3.44Å; F782-D853 HydrophobicContact CB-CB 4.02Å; F782-D853 PolarHBondContact N-O 2.98Å; F782-D853 PolarHBondContact O-N 2.97Å; D853-G858 WeakPolarHBondContact OD1-CA 3.11Å; D853-G859 PolarHBondContact OD1-N 3.01Å
854	F	94.6	Very high	91.9	Very high	14 Å²	14	31.4 Å²	31.4	6%	0.061	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	105.9	-169.9	-54.9	-70.9	0	0	0	110.5	V781 A810 P811 F814 V852 L856 Q857 F860	V781-F854 HydrophobicContact CG2-CD1 4.29Å; V781-F854 HydrophobicContact CG2-CE1 4.49Å; A810-F854 HydrophobicContact CB-CD1 3.91Å; A810-F854 HydrophobicContact CB-CE1 3.71Å; P811-F854 HydrophobicContact CB-CD2 4.39Å; P811-F854 HydrophobicContact CB-CE2 4.08Å; P811-F854 HydrophobicContact CB-CZ 4.3Å; P811-F854 HydrophobicContact CG-CD1 4.19Å; P811-F854 HydrophobicContact CG-CD2 3.9Å; P811-F854 HydrophobicContact CG-CE1 4.32Å; P811-F854 HydrophobicContact CG-CE2 4.02Å; P811-F854 HydrophobicContact CG-CG 4Å; P811-F854 HydrophobicContact CG-CZ 4.25Å; F814-F854 HydrophobicContact CB-CZ 3.97Å; F814-F854 AromaticContact CD2-CE1 3.73Å; F814-F854 HydrophobicContact CD2-CE1 3.73Å; F814-F854 AromaticContact CD2-CZ 3.94Å; F814-F854 HydrophobicContact CD2-CZ 3.94Å; F814-F854 HydrophobicContact CE2-CE1 4.32Å; F814-F854 HydrophobicContact CG-CE1 4.41Å; F814-F854 HydrophobicContact CG-CZ 4.16Å; V852-F854 HydrophobicContact CG1-CE2 4.42Å; V852-F854 HydrophobicContact CG1-CZ 3.98Å; V852-F854 HydrophobicContact CG2-CE1 3.88Å; V852-F854 HydrophobicContact CG2-CZ 3.9Å; F854-L856 PolarHBondContact O-N 3.19Å; F854-L856 VanDerWaalsContact O-N 3.16Å; F854-Q857 PolarHBondContact N-O 2.99Å; F854-Q857 WeakPolarHBondContact O-CA 3.46Å; F854-Q857 WeakPolarHBondContact O-CB 3.39Å; F854-Q857 PolarHBondContact O-N 3.5Å; F854-F860 AromaticContact CE2-CD2 3.88Å; F854-F860 HydrophobicContact CE2-CD2 3.88Å; F854-F860 AromaticContact CE2-CE2 3.85Å; F854-F860 HydrophobicContact CE2-CE2 3.85Å; F854-F860 HydrophobicContact CZ-CD2 4.18Å; F854-F860 HydrophobicContact CZ-CE2 4.25Å
855	G	90	Very high	91.9	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.031	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	-118.5	-175.4	0	0	0	0	0	111.7	R766 C780	R766-G855 VanDerWaalsContact CZ-O 3.28Å; R766-G855 PolarHBondContact NE-O 2.97Å; R766-G855 PolarHBondContact NH2-O 3.45Å; C780-G855 PolarHBondContact O-N 3.37Å
856	L	88.6	Confident	91.9	Very high	102 Å²	102	26.9 Å²	26.9	53%	0.534	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.3	171.6	-66.9	179.3	0	0	0	114.2	R767 V770 F854	R767-L856 HydrophobicContact CB-CD2 4.34Å; R767-L856 HydrophobicContact CG-CD2 3.69Å; V770-L856 HydrophobicContact CB-CD2 4.31Å; V770-L856 HydrophobicContact CB-CG 4.26Å; V770-L856 HydrophobicContact CG1-CG 4.05Å; V770-L856 HydrophobicContact CG2-CD2 4.18Å; V770-L856 HydrophobicContact CG2-CG 4.33Å; F854-L856 PolarHBondContact O-N 3.19Å; F854-L856 VanDerWaalsContact O-N 3.16Å
857	Q	86.2	Confident	92.1	Very high	145 Å²	145	29.5 Å²	29.5	68%	0.678	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	148.6	180	-50.5	-173.7	25.6	0	0	110.3	R766 F854	R766-Q857 PolarHBondContact NH2-O 3.47Å; F854-Q857 PolarHBondContact N-O 2.99Å; F854-Q857 WeakPolarHBondContact O-CA 3.46Å; F854-Q857 WeakPolarHBondContact O-CB 3.39Å; F854-Q857 PolarHBondContact O-N 3.5Å
858	G	83.7	Confident	92	Very high	25 Å²	25	36 Å²	36	26%	0.258	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.6	170.6	0	0	0	0	0	110.3	D853	D853-G858 WeakPolarHBondContact OD1-CA 3.11Å
859	G	92.5	Very high	91.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-121.6	-179.3	0	0	0	0	0	113.8	L834 V852 D853	L834-G859 WeakPolarHBondContact CB-O 3.49Å; L834-G859 PolarHBondContact N-O 3.44Å; V852-G859 CarbonylContact O-C 3.48Å; V852-G859 WeakPolarHBondContact O-CA 3.38Å; D853-G859 PolarHBondContact OD1-N 3.01Å
860	F	95.7	Very high	91.8	Very high	29 Å²	29	40.6 Å²	40.6	13%	0.127	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.2	-175	-53.9	-57.1	0	0	0	112.2	P811 F814 K815 I818 L831 V832 A851 V852 F854	P811-F860 HydrophobicContact CB-CE2 4.17Å; P811-F860 HydrophobicContact CB-CZ 4.45Å; P811-F860 WeakPolarHBondContact O-CE2 3.39Å; F814-F860 HydrophobicContact CB-CD2 4.32Å; K815-F860 HydrophobicContact CB-CE2 4.01Å; K815-F860 HydrophobicContact CB-CZ 4.3Å; I818-F860 HydrophobicContact CD1-CB 3.93Å; L831-F860 HydrophobicContact CD1-CD1 4.16Å; L831-F860 HydrophobicContact CD1-CE1 4.4Å; L831-F860 HydrophobicContact CD1-CG 4.29Å; L831-F860 HydrophobicContact CD2-CD1 3.7Å; L831-F860 HydrophobicContact CD2-CE1 4.06Å; L831-F860 HydrophobicContact CD2-CG 4.47Å; L831-F860 HydrophobicContact CG-CB 4.5Å; L831-F860 HydrophobicContact CG-CD1 4.01Å; L831-F860 HydrophobicContact CG-CG 4.29Å; V832-F860 CarbonylContact O-C 3.11Å; V832-F860 WeakPolarHBondContact O-CA 3.46Å; A851-F860 WeakPolarHBondContact CA-O 3.45Å; V852-F860 HydrophobicContact CG1-CB 4.04Å; V852-F860 HydrophobicContact CG1-CD2 4.38Å; V852-F860 PolarHBondContact N-O 3.28Å; V852-F860 PolarHBondContact O-N 2.95Å; F854-F860 AromaticContact CE2-CD2 3.88Å; F854-F860 HydrophobicContact CE2-CD2 3.88Å; F854-F860 AromaticContact CE2-CE2 3.85Å; F854-F860 HydrophobicContact CE2-CE2 3.85Å; F854-F860 HydrophobicContact CZ-CD2 4.18Å; F854-F860 HydrophobicContact CZ-CE2 4.25Å
861	A	95.3	Very high	91.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	148.8	164.3	0	0	0	0	0	111.2	V832 L834 V843 F850	V832-A861 HydrophobicContact CB-CB 4.32Å; V832-A861 WeakPolarHBondContact CB-O 3.46Å; V832-A861 PolarHBondContact N-O 2.91Å; V832-A861 PolarHBondContact O-N 3.45Å; L834-A861 HydrophobicContact CD1-CB 4.11Å; L834-A861 HydrophobicContact CD2-CB 3.89Å; L834-A861 HydrophobicContact CG-CB 4.13Å; V843-A861 HydrophobicContact CG2-CB 3.83Å; F850-A861 CarbonylContact O-C 3.56Å; F850-A861 WeakPolarHBondContact O-CA 3.45Å
862	H	94.3	Very high	91.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	122.6	174.7	174.5	58.9	0	0	0	108.3	I818 K830 Y849 F850 F870	I818-H862 HydrophobicContact CG2-CB 3.93Å; K830-H862 WeakPolarHBondContact O-CA 3.41Å; K830-H862 WeakPolarHBondContact O-CB 3.29Å; K830-H862 PolarHBondContact O-ND1 3.46Å; Y849-H862 CarbonylContact C-O 3.51Å; Y849-H862 VanDerWaalsContact CA-O 3.23Å; Y849-H862 WeakPolarHBondContact CA-O 3.35Å; Y849-H862 WeakPolarHBondContact CB-O 3.5Å; F850-H862 HydrophobicContact CB-CB 4.43Å; F850-H862 PolarHBondContact N-O 3.02Å; F850-H862 PolarHBondContact O-N 3.11Å; H862-F870 AromaticContact CD2-CE2 3.54Å; H862-F870 AromaticContact NE2-CD2 3.99Å; H862-F870 AromaticContact NE2-CE2 3.94Å
863	V	94.1	Very high	91.2	Very high	14 Å²	14	50.9 Å²	50.9	9%	0.085	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.9	171	179.4	0	0	0	0	107.3	N828 V843 L847	N828-V863 HydrophobicContact CB-CB 4.29Å; V843-V863 HydrophobicContact CG1-CG2 4.26Å; L847-V863 HydrophobicContact CB-CG1 4.21Å; L847-V863 HydrophobicContact CD1-CG1 4Å
864	I	93.5	Very high	91.2	Very high	3 Å²	3	51 Å²	51	2%	0.015	25%	0.25	C	S	.	.			trans	-92.3	123.1	-176.3	-58	161.5	0	0	0	107.9	M787 P848 F850 F870	M787-I864 HydrophobicContact CG-CD1 3.66Å; M787-I864 HydrophobicContact SD-CD1 3.86Å; M787-I864 HydrophobicContact SD-CG2 4.13Å; P848-I864 HydrophobicContact CB-CB 4.17Å; P848-I864 PolarHBondContact O-N 3.01Å; F850-I864 HydrophobicContact CB-CD1 4.1Å; F850-I864 HydrophobicContact CB-CG1 4.5Å; I864-F870 HydrophobicContact CD1-CD1 3.6Å; I864-F870 HydrophobicContact CD1-CD2 4.4Å; I864-F870 HydrophobicContact CD1-CE1 3.57Å; I864-F870 HydrophobicContact CD1-CE2 4.39Å; I864-F870 HydrophobicContact CD1-CG 4.02Å; I864-F870 HydrophobicContact CD1-CZ 3.98Å; I864-F870 HydrophobicContact CG1-CD1 4.12Å; I864-F870 HydrophobicContact CG1-CD2 4.04Å; I864-F870 HydrophobicContact CG1-CE1 4.21Å; I864-F870 HydrophobicContact CG1-CE2 4.15Å; I864-F870 HydrophobicContact CG1-CG 4.02Å; I864-F870 HydrophobicContact CG1-CZ 4.22Å; I864-F870 HydrophobicContact CG2-CB 3.63Å; I864-F870 HydrophobicContact CG2-CD1 4.37Å; I864-F870 HydrophobicContact CG2-CD2 4.33Å; I864-F870 HydrophobicContact CG2-CG 3.86Å
865	E	89.5	Confident	91.2	Very high	60 Å²	60	50.3 Å²	50.3	28%	0.28	25%	0.247	S	C	.	.	S	Bend	trans	-96.9	-49.3	-179.2	-59.7	-175.1	168.9	0	0	109.9	E822 A826 M827 N828	E822-E865 PolarHBondContact OE2-N 2.92Å; A826-E865 WeakPolarHBondContact CA-OE2 3.49Å; M827-E865 PolarHBondContact N-OE1 3.15Å; M827-E865 PolarHBondContact N-OE2 2.93Å; N828-E865 VanDerWaalsContact CB-OE1 3.32Å; N828-E865 WeakPolarHBondContact CB-OE1 3.5Å; N828-E865 PolarHBondContact N-OE1 2.64Å; N828-E865 PolarHBondContact ND2-OE1 3.11Å
866	N	89	Confident	91.4	Very high	55 Å²	55	52.2 Å²	52.2	29%	0.294	26%	0.255	S	S	.	.			trans	-102.7	88.3	-180	-66.6	-86.1	0	0	0	112.6	E822 Q868 K869 F870	E822-N866 HydrophobicContact CG-CB 4.12Å; E822-N866 VanDerWaalsContact OE1-CB 3.24Å; E822-N866 WeakPolarHBondContact OE1-CB 3.26Å; E822-N866 PolarHBondContact OE1-N 3.15Å; E822-N866 PolarHBondContact OE1-ND2 2.92Å; E822-N866 PolarHBondContact OE2-N 3.45Å; E822-N866 VanDerWaalsContact OE2-N 3.1Å; N866-Q868 PolarHBondContact O-N 2.79Å; N866-K869 HydrophobicContact CB-CB 4.06Å; N866-K869 HydrophobicContact CB-CD 4.05Å; N866-K869 HydrophobicContact CB-CG 4.06Å; N866-K869 PolarHBondContact O-N 2.77Å; N866-F870 PolarHBondContact O-N 3.16Å; N866-F870 VanDerWaalsContact O-N 3.14Å
867	E	88.2	Confident	91.7	Very high	69 Å²	69	49.9 Å²	49.9	32%	0.322	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-13.3	173.2	-64	-166.6	158.4	0	0	114.8	M787 N788 P848	M787-E867 HydrophobicContact SD-CB 4.41Å; M787-E867 HydrophobicContact SD-CG 4.34Å; N788-E867 WeakPolarHBondContact CA-OE1 3.32Å; N788-E867 PolarHBondContact N-OE1 3.39Å; P848-E867 HydrophobicContact CG-CG 4.41Å
868	Q	89.3	Confident	92.1	Very high	202 Å²	202	43.8 Å²	43.8	94%	0.944	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-31.4	175.6	-60.7	-173	36.6	0	0	113.7	N866	N866-Q868 PolarHBondContact O-N 2.79Å
869	K	89.1	Confident	92.7	Very high	107 Å²	107	42.6 Å²	42.6	47%	0.465	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-32.3	178.1	-67.3	179.7	-179.7	174.8	0	110.9	E822 E823 N866	E822-K869 HydrophobicContact CG-CB 3.91Å; E823-K869 IonicContact OE1-NZ 3.74Å; E823-K869 PolarHBondContact OE1-NZ 2.87Å; E823-K869 IonicContact OE2-NZ 2.74Å; E823-K869 PolarHBondContact OE2-NZ 3.3Å; N866-K869 HydrophobicContact CB-CB 4.06Å; N866-K869 HydrophobicContact CB-CD 4.05Å; N866-K869 HydrophobicContact CB-CG 4.06Å; N866-K869 PolarHBondContact O-N 2.77Å
870	F	92.4	Very high	92.7	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.026	20%	0.201	C	C	.	.	S	Bend	trans	-85.2	120.7	-177.4	-164.7	-85.6	0	0	0	112.6	T785 M787 F850 H862 I864 N866 F874	T785-F870 HydrophobicContact CG2-CE1 4.44Å; M787-F870 HydrophobicContact CE-CD1 3.8Å; M787-F870 HydrophobicContact CE-CE1 4.41Å; M787-F870 HydrophobicContact SD-CB 4.42Å; M787-F870 HydrophobicContact SD-CD1 3.87Å; F850-F870 HydrophobicContact CB-CE1 4.21Å; F850-F870 HydrophobicContact CB-CZ 3.67Å; F850-F870 HydrophobicContact CD2-CZ 4.46Å; F850-F870 AromaticContact CG-CZ 3.99Å; F850-F870 HydrophobicContact CG-CZ 3.99Å; H862-F870 AromaticContact CD2-CE2 3.54Å; H862-F870 AromaticContact NE2-CD2 3.99Å; H862-F870 AromaticContact NE2-CE2 3.94Å; I864-F870 HydrophobicContact CD1-CD1 3.6Å; I864-F870 HydrophobicContact CD1-CD2 4.4Å; I864-F870 HydrophobicContact CD1-CE1 3.57Å; I864-F870 HydrophobicContact CD1-CE2 4.39Å; I864-F870 HydrophobicContact CD1-CG 4.02Å; I864-F870 HydrophobicContact CD1-CZ 3.98Å; I864-F870 HydrophobicContact CG1-CD1 4.12Å; I864-F870 HydrophobicContact CG1-CD2 4.04Å; I864-F870 HydrophobicContact CG1-CE1 4.21Å; I864-F870 HydrophobicContact CG1-CE2 4.15Å; I864-F870 HydrophobicContact CG1-CG 4.02Å; I864-F870 HydrophobicContact CG1-CZ 4.22Å; I864-F870 HydrophobicContact CG2-CB 3.63Å; I864-F870 HydrophobicContact CG2-CD1 4.37Å; I864-F870 HydrophobicContact CG2-CD2 4.33Å; I864-F870 HydrophobicContact CG2-CG 3.86Å; N866-F870 PolarHBondContact O-N 3.16Å; N866-F870 VanDerWaalsContact O-N 3.14Å; F870-F874 HydrophobicContact CD1-CB 4.41Å; F870-F874 HydrophobicContact CE1-CB 3.56Å; F870-F874 HydrophobicContact CE1-CD1 4.32Å; F870-F874 HydrophobicContact CE1-CG 4.04Å; F870-F874 HydrophobicContact CE2-CB 4.32Å; F870-F874 AromaticContact CE2-CD1 3.97Å; F870-F874 HydrophobicContact CE2-CD1 3.97Å; F870-F874 HydrophobicContact CE2-CD2 4.2Å; F870-F874 HydrophobicContact CE2-CE1 4.3Å; F870-F874 AromaticContact CE2-CG 3.9Å; F870-F874 HydrophobicContact CE2-CG 3.9Å; F870-F874 HydrophobicContact CZ-CB 3.51Å; F870-F874 AromaticContact CZ-CD1 3.43Å; F870-F874 HydrophobicContact CZ-CD1 3.43Å; F870-F874 VanDerWaalsContact CZ-CD1 3.43Å; F870-F874 HydrophobicContact CZ-CD2 4.17Å; F870-F874 HydrophobicContact CZ-CE1 4.13Å; F870-F874 AromaticContact CZ-CG 3.43Å; F870-F874 HydrophobicContact CZ-CG 3.43Å; F870-F874 VanDerWaalsContact CZ-CG 3.43Å
871	P	92.3	Very high	92.6	Very high	36 Å²	36	43.8 Å²	43.8	23%	0.234	22%	0.222	C	C	.	.			trans	-77.7	133.8	-179.3	28.8	-31	0	0	0	112.2	Y873 F874	P871-Y873 HydrophobicContact CB-CD2 4Å; P871-Y873 HydrophobicContact CB-CE2 3.69Å; P871-Y873 HydrophobicContact CG-CE2 4.45Å; P871-Y873 PolarHBondContact O-N 2.67Å; P871-F874 HydrophobicContact CG-CB 4.07Å; P871-F874 HydrophobicContact CG-CD2 4.3Å; P871-F874 VanDerWaalsContact O-CB 3.28Å; P871-F874 WeakPolarHBondContact O-CB 3.49Å; P871-F874 PolarHBondContact O-N 3.35Å
872	H	90.4	Very high	92.5	Very high	133 Å²	133	44.6 Å²	44.6	62%	0.616	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-4.3	179	70	-88.3	0	0	0	115.6	M787	M787-H872 VanDerWaalsContact CE-CA 3.43Å; M787-H872 HydrophobicContact CE-CB 3.71Å
873	Y	92.6	Very high	92.4	Very high	49 Å²	49	46.8 Å²	46.8	19%	0.192	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	14.4	173.7	48.1	-110.1	0	0	0	112.5	P871 G875 K876 E877 W890 R891	P871-Y873 HydrophobicContact CB-CD2 4Å; P871-Y873 HydrophobicContact CB-CE2 3.69Å; P871-Y873 HydrophobicContact CG-CE2 4.45Å; P871-Y873 PolarHBondContact O-N 2.67Å; Y873-G875 PolarHBondContact O-N 2.66Å; Y873-K876 CarbonylContact O-C 3.54Å; Y873-K876 WeakPolarHBondContact O-CA 3.44Å; Y873-K876 WeakPolarHBondContact O-CB 3.48Å; Y873-K876 PolarHBondContact O-N 3.2Å; Y873-E877 HydrophobicContact CD2-CB 4.24Å; Y873-E877 WeakPolarHBondContact CE2-OE2 3.49Å; Y873-E877 PolarHBondContact O-N 3.23Å; Y873-W890 AromaticContact CD2-CD1 3.59Å; Y873-W890 AromaticContact CG-CD1 3.98Å; Y873-R891 HydrophobicContact CD1-CG 4.5Å; Y873-R891 HydrophobicContact CD2-CG 4.41Å; Y873-R891 HydrophobicContact CE1-CB 4.28Å; Y873-R891 HydrophobicContact CE1-CG 4.07Å; Y873-R891 HydrophobicContact CE2-CG 3.94Å
874	F	94.9	Very high	92.3	Very high	16 Å²	16	53.4 Å²	53.4	7%	0.07	27%	0.272	C	S	.	.	H	α-helix	trans	-42.9	-56.9	-173.4	176.2	-106.2	0	0	0	114.1	A817 I818 C821 F850 F870 P871 K876 E877 V878	A817-F874 HydrophobicContact CB-CE2 4.2Å; A817-F874 HydrophobicContact CB-CZ 3.75Å; I818-F874 HydrophobicContact CG1-CE1 3.92Å; I818-F874 HydrophobicContact CG1-CZ 4.12Å; C821-F874 HydrophobicContact CB-CE2 3.71Å; C821-F874 HydrophobicContact CB-CZ 4.04Å; F850-F874 AromaticContact CD1-CD1 3.85Å; F850-F874 HydrophobicContact CD1-CD1 3.85Å; F850-F874 AromaticContact CD1-CE1 3.9Å; F850-F874 HydrophobicContact CD1-CE1 3.9Å; F850-F874 HydrophobicContact CD2-CD1 4.29Å; F850-F874 AromaticContact CE1-CD1 3.82Å; F850-F874 HydrophobicContact CE1-CD1 3.82Å; F850-F874 AromaticContact CE1-CE1 3.84Å; F850-F874 HydrophobicContact CE1-CE1 3.84Å; F850-F874 HydrophobicContact CE2-CD1 4.27Å; F850-F874 HydrophobicContact CG-CD1 4.1Å; F850-F874 HydrophobicContact CZ-CD1 4.05Å; F850-F874 HydrophobicContact CZ-CE1 4.45Å; F870-F874 HydrophobicContact CD1-CB 4.41Å; F870-F874 HydrophobicContact CE1-CB 3.56Å; F870-F874 HydrophobicContact CE1-CD1 4.32Å; F870-F874 HydrophobicContact CE1-CG 4.04Å; F870-F874 HydrophobicContact CE2-CB 4.32Å; F870-F874 AromaticContact CE2-CD1 3.97Å; F870-F874 HydrophobicContact CE2-CD1 3.97Å; F870-F874 HydrophobicContact CE2-CD2 4.2Å; F870-F874 HydrophobicContact CE2-CE1 4.3Å; F870-F874 AromaticContact CE2-CG 3.9Å; F870-F874 HydrophobicContact CE2-CG 3.9Å; F870-F874 HydrophobicContact CZ-CB 3.51Å; F870-F874 AromaticContact CZ-CD1 3.43Å; F870-F874 HydrophobicContact CZ-CD1 3.43Å; F870-F874 VanDerWaalsContact CZ-CD1 3.43Å; F870-F874 HydrophobicContact CZ-CD2 4.17Å; F870-F874 HydrophobicContact CZ-CE1 4.13Å; F870-F874 AromaticContact CZ-CG 3.43Å; F870-F874 HydrophobicContact CZ-CG 3.43Å; F870-F874 VanDerWaalsContact CZ-CG 3.43Å; P871-F874 HydrophobicContact CG-CB 4.07Å; P871-F874 HydrophobicContact CG-CD2 4.3Å; P871-F874 VanDerWaalsContact O-CB 3.28Å; P871-F874 WeakPolarHBondContact O-CB 3.49Å; P871-F874 PolarHBondContact O-N 3.35Å; F874-K876 VanDerWaalsContact C-N 3.26Å; F874-K876 PolarHBondContact O-N 2.83Å; F874-E877 WeakPolarHBondContact O-CA 3.35Å; F874-E877 WeakPolarHBondContact O-CB 3.3Å; F874-E877 PolarHBondContact O-N 3.18Å; F874-V878 HydrophobicContact CE1-CG2 4.34Å; F874-V878 HydrophobicContact CE2-CG2 4.32Å; F874-V878 HydrophobicContact CZ-CG2 4.17Å; F874-V878 PolarHBondContact O-N 2.84Å
875	G	93.9	Very high	92.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-29.4	-179.2	0	0	0	0	0	114.3	Y873 E877 V879	Y873-G875 PolarHBondContact O-N 2.66Å; G875-E877 VanDerWaalsContact C-N 3.35Å; G875-V879 WeakPolarHBondContact O-CB 3.39Å; G875-V879 WeakPolarHBondContact O-CG2 3.24Å; G875-V879 PolarHBondContact O-N 2.68Å
876	K	93.8	Very high	92.3	Very high	43 Å²	43	56.3 Å²	56.3	19%	0.187	29%	0.286	C	S	.	.	H	α-helix	trans	-75.6	-23.7	172.9	-59	-179.3	-176.7	170.2	0	113	M735 M783 E798 I800 Y873 F874 G880 W890	M735-K876 HydrophobicContact CE-CB 4.27Å; M735-K876 VanDerWaalsContact CE-O 3.31Å; M735-K876 WeakPolarHBondContact CE-O 3.46Å; M783-K876 HydrophobicContact CE-CG 4.08Å; E798-K876 VanDerWaalsContact CD-NZ 3.29Å; E798-K876 VanDerWaalsContact OE1-CE 3.29Å; E798-K876 WeakPolarHBondContact OE1-CE 3.43Å; E798-K876 IonicContact OE1-NZ 3.38Å; E798-K876 PolarHBondContact OE1-NZ 2.88Å; E798-K876 WeakPolarHBondContact OE2-CE 3.36Å; E798-K876 IonicContact OE2-NZ 3.5Å; E798-K876 PolarHBondContact OE2-NZ 3.35Å; E798-K876 VanDerWaalsContact OE2-NZ 3.12Å; I800-K876 HydrophobicContact CD1-CG 4.38Å; Y873-K876 CarbonylContact O-C 3.54Å; Y873-K876 WeakPolarHBondContact O-CA 3.44Å; Y873-K876 WeakPolarHBondContact O-CB 3.48Å; Y873-K876 PolarHBondContact O-N 3.2Å; F874-K876 VanDerWaalsContact C-N 3.26Å; F874-K876 PolarHBondContact O-N 2.83Å; K876-G880 VanDerWaalsContact O-CA 3.28Å; K876-G880 WeakPolarHBondContact O-CA 3.4Å; K876-G880 PolarHBondContact O-N 3.46Å; K876-W890 HydrophobicContact CB-CB 3.5Å; K876-W890 VanDerWaalsContact CB-CB 3.5Å; K876-W890 HydrophobicContact CB-CG 4.12Å; K876-W890 HydrophobicContact CD-CB 4.1Å; K876-W890 HydrophobicContact CG-CB 4.43Å
877	E	95.1	Very high	92.5	Very high	52 Å²	52	56.4 Å²	56.4	24%	0.243	29%	0.29	C	S	.	.	H	α-helix	trans	-77.6	-38.5	173.6	-169.3	147.4	-108.6	0	0	111	Y873 F874 G875 G881 W890 R891	Y873-E877 HydrophobicContact CD2-CB 4.24Å; Y873-E877 WeakPolarHBondContact CE2-OE2 3.49Å; Y873-E877 PolarHBondContact O-N 3.23Å; F874-E877 WeakPolarHBondContact O-CA 3.35Å; F874-E877 WeakPolarHBondContact O-CB 3.3Å; F874-E877 PolarHBondContact O-N 3.18Å; G875-E877 VanDerWaalsContact C-N 3.35Å; E877-G881 PolarHBondContact O-N 2.87Å; E877-W890 HydrophobicContact CG-CZ2 4.13Å; E877-W890 PolarHBondContact OE1-NE1 2.92Å; E877-R891 IonicContact OE1-CZ 2.71Å; E877-R891 VanDerWaalsContact OE1-CZ 3.29Å; E877-R891 IonicContact OE1-NE 3.49Å; E877-R891 PolarHBondContact OE1-NE 3.2Å; E877-R891 IonicContact OE1-NH2 3.75Å; E877-R891 PolarHBondContact OE1-NH2 3.49Å
878	V	95.4	Very high	92.5	Very high	18 Å²	18	60.6 Å²	60.6	11%	0.109	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-55.6	169.9	179.9	0	0	0	0	110.5	F814 A817 F874 G880 G881 M882	F814-V878 HydrophobicContact CD1-CB 4.34Å; F814-V878 HydrophobicContact CD1-CG1 4.03Å; F814-V878 HydrophobicContact CD1-CG2 4.37Å; F814-V878 HydrophobicContact CD2-CG1 4.02Å; F814-V878 HydrophobicContact CE1-CB 3.91Å; F814-V878 HydrophobicContact CE1-CG1 3.98Å; F814-V878 HydrophobicContact CE1-CG2 4.17Å; F814-V878 HydrophobicContact CE2-CG1 3.98Å; F814-V878 HydrophobicContact CG-CG1 4.06Å; F814-V878 HydrophobicContact CZ-CB 4.01Å; F814-V878 HydrophobicContact CZ-CG1 3.96Å; A817-V878 HydrophobicContact CB-CG2 3.58Å; F874-V878 HydrophobicContact CE1-CG2 4.34Å; F874-V878 HydrophobicContact CE2-CG2 4.32Å; F874-V878 HydrophobicContact CZ-CG2 4.17Å; F874-V878 PolarHBondContact O-N 2.84Å; V878-G880 PolarHBondContact O-N 3.14Å; V878-G881 PolarHBondContact O-N 3.42Å; V878-M882 HydrophobicContact CG1-SD 4.18Å; V878-M882 WeakPolarHBondContact O-CG 3.46Å; V878-M882 PolarHBondContact O-N 3.09Å
879	V	94.6	Very high	92.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-37.8	179.5	172.8	0	0	0	0	112.1	V781 I800 L802 F814 G875 G881 M882 M883	V781-V879 HydrophobicContact CG1-CG2 4.5Å; I800-V879 HydrophobicContact CG2-CG1 3.99Å; L802-V879 HydrophobicContact CD2-CG1 3.64Å; F814-V879 HydrophobicContact CE2-CG2 3.82Å; F814-V879 HydrophobicContact CZ-CG2 3.79Å; G875-V879 WeakPolarHBondContact O-CB 3.39Å; G875-V879 WeakPolarHBondContact O-CG2 3.24Å; G875-V879 PolarHBondContact O-N 2.68Å; V879-G881 VanDerWaalsContact C-N 3.31Å; V879-G881 PolarHBondContact O-N 2.93Å; V879-M882 PolarHBondContact O-N 3.12Å; V879-M883 HydrophobicContact CG1-CG 4.39Å; V879-M883 HydrophobicContact CG1-SD 4.05Å; V879-M883 WeakPolarHBondContact O-CG 3.41Å; V879-M883 PolarHBondContact O-N 3.34Å
880	G	93.9	Very high	92.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-36.8	175.1	0	0	0	0	0	112.9	K876 V878 D884 L885	K876-G880 VanDerWaalsContact O-CA 3.28Å; K876-G880 WeakPolarHBondContact O-CA 3.4Å; K876-G880 PolarHBondContact O-N 3.46Å; V878-G880 PolarHBondContact O-N 3.14Å; G880-D884 PolarHBondContact O-N 3Å; G880-L885 PolarHBondContact O-N 3.45Å
881	G	93.7	Very high	92.2	Very high	55 Å²	55	57 Å²	57	57%	0.567	28%	0.277	S	S	*	.	H	α-helix	trans	-72.7	-34.1	172	0	0	0	0	0	113.8	E877 V878 V879 M883	E877-G881 PolarHBondContact O-N 2.87Å; V878-G881 PolarHBondContact O-N 3.42Å; V879-G881 VanDerWaalsContact C-N 3.31Å; V879-G881 PolarHBondContact O-N 2.93Å; G881-M883 VanDerWaalsContact C-N 3.32Å
882	M	93.1	Very high	91.9	Very high	17 Å²	17	63.4 Å²	63.4	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-32.6	173.3	-70.1	168	58.1	0	0	113	L802 L806 A810 Y813 V878 V879	L802-M882 HydrophobicContact CD1-CE 4.03Å; L806-M882 HydrophobicContact CB-CE 4.25Å; L806-M882 WeakPolarHBondContact O-CE 3.23Å; A810-M882 HydrophobicContact CB-CE 3.72Å; A810-M882 HydrophobicContact CB-SD 4.48Å; Y813-M882 HydrophobicContact CD1-CG 3.76Å; Y813-M882 HydrophobicContact CD2-CE 4.07Å; Y813-M882 HydrophobicContact CD2-CG 3.69Å; Y813-M882 HydrophobicContact CD2-SD 3.92Å; Y813-M882 HydrophobicContact CE1-CG 4.13Å; Y813-M882 HydrophobicContact CE2-CG 4.08Å; Y813-M882 HydrophobicContact CG-CG 3.52Å; Y813-M882 HydrophobicContact CG-SD 3.82Å; V878-M882 HydrophobicContact CG1-SD 4.18Å; V878-M882 WeakPolarHBondContact O-CG 3.46Å; V878-M882 PolarHBondContact O-N 3.09Å; V879-M882 PolarHBondContact O-N 3.12Å
883	M	91.1	Very high	91.6	Very high	47 Å²	47	62 Å²	62	23%	0.232	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	6.8	-179	-63.7	-174.2	78.3	0	0	113.9	L802 L806 V879 G881 L885	L802-M883 HydrophobicContact CD2-CG 4.15Å; L802-M883 HydrophobicContact CD2-SD 3.51Å; L802-M883 VanDerWaalsContact CD2-SD 3.51Å; L806-M883 HydrophobicContact CD1-CG 4.06Å; V879-M883 HydrophobicContact CG1-CG 4.39Å; V879-M883 HydrophobicContact CG1-SD 4.05Å; V879-M883 WeakPolarHBondContact O-CG 3.41Å; V879-M883 PolarHBondContact O-N 3.34Å; G881-M883 VanDerWaalsContact C-N 3.32Å; M883-L885 VanDerWaalsContact C-N 3.33Å; M883-L885 HydrophobicContact CB-CD1 3.85Å; M883-L885 HydrophobicContact CB-CD2 4.5Å; M883-L885 HydrophobicContact CB-CG 3.71Å; M883-L885 PolarHBondContact O-N 3.41Å; M883-L885 HydrophobicContact SD-CD1 4.13Å
884	D	93.1	Very high	91.4	Very high	154 Å²	154	62.6 Å²	62.6	82%	0.824	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	49.8	-173.6	-160.1	24.1	0	0	0	114.5	G880	G880-D884 PolarHBondContact O-N 3Å
885	L	91.6	Very high	91	Very high	29 Å²	29	72.1 Å²	72.1	15%	0.152	34%	0.339	C	S	.	.			trans	-92.8	151.3	-176.7	-66.5	178.3	0	0	0	112.4	M735 G880 M883 P887 W890	M735-L885 HydrophobicContact CB-CD1 4.41Å; M735-L885 HydrophobicContact CE-CD1 4.02Å; M735-L885 VanDerWaalsContact O-CD1 3.3Å; M735-L885 WeakPolarHBondContact O-CD1 3.46Å; G880-L885 PolarHBondContact O-N 3.45Å; M883-L885 VanDerWaalsContact C-N 3.33Å; M883-L885 HydrophobicContact CB-CD1 3.85Å; M883-L885 HydrophobicContact CB-CD2 4.5Å; M883-L885 HydrophobicContact CB-CG 3.71Å; M883-L885 PolarHBondContact O-N 3.41Å; M883-L885 HydrophobicContact SD-CD1 4.13Å; L885-P887 WeakPolarHBondContact O-CD 3.4Å; L885-W890 HydrophobicContact CB-CZ3 3.83Å; L885-W890 WeakPolarHBondContact O-CH2 3.31Å; L885-W890 WeakPolarHBondContact O-CZ3 3.41Å
886	E	91	Very high	90.6	Very high	95 Å²	95	74.3 Å²	74.3	44%	0.444	35%	0.349	S	S	.	.			trans	-62.6	125.7	176.3	-170.1	-168.5	-151.6	0	0	111.1	R888 R889 W890	E886-R888 HydrophobicContact CG-CB 4.22Å; E886-R888 HydrophobicContact CG-CG 4.49Å; E886-R888 PolarHBondContact O-N 2.99Å; E886-R888 VanDerWaalsContact OE1-CD 3.3Å; E886-R888 WeakPolarHBondContact OE1-CD 3.49Å; E886-R888 IonicContact OE1-CZ 3.8Å; E886-R888 IonicContact OE1-NE 3.72Å; E886-R888 IonicContact OE1-NH1 3.09Å; E886-R888 PolarHBondContact OE1-NH1 3.26Å; E886-R888 IonicContact OE2-CZ 3.65Å; E886-R888 IonicContact OE2-NH1 2.72Å; E886-R888 PolarHBondContact OE2-NH1 2.9Å; E886-R889 PolarHBondContact O-N 3.45Å; E886-W890 WeakPolarHBondContact O-CZ3 3.32Å
887	P	92	Very high	90.3	Very high	57 Å²	57	77.5 Å²	77.5	37%	0.37	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-13	-178.3	-29.2	35.9	0	0	0	116.3	L885 R889 W890 R891	L885-P887 WeakPolarHBondContact O-CD 3.4Å; P887-R889 VanDerWaalsContact C-N 3.28Å; P887-R889 PolarHBondContact O-N 2.97Å; P887-W890 HydrophobicContact CB-CH2 4.06Å; P887-W890 HydrophobicContact CB-CZ2 3.76Å; P887-W890 HydrophobicContact CG-CH2 3.87Å; P887-W890 HydrophobicContact CG-CZ2 3.86Å; P887-R891 VanDerWaalsContact O-CB 3.26Å; P887-R891 WeakPolarHBondContact O-CB 3.45Å; P887-R891 VanDerWaalsContact O-CG 3.22Å; P887-R891 WeakPolarHBondContact O-CG 3.24Å; P887-R891 PolarHBondContact O-N 3.02Å; P887-R891 VanDerWaalsContact O-N 3.1Å
888	R	90.1	Very high	89.8	Confident	157 Å²	157	76 Å²	76	59%	0.592	36%	0.361	S	S	*	.	H	α-helix	trans	-67.9	-24.3	172.3	-73.4	166.7	61.5	-149.6	8.4	112.9	E886 I894	E886-R888 HydrophobicContact CG-CB 4.22Å; E886-R888 HydrophobicContact CG-CG 4.49Å; E886-R888 PolarHBondContact O-N 2.99Å; E886-R888 VanDerWaalsContact OE1-CD 3.3Å; E886-R888 WeakPolarHBondContact OE1-CD 3.49Å; E886-R888 IonicContact OE1-CZ 3.8Å; E886-R888 IonicContact OE1-NE 3.72Å; E886-R888 IonicContact OE1-NH1 3.09Å; E886-R888 PolarHBondContact OE1-NH1 3.26Å; E886-R888 IonicContact OE2-CZ 3.65Å; E886-R888 IonicContact OE2-NH1 2.72Å; E886-R888 PolarHBondContact OE2-NH1 2.9Å; R888-I894 HydrophobicContact CB-CD1 4.27Å
889	R	86.7	Confident	89.4	Confident	89 Å²	89	79.7 Å²	79.7	34%	0.336	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-44	177.1	-66.3	-168	-175.2	-165.3	2.7	112.2	V733 M735 E886 P887	V733-R889 HydrophobicContact CG1-CG 4.39Å; M735-R889 PolarHBondContact O-NH1 3.47Å; M735-R889 HydrophobicContact SD-CB 3.74Å; E886-R889 PolarHBondContact O-N 3.45Å; P887-R889 VanDerWaalsContact C-N 3.28Å; P887-R889 PolarHBondContact O-N 2.97Å
890	W	88.9	Confident	89.1	Confident	24 Å²	24	82.1 Å²	82.1	9%	0.091	39%	0.393	C	S	.	.	H	α-helix	trans	-97.8	-34.8	-177.1	62	96.4	0	0	0	115.2	M735 Y873 K876 E877 L885 E886 P887 K892	M735-W890 HydrophobicContact CE-CB 4.31Å; M735-W890 HydrophobicContact CE-CD2 4.35Å; M735-W890 HydrophobicContact CE-CE3 3.68Å; M735-W890 HydrophobicContact CE-CZ3 4.3Å; M735-W890 HydrophobicContact SD-CB 3.99Å; M735-W890 HydrophobicContact SD-CE3 4.06Å; Y873-W890 AromaticContact CD2-CD1 3.59Å; Y873-W890 AromaticContact CG-CD1 3.98Å; K876-W890 HydrophobicContact CB-CB 3.5Å; K876-W890 VanDerWaalsContact CB-CB 3.5Å; K876-W890 HydrophobicContact CB-CG 4.12Å; K876-W890 HydrophobicContact CD-CB 4.1Å; K876-W890 HydrophobicContact CG-CB 4.43Å; E877-W890 HydrophobicContact CG-CZ2 4.13Å; E877-W890 PolarHBondContact OE1-NE1 2.92Å; L885-W890 HydrophobicContact CB-CZ3 3.83Å; L885-W890 WeakPolarHBondContact O-CH2 3.31Å; L885-W890 WeakPolarHBondContact O-CZ3 3.41Å; E886-W890 WeakPolarHBondContact O-CZ3 3.32Å; P887-W890 HydrophobicContact CB-CH2 4.06Å; P887-W890 HydrophobicContact CB-CZ2 3.76Å; P887-W890 HydrophobicContact CG-CH2 3.87Å; P887-W890 HydrophobicContact CG-CZ2 3.86Å; W890-K892 VanDerWaalsContact C-N 3.33Å; W890-K892 PolarHBondContact O-N 3.13Å
891	R	88.8	Confident	88.8	Confident	126 Å²	126	83.1 Å²	83.1	48%	0.475	40%	0.398	S	S	.	.	H	α-helix	trans	-69	-27.9	-173.9	-67.8	-178.6	171.2	-163.9	-4.9	113.8	Y873 E877 P887	Y873-R891 HydrophobicContact CD1-CG 4.5Å; Y873-R891 HydrophobicContact CD2-CG 4.41Å; Y873-R891 HydrophobicContact CE1-CB 4.28Å; Y873-R891 HydrophobicContact CE1-CG 4.07Å; Y873-R891 HydrophobicContact CE2-CG 3.94Å; E877-R891 IonicContact OE1-CZ 2.71Å; E877-R891 VanDerWaalsContact OE1-CZ 3.29Å; E877-R891 IonicContact OE1-NE 3.49Å; E877-R891 PolarHBondContact OE1-NE 3.2Å; E877-R891 IonicContact OE1-NH2 3.75Å; E877-R891 PolarHBondContact OE1-NH2 3.49Å; P887-R891 VanDerWaalsContact O-CB 3.26Å; P887-R891 WeakPolarHBondContact O-CB 3.45Å; P887-R891 VanDerWaalsContact O-CG 3.22Å; P887-R891 WeakPolarHBondContact O-CG 3.24Å; P887-R891 PolarHBondContact O-N 3.02Å; P887-R891 VanDerWaalsContact O-N 3.1Å
892	K	86.2	Confident	88.6	Confident	171 Å²	171	85.1 Å²	85.1	74%	0.743	39%	0.388	S	S	*	.	S	Bend	trans	-152.1	120.5	173.6	-67.3	-173	-179.4	175.3	0	110.2	W890 I894	W890-K892 VanDerWaalsContact C-N 3.33Å; W890-K892 PolarHBondContact O-N 3.13Å; K892-I894 PolarHBondContact O-N 3.44Å
893	L	82.8	Confident	88.5	Confident	104 Å²	104	90.2 Å²	90.2	55%	0.545	41%	0.41	S	S	.	.			trans	-56.2	112.5	-179.6	-173	66.9	0	0	0	111.8	R895	L893-R895 PolarHBondContact O-N 2.97Å
894	I	88.6	Confident	88.5	Confident	61 Å²	61	90.5 Å²	90.5	31%	0.313	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-75.3	118.7	173.1	-56.9	173.1	0	0	0	107.4	G732 V733 R888 K892	G732-I894 CarbonylContact C-O 3.57Å; G732-I894 WeakPolarHBondContact CA-O 3.27Å; V733-I894 HydrophobicContact CB-CB 4.14Å; V733-I894 HydrophobicContact CG2-CB 3.68Å; V733-I894 HydrophobicContact CG2-CG2 3.71Å; V733-I894 PolarHBondContact N-O 2.82Å; R888-I894 HydrophobicContact CB-CD1 4.27Å; K892-I894 PolarHBondContact O-N 3.44Å
895	R	85.9	Confident	88.4	Confident	215 Å²	215	83.1 Å²	83.1	81%	0.811	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-71.8	136.4	177	-75.2	-177.8	167.2	130.8	-3.4	110.7	L893	L893-R895 PolarHBondContact O-N 2.97Å
896	E	85.9	Confident	88.4	Confident	47 Å²	47	85 Å²	85	22%	0.22	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-100.5	169.7	176.2	-66.4	-176.6	137.9	0	0	111.3	V733 Q901 K904	V733-E896 WeakPolarHBondContact CA-OE1 3.46Å; V733-E896 HydrophobicContact CG2-CG 3.67Å; E896-Q901 HydrophobicContact CB-CG 4.11Å; E896-K904 IonicContact OE1-NZ 2.8Å; E896-K904 PolarHBondContact OE1-NZ 3.43Å; E896-K904 IonicContact OE2-NZ 2.79Å; E896-K904 PolarHBondContact OE2-NZ 3.39Å
897	N	88.3	Confident	88.6	Confident	109 Å²	109	83.8 Å²	83.8	58%	0.583	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-74.1	155	170.9	-53.1	-55.4	0	0	0	110.6	D899 D900 Q901	N897-D899 PolarHBondContact O-N 3.17Å; N897-D900 WeakPolarHBondContact CB-OD2 3.27Å; N897-D900 PolarHBondContact ND2-OD2 3.47Å; N897-D900 PolarHBondContact O-N 3.14Å; N897-Q901 WeakPolarHBondContact O-CG 3.28Å; N897-Q901 PolarHBondContact O-N 3.42Å; N897-Q901 VanDerWaalsContact O-N 3.1Å
898	F	84.7	Confident	88.7	Confident	20 Å²	20	81.2 Å²	81.2	9%	0.088	36%	0.358	C	S	.	.	H	α-helix	trans	-59.5	-43.5	178.1	-176.7	-94.1	0	0	0	112.9	E51 W54 H716 D900 Q901 R902	E51-F898 HydrophobicContact CB-CD1 4.35Å; E51-F898 HydrophobicContact CB-CD2 3.71Å; E51-F898 HydrophobicContact CB-CE1 4.48Å; E51-F898 HydrophobicContact CB-CE2 3.85Å; E51-F898 HydrophobicContact CB-CG 3.98Å; E51-F898 HydrophobicContact CB-CZ 4.25Å; E51-F898 HydrophobicContact CG-CB 3.87Å; E51-F898 HydrophobicContact CG-CD1 3.88Å; E51-F898 HydrophobicContact CG-CD2 3.82Å; E51-F898 HydrophobicContact CG-CE1 4.41Å; E51-F898 HydrophobicContact CG-CE2 4.35Å; E51-F898 HydrophobicContact CG-CG 3.55Å; E51-F898 VanDerWaalsContact O-CE2 3.23Å; E51-F898 WeakPolarHBondContact O-CE2 3.41Å; W54-F898 HydrophobicContact CB-CZ 4.13Å; W54-F898 HydrophobicContact CE3-CE1 4.5Å; W54-F898 HydrophobicContact CE3-CZ 4.01Å; H716-F898 HydrophobicContact CB-CE2 4Å; H716-F898 HydrophobicContact CB-CZ 4.24Å; H716-F898 AromaticContact CD2-CD2 3.85Å; H716-F898 AromaticContact CD2-CE2 3.36Å; H716-F898 WeakPolarHBondContact CD2-CE2 2.87Å; H716-F898 AromaticContact CE1-CE2 4Å; H716-F898 AromaticContact CG-CE2 3.55Å; H716-F898 AromaticContact ND1-CE2 3.98Å; H716-F898 AromaticContact NE2-CD2 3.74Å; H716-F898 AromaticContact NE2-CE2 3.67Å; F898-D900 VanDerWaalsContact C-N 3.28Å; F898-D900 PolarHBondContact O-N 2.9Å; F898-Q901 WeakPolarHBondContact O-CB 3.43Å; F898-Q901 PolarHBondContact O-N 3.09Å; F898-R902 HydrophobicContact CE1-CB 4.41Å; F898-R902 WeakPolarHBondContact O-CB 3.49Å; F898-R902 PolarHBondContact O-N 3.14Å
899	D	85.6	Confident	88.8	Confident	96 Å²	96	74.9 Å²	74.9	51%	0.513	34%	0.339	S	S	.	.	H	α-helix	trans	-65.4	-32	-179	-62.8	-58.8	0	0	0	112.8	N897 R902 K903	N897-D899 PolarHBondContact O-N 3.17Å; D899-R902 PolarHBondContact O-N 3.14Å; D899-K903 WeakPolarHBondContact O-CE 3.46Å; D899-K903 WeakPolarHBondContact O-CG 3.42Å; D899-K903 PolarHBondContact O-N 3.37Å
900	D	88.3	Confident	89.1	Confident	52 Å²	52	77.5 Å²	77.5	28%	0.278	36%	0.355	S	S	.	.	H	α-helix	trans	-76.2	-38.5	178.6	-57.8	-42	0	0	0	111	N897 F898 K903 K904	N897-D900 WeakPolarHBondContact CB-OD2 3.27Å; N897-D900 PolarHBondContact ND2-OD2 3.47Å; N897-D900 PolarHBondContact O-N 3.14Å; F898-D900 VanDerWaalsContact C-N 3.28Å; F898-D900 PolarHBondContact O-N 2.9Å; D900-K903 PolarHBondContact O-N 3.35Å; D900-K903 IonicContact OD1-NZ 2.69Å; D900-K903 PolarHBondContact OD1-NZ 3.35Å; D900-K904 WeakPolarHBondContact O-CG 3.31Å; D900-K904 PolarHBondContact O-N 3.28Å; D900-K904 VanDerWaalsContact O-N 3.12Å
901	Q	89.1	Confident	89.3	Confident	20 Å²	20	79.9 Å²	79.9	9%	0.093	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-46.6	167.6	-72.6	176.7	-9.1	0	0	111.6	H716 L717 A731 E896 N897 F898 K903 K904 V905	H716-Q901 PolarHBondContact NE2-OE1 2.74Å; L717-Q901 HydrophobicContact CD2-CB 3.88Å; L717-Q901 HydrophobicContact CD2-CG 4.23Å; A731-Q901 PolarHBondContact O-NE2 2.93Å; A731-Q901 VanDerWaalsContact O-NE2 3.16Å; E896-Q901 HydrophobicContact CB-CG 4.11Å; N897-Q901 WeakPolarHBondContact O-CG 3.28Å; N897-Q901 PolarHBondContact O-N 3.42Å; N897-Q901 VanDerWaalsContact O-N 3.1Å; F898-Q901 WeakPolarHBondContact O-CB 3.43Å; F898-Q901 PolarHBondContact O-N 3.09Å; Q901-K903 PolarHBondContact O-N 2.82Å; Q901-K904 PolarHBondContact O-N 3.27Å; Q901-V905 WeakPolarHBondContact O-CG2 3.45Å; Q901-V905 PolarHBondContact O-N 3.06Å
902	R	88.1	Confident	89.6	Confident	97 Å²	97	74 Å²	74	37%	0.366	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-42.4	177.4	173	168.2	-177.4	-149.1	-1.4	112.6	W54 F898 D899 V905 L906	W54-R902 HydrophobicContact CD2-CG 4.12Å; W54-R902 HydrophobicContact CE3-CB 4.21Å; W54-R902 HydrophobicContact CE3-CG 3.88Å; W54-R902 HydrophobicContact CH2-CB 4.35Å; W54-R902 HydrophobicContact CH2-CG 3.7Å; W54-R902 HydrophobicContact CZ2-CG 3.9Å; W54-R902 HydrophobicContact CZ3-CB 3.94Å; W54-R902 HydrophobicContact CZ3-CG 3.68Å; F898-R902 HydrophobicContact CE1-CB 4.41Å; F898-R902 WeakPolarHBondContact O-CB 3.49Å; F898-R902 PolarHBondContact O-N 3.14Å; D899-R902 PolarHBondContact O-N 3.14Å; R902-V905 PolarHBondContact O-N 3.23Å; R902-L906 HydrophobicContact CG-CD1 4.03Å; R902-L906 WeakPolarHBondContact O-CG 3.34Å; R902-L906 PolarHBondContact O-N 2.94Å
903	K	90.9	Very high	89.8	Confident	124 Å²	124	71.9 Å²	71.9	54%	0.539	33%	0.332	S	S	.	.	H	α-helix	trans	-59	-48	174	-70.9	162.2	-152.7	164.9	0	111.4	D899 D900 Q901 V905 L906 Q907	D899-K903 WeakPolarHBondContact O-CE 3.46Å; D899-K903 WeakPolarHBondContact O-CG 3.42Å; D899-K903 PolarHBondContact O-N 3.37Å; D900-K903 PolarHBondContact O-N 3.35Å; D900-K903 IonicContact OD1-NZ 2.69Å; D900-K903 PolarHBondContact OD1-NZ 3.35Å; Q901-K903 PolarHBondContact O-N 2.82Å; K903-V905 PolarHBondContact O-N 3.27Å; K903-L906 PolarHBondContact O-N 3.35Å; K903-Q907 WeakPolarHBondContact O-CB 3.39Å; K903-Q907 PolarHBondContact O-N 3.07Å
904	K	91.4	Very high	90.3	Very high	53 Å²	53	71.4 Å²	71.4	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-43.3	178.1	-69.9	178.2	-178.1	-173.8	0	112.7	L729 S734 E896 D900 Q901 L906 Q907 F908	L729-K904 HydrophobicContact CD1-CB 4.06Å; S734-K904 PolarHBondContact OG-NZ 3Å; E896-K904 IonicContact OE1-NZ 2.8Å; E896-K904 PolarHBondContact OE1-NZ 3.43Å; E896-K904 IonicContact OE2-NZ 2.79Å; E896-K904 PolarHBondContact OE2-NZ 3.39Å; D900-K904 WeakPolarHBondContact O-CG 3.31Å; D900-K904 PolarHBondContact O-N 3.28Å; D900-K904 VanDerWaalsContact O-N 3.12Å; Q901-K904 PolarHBondContact O-N 3.27Å; K904-L906 VanDerWaalsContact C-N 3.33Å; K904-L906 PolarHBondContact O-N 2.92Å; K904-Q907 PolarHBondContact O-N 3.14Å; K904-F908 VanDerWaalsContact O-CB 3.3Å; K904-F908 WeakPolarHBondContact O-CB 3.43Å; K904-F908 PolarHBondContact O-N 2.93Å
905	V	91.9	Very high	90.4	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-42.4	176.5	173.6	0	0	0	0	110.9	W54 L56 H716 L717 L729 Q901 R902 K903 A909	W54-V905 HydrophobicContact CH2-CB 4.24Å; W54-V905 HydrophobicContact CH2-CG1 3.95Å; W54-V905 HydrophobicContact CZ3-CB 4.46Å; W54-V905 HydrophobicContact CZ3-CG1 4.33Å; L56-V905 HydrophobicContact CD1-CG1 3.78Å; L56-V905 HydrophobicContact CD2-CG1 4.09Å; L56-V905 HydrophobicContact CG-CG1 3.83Å; H716-V905 WeakPolarHBondContact O-CG2 3.43Å; L717-V905 HydrophobicContact CD2-CG2 3.89Å; L729-V905 HydrophobicContact CD1-CB 4.43Å; L729-V905 HydrophobicContact CD1-CG2 3.85Å; L729-V905 HydrophobicContact CG-CG2 4.45Å; Q901-V905 WeakPolarHBondContact O-CG2 3.45Å; Q901-V905 PolarHBondContact O-N 3.06Å; R902-V905 PolarHBondContact O-N 3.23Å; K903-V905 PolarHBondContact O-N 3.27Å; V905-A909 WeakPolarHBondContact O-CB 3.27Å; V905-A909 PolarHBondContact O-N 3.4Å
906	L	92.3	Very high	90.5	Very high	68 Å²	68	62.6 Å²	62.6	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-43.3	176.9	-72.6	167	0	0	0	112.8	W54 L56 R902 K903 K904 A909 Q910	W54-L906 HydrophobicContact CH2-CD2 4.49Å; W54-L906 HydrophobicContact CH2-CG 4.2Å; W54-L906 HydrophobicContact CZ2-CD1 4.34Å; W54-L906 HydrophobicContact CZ2-CD2 4.04Å; W54-L906 HydrophobicContact CZ2-CG 4.09Å; L56-L906 HydrophobicContact CD2-CD2 4Å; R902-L906 HydrophobicContact CG-CD1 4.03Å; R902-L906 WeakPolarHBondContact O-CG 3.34Å; R902-L906 PolarHBondContact O-N 2.94Å; K903-L906 PolarHBondContact O-N 3.35Å; K904-L906 VanDerWaalsContact C-N 3.33Å; K904-L906 PolarHBondContact O-N 2.92Å; L906-A909 PolarHBondContact O-N 3.01Å; L906-Q910 WeakPolarHBondContact O-CG 3.45Å; L906-Q910 PolarHBondContact O-N 2.98Å; L906-Q910 VanDerWaalsContact O-N 3.15Å
907	Q	93.5	Very high	90.5	Very high	69 Å²	69	61.6 Å²	61.6	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-59.5	-50.4	175	179.2	-177.5	-2.3	0	0	110.9	E737 K903 K904 A909 Q910 W911	E737-Q907 PolarHBondContact OE2-NE2 3.07Å; K903-Q907 WeakPolarHBondContact O-CB 3.39Å; K903-Q907 PolarHBondContact O-N 3.07Å; K904-Q907 PolarHBondContact O-N 3.14Å; Q907-A909 PolarHBondContact O-N 2.98Å; Q907-Q910 WeakPolarHBondContact O-CB 3.36Å; Q907-Q910 PolarHBondContact O-N 3.47Å; Q907-W911 HydrophobicContact CG-CH2 3.99Å; Q907-W911 HydrophobicContact CG-CZ2 3.72Å; Q907-W911 VanDerWaalsContact NE2-CZ2 3.29Å; Q907-W911 PolarHBondContact O-N 2.92Å
908	F	94.4	Very high	90.3	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-38.7	179.5	-169.9	-85	0	0	0	112.5	V719 L727 L729 G738 C740 L769 M772 F773 K904 Q910 W911 W912	V719-F908 HydrophobicContact CB-CD1 4.28Å; V719-F908 HydrophobicContact CB-CE1 4.44Å; V719-F908 HydrophobicContact CG1-CD1 3.73Å; V719-F908 HydrophobicContact CG1-CE1 3.96Å; V719-F908 HydrophobicContact CG2-CD1 3.71Å; V719-F908 HydrophobicContact CG2-CE1 4.16Å; L727-F908 HydrophobicContact CD2-CE1 3.89Å; L727-F908 HydrophobicContact CD2-CZ 4.36Å; L729-F908 HydrophobicContact CD1-CB 4.1Å; L729-F908 HydrophobicContact CD2-CB 4.44Å; L729-F908 HydrophobicContact CD2-CD1 4.31Å; L729-F908 HydrophobicContact CD2-CD2 4.06Å; L729-F908 HydrophobicContact CD2-CE2 4.37Å; L729-F908 HydrophobicContact CD2-CG 4Å; G738-F908 WeakPolarHBondContact O-CE2 3.46Å; C740-F908 HydrophobicContact CB-CE2 4.13Å; C740-F908 HydrophobicContact CB-CZ 3.93Å; L769-F908 HydrophobicContact CD2-CZ 3.92Å; M772-F908 HydrophobicContact CE-CE2 3.92Å; M772-F908 HydrophobicContact CE-CZ 3.93Å; F773-F908 HydrophobicContact CZ-CE2 4.09Å; K904-F908 VanDerWaalsContact O-CB 3.3Å; K904-F908 WeakPolarHBondContact O-CB 3.43Å; K904-F908 PolarHBondContact O-N 2.93Å; F908-Q910 VanDerWaalsContact C-N 3.26Å; F908-Q910 PolarHBondContact O-N 3.3Å; F908-W911 HydrophobicContact CD2-CE3 4.24Å; F908-W911 PolarHBondContact O-N 3.13Å; F908-W912 HydrophobicContact CD1-CB 4.35Å; F908-W912 HydrophobicContact CE1-CB 4.2Å; F908-W912 WeakPolarHBondContact O-CB 3.49Å; F908-W912 PolarHBondContact O-N 3.06Å
909	A	92.9	Very high	89.7	Confident	24 Å²	24	61 Å²	61	20%	0.198	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-30.4	176.7	0	0	0	0	0	112.8	L56 V905 L906 Q907 K913	L56-A909 HydrophobicContact CD1-CB 3.83Å; L56-A909 HydrophobicContact CD2-CB 4.21Å; V905-A909 WeakPolarHBondContact O-CB 3.27Å; V905-A909 PolarHBondContact O-N 3.4Å; L906-A909 PolarHBondContact O-N 3.01Å; Q907-A909 PolarHBondContact O-N 2.98Å; A909-K913 WeakPolarHBondContact O-CB 3.38Å; A909-K913 PolarHBondContact O-N 2.95Å
910	Q	93.1	Very high	88.4	Confident	144 Å²	144	62.1 Å²	62.1	67%	0.673	31%	0.305	S	S	*	.	H	α-helix	trans	-66.3	-43.7	172.5	-70.8	168.2	16.8	0	0	111.5	L906 Q907 F908	L906-Q910 WeakPolarHBondContact O-CG 3.45Å; L906-Q910 PolarHBondContact O-N 2.98Å; L906-Q910 VanDerWaalsContact O-N 3.15Å; Q907-Q910 WeakPolarHBondContact O-CB 3.36Å; Q907-Q910 PolarHBondContact O-N 3.47Å; F908-Q910 VanDerWaalsContact C-N 3.26Å; F908-Q910 PolarHBondContact O-N 3.3Å
911	W	93.5	Very high	86.4	Confident	73 Å²	73	64 Å²	64	28%	0.277	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-42.3	175.9	-57.5	-23.3	0	0	0	112.6	M772 Q907 F908 K913	M772-W911 HydrophobicContact SD-CB 3.92Å; Q907-W911 HydrophobicContact CG-CH2 3.99Å; Q907-W911 HydrophobicContact CG-CZ2 3.72Å; Q907-W911 VanDerWaalsContact NE2-CZ2 3.29Å; Q907-W911 PolarHBondContact O-N 2.92Å; F908-W911 HydrophobicContact CD2-CE3 4.24Å; F908-W911 PolarHBondContact O-N 3.13Å; W911-K913 VanDerWaalsContact C-N 3.28Å; W911-K913 PolarHBondContact O-N 3.11Å
912	W	94	Very high	83.6	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.015	37%	0.371	C	S	.	.	H	α-helix	trans	-67	-26.5	-179.2	-175.2	-111.1	0	0	0	113.3	V719 L727 F765 A768 L769 M772 F908 S914 Y915 D916	V719-W912 HydrophobicContact CG1-CB 4.23Å; V719-W912 HydrophobicContact CG1-CG 4.11Å; L727-W912 HydrophobicContact CD2-CD2 3.94Å; L727-W912 HydrophobicContact CD2-CE3 4.1Å; L727-W912 HydrophobicContact CD2-CH2 4.09Å; L727-W912 HydrophobicContact CD2-CZ2 3.94Å; L727-W912 HydrophobicContact CD2-CZ3 4.19Å; F765-W912 HydrophobicContact CD1-CH2 4.03Å; F765-W912 AromaticContact CD1-CZ2 3.85Å; F765-W912 HydrophobicContact CD1-CZ2 3.85Å; F765-W912 AromaticContact CE1-CZ2 4Å; F765-W912 HydrophobicContact CE1-CZ2 4Å; A768-W912 HydrophobicContact CB-CH2 3.52Å; A768-W912 HydrophobicContact CB-CZ2 4.46Å; A768-W912 HydrophobicContact CB-CZ3 3.92Å; L769-W912 HydrophobicContact CD2-CE3 3.92Å; L769-W912 HydrophobicContact CD2-CH2 4.35Å; L769-W912 HydrophobicContact CD2-CZ3 3.5Å; L769-W912 HydrophobicContact CG-CH2 4.19Å; L769-W912 HydrophobicContact CG-CZ3 3.68Å; M772-W912 HydrophobicContact SD-CB 4.45Å; M772-W912 HydrophobicContact SD-CE3 3.97Å; F908-W912 HydrophobicContact CD1-CB 4.35Å; F908-W912 HydrophobicContact CE1-CB 4.2Å; F908-W912 WeakPolarHBondContact O-CB 3.49Å; F908-W912 PolarHBondContact O-N 3.06Å; W912-S914 VanDerWaalsContact C-N 3.27Å; W912-S914 PolarHBondContact O-N 3.29Å; W912-S914 VanDerWaalsContact O-N 3.1Å; W912-Y915 CarbonylContact O-C 3.56Å; W912-Y915 PolarHBondContact O-N 3.05Å; W912-D916 HydrophobicContact CG-CB 4.5Å; W912-D916 PolarHBondContact NE1-OD1 3.14Å; W912-D916 PolarHBondContact O-N 3.04Å
913	K	91.3	Very high	83.4	Confident	125 Å²	125	71.3 Å²	71.3	54%	0.543	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.8	-168	-171.5	161.3	-177.9	136.9	0	115	E58 A909 W911	E58-K913 IonicContact OE1-NZ 3.98Å; E58-K913 PolarHBondContact OE1-NZ 2.98Å; A909-K913 WeakPolarHBondContact O-CB 3.38Å; A909-K913 PolarHBondContact O-N 2.95Å; W911-K913 VanDerWaalsContact C-N 3.28Å; W911-K913 PolarHBondContact O-N 3.11Å
914	S	91.6	Very high	83	Confident	94 Å²	94	68.5 Å²	68.5	66%	0.657	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.9	176.3	47.1	0	0	0	0	114.4	W912	W912-S914 VanDerWaalsContact C-N 3.27Å; W912-S914 PolarHBondContact O-N 3.29Å; W912-S914 VanDerWaalsContact O-N 3.1Å
915	Y	91	Very high	82.5	Confident	76 Å²	76	69.3 Å²	69.3	30%	0.298	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	1.9	-175.2	-62.2	-77	0	0	0	113.2	A768 R771 M772 S775 W912 C917	A768-Y915 WeakPolarHBondContact CB-O 3.25Å; R771-Y915 HydrophobicContact CB-CD1 4.18Å; R771-Y915 HydrophobicContact CB-CE1 4.22Å; M772-Y915 HydrophobicContact CB-CD1 4.45Å; M772-Y915 HydrophobicContact CB-CD2 3.57Å; M772-Y915 HydrophobicContact CB-CE2 3.99Å; M772-Y915 HydrophobicContact CB-CG 3.82Å; M772-Y915 HydrophobicContact CG-CD2 3.58Å; M772-Y915 HydrophobicContact CG-CE2 3.93Å; M772-Y915 HydrophobicContact CG-CG 4.3Å; S775-Y915 WeakPolarHBondContact CB-OH 3.49Å; S775-Y915 PolarHBondContact OG-OH 3.27Å; W912-Y915 CarbonylContact O-C 3.56Å; W912-Y915 PolarHBondContact O-N 3.05Å; Y915-C917 PolarHBondContact O-N 3.05Å
916	D	88.5	Confident	82	Confident	15 Å²	15	73.4 Å²	73.4	8%	0.08	39%	0.391	C	S	.	.			trans	-66.9	94.3	-171.4	-172.5	5.8	0	0	0	113.9	W912 T918 K919	W912-D916 HydrophobicContact CG-CB 4.5Å; W912-D916 PolarHBondContact NE1-OD1 3.14Å; W912-D916 PolarHBondContact O-N 3.04Å; D916-T918 VanDerWaalsContact CG-OG1 3.28Å; D916-T918 PolarHBondContact O-N 3.31Å; D916-T918 VanDerWaalsContact O-N 3.1Å; D916-T918 WeakPolarHBondContact OD1-CB 3.45Å; D916-T918 PolarHBondContact OD1-N 3.36Å; D916-T918 PolarHBondContact OD1-OG1 3.41Å; D916-T918 PolarHBondContact OD2-OG1 3.4Å; D916-K919 PolarHBondContact O-N 2.99Å; D916-K919 IonicContact OD2-NZ 2.67Å; D916-K919 PolarHBondContact OD2-NZ 3.03Å
917	C	85.9	Confident	81.4	Confident	26 Å²	26	73.8 Å²	73.8	18%	0.176	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-9.5	177.1	60.9	0	0	0	0	114.4	A768 Y915 T920 V921	A768-C917 HydrophobicContact CB-CB 4.29Å; Y915-C917 PolarHBondContact O-N 3.05Å; C917-T920 PolarHBondContact O-OG1 2.67Å; C917-V921 WeakPolarHBondContact O-CG2 3.49Å
918	T	83.6	Confident	80.5	Confident	21 Å²	21	74.1 Å²	74.1	13%	0.129	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-24.5	178.3	69.2	0	0	0	0	113	A720 F765 D916	A720-T918 HydrophobicContact CB-CG2 4.05Å; F765-T918 HydrophobicContact CE1-CG2 3.76Å; F765-T918 HydrophobicContact CZ-CG2 3.47Å; F765-T918 VanDerWaalsContact CZ-CG2 3.47Å; D916-T918 VanDerWaalsContact CG-OG1 3.28Å; D916-T918 PolarHBondContact O-N 3.31Å; D916-T918 VanDerWaalsContact O-N 3.1Å; D916-T918 WeakPolarHBondContact OD1-CB 3.45Å; D916-T918 PolarHBondContact OD1-N 3.36Å; D916-T918 PolarHBondContact OD1-OG1 3.41Å; D916-T918 PolarHBondContact OD2-OG1 3.4Å
919	K	73.4	Confident	79.6	Confident	96 Å²	96	79.1 Å²	79.1	42%	0.417	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-19.8	-179.2	-67.4	-177.4	175.1	88.1	0	113.9	E58 D916	E58-K919 WeakPolarHBondContact OE2-CE 3.35Å; E58-K919 IonicContact OE2-NZ 3.91Å; E58-K919 PolarHBondContact OE2-NZ 2.96Å; D916-K919 PolarHBondContact O-N 2.99Å; D916-K919 IonicContact OD2-NZ 2.67Å; D916-K919 PolarHBondContact OD2-NZ 3.03Å
920	T	57.5	Low	78.5	Confident	119 Å²	119	83.3 Å²	83.3	73%	0.73	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	0.6	-179.1	48.9	0	0	0	0	114	C917 V922	C917-T920 PolarHBondContact O-OG1 2.67Å; T920-V922 PolarHBondContact O-N 3.02Å
921	V	46.5	Very low	77.3	Confident	91 Å²	91	78.3 Å²	78.3	55%	0.552	42%	0.423	S	S	*	.			trans	-95.8	84	173.8	-178	0	0	0	0	109.4	C917	C917-V921 WeakPolarHBondContact O-CG2 3.49Å
922	V	30.9	Very low	75.8	Confident	199 Å²	199	78.7 Å²	78.7	100%	1.206	44%	0.437	S	S	*	.			trans	-134.7	0	172.9	-179.9	0	0	0	0	108.7	T920	T920-V922 PolarHBondContact O-N 3.02Å

Retrieved 922 of 922 residues in 1488.3 ms (Link to these results)

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