A0A3B3UST4_9TELE Loading...

Stress-activated protein kinase JNK

Responds to activation by environmental stress and pro-inflammatory cytokines by phosphorylating a number of transcription factors, and thus regulates transcriptional activity. Responds to activation by environmental stress and pro-inflammatory cytokines by phosphorylating a number of transcription factors, primarily components of AP-1 such as c-Jun and ATF2 and thus regulates AP-1 transcriptional activity. May play a role in the regulation of the circadian clock.

AlphaFold DB , UniProt , Accession A0A3B3UST4, Species 9TELE (Poecilia latipinna, sailfin molly), Gene MAPK8, Length 460 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.9	Very low	50	Low	219 Å²	219	127.5 Å²	127.5	100%	1.079	63%	0.634	S	S	*	*				0	38.9	0	-69.6	176.1	176.4	0	0	109.2
2	T	45.6	Very low	50.1	Low	103 Å²	103	121.3 Å²	121.3	63%	0.632	62%	0.618	S	S	*	*				71.2	111.4	65.4	51.2	0	0	0	0	114.2	R4 T5	T2-R4 PolarHBondContact O-N 3.31Å; T2-T5 PolarHBondContact O-N 3.36Å; T2-T5 VanDerWaalsContact O-N 3.1Å; T2-T5 PolarHBondContact O-OG1 2.77Å; T2-T5 VanDerWaalsContact O-OG1 3.12Å
3	E	46.9	Very low	50.3	Low	167 Å²	167	119.5 Å²	119.5	78%	0.78	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-34.4	-22.1	172.2	-72.4	166	125.2	0	0	116.5	T5 F6 L7	E3-T5 VanDerWaalsContact C-N 3.29Å; E3-T5 PolarHBondContact O-N 3.26Å; E3-F6 PolarHBondContact O-N 3.06Å; E3-F6 VanDerWaalsContact O-N 3.13Å; E3-L7 PolarHBondContact O-N 3.24Å
4	R	47.7	Very low	50.7	Low	192 Å²	192	118.9 Å²	118.9	73%	0.725	61%	0.612	S	S	*	*	H	α-helix	trans	-51.4	-42.7	170.6	-87	-178.3	177.6	173.9	-1.1	113.2	T2 F6 L7 D8	T2-R4 PolarHBondContact O-N 3.31Å; R4-F6 VanDerWaalsContact C-N 3.28Å; R4-F6 PolarHBondContact O-N 3.2Å; R4-L7 PolarHBondContact O-N 2.9Å; R4-D8 VanDerWaalsContact O-CB 3.3Å; R4-D8 WeakPolarHBondContact O-CB 3.4Å; R4-D8 PolarHBondContact O-N 3.49Å; R4-D8 VanDerWaalsContact O-OD2 3.09Å
5	T	55.5	Low	50.3	Low	99 Å²	99	118.4 Å²	118.4	61%	0.607	61%	0.606	S	S	*	*	H	α-helix	trans	-68.6	-26	-180	41.5	0	0	0	0	113.5	T2 E3 A9	T2-T5 PolarHBondContact O-N 3.36Å; T2-T5 VanDerWaalsContact O-N 3.1Å; T2-T5 PolarHBondContact O-OG1 2.77Å; T2-T5 VanDerWaalsContact O-OG1 3.12Å; E3-T5 VanDerWaalsContact C-N 3.29Å; E3-T5 PolarHBondContact O-N 3.26Å; T5-A9 WeakPolarHBondContact O-CB 3.16Å; T5-A9 PolarHBondContact O-N 3.37Å
6	F	48.7	Very low	50.1	Low	142 Å²	142	117.5 Å²	117.5	62%	0.623	60%	0.603	S	S	*	*	H	α-helix	trans	-82.6	-39.9	177.7	-162.5	-93.7	0	0	0	111.5	E3 R4 A9 Q10	E3-F6 PolarHBondContact O-N 3.06Å; E3-F6 VanDerWaalsContact O-N 3.13Å; R4-F6 VanDerWaalsContact C-N 3.28Å; R4-F6 PolarHBondContact O-N 3.2Å; F6-A9 PolarHBondContact O-N 3.26Å; F6-Q10 HydrophobicContact CE1-CG 4.44Å; F6-Q10 PolarHBondContact O-N 3.03Å
7	L	51.2	Low	49.8	Very low	104 Å²	104	119.6 Å²	119.6	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-65.5	-40.3	173.1	-80.3	157.5	0	0	0	111.9	E3 R4 Q10 K11	E3-L7 PolarHBondContact O-N 3.24Å; R4-L7 PolarHBondContact O-N 2.9Å; L7-Q10 PolarHBondContact O-N 3.37Å; L7-K11 WeakPolarHBondContact O-CB 3.46Å; L7-K11 PolarHBondContact O-N 2.86Å
8	D	53.9	Low	49.4	Very low	97 Å²	97	115.5 Å²	115.5	52%	0.519	60%	0.595	S	S	.	*	H	α-helix	trans	-67.8	-35.3	176.4	-68.9	-27.1	0	0	0	111.7	R4 K11 A12	R4-D8 VanDerWaalsContact O-CB 3.3Å; R4-D8 WeakPolarHBondContact O-CB 3.4Å; R4-D8 PolarHBondContact O-N 3.49Å; R4-D8 VanDerWaalsContact O-OD2 3.09Å; D8-K11 PolarHBondContact O-N 2.9Å; D8-A12 WeakPolarHBondContact O-CB 3.32Å; D8-A12 PolarHBondContact O-N 3.42Å
9	A	53.5	Low	49	Very low	55 Å²	55	117.3 Å²	117.3	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-67.8	-42.7	172.4	0	0	0	0	0	112.2	T5 F6 K11 A12 V13	T5-A9 WeakPolarHBondContact O-CB 3.16Å; T5-A9 PolarHBondContact O-N 3.37Å; F6-A9 PolarHBondContact O-N 3.26Å; A9-K11 VanDerWaalsContact C-N 3.34Å; A9-A12 PolarHBondContact O-N 3.23Å; A9-V13 VanDerWaalsContact O-CG2 3.27Å; A9-V13 WeakPolarHBondContact O-CG2 3.2Å; A9-V13 PolarHBondContact O-N 3.17Å
10	Q	47.2	Very low	49	Very low	100 Å²	100	116.2 Å²	116.2	47%	0.467	60%	0.597	S	S	.	*	H	α-helix	trans	-63.2	-39.7	172.4	-86.9	-173.1	-16.4	0	0	112	F6 L7 V13 I14	F6-Q10 HydrophobicContact CE1-CG 4.44Å; F6-Q10 PolarHBondContact O-N 3.03Å; L7-Q10 PolarHBondContact O-N 3.37Å; Q10-V13 PolarHBondContact O-N 3.43Å; Q10-I14 WeakPolarHBondContact O-CB 3.38Å; Q10-I14 WeakPolarHBondContact O-CD1 3.28Å; Q10-I14 WeakPolarHBondContact O-CG1 3.5Å; Q10-I14 PolarHBondContact O-N 3.45Å
11	K	52.1	Low	48.9	Very low	124 Å²	124	116.2 Å²	116.2	54%	0.539	59%	0.593	S	S	.	*	H	α-helix	trans	-65.7	-42.9	177	-129.7	179.7	180	-172.1	0	111.9	L7 D8 A9 V13 I14 E15	L7-K11 WeakPolarHBondContact O-CB 3.46Å; L7-K11 PolarHBondContact O-N 2.86Å; D8-K11 PolarHBondContact O-N 2.9Å; A9-K11 VanDerWaalsContact C-N 3.34Å; K11-V13 VanDerWaalsContact C-N 3.34Å; K11-V13 PolarHBondContact O-N 2.88Å; K11-I14 PolarHBondContact O-N 2.92Å; K11-E15 VanDerWaalsContact O-CB 3.26Å; K11-E15 WeakPolarHBondContact O-CB 3.38Å; K11-E15 VanDerWaalsContact O-CG 3.28Å; K11-E15 WeakPolarHBondContact O-CG 3.3Å; K11-E15 PolarHBondContact O-N 3.15Å
12	A	51.3	Low	49.2	Very low	54 Å²	54	110.6 Å²	110.6	45%	0.446	57%	0.567	S	S	.	*	H	α-helix	trans	-62.1	-41.4	175.2	0	0	0	0	0	111.7	D8 A9 D16	D8-A12 WeakPolarHBondContact O-CB 3.32Å; D8-A12 PolarHBondContact O-N 3.42Å; A9-A12 PolarHBondContact O-N 3.23Å; A12-D16 WeakPolarHBondContact O-CB 3.3Å; A12-D16 PolarHBondContact O-N 3.26Å
13	V	52.8	Low	49.7	Very low	97 Å²	97	111.6 Å²	111.6	59%	0.588	56%	0.563	S	S	*	*	H	α-helix	trans	-65.3	-42.7	174.5	172.4	0	0	0	0	111.3	A9 Q10 K11 F17	A9-V13 VanDerWaalsContact O-CG2 3.27Å; A9-V13 WeakPolarHBondContact O-CG2 3.2Å; A9-V13 PolarHBondContact O-N 3.17Å; Q10-V13 PolarHBondContact O-N 3.43Å; K11-V13 VanDerWaalsContact C-N 3.34Å; K11-V13 PolarHBondContact O-N 2.88Å; V13-F17 WeakPolarHBondContact O-CB 3.19Å; V13-F17 PolarHBondContact O-N 3.4Å
14	I	55.2	Low	50.4	Low	111 Å²	111	105.2 Å²	105.2	57%	0.569	53%	0.532	S	S	*	.	H	α-helix	trans	-67.8	-39.5	178.3	-69.3	163.6	0	0	0	111.5	Q10 K11 A18	Q10-I14 WeakPolarHBondContact O-CB 3.38Å; Q10-I14 WeakPolarHBondContact O-CD1 3.28Å; Q10-I14 WeakPolarHBondContact O-CG1 3.5Å; Q10-I14 PolarHBondContact O-N 3.45Å; K11-I14 PolarHBondContact O-N 2.92Å; I14-A18 WeakPolarHBondContact O-CB 3.22Å; I14-A18 PolarHBondContact O-N 3.04Å
15	E	45.1	Very low	51	Low	112 Å²	112	100.7 Å²	100.7	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-70.2	-40.3	177.7	-76.2	175.1	-176.6	0	0	111.5	K11 A18 M19	K11-E15 VanDerWaalsContact O-CB 3.26Å; K11-E15 WeakPolarHBondContact O-CB 3.38Å; K11-E15 VanDerWaalsContact O-CG 3.28Å; K11-E15 WeakPolarHBondContact O-CG 3.3Å; K11-E15 PolarHBondContact O-N 3.15Å; E15-A18 PolarHBondContact O-N 2.99Å; E15-M19 VanDerWaalsContact O-CB 3.3Å; E15-M19 WeakPolarHBondContact O-CB 3.28Å; E15-M19 PolarHBondContact O-N 3.33Å
16	D	47.4	Very low	51.9	Low	104 Å²	104	104.8 Å²	104.8	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-41.7	173.5	-163.7	47	0	0	0	111	A12 M19 N20	A12-D16 WeakPolarHBondContact O-CB 3.3Å; A12-D16 PolarHBondContact O-N 3.26Å; D16-M19 PolarHBondContact O-N 2.63Å; D16-N20 WeakPolarHBondContact O-CB 3.26Å; D16-N20 PolarHBondContact O-N 3.47Å
17	F	45.2	Very low	53.7	Low	153 Å²	153	101 Å²	101	67%	0.671	51%	0.511	S	S	*	.	H	α-helix	trans	-64.5	-40.4	174	-153.3	-94.1	0	0	0	112.1	V13 K21	V13-F17 WeakPolarHBondContact O-CB 3.19Å; V13-F17 PolarHBondContact O-N 3.4Å; F17-K21 VanDerWaalsContact O-CB 3.24Å; F17-K21 WeakPolarHBondContact O-CB 3.2Å; F17-K21 PolarHBondContact O-N 2.8Å
18	A	42.4	Very low	55.8	Low	46 Å²	46	96.9 Å²	96.9	38%	0.38	49%	0.488	S	S	.	.	H	α-helix	trans	-73	-37.4	177.8	0	0	0	0	0	113	I14 E15 K21 N22	I14-A18 WeakPolarHBondContact O-CB 3.22Å; I14-A18 PolarHBondContact O-N 3.04Å; E15-A18 PolarHBondContact O-N 2.99Å; A18-K21 PolarHBondContact O-N 2.86Å; A18-N22 PolarHBondContact O-N 3.49Å
19	M	41.5	Very low	57.7	Low	150 Å²	150	95.2 Å²	95.2	74%	0.739	48%	0.475	S	S	*	.	H	α-helix	trans	-65.2	-45.5	173.7	-90.5	-169.3	145.6	0	0	111.4	E15 D16 K21 N22 K23	E15-M19 VanDerWaalsContact O-CB 3.3Å; E15-M19 WeakPolarHBondContact O-CB 3.28Å; E15-M19 PolarHBondContact O-N 3.33Å; D16-M19 PolarHBondContact O-N 2.63Å; M19-K21 VanDerWaalsContact C-N 3.31Å; M19-K21 PolarHBondContact O-N 2.96Å; M19-N22 PolarHBondContact O-N 3.36Å; M19-K23 PolarHBondContact O-N 3.36Å; M19-K23 VanDerWaalsContact O-N 3.15Å
20	N	49.3	Very low	59.7	Low	94 Å²	94	96.2 Å²	96.2	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-66	-33.9	173.8	-98.8	-23.7	0	0	0	112.2	D16 K23 R24	D16-N20 WeakPolarHBondContact O-CB 3.26Å; D16-N20 PolarHBondContact O-N 3.47Å; N20-K23 PolarHBondContact O-N 3.25Å; N20-R24 PolarHBondContact O-N 3.31Å
21	K	46.9	Very low	62	Low	118 Å²	118	93.9 Å²	93.9	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-49.8	175.4	-169.2	174.9	-178.7	176.6	0	111.2	F17 A18 M19 K23 D25 K114	F17-K21 VanDerWaalsContact O-CB 3.24Å; F17-K21 WeakPolarHBondContact O-CB 3.2Å; F17-K21 PolarHBondContact O-N 2.8Å; A18-K21 PolarHBondContact O-N 2.86Å; M19-K21 VanDerWaalsContact C-N 3.31Å; M19-K21 PolarHBondContact O-N 2.96Å; K21-K23 VanDerWaalsContact C-N 3.35Å; K21-K23 PolarHBondContact O-N 2.85Å; K21-D25 VanDerWaalsContact O-CG 3.23Å; K21-D25 PolarHBondContact O-N 2.88Å; K21-K114 VanDerWaalsContact CA-NZ 3.34Å; K21-K114 PolarHBondContact O-NZ 2.81Å
22	N	53.3	Low	64	Low	100 Å²	100	93.6 Å²	93.6	54%	0.535	48%	0.475	S	S	.	.	H	α-helix	trans	-68.5	-26.2	-179.6	-86.1	-25.5	0	0	0	114.5	A18 M19 R26	A18-N22 PolarHBondContact O-N 3.49Å; M19-N22 PolarHBondContact O-N 3.36Å; N22-R26 VanDerWaalsContact O-CD 3.3Å; N22-R26 WeakPolarHBondContact O-CD 3.3Å; N22-R26 WeakPolarHBondContact O-CG 3.33Å
23	K	56.1	Low	65.9	Low	125 Å²	125	91.6 Å²	91.6	54%	0.543	46%	0.458	S	S	.	.	H	α-helix	trans	-74.8	-49.3	-179.3	-170.9	-179.2	174.3	-170.5	0	112.5	M19 N20 K21 R26 E27	M19-K23 PolarHBondContact O-N 3.36Å; M19-K23 VanDerWaalsContact O-N 3.15Å; N20-K23 PolarHBondContact O-N 3.25Å; K21-K23 VanDerWaalsContact C-N 3.35Å; K21-K23 PolarHBondContact O-N 2.85Å; K23-R26 WeakPolarHBondContact O-CB 3.36Å; K23-R26 PolarHBondContact O-N 2.77Å; K23-E27 PolarHBondContact O-N 2.88Å
24	R	61.2	Low	67.4	Low	33 Å²	33	90.4 Å²	90.4	13%	0.125	47%	0.465	C	S	.	.	H	α-helix	trans	-73.3	-32.1	179.9	-91.4	-156.6	-171.5	174.8	2.5	114	N20 R26 E27 F28 T111 P112 Q113 E382	N20-R24 PolarHBondContact O-N 3.31Å; R24-R26 PolarHBondContact O-N 3.44Å; R24-E27 PolarHBondContact O-N 3.27Å; R24-F28 HydrophobicContact CB-CD2 4.41Å; R24-F28 HydrophobicContact CG-CD2 4.4Å; R24-F28 HydrophobicContact CG-CE2 4.09Å; R24-F28 WeakPolarHBondContact O-CD2 3.37Å; R24-F28 PolarHBondContact O-N 3.49Å; R24-F28 VanDerWaalsContact O-N 3.12Å; R24-T111 PolarHBondContact NH1-O 2.75Å; R24-P112 PolarHBondContact NH1-O 3.43Å; R24-Q113 PolarHBondContact NH1-O 2.89Å; R24-E382 IonicContact NH2-OE1 2.82Å; R24-E382 IonicContact NH2-OE2 2.69Å; R24-E382 PolarHBondContact NH2-OE2 2.82Å
25	D	62.3	Low	68.7	Low	97 Å²	97	93.8 Å²	93.8	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-20.3	173.6	-64	-3.2	0	0	0	111.2	K21 K114	K21-D25 VanDerWaalsContact O-CG 3.23Å; K21-D25 PolarHBondContact O-N 2.88Å; D25-K114 IonicContact OD1-NZ 3.22Å; D25-K114 PolarHBondContact OD1-NZ 2.94Å; D25-K114 IonicContact OD2-NZ 2.9Å
26	R	73.3	Confident	70.9	Confident	184 Å²	184	89.6 Å²	89.6	69%	0.694	47%	0.468	S	S	*	.	H	α-helix	trans	-82.2	-21.9	170.6	-70.5	171.6	-177.8	-165.4	0.9	113.6	N22 K23 R24 K42	N22-R26 VanDerWaalsContact O-CD 3.3Å; N22-R26 WeakPolarHBondContact O-CD 3.3Å; N22-R26 WeakPolarHBondContact O-CG 3.33Å; K23-R26 WeakPolarHBondContact O-CB 3.36Å; K23-R26 PolarHBondContact O-N 2.77Å; R24-R26 PolarHBondContact O-N 3.44Å; R26-K42 VanDerWaalsContact O-CD 3.28Å; R26-K42 WeakPolarHBondContact O-CD 3.35Å; R26-K42 WeakPolarHBondContact O-CE 3.49Å; R26-K42 PolarHBondContact O-NZ 2.94Å
27	E	87.1	Confident	73.1	Confident	63 Å²	63	87.5 Å²	87.5	29%	0.294	46%	0.459	S	S	.	.	H	α-helix	trans	-95.7	-27	-173	-72.8	175.6	179.9	0	0	113.6	K23 R24 L41 K42	K23-E27 PolarHBondContact O-N 2.88Å; R24-E27 PolarHBondContact O-N 3.27Å; E27-L41 HydrophobicContact CB-CD2 4.33Å; E27-L41 CarbonylContact O-C 3.57Å; E27-L41 WeakPolarHBondContact O-CA 3.44Å; E27-K42 WeakPolarHBondContact O-CG 3.24Å; E27-K42 PolarHBondContact O-N 2.86Å
28	F	93.9	Very high	75.5	Confident	17 Å²	17	80.2 Å²	80.2	8%	0.075	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	159.7	-178.8	-68.4	-96.1	0	0	0	112.6	R24 T39 V40 L41 F110 P112	R24-F28 HydrophobicContact CB-CD2 4.41Å; R24-F28 HydrophobicContact CG-CD2 4.4Å; R24-F28 HydrophobicContact CG-CE2 4.09Å; R24-F28 WeakPolarHBondContact O-CD2 3.37Å; R24-F28 PolarHBondContact O-N 3.49Å; R24-F28 VanDerWaalsContact O-N 3.12Å; F28-T39 HydrophobicContact CB-CG2 4.07Å; F28-T39 HydrophobicContact CD1-CG2 4.42Å; F28-V40 CarbonylContact C-O 3.57Å; F28-V40 VanDerWaalsContact CA-O 3.24Å; F28-V40 WeakPolarHBondContact CA-O 3.24Å; F28-V40 VanDerWaalsContact CD1-C 3.42Å; F28-L41 HydrophobicContact CD1-CD2 4.27Å; F28-L41 HydrophobicContact CD1-CG 4.37Å; F28-L41 HydrophobicContact CD2-CD2 4.21Å; F28-L41 HydrophobicContact CE1-CD2 3.74Å; F28-L41 HydrophobicContact CE1-CG 3.78Å; F28-L41 HydrophobicContact CE2-CD2 3.68Å; F28-L41 HydrophobicContact CG-CD2 4.49Å; F28-L41 HydrophobicContact CZ-CD2 3.42Å; F28-L41 VanDerWaalsContact CZ-CD2 3.42Å; F28-L41 HydrophobicContact CZ-CG 3.91Å; F28-F110 AromaticContact CE1-CD2 3.6Å; F28-F110 HydrophobicContact CE1-CD2 3.6Å; F28-F110 AromaticContact CE1-CE2 3.9Å; F28-F110 HydrophobicContact CE1-CE2 3.9Å; F28-F110 HydrophobicContact CE1-CG 4.48Å; F28-F110 HydrophobicContact CZ-CD2 4.27Å; F28-P112 HydrophobicContact CD1-CB 3.92Å; F28-P112 HydrophobicContact CE1-CB 4.07Å; F28-P112 HydrophobicContact CG-CB 4.39Å
29	Y	95.3	Very high	78.1	Confident	63 Å²	63	79.6 Å²	79.6	25%	0.247	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	158.3	166.6	76.7	-72.1	0	0	0	109.9	V31 T39 V40 K42 Y44 L47	Y29-V31 HydrophobicContact CD2-CG2 3.78Å; Y29-V31 HydrophobicContact CE2-CG2 3.35Å; Y29-T39 CarbonylContact O-C 3.6Å; Y29-T39 WeakPolarHBondContact O-CA 3.45Å; Y29-V40 HydrophobicContact CD1-CG2 4.08Å; Y29-V40 WeakPolarHBondContact CD1-O 3.28Å; Y29-V40 HydrophobicContact CE1-CG2 3.49Å; Y29-V40 VanDerWaalsContact CE1-CG2 3.49Å; Y29-V40 PolarHBondContact N-O 2.59Å; Y29-V40 PolarHBondContact O-N 2.83Å; Y29-K42 HydrophobicContact CD1-CB 4.47Å; Y29-K42 HydrophobicContact CD1-CG 3.93Å; Y29-Y44 VanDerWaalsContact CE1-O 3.24Å; Y29-Y44 WeakPolarHBondContact CE1-O 3.46Å; Y29-Y44 PolarHBondContact OH-O 2.83Å; Y29-L47 VanDerWaalsContact OH-CD1 3.28Å; Y29-L47 WeakPolarHBondContact OH-CD1 3.35Å
30	S	95.4	Very high	80.7	Confident	75 Å²	75	72.5 Å²	72.5	52%	0.524	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.9	-177.1	-60.4	0	0	0	0	111.7	F38 T39	S30-F38 CarbonylContact C-O 3.25Å; S30-F38 VanDerWaalsContact CA-O 3.24Å; S30-F38 WeakPolarHBondContact CA-O 3.4Å; S30-T39 PolarHBondContact OG-OG1 3.38Å
31	V	95.2	Very high	82.9	Confident	51 Å²	51	68.4 Å²	68.4	31%	0.309	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.3	173.9	175.2	0	0	0	0	108.6	Y29 V33 F38	Y29-V31 HydrophobicContact CD2-CG2 3.78Å; Y29-V31 HydrophobicContact CE2-CG2 3.35Å; V31-V33 HydrophobicContact CG1-CG2 4.36Å; V31-F38 PolarHBondContact N-O 3.41Å; V31-F38 PolarHBondContact O-N 3.26Å
32	D	94.5	Very high	85.1	Confident	118 Å²	118	67.5 Å²	67.5	63%	0.631	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.6	173.7	-64.2	-35.9	0	0	0	110.6	T37	D32-T37 WeakPolarHBondContact OD1-CB 3.47Å; D32-T37 PolarHBondContact OD1-OG1 3.1Å
33	V	89.8	Confident	87.1	Confident	12 Å²	12	63.7 Å²	63.7	7%	0.073	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	94.6	-179.5	-177.2	0	0	0	0	107.9	V31 D35 S36 F38 P49 I57	V31-V33 HydrophobicContact CG1-CG2 4.36Å; V33-D35 PolarHBondContact O-N 3.33Å; V33-S36 PolarHBondContact N-O 2.88Å; V33-S36 PolarHBondContact O-N 2.77Å; V33-F38 HydrophobicContact CB-CD2 3.81Å; V33-F38 HydrophobicContact CB-CE2 4.07Å; V33-F38 HydrophobicContact CG1-CE2 4.43Å; V33-F38 HydrophobicContact CG2-CB 4.25Å; V33-F38 HydrophobicContact CG2-CD2 3.72Å; V33-F38 HydrophobicContact CG2-CE2 4.32Å; V33-F38 HydrophobicContact CG2-CG 4.07Å; V33-P49 HydrophobicContact CG1-CB 3.63Å; V33-P49 HydrophobicContact CG1-CG 3.96Å; V33-I57 HydrophobicContact CG1-CG2 4.41Å
34	G	84.1	Confident	89	Confident	72 Å²	72	57.8 Å²	57.8	74%	0.742	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-127.7	-169.6	0	0	0	0	0	110.3	S36	G34-S36 VanDerWaalsContact C-N 3.28Å; G34-S36 PolarHBondContact O-N 3.43Å
35	D	84.3	Confident	90.7	Very high	182 Å²	182	59.5 Å²	59.5	97%	0.973	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	13.7	-178.9	-56.1	-37	0	0	0	113.8	V33	V33-D35 PolarHBondContact O-N 3.33Å
36	S	89.6	Confident	92.3	Very high	25 Å²	25	60.2 Å²	60.2	18%	0.175	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.4	-175.9	-176.8	0	0	0	0	112	V33 G34	V33-S36 PolarHBondContact N-O 2.88Å; V33-S36 PolarHBondContact O-N 2.77Å; G34-S36 VanDerWaalsContact C-N 3.28Å; G34-S36 PolarHBondContact O-N 3.43Å
37	T	94.3	Very high	93.5	Very high	60 Å²	60	52.6 Å²	52.6	37%	0.368	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.2	174.1	-52.5	0	0	0	0	110.8	D32 K74	D32-T37 WeakPolarHBondContact OD1-CB 3.47Å; D32-T37 PolarHBondContact OD1-OG1 3.1Å; T37-K74 PolarHBondContact O-NZ 3.12Å
38	F	96.4	Very high	93.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	118.4	170.4	-87.7	-116.3	0	0	0	109.3	S30 V31 V33 V40 L47 I57 C59 K74 Y123	S30-F38 CarbonylContact C-O 3.25Å; S30-F38 VanDerWaalsContact CA-O 3.24Å; S30-F38 WeakPolarHBondContact CA-O 3.4Å; V31-F38 PolarHBondContact N-O 3.41Å; V31-F38 PolarHBondContact O-N 3.26Å; V33-F38 HydrophobicContact CB-CD2 3.81Å; V33-F38 HydrophobicContact CB-CE2 4.07Å; V33-F38 HydrophobicContact CG1-CE2 4.43Å; V33-F38 HydrophobicContact CG2-CB 4.25Å; V33-F38 HydrophobicContact CG2-CD2 3.72Å; V33-F38 HydrophobicContact CG2-CE2 4.32Å; V33-F38 HydrophobicContact CG2-CG 4.07Å; F38-V40 HydrophobicContact CB-CG1 4.23Å; F38-V40 HydrophobicContact CD1-CG1 4.16Å; F38-L47 HydrophobicContact CB-CD2 3.88Å; F38-L47 HydrophobicContact CD1-CD2 3.92Å; F38-L47 HydrophobicContact CG-CD2 4.18Å; F38-I57 HydrophobicContact CE2-CB 3.84Å; F38-I57 HydrophobicContact CE2-CD1 4.47Å; F38-I57 HydrophobicContact CE2-CG2 3.66Å; F38-I57 HydrophobicContact CZ-CB 3.76Å; F38-I57 HydrophobicContact CZ-CG2 3.66Å; F38-C59 HydrophobicContact CE1-CB 4.22Å; F38-K74 HydrophobicContact CD1-CB 4.49Å; F38-K74 HydrophobicContact CD2-CD 4.41Å; F38-K74 HydrophobicContact CE1-CB 3.79Å; F38-K74 HydrophobicContact CE2-CB 4.23Å; F38-K74 HydrophobicContact CE2-CD 4.28Å; F38-K74 HydrophobicContact CZ-CB 3.63Å; F38-Y123 HydrophobicContact CB-CE1 4.48Å; F38-Y123 HydrophobicContact CD1-CD1 4.25Å; F38-Y123 AromaticContact CD1-CE1 3.71Å; F38-Y123 HydrophobicContact CD1-CE1 3.71Å; F38-Y123 HydrophobicContact CE1-CD1 4.45Å; F38-Y123 HydrophobicContact CE1-CE1 4.16Å; F38-Y123 HydrophobicContact CG-CE1 4.19Å
39	T	95.8	Very high	93.8	Very high	33 Å²	33	61.2 Å²	61.2	20%	0.202	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	101.3	172.9	-56.7	0	0	0	0	108.5	F28 Y29 S30 P112 Y123	F28-T39 HydrophobicContact CB-CG2 4.07Å; F28-T39 HydrophobicContact CD1-CG2 4.42Å; Y29-T39 CarbonylContact O-C 3.6Å; Y29-T39 WeakPolarHBondContact O-CA 3.45Å; S30-T39 PolarHBondContact OG-OG1 3.38Å; T39-P112 HydrophobicContact CG2-CB 3.58Å; T39-P112 HydrophobicContact CG2-CG 4.18Å; T39-Y123 PolarHBondContact N-OH 3.4Å
40	V	96.2	Very high	93.4	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	160.6	-167.8	-58.8	0	0	0	0	112	F28 Y29 F38 L47 F110 Y123	F28-V40 CarbonylContact C-O 3.57Å; F28-V40 VanDerWaalsContact CA-O 3.24Å; F28-V40 WeakPolarHBondContact CA-O 3.24Å; F28-V40 VanDerWaalsContact CD1-C 3.42Å; Y29-V40 HydrophobicContact CD1-CG2 4.08Å; Y29-V40 WeakPolarHBondContact CD1-O 3.28Å; Y29-V40 HydrophobicContact CE1-CG2 3.49Å; Y29-V40 VanDerWaalsContact CE1-CG2 3.49Å; Y29-V40 PolarHBondContact N-O 2.59Å; Y29-V40 PolarHBondContact O-N 2.83Å; F38-V40 HydrophobicContact CB-CG1 4.23Å; F38-V40 HydrophobicContact CD1-CG1 4.16Å; V40-L47 HydrophobicContact CG1-CD2 4.09Å; V40-L47 HydrophobicContact CG2-CD1 4.07Å; V40-L47 HydrophobicContact CG2-CD2 3.98Å; V40-F110 HydrophobicContact CB-CE2 4.28Å; V40-F110 HydrophobicContact CB-CZ 3.91Å; V40-F110 HydrophobicContact CG1-CE2 4.33Å; V40-F110 HydrophobicContact CG1-CZ 3.94Å; V40-Y123 HydrophobicContact CG1-CD1 4.03Å; V40-Y123 HydrophobicContact CG1-CE1 3.94Å
41	L	95.2	Very high	92.7	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	139.5	173.8	-69.4	166.2	0	0	0	110.7	E27 F28 R43 Y44 F110 N387	E27-L41 HydrophobicContact CB-CD2 4.33Å; E27-L41 CarbonylContact O-C 3.57Å; E27-L41 WeakPolarHBondContact O-CA 3.44Å; F28-L41 HydrophobicContact CD1-CD2 4.27Å; F28-L41 HydrophobicContact CD1-CG 4.37Å; F28-L41 HydrophobicContact CD2-CD2 4.21Å; F28-L41 HydrophobicContact CE1-CD2 3.74Å; F28-L41 HydrophobicContact CE1-CG 3.78Å; F28-L41 HydrophobicContact CE2-CD2 3.68Å; F28-L41 HydrophobicContact CG-CD2 4.49Å; F28-L41 HydrophobicContact CZ-CD2 3.42Å; F28-L41 VanDerWaalsContact CZ-CD2 3.42Å; F28-L41 HydrophobicContact CZ-CG 3.91Å; L41-R43 HydrophobicContact CB-CG 3.94Å; L41-R43 PolarHBondContact O-N 2.82Å; L41-Y44 HydrophobicContact CB-CD2 3.87Å; L41-Y44 HydrophobicContact CB-CE2 3.96Å; L41-Y44 HydrophobicContact CD1-CE2 4Å; L41-Y44 HydrophobicContact CG-CE2 4.48Å; L41-Y44 PolarHBondContact O-N 3.02Å; L41-F110 HydrophobicContact CD1-CB 4.41Å; L41-F110 HydrophobicContact CD1-CD1 4.04Å; L41-F110 HydrophobicContact CD1-CE1 4.49Å; L41-F110 HydrophobicContact CD1-CG 4.15Å; L41-F110 HydrophobicContact CG-CG 4.42Å; L41-N387 HydrophobicContact CD1-CB 4.01Å
42	K	94.6	Very high	91.8	Very high	99 Å²	99	63.1 Å²	63.1	43%	0.43	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.7	-179.7	-75.9	-178.3	-177.8	171.6	0	115.1	R26 E27 Y29 Y44	R26-K42 VanDerWaalsContact O-CD 3.28Å; R26-K42 WeakPolarHBondContact O-CD 3.35Å; R26-K42 WeakPolarHBondContact O-CE 3.49Å; R26-K42 PolarHBondContact O-NZ 2.94Å; E27-K42 WeakPolarHBondContact O-CG 3.24Å; E27-K42 PolarHBondContact O-N 2.86Å; Y29-K42 HydrophobicContact CD1-CB 4.47Å; Y29-K42 HydrophobicContact CD1-CG 3.93Å; K42-Y44 PolarHBondContact O-N 2.88Å
43	R	94.3	Very high	90.6	Very high	19 Å²	19	59.9 Å²	59.9	7%	0.072	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.9	172.5	69.5	179.9	-74.8	155.5	-7.1	112.9	L41 D63 Q64 I65 N387 G388	L41-R43 HydrophobicContact CB-CG 3.94Å; L41-R43 PolarHBondContact O-N 2.82Å; R43-D63 IonicContact CZ-OD1 3.01Å; R43-D63 IonicContact CZ-OD2 2.83Å; R43-D63 IonicContact NE-OD1 2.72Å; R43-D63 PolarHBondContact NE-OD1 3.3Å; R43-D63 IonicContact NE-OD2 3.74Å; R43-D63 PolarHBondContact NE-OD2 2.88Å; R43-D63 IonicContact NH2-OD1 3.55Å; R43-D63 PolarHBondContact NH2-OD1 2.91Å; R43-D63 IonicContact NH2-OD2 3.73Å; R43-D63 PolarHBondContact NH2-OD2 3.39Å; R43-Q64 PolarHBondContact O-N 3.01Å; R43-I65 HydrophobicContact CB-CD1 3.86Å; R43-I65 HydrophobicContact CB-CG1 4.22Å; R43-N387 PolarHBondContact NH1-O 2.84Å; R43-G388 PolarHBondContact NH1-O 3.28Å
44	Y	97.2	Very high	89.4	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	109.6	-179.9	-57.4	-58.8	0	0	0	109.1	Y29 L41 K42 Y62 D63 V70 I72 N108 F110 V125	Y29-Y44 VanDerWaalsContact CE1-O 3.24Å; Y29-Y44 WeakPolarHBondContact CE1-O 3.46Å; Y29-Y44 PolarHBondContact OH-O 2.83Å; L41-Y44 HydrophobicContact CB-CD2 3.87Å; L41-Y44 HydrophobicContact CB-CE2 3.96Å; L41-Y44 HydrophobicContact CD1-CE2 4Å; L41-Y44 HydrophobicContact CG-CE2 4.48Å; L41-Y44 PolarHBondContact O-N 3.02Å; K42-Y44 PolarHBondContact O-N 2.88Å; Y44-Y62 WeakPolarHBondContact CA-O 3.14Å; Y44-D63 HydrophobicContact CD1-CB 4.05Å; Y44-D63 HydrophobicContact CE1-CB 4.02Å; Y44-D63 WeakPolarHBondContact CE1-OD2 3.37Å; Y44-V70 HydrophobicContact CD1-CG2 3.83Å; Y44-V70 HydrophobicContact CE1-CG2 4.03Å; Y44-I72 HydrophobicContact CD1-CD1 3.91Å; Y44-I72 HydrophobicContact CD2-CD1 3.89Å; Y44-I72 HydrophobicContact CG-CD1 3.51Å; Y44-N108 WeakPolarHBondContact OH-CB 3.42Å; Y44-N108 PolarHBondContact OH-ND2 2.93Å; Y44-F110 HydrophobicContact CD2-CE1 4.06Å; Y44-F110 HydrophobicContact CD2-CZ 4.35Å; Y44-F110 HydrophobicContact CE2-CD1 4.23Å; Y44-F110 AromaticContact CE2-CE1 3.6Å; Y44-F110 HydrophobicContact CE2-CE1 3.6Å; Y44-F110 HydrophobicContact CE2-CZ 4.31Å; Y44-V125 HydrophobicContact CE1-CG1 3.86Å; Y44-V125 HydrophobicContact CE1-CG2 4.37Å; Y44-V125 HydrophobicContact CE2-CG2 3.98Å
45	Q	96.8	Very high	88.7	Confident	69 Å²	69	62.9 Å²	62.9	32%	0.322	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	167.2	-176	-62.1	-163	-10.5	0	0	112.1	L47 A61 Y62 Q64	Q45-L47 PolarHBondContact O-N 2.69Å; Q45-A61 CarbonylContact O-C 3.56Å; Q45-A61 WeakPolarHBondContact O-CA 3.43Å; Q45-Y62 PolarHBondContact N-O 3.42Å; Q45-Y62 PolarHBondContact O-N 3.38Å; Q45-Q64 HydrophobicContact CG-CG 4.07Å
46	N	96	Very high	88.5	Confident	112 Å²	112	54.4 Å²	54.4	60%	0.599	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.3	46.7	174.2	-55.5	-33.4	0	0	0	113	R48	N46-R48 PolarHBondContact O-N 3.22Å
47	L	96.9	Very high	88.4	Confident	24 Å²	24	54.8 Å²	54.8	13%	0.126	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	127.9	179.5	-87.1	67.4	0	0	0	110.4	Y29 F38 V40 Q45 C59 S60 A61	Y29-L47 VanDerWaalsContact OH-CD1 3.28Å; Y29-L47 WeakPolarHBondContact OH-CD1 3.35Å; F38-L47 HydrophobicContact CB-CD2 3.88Å; F38-L47 HydrophobicContact CD1-CD2 3.92Å; F38-L47 HydrophobicContact CG-CD2 4.18Å; V40-L47 HydrophobicContact CG1-CD2 4.09Å; V40-L47 HydrophobicContact CG2-CD1 4.07Å; V40-L47 HydrophobicContact CG2-CD2 3.98Å; Q45-L47 PolarHBondContact O-N 2.69Å; L47-C59 HydrophobicContact CB-CB 4.41Å; L47-C59 HydrophobicContact CD2-CB 4.49Å; L47-C59 HydrophobicContact CG-CB 4.28Å; L47-S60 CarbonylContact C-O 3.52Å; L47-S60 VanDerWaalsContact CA-O 3.28Å; L47-S60 WeakPolarHBondContact CA-O 3.46Å; L47-A61 HydrophobicContact CD1-CB 3.85Å; L47-A61 HydrophobicContact CG-CB 4.22Å
48	R	94.9	Very high	88.3	Confident	173 Å²	173	53.4 Å²	53.4	65%	0.653	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.8	172.9	-62	178.4	-177.8	-171.2	0.1	109.9	N46 I50 C59 S60	N46-R48 PolarHBondContact O-N 3.22Å; R48-I50 PolarHBondContact O-N 2.77Å; R48-C59 CarbonylContact O-C 3.58Å; R48-C59 WeakPolarHBondContact O-CA 3.24Å; R48-S60 PolarHBondContact N-O 3.12Å; R48-S60 PolarHBondContact O-N 3.38Å; R48-S60 PolarHBondContact O-OG 2.92Å
49	P	92.3	Very high	88.3	Confident	89 Å²	89	53.4 Å²	53.4	58%	0.578	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	130.7	176.2	24.2	-30.8	0	0	0	110.3	V33	V33-P49 HydrophobicContact CG1-CB 3.63Å; V33-P49 HydrophobicContact CG1-CG 3.96Å
50	I	88.1	Confident	88.3	Confident	90 Å²	90	52.8 Å²	52.8	46%	0.462	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	-14.9	176.9	61	174.1	0	0	0	112.6	R48 V58 A71 L128	R48-I50 PolarHBondContact O-N 2.77Å; I50-V58 HydrophobicContact CD1-CG1 3.86Å; I50-V58 HydrophobicContact CG1-CB 4.12Å; I50-V58 HydrophobicContact CG1-CG1 3.82Å; I50-V58 WeakPolarHBondContact CG1-O 3.4Å; I50-V58 PolarHBondContact N-O 2.93Å; I50-A71 HydrophobicContact CD1-CB 4.42Å; I50-L128 HydrophobicContact CD1-CD1 3.57Å
51	G	80.4	Confident	88.4	Confident	32 Å²	32	52.9 Å²	52.9	33%	0.33	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	151	175.5	0	0	0	0	0	112.8	V58	G51-V58 PolarHBondContact N-O 3.42Å; G51-V58 PolarHBondContact O-N 3.05Å
52	S	75.8	Confident	88.5	Confident	107 Å²	107	56.2 Å²	56.2	75%	0.748	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.8	173.6	59.3	0	0	0	0	109.1
53	G	68.9	Low	88.6	Confident	49 Å²	49	51.6 Å²	51.6	51%	0.505	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	-179.5	177.3	0	0	0	0	0	112.5	Q55 G56	G53-Q55 PolarHBondContact O-N 3.49Å; G53-G56 PolarHBondContact N-O 2.92Å; G53-G56 PolarHBondContact O-N 2.81Å; G53-G56 VanDerWaalsContact O-N 3.11Å; G53-G56 VanDerWaalsContact O-O 3.11Å
54	A	66.6	Low	88.7	Confident	108 Å²	108	55 Å²	55	89%	0.893	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.4	-178.2	0	0	0	0	0	114.3
55	Q	68.3	Low	88.4	Confident	39 Å²	39	59.4 Å²	59.4	18%	0.182	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-14.1	-175.9	-56.9	-179.2	55.6	0	0	113.3	G53 S76 D187	G53-Q55 PolarHBondContact O-N 3.49Å; Q55-S76 PolarHBondContact O-N 3.42Å; Q55-S76 VanDerWaalsContact O-N 3.15Å; Q55-D187 PolarHBondContact NE2-OD2 3.19Å; Q55-D187 PolarHBondContact OE1-OD2 3.37Å
56	G	80	Confident	88.2	Confident	4 Å²	4	59.5 Å²	59.5	4%	0.041	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.2	172.1	-168.4	0	0	0	0	0	114.4	G53 K74 S76	G53-G56 PolarHBondContact N-O 2.92Å; G53-G56 PolarHBondContact O-N 2.81Å; G53-G56 VanDerWaalsContact O-N 3.11Å; G53-G56 VanDerWaalsContact O-O 3.11Å; G56-K74 WeakPolarHBondContact CA-O 3.35Å; G56-S76 VanDerWaalsContact CA-OG 3.26Å; G56-S76 WeakPolarHBondContact CA-OG 3.45Å
57	I	88.1	Confident	88.1	Confident	33 Å²	33	61.3 Å²	61.3	17%	0.169	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.4	167.9	-60	167	0	0	0	107.3	V33 F38 K73 K74	V33-I57 HydrophobicContact CG1-CG2 4.41Å; F38-I57 HydrophobicContact CE2-CB 3.84Å; F38-I57 HydrophobicContact CE2-CD1 4.47Å; F38-I57 HydrophobicContact CE2-CG2 3.66Å; F38-I57 HydrophobicContact CZ-CB 3.76Å; F38-I57 HydrophobicContact CZ-CG2 3.66Å; I57-K73 WeakPolarHBondContact O-CA 3.41Å; I57-K74 PolarHBondContact N-O 2.83Å; I57-K74 PolarHBondContact O-N 2.77Å
58	V	91.5	Very high	88	Confident	32 Å²	32	64.3 Å²	64.3	19%	0.194	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.7	179.4	-169.1	0	0	0	0	109.1	I50 G51 A71 I72 K73	I50-V58 HydrophobicContact CD1-CG1 3.86Å; I50-V58 HydrophobicContact CG1-CB 4.12Å; I50-V58 HydrophobicContact CG1-CG1 3.82Å; I50-V58 WeakPolarHBondContact CG1-O 3.4Å; I50-V58 PolarHBondContact N-O 2.93Å; G51-V58 PolarHBondContact N-O 3.42Å; G51-V58 PolarHBondContact O-N 3.05Å; V58-A71 HydrophobicContact CG1-CB 4.18Å; V58-I72 WeakPolarHBondContact CA-O 3.46Å; V58-K73 HydrophobicContact CG2-CB 4.09Å; V58-K73 HydrophobicContact CG2-CG 4.04Å
59	C	95.6	Very high	88.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.5	170.6	-66.7	0	0	0	0	110.7	F38 L47 R48 A71 I72	F38-C59 HydrophobicContact CE1-CB 4.22Å; L47-C59 HydrophobicContact CB-CB 4.41Å; L47-C59 HydrophobicContact CD2-CB 4.49Å; L47-C59 HydrophobicContact CG-CB 4.28Å; R48-C59 CarbonylContact O-C 3.58Å; R48-C59 WeakPolarHBondContact O-CA 3.24Å; C59-A71 CarbonylContact O-C 3.52Å; C59-A71 WeakPolarHBondContact O-CA 3.43Å; C59-I72 PolarHBondContact N-O 2.88Å; C59-I72 PolarHBondContact O-N 3.37Å
60	S	96.6	Very high	88.3	Confident	19 Å²	19	56.3 Å²	56.3	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	148	155.8	61.4	0	0	0	0	109.2	L47 R48 V70	L47-S60 CarbonylContact C-O 3.52Å; L47-S60 VanDerWaalsContact CA-O 3.28Å; L47-S60 WeakPolarHBondContact CA-O 3.46Å; R48-S60 PolarHBondContact N-O 3.12Å; R48-S60 PolarHBondContact O-N 3.38Å; R48-S60 PolarHBondContact O-OG 2.92Å; S60-V70 CarbonylContact C-O 3.56Å; S60-V70 WeakPolarHBondContact CA-O 3.28Å
61	A	97.9	Very high	88.7	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.017	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156	172.4	0	0	0	0	0	109.8	Q45 L47 N69 V70 I72	Q45-A61 CarbonylContact O-C 3.56Å; Q45-A61 WeakPolarHBondContact O-CA 3.43Å; L47-A61 HydrophobicContact CD1-CB 3.85Å; L47-A61 HydrophobicContact CG-CB 4.22Å; A61-N69 CarbonylContact O-C 3.5Å; A61-N69 WeakPolarHBondContact O-CA 3.38Å; A61-V70 HydrophobicContact CB-CG2 4.23Å; A61-V70 PolarHBondContact N-O 3.29Å; A61-V70 WeakPolarHBondContact O-CG2 3.19Å; A61-V70 PolarHBondContact O-N 3.34Å; A61-I72 HydrophobicContact CB-CD1 3.69Å; A61-I72 HydrophobicContact CB-CG1 4.28Å
62	Y	97.8	Very high	89.4	Confident	80 Å²	80	50.9 Å²	50.9	31%	0.314	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.2	168.8	-174.3	-102.6	0	0	0	109.5	Y44 Q45 Q64 E67	Y44-Y62 WeakPolarHBondContact CA-O 3.14Å; Q45-Y62 PolarHBondContact N-O 3.42Å; Q45-Y62 PolarHBondContact O-N 3.38Å; Y62-Q64 HydrophobicContact CD1-CG 4.12Å; Y62-Q64 HydrophobicContact CE1-CG 4.37Å; Y62-E67 WeakPolarHBondContact OH-CA 3.38Å
63	D	97.1	Very high	90.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	107.7	174.5	-174.3	-15	0	0	0	109.8	R43 Y44 I65 L66 E67 R68 V70	R43-D63 IonicContact CZ-OD1 3.01Å; R43-D63 IonicContact CZ-OD2 2.83Å; R43-D63 IonicContact NE-OD1 2.72Å; R43-D63 PolarHBondContact NE-OD1 3.3Å; R43-D63 IonicContact NE-OD2 3.74Å; R43-D63 PolarHBondContact NE-OD2 2.88Å; R43-D63 IonicContact NH2-OD1 3.55Å; R43-D63 PolarHBondContact NH2-OD1 2.91Å; R43-D63 IonicContact NH2-OD2 3.73Å; R43-D63 PolarHBondContact NH2-OD2 3.39Å; Y44-D63 HydrophobicContact CD1-CB 4.05Å; Y44-D63 HydrophobicContact CE1-CB 4.02Å; Y44-D63 WeakPolarHBondContact CE1-OD2 3.37Å; D63-I65 PolarHBondContact O-N 2.89Å; D63-I65 PolarHBondContact OD1-N 3.43Å; D63-L66 HydrophobicContact CB-CB 4.34Å; D63-L66 PolarHBondContact O-N 3.31Å; D63-L66 PolarHBondContact OD1-N 2.97Å; D63-L66 WeakPolarHBondContact OD2-CD1 3.31Å; D63-L66 WeakPolarHBondContact OD2-CG 3.4Å; D63-E67 WeakPolarHBondContact O-CA 3.42Å; D63-E67 PolarHBondContact O-N 2.94Å; D63-R68 WeakPolarHBondContact CB-O 3.27Å; D63-R68 PolarHBondContact N-O 3.35Å; D63-R68 PolarHBondContact O-N 3.04Å; D63-V70 HydrophobicContact CB-CG1 3.94Å; D63-V70 HydrophobicContact CB-CG2 4.18Å
64	Q	95.4	Very high	91.4	Very high	91 Å²	91	45 Å²	45	43%	0.425	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.3	-176.9	-64.6	-169.4	-52.5	0	0	114.5	R43 Q45 Y62	R43-Q64 PolarHBondContact O-N 3.01Å; Q45-Q64 HydrophobicContact CG-CG 4.07Å; Y62-Q64 HydrophobicContact CD1-CG 4.12Å; Y62-Q64 HydrophobicContact CE1-CG 4.37Å
65	I	92.3	Very high	92.6	Very high	94 Å²	94	40.4 Å²	40.4	48%	0.482	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-37.1	-178.6	-68.7	171.4	0	0	0	110.7	R43 D63 G388	R43-I65 HydrophobicContact CB-CD1 3.86Å; R43-I65 HydrophobicContact CB-CG1 4.22Å; D63-I65 PolarHBondContact O-N 2.89Å; D63-I65 PolarHBondContact OD1-N 3.43Å; I65-G388 WeakPolarHBondContact CG2-O 3.4Å
66	L	90.9	Very high	93.2	Very high	70 Å²	70	40.9 Å²	40.9	37%	0.366	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.3	175.6	-65	177.9	0	0	0	113.3	D63 R68	D63-L66 HydrophobicContact CB-CB 4.34Å; D63-L66 PolarHBondContact O-N 3.31Å; D63-L66 PolarHBondContact OD1-N 2.97Å; D63-L66 WeakPolarHBondContact OD2-CD1 3.31Å; D63-L66 WeakPolarHBondContact OD2-CG 3.4Å; L66-R68 HydrophobicContact CB-CG 3.86Å; L66-R68 PolarHBondContact O-N 3.13Å
67	E	94.9	Very high	93.4	Very high	151 Å²	151	49.1 Å²	49.1	71%	0.706	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	43.1	-178.8	-60.8	-176.3	162.8	0	0	112.9	Y62 D63	Y62-E67 WeakPolarHBondContact OH-CA 3.38Å; D63-E67 WeakPolarHBondContact O-CA 3.42Å; D63-E67 PolarHBondContact O-N 2.94Å
68	R	94.8	Very high	93.4	Very high	87 Å²	87	47.8 Å²	47.8	33%	0.328	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	157.9	-178.7	69.3	-178.3	-178.8	-176.6	-6.9	112.5	D63 L66 V70	D63-R68 WeakPolarHBondContact CB-O 3.27Å; D63-R68 PolarHBondContact N-O 3.35Å; D63-R68 PolarHBondContact O-N 3.04Å; L66-R68 HydrophobicContact CB-CG 3.86Å; L66-R68 PolarHBondContact O-N 3.13Å; R68-V70 HydrophobicContact CG-CG1 4.31Å
69	N	96.6	Very high	93.4	Very high	94 Å²	94	47.9 Å²	47.9	50%	0.503	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	142.2	170.5	-65.8	-45.5	0	0	0	111.2	A61 L128	A61-N69 CarbonylContact O-C 3.5Å; A61-N69 WeakPolarHBondContact O-CA 3.38Å; N69-L128 HydrophobicContact CB-CB 4.23Å; N69-L128 HydrophobicContact CB-CD2 3.55Å
70	V	97.1	Very high	93.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157.8	-179.6	-63.3	0	0	0	0	110.4	Y44 S60 A61 D63 R68 I72 L107 V125 M126	Y44-V70 HydrophobicContact CD1-CG2 3.83Å; Y44-V70 HydrophobicContact CE1-CG2 4.03Å; S60-V70 CarbonylContact C-O 3.56Å; S60-V70 WeakPolarHBondContact CA-O 3.28Å; A61-V70 HydrophobicContact CB-CG2 4.23Å; A61-V70 PolarHBondContact N-O 3.29Å; A61-V70 WeakPolarHBondContact O-CG2 3.19Å; A61-V70 PolarHBondContact O-N 3.34Å; D63-V70 HydrophobicContact CB-CG1 3.94Å; D63-V70 HydrophobicContact CB-CG2 4.18Å; R68-V70 HydrophobicContact CG-CG1 4.31Å; V70-I72 HydrophobicContact CG2-CD1 4.45Å; V70-I72 HydrophobicContact CG2-CG1 4.18Å; V70-L107 HydrophobicContact CG1-CD1 3.79Å; V70-V125 HydrophobicContact CB-CG1 3.83Å; V70-V125 HydrophobicContact CG1-CG1 4.22Å; V70-V125 HydrophobicContact CG2-CG1 3.88Å; V70-M126 WeakPolarHBondContact CA-O 3.14Å; V70-M126 WeakPolarHBondContact CB-O 3.32Å
71	A	95.9	Very high	92.7	Very high	8 Å²	8	54.6 Å²	54.6	7%	0.066	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130	169.3	0	0	0	0	0	109.6	I50 V58 C59 V125 M126 L128	I50-A71 HydrophobicContact CD1-CB 4.42Å; V58-A71 HydrophobicContact CG1-CB 4.18Å; C59-A71 CarbonylContact O-C 3.52Å; C59-A71 WeakPolarHBondContact O-CA 3.43Å; A71-V125 CarbonylContact O-C 3.54Å; A71-V125 WeakPolarHBondContact O-CA 3.24Å; A71-M126 HydrophobicContact CB-CE 4.46Å; A71-M126 PolarHBondContact N-O 3.44Å; A71-M126 PolarHBondContact O-N 2.92Å; A71-L128 HydrophobicContact CB-CD1 4Å
72	I	95.9	Very high	92.2	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	109.2	179.3	-52.7	-177.5	0	0	0	108.5	Y44 V58 C59 A61 V70 Y123 L124 V125	Y44-I72 HydrophobicContact CD1-CD1 3.91Å; Y44-I72 HydrophobicContact CD2-CD1 3.89Å; Y44-I72 HydrophobicContact CG-CD1 3.51Å; V58-I72 WeakPolarHBondContact CA-O 3.46Å; C59-I72 PolarHBondContact N-O 2.88Å; C59-I72 PolarHBondContact O-N 3.37Å; A61-I72 HydrophobicContact CB-CD1 3.69Å; A61-I72 HydrophobicContact CB-CG1 4.28Å; V70-I72 HydrophobicContact CG2-CD1 4.45Å; V70-I72 HydrophobicContact CG2-CG1 4.18Å; I72-Y123 HydrophobicContact CG2-CD1 3.95Å; I72-L124 CarbonylContact C-O 3.55Å; I72-L124 WeakPolarHBondContact CA-O 3.41Å; I72-V125 HydrophobicContact CG1-CG1 4.38Å; I72-V125 HydrophobicContact CG1-CG2 4.26Å; I72-V125 HydrophobicContact CG2-CG2 4.49Å
73	K	93.4	Very high	91.6	Very high	8 Å²	8	60 Å²	60	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	115.8	175.9	-178.9	178.2	-177.9	-173.5	0	109.4	I57 V58 L75 E91 Y123 L124 M126 D187	I57-K73 WeakPolarHBondContact O-CA 3.41Å; V58-K73 HydrophobicContact CG2-CB 4.09Å; V58-K73 HydrophobicContact CG2-CG 4.04Å; K73-L75 HydrophobicContact CD-CD2 4.34Å; K73-L75 HydrophobicContact CG-CD2 4.35Å; K73-E91 IonicContact NZ-OE1 3.74Å; K73-E91 PolarHBondContact NZ-OE1 2.86Å; K73-E91 IonicContact NZ-OE2 3.26Å; K73-Y123 WeakPolarHBondContact O-CA 3.32Å; K73-L124 HydrophobicContact CB-CB 4.41Å; K73-L124 PolarHBondContact N-O 2.76Å; K73-L124 PolarHBondContact O-N 3.37Å; K73-M126 HydrophobicContact CB-CE 3.7Å; K73-M126 HydrophobicContact CD-CE 4.39Å; K73-D187 IonicContact NZ-OD1 2.75Å; K73-D187 PolarHBondContact NZ-OD1 3.35Å
74	K	93.8	Very high	91	Very high	25 Å²	25	63.2 Å²	63.2	11%	0.109	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.4	167.8	-176.4	-176.7	-177.1	-178.6	0	108.5	T37 F38 G56 I57 S76 D121 Y123	T37-K74 PolarHBondContact O-NZ 3.12Å; F38-K74 HydrophobicContact CD1-CB 4.49Å; F38-K74 HydrophobicContact CD2-CD 4.41Å; F38-K74 HydrophobicContact CE1-CB 3.79Å; F38-K74 HydrophobicContact CE2-CB 4.23Å; F38-K74 HydrophobicContact CE2-CD 4.28Å; F38-K74 HydrophobicContact CZ-CB 3.63Å; G56-K74 WeakPolarHBondContact CA-O 3.35Å; I57-K74 PolarHBondContact N-O 2.83Å; I57-K74 PolarHBondContact O-N 2.77Å; K74-S76 PolarHBondContact O-N 3.26Å; K74-D121 VanDerWaalsContact CE-CG 3.44Å; K74-D121 WeakPolarHBondContact CE-OD1 3.42Å; K74-D121 IonicContact NZ-OD1 2.77Å; K74-D121 PolarHBondContact NZ-OD1 2.94Å; K74-D121 IonicContact NZ-OD2 3.88Å; K74-Y123 HydrophobicContact CB-CD1 3.88Å; K74-Y123 HydrophobicContact CB-CE1 3.68Å; K74-Y123 HydrophobicContact CD-CE1 3.8Å; K74-Y123 WeakPolarHBondContact CD-OH 3.33Å; K74-Y123 WeakPolarHBondContact CE-OH 3.43Å; K74-Y123 HydrophobicContact CG-CD1 4.15Å; K74-Y123 HydrophobicContact CG-CE1 3.64Å; K74-Y123 HydrophobicContact CG-CE2 4.48Å
75	L	90	Very high	90.7	Very high	10 Å²	10	58.9 Å²	58.9	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.9	177.3	-62.7	-171	0	0	0	110.6	K73 R77 P78 A88 V122 L124	K73-L75 HydrophobicContact CD-CD2 4.34Å; K73-L75 HydrophobicContact CG-CD2 4.35Å; L75-R77 PolarHBondContact O-N 2.91Å; L75-P78 HydrophobicContact CB-CB 4.42Å; L75-P78 HydrophobicContact CB-CG 4.35Å; L75-A88 HydrophobicContact CD1-CB 3.84Å; L75-V122 HydrophobicContact CB-CB 4.43Å; L75-V122 HydrophobicContact CD1-CB 3.98Å; L75-V122 HydrophobicContact CD1-CG1 4.08Å; L75-V122 HydrophobicContact CG-CB 4.22Å; L75-V122 HydrophobicContact CG-CG1 4.49Å; L75-V122 PolarHBondContact N-O 2.77Å; L75-L124 HydrophobicContact CD2-CD1 3.96Å; L75-L124 HydrophobicContact CG-CD1 4.41Å
76	S	81.5	Confident	90.5	Very high	49 Å²	49	56.3 Å²	56.3	34%	0.343	27%	0.271	S	S	.	.	S	Bend	trans	-81.9	111.9	179.6	-72.6	0	0	0	0	111.2	Q55 G56 K74	Q55-S76 PolarHBondContact O-N 3.42Å; Q55-S76 VanDerWaalsContact O-N 3.15Å; G56-S76 VanDerWaalsContact CA-OG 3.26Å; G56-S76 WeakPolarHBondContact CA-OG 3.45Å; K74-S76 PolarHBondContact O-N 3.26Å
77	R	83.4	Confident	90.2	Very high	177 Å²	177	56 Å²	56	67%	0.668	27%	0.265	S	S	*	.			trans	46.7	56.4	173.4	-61.9	179.9	-78.5	172.2	-6.8	113.1	L75 F79 Q80	L75-R77 PolarHBondContact O-N 2.91Å; R77-F79 PolarHBondContact O-N 2.93Å; R77-F79 VanDerWaalsContact O-N 3.13Å; R77-Q80 HydrophobicContact CB-CB 4.18Å; R77-Q80 WeakPolarHBondContact O-CB 3.25Å; R77-Q80 PolarHBondContact O-N 2.85Å; R77-Q80 VanDerWaalsContact O-N 3.16Å
78	P	88.6	Confident	89.9	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.032	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.9	-176.2	25.3	-34.1	0	0	0	112.8	L75 H84 A85 A88	L75-P78 HydrophobicContact CB-CB 4.42Å; L75-P78 HydrophobicContact CB-CG 4.35Å; P78-H84 CarbonylContact O-C 3.56Å; P78-H84 WeakPolarHBondContact O-CB 3.3Å; P78-A85 WeakPolarHBondContact O-CA 3.21Å; P78-A85 PolarHBondContact O-N 3.23Å; P78-A88 HydrophobicContact CB-CB 3.7Å
79	F	92.3	Very high	89.6	Confident	34 Å²	34	46 Å²	46	15%	0.149	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	19.1	-178.4	-43.7	-59.4	0	0	0	113.9	R77 N81 F119 V122 V367 K371 I374	R77-F79 PolarHBondContact O-N 2.93Å; R77-F79 VanDerWaalsContact O-N 3.13Å; F79-N81 VanDerWaalsContact C-N 3.33Å; F79-N81 PolarHBondContact O-N 3.01Å; F79-F119 HydrophobicContact CE1-CE1 4.04Å; F79-F119 AromaticContact CE2-CD1 3.91Å; F79-F119 HydrophobicContact CE2-CD1 3.91Å; F79-F119 AromaticContact CE2-CE1 3.84Å; F79-F119 HydrophobicContact CE2-CE1 3.84Å; F79-F119 HydrophobicContact CE2-CG 4.34Å; F79-F119 HydrophobicContact CE2-CZ 4.19Å; F79-F119 AromaticContact CZ-CD1 3.7Å; F79-F119 HydrophobicContact CZ-CD1 3.7Å; F79-F119 AromaticContact CZ-CE1 3.21Å; F79-F119 HydrophobicContact CZ-CE1 3.21Å; F79-F119 HydrophobicContact CZ-CE2 4.39Å; F79-F119 HydrophobicContact CZ-CG 4.49Å; F79-F119 AromaticContact CZ-CZ 3.62Å; F79-F119 HydrophobicContact CZ-CZ 3.62Å; F79-V122 HydrophobicContact CZ-CG2 4.48Å; F79-V367 HydrophobicContact CB-CG1 3.88Å; F79-V367 WeakPolarHBondContact O-CG1 3.48Å; F79-K371 HydrophobicContact CD1-CB 3.72Å; F79-K371 HydrophobicContact CD1-CD 4.49Å; F79-K371 HydrophobicContact CD1-CG 3.97Å; F79-K371 HydrophobicContact CD2-CD 4.2Å; F79-K371 HydrophobicContact CD2-CG 4.27Å; F79-K371 HydrophobicContact CE1-CB 3.89Å; F79-K371 HydrophobicContact CE1-CG 3.93Å; F79-K371 HydrophobicContact CE2-CG 4.23Å; F79-K371 HydrophobicContact CG-CB 4.25Å; F79-K371 HydrophobicContact CG-CD 4.21Å; F79-K371 HydrophobicContact CG-CG 4.17Å; F79-K371 HydrophobicContact CZ-CG 4.1Å; F79-I374 HydrophobicContact CD1-CD1 4.43Å; F79-I374 HydrophobicContact CE1-CB 4.32Å; F79-I374 HydrophobicContact CE1-CD1 3.62Å; F79-I374 HydrophobicContact CZ-CD1 4.46Å; F79-I374 HydrophobicContact CZ-CG2 4.43Å
80	Q	88.7	Confident	89.1	Confident	106 Å²	106	41.7 Å²	41.7	50%	0.495	20%	0.199	S	C	.	.	S	Bend	trans	-66.3	-36	-179.5	-176	178.8	-9.1	0	0	112.8	R77 H84	R77-Q80 HydrophobicContact CB-CB 4.18Å; R77-Q80 WeakPolarHBondContact O-CB 3.25Å; R77-Q80 PolarHBondContact O-N 2.85Å; R77-Q80 VanDerWaalsContact O-N 3.16Å; Q80-H84 PolarHBondContact OE1-CE1 2.65Å
81	N	88.1	Confident	88.6	Confident	55 Å²	55	41.9 Å²	41.9	29%	0.294	20%	0.199	S	C	.	.	S	Bend	trans	-158.3	168.3	179.1	61.2	59.4	0	0	0	109.8	F79 T83 H84 A85	F79-N81 VanDerWaalsContact C-N 3.33Å; F79-N81 PolarHBondContact O-N 3.01Å; N81-T83 PolarHBondContact O-N 3.26Å; N81-T83 WeakPolarHBondContact OD1-CA 3.39Å; N81-T83 WeakPolarHBondContact OD1-CB 3.42Å; N81-T83 PolarHBondContact OD1-N 2.87Å; N81-H84 PolarHBondContact O-N 2.94Å; N81-H84 PolarHBondContact OD1-CD2 3.15Å; N81-H84 PolarHBondContact OD1-N 2.8Å; N81-A85 PolarHBondContact O-N 2.7Å
82	Q	88.4	Confident	88.2	Confident	103 Å²	103	41.6 Å²	41.6	48%	0.481	20%	0.197	S	C	.	.	H	α-helix	trans	-58.9	-33.4	-177.6	-64.5	178.4	16.7	0	0	113.1	A85 K86 V367	Q82-A85 PolarHBondContact O-N 3.14Å; Q82-K86 VanDerWaalsContact O-CB 3.24Å; Q82-K86 WeakPolarHBondContact O-CB 3.36Å; Q82-K86 PolarHBondContact O-N 2.79Å; Q82-V367 HydrophobicContact CG-CG2 3.9Å
83	T	84.1	Confident	87.7	Confident	93 Å²	93	42.1 Å²	42.1	57%	0.571	20%	0.2	S	C	*	.	H	α-helix	trans	-68.5	-43.7	179.4	-61.9	0	0	0	0	111.4	N81 R87	N81-T83 PolarHBondContact O-N 3.26Å; N81-T83 WeakPolarHBondContact OD1-CA 3.39Å; N81-T83 WeakPolarHBondContact OD1-CB 3.42Å; N81-T83 PolarHBondContact OD1-N 2.87Å; T83-R87 WeakPolarHBondContact O-CB 3Å; T83-R87 PolarHBondContact O-N 3.07Å
84	H	84.8	Confident	87.3	Confident	68 Å²	68	42.2 Å²	42.2	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-65.2	-42.1	175.7	-69.9	-171.5	0	0	0	111	P78 Q80 N81 R87 A88	P78-H84 CarbonylContact O-C 3.56Å; P78-H84 WeakPolarHBondContact O-CB 3.3Å; Q80-H84 PolarHBondContact OE1-CE1 2.65Å; N81-H84 PolarHBondContact O-N 2.94Å; N81-H84 PolarHBondContact OD1-CD2 3.15Å; N81-H84 PolarHBondContact OD1-N 2.8Å; H84-R87 WeakPolarHBondContact O-CB 3.12Å; H84-R87 PolarHBondContact O-N 3.34Å; H84-A88 WeakPolarHBondContact O-CB 3.2Å; H84-A88 PolarHBondContact O-N 3.38Å
85	A	90.1	Very high	87	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68	-48.3	-176.9	0	0	0	0	0	111.2	P78 N81 Q82 R87 A88 Y89 W370 I374	P78-A85 WeakPolarHBondContact O-CA 3.21Å; P78-A85 PolarHBondContact O-N 3.23Å; N81-A85 PolarHBondContact O-N 2.7Å; Q82-A85 PolarHBondContact O-N 3.14Å; A85-R87 VanDerWaalsContact C-N 3.28Å; A85-R87 PolarHBondContact O-N 2.99Å; A85-A88 PolarHBondContact O-N 3.3Å; A85-Y89 PolarHBondContact O-N 2.73Å; A85-W370 HydrophobicContact CB-CB 3.53Å; A85-W370 HydrophobicContact CB-CG 3.86Å; A85-I374 WeakPolarHBondContact O-CD1 3.36Å
86	K	87.1	Confident	86.7	Confident	40 Å²	40	43 Å²	43	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-40.1	173.8	-174.6	167.1	-176.2	164.9	0	112.2	Q82 R90 D361 R363 W370	Q82-K86 VanDerWaalsContact O-CB 3.24Å; Q82-K86 WeakPolarHBondContact O-CB 3.36Å; Q82-K86 PolarHBondContact O-N 2.79Å; K86-R90 WeakPolarHBondContact O-CB 3.14Å; K86-R90 PolarHBondContact O-N 2.57Å; K86-D361 WeakPolarHBondContact CE-O 2.97Å; K86-D361 PolarHBondContact NZ-O 3.22Å; K86-R363 PolarHBondContact NZ-O 2.79Å; K86-W370 HydrophobicContact CB-CD2 4.45Å; K86-W370 HydrophobicContact CB-CZ2 3.86Å; K86-W370 HydrophobicContact CD-CZ2 3.8Å; K86-W370 HydrophobicContact CG-CH2 4.13Å; K86-W370 HydrophobicContact CG-CZ2 3.63Å
87	R	84.4	Confident	86.8	Confident	64 Å²	64	42.1 Å²	42.1	24%	0.242	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-48.5	176.1	176.3	173.9	-176.3	155.6	11.8	111.8	T83 H84 A85 R90 E91 G189	T83-R87 WeakPolarHBondContact O-CB 3Å; T83-R87 PolarHBondContact O-N 3.07Å; H84-R87 WeakPolarHBondContact O-CB 3.12Å; H84-R87 PolarHBondContact O-N 3.34Å; A85-R87 VanDerWaalsContact C-N 3.28Å; A85-R87 PolarHBondContact O-N 2.99Å; R87-R90 PolarHBondContact O-N 2.66Å; R87-E91 WeakPolarHBondContact O-CB 3.48Å; R87-E91 PolarHBondContact O-N 3.35Å; R87-G189 WeakPolarHBondContact CG-O 3.44Å
88	A	88.2	Confident	86.8	Confident	6 Å²	6	34.1 Å²	34.1	5%	0.05	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-45.3	179.7	0	0	0	0	0	111.8	L75 P78 H84 A85 R90 E91 L92 I374	L75-A88 HydrophobicContact CD1-CB 3.84Å; P78-A88 HydrophobicContact CB-CB 3.7Å; H84-A88 WeakPolarHBondContact O-CB 3.2Å; H84-A88 PolarHBondContact O-N 3.38Å; A85-A88 PolarHBondContact O-N 3.3Å; A88-R90 VanDerWaalsContact C-N 3.34Å; A88-R90 PolarHBondContact O-N 2.7Å; A88-E91 PolarHBondContact O-N 3.02Å; A88-L92 PolarHBondContact O-N 3.04Å; A88-I374 HydrophobicContact CB-CD1 3.99Å
89	Y	89.1	Confident	86.7	Confident	20 Å²	20	40.8 Å²	40.8	8%	0.078	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-47.5	176.1	-177.9	-107.8	0	0	0	111.4	A85 L92 V93 L360 W370 L373 I374 E377	A85-Y89 PolarHBondContact O-N 2.73Å; Y89-L92 WeakPolarHBondContact O-CB 3.29Å; Y89-L92 PolarHBondContact O-N 3.34Å; Y89-V93 HydrophobicContact CD1-CG2 4.16Å; Y89-V93 HydrophobicContact CD2-CG2 4.35Å; Y89-V93 HydrophobicContact CE1-CG2 3.75Å; Y89-V93 HydrophobicContact CE2-CG2 3.93Å; Y89-V93 HydrophobicContact CG-CG2 4.46Å; Y89-V93 WeakPolarHBondContact O-CG2 3.22Å; Y89-V93 PolarHBondContact O-N 3.23Å; Y89-L360 HydrophobicContact CD1-CD1 3.98Å; Y89-L360 HydrophobicContact CD1-CG 4.3Å; Y89-L360 HydrophobicContact CE1-CD1 3.53Å; Y89-L360 HydrophobicContact CE1-CG 4.1Å; Y89-W370 AromaticContact CD1-CE3 3.91Å; Y89-W370 HydrophobicContact CD1-CE3 3.91Å; Y89-W370 HydrophobicContact CD1-CH2 4.2Å; Y89-W370 AromaticContact CD1-CZ3 3.3Å; Y89-W370 HydrophobicContact CD1-CZ3 3.3Å; Y89-W370 AromaticContact CE1-CZ3 3.81Å; Y89-W370 HydrophobicContact CE1-CZ3 3.81Å; Y89-W370 AromaticContact CG-CE3 3.86Å; Y89-W370 HydrophobicContact CG-CE3 3.86Å; Y89-W370 AromaticContact CG-CZ3 3.76Å; Y89-W370 HydrophobicContact CG-CZ3 3.76Å; Y89-L373 HydrophobicContact CD2-CB 3.95Å; Y89-L373 HydrophobicContact CE2-CB 3.66Å; Y89-I374 HydrophobicContact CD2-CG1 3.65Å; Y89-I374 HydrophobicContact CG-CG1 4.11Å; Y89-E377 HydrophobicContact CD2-CG 4.37Å; Y89-E377 HydrophobicContact CE2-CG 3.57Å
90	R	85.6	Confident	86.8	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-41.9	-179.1	-169.3	174.9	73.7	166.6	12.8	113	K86 R87 A88 L92 V93 L94 F188 G189 L190 A191 L360 D361	K86-R90 WeakPolarHBondContact O-CB 3.14Å; K86-R90 PolarHBondContact O-N 2.57Å; R87-R90 PolarHBondContact O-N 2.66Å; A88-R90 VanDerWaalsContact C-N 3.34Å; A88-R90 PolarHBondContact O-N 2.7Å; R90-L92 VanDerWaalsContact C-N 3.26Å; R90-L92 PolarHBondContact O-N 3.18Å; R90-V93 PolarHBondContact O-N 2.94Å; R90-L94 HydrophobicContact CG-CD1 3.7Å; R90-L94 HydrophobicContact CG-CG 3.93Å; R90-L94 WeakPolarHBondContact O-CB 3.19Å; R90-L94 VanDerWaalsContact O-CG 3.27Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 3.2Å; R90-F188 PolarHBondContact NH2-O 3Å; R90-G189 VanDerWaalsContact NH2-C 3.26Å; R90-G189 PolarHBondContact NH2-O 3.14Å; R90-L190 VanDerWaalsContact NH2-CA 3.27Å; R90-L190 PolarHBondContact NH2-O 3.19Å; R90-A191 VanDerWaalsContact CZ-C 3.47Å; R90-A191 PolarHBondContact NE-O 3.37Å; R90-A191 PolarHBondContact NH1-O 2.87Å; R90-A191 PolarHBondContact NH2-O 2.96Å; R90-L360 HydrophobicContact CB-CD2 3.73Å; R90-L360 HydrophobicContact CG-CD2 3.43Å; R90-L360 VanDerWaalsContact CG-CD2 3.43Å; R90-D361 WeakPolarHBondContact CD-OD1 3.48Å; R90-D361 IonicContact CZ-OD1 2.7Å; R90-D361 IonicContact NH1-OD1 3.65Å; R90-D361 PolarHBondContact NH1-OD1 2.9Å; R90-D361 IonicContact NH1-OD2 3.36Å
91	E	86.3	Confident	87	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-46	175.4	-174	172.8	166.4	0	0	110.4	K73 R87 A88 M95 L124	K73-E91 IonicContact NZ-OE1 3.74Å; K73-E91 PolarHBondContact NZ-OE1 2.86Å; K73-E91 IonicContact NZ-OE2 3.26Å; R87-E91 WeakPolarHBondContact O-CB 3.48Å; R87-E91 PolarHBondContact O-N 3.35Å; A88-E91 PolarHBondContact O-N 3.02Å; E91-M95 HydrophobicContact CG-SD 4.15Å; E91-M95 WeakPolarHBondContact O-CB 3.47Å; E91-M95 VanDerWaalsContact O-CG 3.24Å; E91-M95 WeakPolarHBondContact O-CG 3.47Å; E91-M95 PolarHBondContact O-N 2.92Å; E91-L124 HydrophobicContact CG-CD1 4.48Å
92	L	88.3	Confident	87.4	Confident	3 Å²	3	36 Å²	36	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-51.6	175.9	179.1	58.3	0	0	0	112.6	A88 Y89 R90 L94 M95 K96 L106 V109 L124 I374 E377 V378	A88-L92 PolarHBondContact O-N 3.04Å; Y89-L92 WeakPolarHBondContact O-CB 3.29Å; Y89-L92 PolarHBondContact O-N 3.34Å; R90-L92 VanDerWaalsContact C-N 3.26Å; R90-L92 PolarHBondContact O-N 3.18Å; L92-L94 PolarHBondContact O-N 3.45Å; L92-M95 PolarHBondContact O-N 2.89Å; L92-K96 HydrophobicContact CD1-CD 4.03Å; L92-K96 HydrophobicContact CD1-CG 4.33Å; L92-K96 HydrophobicContact CG-CD 4.17Å; L92-K96 VanDerWaalsContact O-CG 3.28Å; L92-K96 WeakPolarHBondContact O-CG 3.29Å; L92-K96 PolarHBondContact O-N 2.63Å; L92-L106 HydrophobicContact CD1-CD2 4.18Å; L92-V109 HydrophobicContact CD1-CB 4.19Å; L92-V109 HydrophobicContact CD1-CG1 4.06Å; L92-V109 HydrophobicContact CD1-CG2 3.95Å; L92-L124 HydrophobicContact CD1-CD2 4.07Å; L92-I374 HydrophobicContact CD2-CG2 4.32Å; L92-E377 HydrophobicContact CD2-CB 3.6Å; L92-E377 HydrophobicContact CG-CB 4.4Å; L92-V378 HydrophobicContact CD2-CG2 3.98Å
93	V	86.3	Confident	87.7	Confident	11 Å²	11	31.2 Å²	31.2	7%	0.067	16%	0.157	C	C	.	.	H	α-helix	trans	-61.9	-44.8	-178.3	170.9	0	0	0	0	111.5	Y89 R90 K96 C97 L360	Y89-V93 HydrophobicContact CD1-CG2 4.16Å; Y89-V93 HydrophobicContact CD2-CG2 4.35Å; Y89-V93 HydrophobicContact CE1-CG2 3.75Å; Y89-V93 HydrophobicContact CE2-CG2 3.93Å; Y89-V93 HydrophobicContact CG-CG2 4.46Å; Y89-V93 WeakPolarHBondContact O-CG2 3.22Å; Y89-V93 PolarHBondContact O-N 3.23Å; R90-V93 PolarHBondContact O-N 2.94Å; V93-K96 PolarHBondContact O-N 3.37Å; V93-C97 PolarHBondContact O-N 2.81Å; V93-C97 PolarHBondContact O-SG 3.32Å; V93-L360 HydrophobicContact CB-CD1 4.08Å; V93-L360 HydrophobicContact CG1-CD1 3.85Å; V93-L360 HydrophobicContact CG2-CD1 4.1Å
94	L	83.9	Confident	88.1	Confident	10 Å²	10	27 Å²	27	5%	0.052	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-46.7	179.3	-68.4	-179.3	0	0	0	111	R90 L92 K96 C97 V98 I165 F188 A191 I355	R90-L94 HydrophobicContact CG-CD1 3.7Å; R90-L94 HydrophobicContact CG-CG 3.93Å; R90-L94 WeakPolarHBondContact O-CB 3.19Å; R90-L94 VanDerWaalsContact O-CG 3.27Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 3.2Å; L92-L94 PolarHBondContact O-N 3.45Å; L94-K96 PolarHBondContact O-N 2.9Å; L94-C97 PolarHBondContact O-N 2.73Å; L94-V98 WeakPolarHBondContact O-CG2 3.35Å; L94-V98 PolarHBondContact O-N 2.72Å; L94-I165 HydrophobicContact CD2-CD1 3.62Å; L94-I165 HydrophobicContact CD2-CG1 4.11Å; L94-F188 HydrophobicContact CB-CB 4.07Å; L94-F188 HydrophobicContact CB-CD2 4.25Å; L94-F188 HydrophobicContact CB-CG 4.18Å; L94-F188 HydrophobicContact CD1-CB 3.58Å; L94-F188 HydrophobicContact CD1-CG 4.26Å; L94-F188 HydrophobicContact CG-CB 4.48Å; L94-A191 HydrophobicContact CD1-CB 4.47Å; L94-I355 HydrophobicContact CD2-CD1 4.36Å
95	M	86.9	Confident	88.3	Confident	8 Å²	8	24.9 Å²	24.9	4%	0.039	13%	0.127	C	C	.	.	H	α-helix	trans	-61.2	-28.2	177.2	-75.2	-176	72.6	0	0	113.6	E91 L92 I104 L106 L124 M126 F188	E91-M95 HydrophobicContact CG-SD 4.15Å; E91-M95 WeakPolarHBondContact O-CB 3.47Å; E91-M95 VanDerWaalsContact O-CG 3.24Å; E91-M95 WeakPolarHBondContact O-CG 3.47Å; E91-M95 PolarHBondContact O-N 2.92Å; L92-M95 PolarHBondContact O-N 2.89Å; M95-I104 HydrophobicContact CE-CG2 4.44Å; M95-L106 HydrophobicContact CB-CB 4.19Å; M95-L106 HydrophobicContact CE-CB 4.09Å; M95-L106 HydrophobicContact CE-CD1 3.77Å; M95-L124 HydrophobicContact SD-CD1 4.06Å; M95-M126 HydrophobicContact CE-CG 3.56Å; M95-M126 HydrophobicContact CE-SD 3.59Å; M95-M126 VanDerWaalsContact CE-SD 3.59Å; M95-F188 HydrophobicContact CG-CD2 3.91Å; M95-F188 HydrophobicContact CG-CE2 4.1Å
96	K	84.8	Confident	88.4	Confident	42 Å²	42	25.7 Å²	25.7	18%	0.183	13%	0.131	C	C	.	.	H	α-helix	trans	-73.8	-28.6	174	-72.7	174.2	63.4	161.8	0	113.2	L92 V93 L94 L106 E377 W381	L92-K96 HydrophobicContact CD1-CD 4.03Å; L92-K96 HydrophobicContact CD1-CG 4.33Å; L92-K96 HydrophobicContact CG-CD 4.17Å; L92-K96 VanDerWaalsContact O-CG 3.28Å; L92-K96 WeakPolarHBondContact O-CG 3.29Å; L92-K96 PolarHBondContact O-N 2.63Å; V93-K96 PolarHBondContact O-N 3.37Å; L94-K96 PolarHBondContact O-N 2.9Å; K96-L106 HydrophobicContact CG-CD2 3.82Å; K96-E377 PolarHBondContact NZ-O 2.8Å; K96-E377 IonicContact NZ-OE2 3.75Å; K96-E377 PolarHBondContact NZ-OE2 2.84Å; K96-W381 HydrophobicContact CB-CZ3 4.18Å; K96-W381 HydrophobicContact CD-CE3 3.97Å; K96-W381 HydrophobicContact CD-CZ3 4.24Å; K96-W381 HydrophobicContact CG-CE3 3.87Å; K96-W381 HydrophobicContact CG-CH2 4.41Å; K96-W381 HydrophobicContact CG-CZ3 3.66Å
97	C	82.6	Confident	88.6	Confident	31 Å²	31	25.3 Å²	25.3	21%	0.209	13%	0.131	C	C	.	.	H	α-helix	trans	-93.9	-37.6	-173.5	-61.8	0	0	0	0	112.4	V93 L94 P353 P356	V93-C97 PolarHBondContact O-N 2.81Å; V93-C97 PolarHBondContact O-SG 3.32Å; L94-C97 PolarHBondContact O-N 2.73Å; C97-P353 HydrophobicContact CB-CB 4.34Å; C97-P353 WeakPolarHBondContact O-CB 3.38Å; C97-P356 VanDerWaalsContact SG-CD 3.5Å
98	V	85	Confident	89	Confident	9 Å²	9	22.3 Å²	22.3	6%	0.055	12%	0.12	C	C	.	.			trans	-79.6	126.8	-173.8	-172.1	0	0	0	0	111.2	L94 I103 L160 I165 P353	L94-V98 WeakPolarHBondContact O-CG2 3.35Å; L94-V98 PolarHBondContact O-N 2.72Å; V98-I103 HydrophobicContact CB-CG2 4.23Å; V98-I103 HydrophobicContact CG1-CB 4.03Å; V98-I103 HydrophobicContact CG1-CG1 3.99Å; V98-I103 HydrophobicContact CG1-CG2 3.61Å; V98-L160 HydrophobicContact CG1-CD2 4.14Å; V98-L160 HydrophobicContact CG2-CD2 4.13Å; V98-I165 HydrophobicContact CG2-CD1 4.08Å; V98-P353 HydrophobicContact CB-CG 4.27Å; V98-P353 HydrophobicContact CG1-CG 4.32Å; V98-P353 HydrophobicContact CG2-CG 3.88Å
99	N	86.4	Confident	89.3	Confident	145 Å²	145	22 Å²	22	78%	0.775	12%	0.117	S	C	*	.			trans	-135.3	95.4	176.8	-179	31.2	0	0	0	110.2	H159	N99-H159 PolarHBondContact O-NE2 2.78Å
100	H	92.8	Very high	89.6	Confident	14 Å²	14	21 Å²	21	7%	0.065	11%	0.113	C	C	.	.			trans	-149.3	144.9	178.2	-177.2	-101.2	0	0	0	110.3	N102 I103 H159 E347	H100-N102 PolarHBondContact CE1-OD1 3.12Å; H100-N102 VanDerWaalsContact CE1-OD1 3.23Å; H100-N102 PolarHBondContact ND1-N 3.2Å; H100-N102 PolarHBondContact O-N 3Å; H100-N102 VanDerWaalsContact O-N 3.17Å; H100-I103 HydrophobicContact CB-CB 4.21Å; H100-I103 HydrophobicContact CB-CG1 4.01Å; H100-I103 PolarHBondContact O-N 3Å; H100-H159 HydrophobicContact CB-CB 4.29Å; H100-H159 WeakPolarHBondContact CB-CD2 3.36Å; H100-H159 AromaticContact CD2-CG 3.89Å; H100-H159 AromaticContact CD2-ND1 3.82Å; H100-H159 AromaticContact CG-CG 3.78Å; H100-E347 PolarHBondContact NE2-O 3.07Å
101	K	94.3	Very high	90	Very high	80 Å²	80	20.9 Å²	20.9	35%	0.348	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.3	-175.5	67	168.1	-167.8	158.4	0	113.4	K184 E347	K101-K184 WeakPolarHBondContact O-CE 3.49Å; K101-K184 WeakPolarHBondContact O-CG 3.31Å; K101-K184 PolarHBondContact O-NZ 3.06Å; K101-E347 WeakPolarHBondContact CE-OE1 3.49Å; K101-E347 WeakPolarHBondContact CE-OE2 3.43Å; K101-E347 IonicContact NZ-OE1 3.79Å; K101-E347 PolarHBondContact NZ-OE1 3.26Å; K101-E347 IonicContact NZ-OE2 3.81Å; K101-E347 PolarHBondContact NZ-OE2 2.99Å
102	N	96.8	Very high	90.3	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.011	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	12.8	177.4	-54.5	113.5	0	0	0	114.3	H100 Q152 L183 K184 I185	H100-N102 PolarHBondContact CE1-OD1 3.12Å; H100-N102 VanDerWaalsContact CE1-OD1 3.23Å; H100-N102 PolarHBondContact ND1-N 3.2Å; H100-N102 PolarHBondContact O-N 3Å; H100-N102 VanDerWaalsContact O-N 3.17Å; N102-Q152 VanDerWaalsContact CB-O 3.27Å; N102-Q152 WeakPolarHBondContact CB-O 3.37Å; N102-Q152 WeakPolarHBondContact ND2-CB 3.41Å; N102-Q152 WeakPolarHBondContact ND2-CG 3.47Å; N102-Q152 PolarHBondContact ND2-OE1 2.8Å; N102-Q152 VanDerWaalsContact ND2-OE1 3.15Å; N102-L183 VanDerWaalsContact CA-O 3.28Å; N102-L183 WeakPolarHBondContact CA-O 3.42Å; N102-L183 PolarHBondContact ND2-O 3.49Å; N102-K184 WeakPolarHBondContact O-CA 3.3Å; N102-I185 PolarHBondContact O-N 2.92Å
103	I	94.2	Very high	90.5	Very high	2 Å²	2	23 Å²	23	1%	0.01	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-118.4	141.9	171.4	-62.5	-58	0	0	0	108.2	V98 H100 G105 L160 K184 I185 F188	V98-I103 HydrophobicContact CB-CG2 4.23Å; V98-I103 HydrophobicContact CG1-CB 4.03Å; V98-I103 HydrophobicContact CG1-CG1 3.99Å; V98-I103 HydrophobicContact CG1-CG2 3.61Å; H100-I103 HydrophobicContact CB-CB 4.21Å; H100-I103 HydrophobicContact CB-CG1 4.01Å; H100-I103 PolarHBondContact O-N 3Å; I103-G105 PolarHBondContact O-N 2.75Å; I103-L160 HydrophobicContact CD1-CD1 3.86Å; I103-L160 HydrophobicContact CD1-CD2 4.14Å; I103-L160 HydrophobicContact CD1-CG 3.9Å; I103-K184 PolarHBondContact O-NZ 3.29Å; I103-K184 VanDerWaalsContact O-NZ 3.15Å; I103-I185 HydrophobicContact CD1-CB 3.89Å; I103-I185 HydrophobicContact CD1-CD1 4.1Å; I103-I185 HydrophobicContact CD1-CG1 4.36Å; I103-F188 HydrophobicContact CD1-CZ 4.43Å; I103-F188 HydrophobicContact CG2-CE1 4.5Å; I103-F188 HydrophobicContact CG2-CE2 4.07Å; I103-F188 HydrophobicContact CG2-CZ 3.47Å; I103-F188 VanDerWaalsContact CG2-CZ 3.47Å
104	I	92.8	Very high	90.4	Very high	5 Å²	5	26.2 Å²	26.2	3%	0.026	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-65.1	128.9	176.4	-163.6	74.9	0	0	0	111.1	M95 M126 E127 M129 K184 I185 L186	M95-I104 HydrophobicContact CE-CG2 4.44Å; I104-M126 HydrophobicContact CD1-CB 4.39Å; I104-M126 HydrophobicContact CG1-CB 4Å; I104-M126 HydrophobicContact CG1-CG 4.17Å; I104-M126 HydrophobicContact CG1-SD 4.03Å; I104-E127 HydrophobicContact CD1-CG 3.37Å; I104-E127 HydrophobicContact CG1-CG 4.37Å; I104-M129 HydrophobicContact CD1-CG 4.36Å; I104-K184 HydrophobicContact CD1-CD 4.36Å; I104-I185 WeakPolarHBondContact CG2-O 3.35Å; I104-I185 PolarHBondContact N-O 2.82Å; I104-L186 HydrophobicContact CB-CD2 3.71Å; I104-L186 HydrophobicContact CD1-CD2 3.86Å; I104-L186 HydrophobicContact CG1-CD2 3.69Å; I104-L186 HydrophobicContact CG2-CD2 3.85Å
105	G	89.5	Confident	90.7	Very high	23 Å²	23	27.2 Å²	27.2	24%	0.237	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-89.2	141.3	178.6	0	0	0	0	0	113.2	I103 E127	I103-G105 PolarHBondContact O-N 2.75Å; G105-E127 PolarHBondContact N-OE1 3.32Å; G105-E127 VanDerWaalsContact N-OE1 3.14Å
106	L	91.1	Very high	90.9	Very high	16 Å²	16	29.5 Å²	29.5	8%	0.084	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.2	166.3	-169.6	67.6	0	0	0	110	L92 M95 K96 N108 V109 L124 W381	L92-L106 HydrophobicContact CD1-CD2 4.18Å; M95-L106 HydrophobicContact CB-CB 4.19Å; M95-L106 HydrophobicContact CE-CB 4.09Å; M95-L106 HydrophobicContact CE-CD1 3.77Å; K96-L106 HydrophobicContact CG-CD2 3.82Å; L106-N108 VanDerWaalsContact CD1-O 3.29Å; L106-N108 WeakPolarHBondContact CD1-O 3.5Å; L106-V109 HydrophobicContact CD2-CB 4.31Å; L106-V109 HydrophobicContact CD2-CG1 4.19Å; L106-L124 HydrophobicContact CD1-CB 4.18Å; L106-L124 HydrophobicContact CD1-CD2 4.13Å; L106-W381 HydrophobicContact CD2-CH2 4.22Å; L106-W381 HydrophobicContact CD2-CZ2 4.08Å; L106-W381 HydrophobicContact CG-CZ2 4.28Å
107	L	91.5	Very high	91.2	Very high	32 Å²	32	35.5 Å²	35.5	17%	0.168	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-41.6	175.4	-58	-176.2	0	0	0	111.5	V70 V125	V70-L107 HydrophobicContact CG1-CD1 3.79Å; L107-V125 HydrophobicContact CB-CG1 4.32Å; L107-V125 WeakPolarHBondContact CB-O 3.25Å; L107-V125 PolarHBondContact N-O 3.27Å
108	N	93.3	Very high	91.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157	177	-163.3	30.8	0	0	0	110.8	Y44 L106 V125 W381	Y44-N108 WeakPolarHBondContact OH-CB 3.42Å; Y44-N108 PolarHBondContact OH-ND2 2.93Å; L106-N108 VanDerWaalsContact CD1-O 3.29Å; L106-N108 WeakPolarHBondContact CD1-O 3.5Å; N108-V125 HydrophobicContact CB-CB 3.82Å; N108-V125 HydrophobicContact CB-CG2 3.92Å; N108-V125 PolarHBondContact N-O 3.09Å; N108-V125 WeakPolarHBondContact O-CB 3.37Å; N108-V125 PolarHBondContact O-N 2.84Å; N108-W381 PolarHBondContact OD1-NE1 2.9Å
109	V	94.4	Very high	92.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.2	165.5	54.5	0	0	0	0	108.3	L92 L106 V122 Y123 L124 V378 W381	L92-V109 HydrophobicContact CD1-CB 4.19Å; L92-V109 HydrophobicContact CD1-CG1 4.06Å; L92-V109 HydrophobicContact CD1-CG2 3.95Å; L106-V109 HydrophobicContact CD2-CB 4.31Å; L106-V109 HydrophobicContact CD2-CG1 4.19Å; V109-V122 HydrophobicContact CG2-CG1 3.95Å; V109-Y123 VanDerWaalsContact CA-O 3.29Å; V109-Y123 WeakPolarHBondContact CA-O 2.89Å; V109-L124 HydrophobicContact CB-CD2 4.15Å; V109-L124 HydrophobicContact CG2-CD2 3.75Å; V109-V378 HydrophobicContact CG2-CG1 4.29Å; V109-V378 HydrophobicContact CG2-CG2 3.84Å; V109-W381 HydrophobicContact CG1-CB 3.57Å; V109-W381 HydrophobicContact CG1-CD2 4Å; V109-W381 HydrophobicContact CG1-CG 3.34Å
110	F	94.4	Very high	92.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	165.4	179	64.3	-93.7	0	0	0	112.3	F28 V40 L41 Y44 Y123 V125	F28-F110 AromaticContact CE1-CD2 3.6Å; F28-F110 HydrophobicContact CE1-CD2 3.6Å; F28-F110 AromaticContact CE1-CE2 3.9Å; F28-F110 HydrophobicContact CE1-CE2 3.9Å; F28-F110 HydrophobicContact CE1-CG 4.48Å; F28-F110 HydrophobicContact CZ-CD2 4.27Å; V40-F110 HydrophobicContact CB-CE2 4.28Å; V40-F110 HydrophobicContact CB-CZ 3.91Å; V40-F110 HydrophobicContact CG1-CE2 4.33Å; V40-F110 HydrophobicContact CG1-CZ 3.94Å; L41-F110 HydrophobicContact CD1-CB 4.41Å; L41-F110 HydrophobicContact CD1-CD1 4.04Å; L41-F110 HydrophobicContact CD1-CE1 4.49Å; L41-F110 HydrophobicContact CD1-CG 4.15Å; L41-F110 HydrophobicContact CG-CG 4.42Å; Y44-F110 HydrophobicContact CD2-CE1 4.06Å; Y44-F110 HydrophobicContact CD2-CZ 4.35Å; Y44-F110 HydrophobicContact CE2-CD1 4.23Å; Y44-F110 AromaticContact CE2-CE1 3.6Å; Y44-F110 HydrophobicContact CE2-CE1 3.6Å; Y44-F110 HydrophobicContact CE2-CZ 4.31Å; F110-Y123 AromaticContact CD2-CD2 3.96Å; F110-Y123 HydrophobicContact CD2-CD2 3.96Å; F110-Y123 HydrophobicContact CD2-CG 4.14Å; F110-Y123 HydrophobicContact CE1-CG 4.47Å; F110-Y123 VanDerWaalsContact CE2-CB 3.46Å; F110-Y123 HydrophobicContact CE2-CD1 4.19Å; F110-Y123 AromaticContact CE2-CD2 3.53Å; F110-Y123 HydrophobicContact CE2-CD2 3.53Å; F110-Y123 HydrophobicContact CE2-CE2 4.32Å; F110-Y123 AromaticContact CE2-CG 3.46Å; F110-Y123 HydrophobicContact CE2-CG 3.46Å; F110-Y123 VanDerWaalsContact CE2-CG 3.46Å; F110-Y123 HydrophobicContact CZ-CD1 4.14Å; F110-Y123 HydrophobicContact CZ-CD2 4.23Å; F110-Y123 AromaticContact CZ-CG 3.67Å; F110-Y123 HydrophobicContact CZ-CG 3.67Å; F110-Y123 PolarHBondContact N-O 3Å; F110-Y123 PolarHBondContact O-N 3.49Å; F110-V125 HydrophobicContact CD1-CG2 4.07Å; F110-V125 HydrophobicContact CE1-CG2 3.6Å
111	T	94.4	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.			trans	-132.8	139.2	167.8	-179.3	0	0	0	0	109.7	R24 Q113 F119 D121 Y375 V378	R24-T111 PolarHBondContact NH1-O 2.75Å; T111-Q113 VanDerWaalsContact C-N 3.28Å; T111-Q113 PolarHBondContact OG1-N 3.45Å; T111-Q113 PolarHBondContact OG1-OE1 3.04Å; T111-F119 HydrophobicContact CG2-CD2 4Å; T111-F119 HydrophobicContact CG2-CE2 3.95Å; T111-F119 WeakPolarHBondContact OG1-CD2 3.33Å; T111-D121 WeakPolarHBondContact CB-O 3.27Å; T111-D121 PolarHBondContact OG1-O 3.42Å; T111-Y375 HydrophobicContact CG2-CE2 4.28Å; T111-V378 HydrophobicContact CG2-CG1 3.93Å
112	P	92.5	Very high	92.4	Very high	17 Å²	17	34.2 Å²	34.2	11%	0.11	18%	0.177	C	C	.	.	S	Bend	trans	-72.7	-22.7	175	29.8	-34.7	0	0	0	112.2	R24 F28 T39 Y123	R24-P112 PolarHBondContact NH1-O 3.43Å; F28-P112 HydrophobicContact CD1-CB 3.92Å; F28-P112 HydrophobicContact CE1-CB 4.07Å; F28-P112 HydrophobicContact CG-CB 4.39Å; T39-P112 HydrophobicContact CG2-CB 3.58Å; T39-P112 HydrophobicContact CG2-CG 4.18Å; P112-Y123 HydrophobicContact CG-CE2 4.01Å
113	Q	91.8	Very high	92.3	Very high	34 Å²	34	34.1 Å²	34.1	16%	0.159	18%	0.176	C	C	.	.			trans	-81.1	137.1	-172.6	-64.6	101.7	5	0	0	113.3	R24 T111 D118 D121	R24-Q113 PolarHBondContact NH1-O 2.89Å; T111-Q113 VanDerWaalsContact C-N 3.28Å; T111-Q113 PolarHBondContact OG1-N 3.45Å; T111-Q113 PolarHBondContact OG1-OE1 3.04Å; Q113-D118 HydrophobicContact CB-CB 4.08Å; Q113-D118 HydrophobicContact CG-CB 4.33Å; Q113-D118 VanDerWaalsContact CG-O 3.25Å; Q113-D118 WeakPolarHBondContact CG-O 3.48Å; Q113-D121 PolarHBondContact NE2-OD2 2.93Å; Q113-D121 PolarHBondContact OE1-O 3.06Å
114	K	84.4	Confident	92.3	Very high	79 Å²	79	34 Å²	34	34%	0.343	18%	0.176	S	C	.	.	S	Bend	trans	-85.3	-27.2	-164.1	-65.8	174.2	-163.6	-179.1	0	114.3	K21 D25 Y375	K21-K114 VanDerWaalsContact CA-NZ 3.34Å; K21-K114 PolarHBondContact O-NZ 2.81Å; D25-K114 IonicContact OD1-NZ 3.22Å; D25-K114 PolarHBondContact OD1-NZ 2.94Å; D25-K114 IonicContact OD2-NZ 2.9Å; K114-Y375 PolarHBondContact O-OH 3.27Å
115	S	90.6	Very high	92.4	Very high	31 Å²	31	33.8 Å²	33.8	22%	0.217	18%	0.175	C	C	.	.	S	Bend	trans	-124.7	158.8	-176.9	67.3	0	0	0	0	109.6	E117 D118 F119	S115-E117 PolarHBondContact O-N 2.85Å; S115-D118 PolarHBondContact O-N 2.86Å; S115-D118 PolarHBondContact OG-N 2.87Å; S115-D118 PolarHBondContact OG-OD2 3.22Å; S115-F119 WeakPolarHBondContact O-CB 3.19Å; S115-F119 PolarHBondContact O-N 3.05Å; S115-F119 VanDerWaalsContact O-N 3.09Å
116	L	92	Very high	92.6	Very high	57 Å²	57	33.4 Å²	33.4	30%	0.298	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-36.1	169.7	175.7	66.4	0	0	0	111.5	D118 F119 K371 E372 Y375	L116-D118 PolarHBondContact O-N 2.91Å; L116-F119 WeakPolarHBondContact O-CB 3.46Å; L116-F119 PolarHBondContact O-N 3.47Å; L116-K371 HydrophobicContact CD1-CG 4.13Å; L116-K371 WeakPolarHBondContact O-CE 3.45Å; L116-K371 PolarHBondContact O-NZ 3.46Å; L116-E372 HydrophobicContact CD1-CB 4.49Å; L116-E372 HydrophobicContact CD1-CG 3.93Å; L116-E372 HydrophobicContact CD2-CG 3.45Å; L116-E372 VanDerWaalsContact CD2-CG 3.45Å; L116-E372 HydrophobicContact CG-CG 4.28Å; L116-Y375 HydrophobicContact CB-CD1 4.19Å; L116-Y375 HydrophobicContact CB-CE1 4.3Å; L116-Y375 HydrophobicContact CD1-CD1 4.18Å; L116-Y375 HydrophobicContact CD1-CG 4Å
117	E	91.5	Very high	92.7	Very high	167 Å²	167	34.3 Å²	34.3	78%	0.78	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-49.5	179.9	-66.2	165.1	-175.7	0	0	110.7	S115 F119 K371	S115-E117 PolarHBondContact O-N 2.85Å; E117-F119 VanDerWaalsContact C-N 3.33Å; E117-F119 PolarHBondContact O-N 3.49Å; E117-K371 PolarHBondContact O-NZ 2.83Å
118	D	91	Very high	92.8	Very high	97 Å²	97	34.7 Å²	34.7	52%	0.519	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.7	-178.7	-65.1	-35	0	0	0	113.9	Q113 S115 L116 Q120	Q113-D118 HydrophobicContact CB-CB 4.08Å; Q113-D118 HydrophobicContact CG-CB 4.33Å; Q113-D118 VanDerWaalsContact CG-O 3.25Å; Q113-D118 WeakPolarHBondContact CG-O 3.48Å; S115-D118 PolarHBondContact O-N 2.86Å; S115-D118 PolarHBondContact OG-N 2.87Å; S115-D118 PolarHBondContact OG-OD2 3.22Å; L116-D118 PolarHBondContact O-N 2.91Å; D118-Q120 WeakPolarHBondContact O-CG 3.46Å; D118-Q120 PolarHBondContact O-N 3.15Å
119	F	94.1	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.			trans	-61.5	118.7	-173.2	177	-132.3	0	0	0	112.4	F79 T111 S115 L116 E117 D121 V122 K371 I374 Y375	F79-F119 HydrophobicContact CE1-CE1 4.04Å; F79-F119 AromaticContact CE2-CD1 3.91Å; F79-F119 HydrophobicContact CE2-CD1 3.91Å; F79-F119 AromaticContact CE2-CE1 3.84Å; F79-F119 HydrophobicContact CE2-CE1 3.84Å; F79-F119 HydrophobicContact CE2-CG 4.34Å; F79-F119 HydrophobicContact CE2-CZ 4.19Å; F79-F119 AromaticContact CZ-CD1 3.7Å; F79-F119 HydrophobicContact CZ-CD1 3.7Å; F79-F119 AromaticContact CZ-CE1 3.21Å; F79-F119 HydrophobicContact CZ-CE1 3.21Å; F79-F119 HydrophobicContact CZ-CE2 4.39Å; F79-F119 HydrophobicContact CZ-CG 4.49Å; F79-F119 AromaticContact CZ-CZ 3.62Å; F79-F119 HydrophobicContact CZ-CZ 3.62Å; T111-F119 HydrophobicContact CG2-CD2 4Å; T111-F119 HydrophobicContact CG2-CE2 3.95Å; T111-F119 WeakPolarHBondContact OG1-CD2 3.33Å; S115-F119 WeakPolarHBondContact O-CB 3.19Å; S115-F119 PolarHBondContact O-N 3.05Å; S115-F119 VanDerWaalsContact O-N 3.09Å; L116-F119 WeakPolarHBondContact O-CB 3.46Å; L116-F119 PolarHBondContact O-N 3.47Å; E117-F119 VanDerWaalsContact C-N 3.33Å; E117-F119 PolarHBondContact O-N 3.49Å; F119-D121 WeakPolarHBondContact CE2-O 3.48Å; F119-V122 HydrophobicContact CE2-CG2 3.64Å; F119-V122 HydrophobicContact CZ-CG2 3.41Å; F119-V122 VanDerWaalsContact CZ-CG2 3.41Å; F119-K371 HydrophobicContact CD1-CD 4.49Å; F119-K371 HydrophobicContact CD1-CG 3.68Å; F119-K371 HydrophobicContact CE1-CG 4.28Å; F119-K371 WeakPolarHBondContact O-CE 3.29Å; F119-K371 PolarHBondContact O-NZ 2.93Å; F119-I374 HydrophobicContact CE1-CB 4.18Å; F119-I374 HydrophobicContact CE1-CG2 3.97Å; F119-I374 HydrophobicContact CZ-CB 4.48Å; F119-I374 HydrophobicContact CZ-CG2 3.77Å; F119-Y375 HydrophobicContact CB-CD2 3.84Å; F119-Y375 HydrophobicContact CB-CE2 4.21Å; F119-Y375 AromaticContact CD1-CD2 3.68Å; F119-Y375 HydrophobicContact CD1-CD2 3.68Å; F119-Y375 HydrophobicContact CD1-CG 4.08Å; F119-Y375 AromaticContact CD2-CD2 3.85Å; F119-Y375 HydrophobicContact CD2-CD2 3.85Å; F119-Y375 HydrophobicContact CD2-CE2 4.43Å; F119-Y375 HydrophobicContact CE1-CD2 4.09Å; F119-Y375 HydrophobicContact CE1-CG 4.38Å; F119-Y375 HydrophobicContact CE2-CD2 4.27Å; F119-Y375 AromaticContact CG-CD2 3.53Å; F119-Y375 HydrophobicContact CG-CD2 3.53Å; F119-Y375 HydrophobicContact CG-CE2 4.26Å; F119-Y375 HydrophobicContact CG-CG 4.36Å; F119-Y375 HydrophobicContact CZ-CD2 4.36Å
120	Q	91.5	Very high	92.7	Very high	124 Å²	124	40.3 Å²	40.3	58%	0.579	20%	0.203	S	C	*	.			trans	-139.3	-36.6	-177.1	-70.9	-176	18.2	0	0	112.7	D118	D118-Q120 WeakPolarHBondContact O-CG 3.46Å; D118-Q120 PolarHBondContact O-N 3.15Å
121	D	93.1	Very high	92.6	Very high	30 Å²	30	41.5 Å²	41.5	16%	0.16	21%	0.212	C	C	.	.			trans	-109.8	136.2	-173.7	-61.6	-55.4	0	0	0	111.7	K74 T111 Q113 F119 Y123	K74-D121 VanDerWaalsContact CE-CG 3.44Å; K74-D121 WeakPolarHBondContact CE-OD1 3.42Å; K74-D121 IonicContact NZ-OD1 2.77Å; K74-D121 PolarHBondContact NZ-OD1 2.94Å; K74-D121 IonicContact NZ-OD2 3.88Å; T111-D121 WeakPolarHBondContact CB-O 3.27Å; T111-D121 PolarHBondContact OG1-O 3.42Å; Q113-D121 PolarHBondContact NE2-OD2 2.93Å; Q113-D121 PolarHBondContact OE1-O 3.06Å; F119-D121 WeakPolarHBondContact CE2-O 3.48Å; D121-Y123 HydrophobicContact CB-CD2 4.35Å; D121-Y123 HydrophobicContact CB-CE2 3.62Å
122	V	94.6	Very high	92.4	Very high	1 Å²	1	44 Å²	44	1%	0.006	23%	0.225	C	C	.	.			trans	-121.8	128.7	171.1	-179.1	0	0	0	0	108.3	L75 F79 V109 F119 L124 I374 V378	L75-V122 HydrophobicContact CB-CB 4.43Å; L75-V122 HydrophobicContact CD1-CB 3.98Å; L75-V122 HydrophobicContact CD1-CG1 4.08Å; L75-V122 HydrophobicContact CG-CB 4.22Å; L75-V122 HydrophobicContact CG-CG1 4.49Å; L75-V122 PolarHBondContact N-O 2.77Å; F79-V122 HydrophobicContact CZ-CG2 4.48Å; V109-V122 HydrophobicContact CG2-CG1 3.95Å; F119-V122 HydrophobicContact CE2-CG2 3.64Å; F119-V122 HydrophobicContact CZ-CG2 3.41Å; F119-V122 VanDerWaalsContact CZ-CG2 3.41Å; V122-L124 HydrophobicContact CG1-CD2 4.13Å; V122-I374 HydrophobicContact CG2-CG2 3.97Å; V122-V378 HydrophobicContact CG1-CG2 4.3Å
123	Y	95.1	Very high	92.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.1	176.4	-64.7	-98	0	0	0	109.5	F38 T39 V40 I72 K73 K74 V109 F110 P112 D121	F38-Y123 HydrophobicContact CB-CE1 4.48Å; F38-Y123 HydrophobicContact CD1-CD1 4.25Å; F38-Y123 AromaticContact CD1-CE1 3.71Å; F38-Y123 HydrophobicContact CD1-CE1 3.71Å; F38-Y123 HydrophobicContact CE1-CD1 4.45Å; F38-Y123 HydrophobicContact CE1-CE1 4.16Å; F38-Y123 HydrophobicContact CG-CE1 4.19Å; T39-Y123 PolarHBondContact N-OH 3.4Å; V40-Y123 HydrophobicContact CG1-CD1 4.03Å; V40-Y123 HydrophobicContact CG1-CE1 3.94Å; I72-Y123 HydrophobicContact CG2-CD1 3.95Å; K73-Y123 WeakPolarHBondContact O-CA 3.32Å; K74-Y123 HydrophobicContact CB-CD1 3.88Å; K74-Y123 HydrophobicContact CB-CE1 3.68Å; K74-Y123 HydrophobicContact CD-CE1 3.8Å; K74-Y123 WeakPolarHBondContact CD-OH 3.33Å; K74-Y123 WeakPolarHBondContact CE-OH 3.43Å; K74-Y123 HydrophobicContact CG-CD1 4.15Å; K74-Y123 HydrophobicContact CG-CE1 3.64Å; K74-Y123 HydrophobicContact CG-CE2 4.48Å; V109-Y123 VanDerWaalsContact CA-O 3.29Å; V109-Y123 WeakPolarHBondContact CA-O 2.89Å; F110-Y123 AromaticContact CD2-CD2 3.96Å; F110-Y123 HydrophobicContact CD2-CD2 3.96Å; F110-Y123 HydrophobicContact CD2-CG 4.14Å; F110-Y123 HydrophobicContact CE1-CG 4.47Å; F110-Y123 VanDerWaalsContact CE2-CB 3.46Å; F110-Y123 HydrophobicContact CE2-CD1 4.19Å; F110-Y123 AromaticContact CE2-CD2 3.53Å; F110-Y123 HydrophobicContact CE2-CD2 3.53Å; F110-Y123 HydrophobicContact CE2-CE2 4.32Å; F110-Y123 AromaticContact CE2-CG 3.46Å; F110-Y123 HydrophobicContact CE2-CG 3.46Å; F110-Y123 VanDerWaalsContact CE2-CG 3.46Å; F110-Y123 HydrophobicContact CZ-CD1 4.14Å; F110-Y123 HydrophobicContact CZ-CD2 4.23Å; F110-Y123 AromaticContact CZ-CG 3.67Å; F110-Y123 HydrophobicContact CZ-CG 3.67Å; F110-Y123 PolarHBondContact N-O 3Å; F110-Y123 PolarHBondContact O-N 3.49Å; P112-Y123 HydrophobicContact CG-CE2 4.01Å; D121-Y123 HydrophobicContact CB-CD2 4.35Å; D121-Y123 HydrophobicContact CB-CE2 3.62Å
124	L	93.9	Very high	92.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.2	175.1	-54.8	176.2	0	0	0	108.6	I72 K73 L75 E91 L92 M95 L106 V109 V122	I72-L124 CarbonylContact C-O 3.55Å; I72-L124 WeakPolarHBondContact CA-O 3.41Å; K73-L124 HydrophobicContact CB-CB 4.41Å; K73-L124 PolarHBondContact N-O 2.76Å; K73-L124 PolarHBondContact O-N 3.37Å; L75-L124 HydrophobicContact CD2-CD1 3.96Å; L75-L124 HydrophobicContact CG-CD1 4.41Å; E91-L124 HydrophobicContact CG-CD1 4.48Å; L92-L124 HydrophobicContact CD1-CD2 4.07Å; M95-L124 HydrophobicContact SD-CD1 4.06Å; L106-L124 HydrophobicContact CD1-CB 4.18Å; L106-L124 HydrophobicContact CD1-CD2 4.13Å; V109-L124 HydrophobicContact CB-CD2 4.15Å; V109-L124 HydrophobicContact CG2-CD2 3.75Å; V122-L124 HydrophobicContact CG1-CD2 4.13Å
125	V	95.1	Very high	92.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.5	177	-172.5	0	0	0	0	108.5	Y44 V70 A71 I72 L107 N108 F110	Y44-V125 HydrophobicContact CE1-CG1 3.86Å; Y44-V125 HydrophobicContact CE1-CG2 4.37Å; Y44-V125 HydrophobicContact CE2-CG2 3.98Å; V70-V125 HydrophobicContact CB-CG1 3.83Å; V70-V125 HydrophobicContact CG1-CG1 4.22Å; V70-V125 HydrophobicContact CG2-CG1 3.88Å; A71-V125 CarbonylContact O-C 3.54Å; A71-V125 WeakPolarHBondContact O-CA 3.24Å; I72-V125 HydrophobicContact CG1-CG1 4.38Å; I72-V125 HydrophobicContact CG1-CG2 4.26Å; I72-V125 HydrophobicContact CG2-CG2 4.49Å; L107-V125 HydrophobicContact CB-CG1 4.32Å; L107-V125 WeakPolarHBondContact CB-O 3.25Å; L107-V125 PolarHBondContact N-O 3.27Å; N108-V125 HydrophobicContact CB-CB 3.82Å; N108-V125 HydrophobicContact CB-CG2 3.92Å; N108-V125 PolarHBondContact N-O 3.09Å; N108-V125 WeakPolarHBondContact O-CB 3.37Å; N108-V125 PolarHBondContact O-N 2.84Å; F110-V125 HydrophobicContact CD1-CG2 4.07Å; F110-V125 HydrophobicContact CE1-CG2 3.6Å
126	M	94.1	Very high	92.8	Very high	15 Å²	15	44.8 Å²	44.8	7%	0.074	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	167.1	-175.5	-61.5	166.7	-67.9	0	0	109.5	V70 A71 K73 M95 I104	V70-M126 WeakPolarHBondContact CA-O 3.14Å; V70-M126 WeakPolarHBondContact CB-O 3.32Å; A71-M126 HydrophobicContact CB-CE 4.46Å; A71-M126 PolarHBondContact N-O 3.44Å; A71-M126 PolarHBondContact O-N 2.92Å; K73-M126 HydrophobicContact CB-CE 3.7Å; K73-M126 HydrophobicContact CD-CE 4.39Å; M95-M126 HydrophobicContact CE-CG 3.56Å; M95-M126 HydrophobicContact CE-SD 3.59Å; M95-M126 VanDerWaalsContact CE-SD 3.59Å; I104-M126 HydrophobicContact CD1-CB 4.39Å; I104-M126 HydrophobicContact CG1-CB 4Å; I104-M126 HydrophobicContact CG1-CG 4.17Å; I104-M126 HydrophobicContact CG1-SD 4.03Å
127	E	92.4	Very high	92.7	Very high	35 Å²	35	42.1 Å²	42.1	16%	0.164	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	140.2	166.3	62.1	-163.3	128.1	0	0	111.4	I104 G105 M129 K184	I104-E127 HydrophobicContact CD1-CG 3.37Å; I104-E127 HydrophobicContact CG1-CG 4.37Å; G105-E127 PolarHBondContact N-OE1 3.32Å; G105-E127 VanDerWaalsContact N-OE1 3.14Å; E127-M129 HydrophobicContact CG-SD 4.29Å; E127-K184 VanDerWaalsContact CD-NZ 3.32Å; E127-K184 HydrophobicContact CG-CD 4.26Å; E127-K184 WeakPolarHBondContact OE1-CD 3.41Å; E127-K184 WeakPolarHBondContact OE1-CE 3.35Å; E127-K184 IonicContact OE1-NZ 3.42Å; E127-K184 PolarHBondContact OE1-NZ 3.41Å; E127-K184 WeakPolarHBondContact OE2-CD 3.39Å; E127-K184 WeakPolarHBondContact OE2-CE 3.36Å; E127-K184 IonicContact OE2-NZ 2.88Å; E127-K184 PolarHBondContact OE2-NZ 3.4Å
128	L	94.4	Very high	92.7	Very high	40 Å²	40	40.5 Å²	40.5	21%	0.209	21%	0.21	C	C	.	.			trans	-80.8	136.5	172.6	-172.7	65.1	0	0	0	109.8	I50 N69 A71	I50-L128 HydrophobicContact CD1-CD1 3.57Å; N69-L128 HydrophobicContact CB-CB 4.23Å; N69-L128 HydrophobicContact CB-CD2 3.55Å; A71-L128 HydrophobicContact CB-CD1 4Å
129	M	94.7	Very high	92.7	Very high	21 Å²	21	41.1 Å²	41.1	10%	0.103	21%	0.211	C	C	.	.			trans	-118.2	157.3	175.8	-57.7	-66.9	-73.3	0	0	108.9	I104 E127 V176 K178 K184	I104-M129 HydrophobicContact CD1-CG 4.36Å; E127-M129 HydrophobicContact CG-SD 4.29Å; M129-V176 HydrophobicContact CB-CB 3.73Å; M129-V176 HydrophobicContact CB-CG1 4.48Å; M129-V176 HydrophobicContact CB-CG2 3.98Å; M129-V176 HydrophobicContact CE-CG2 4.28Å; M129-V176 HydrophobicContact CG-CB 3.93Å; M129-V176 HydrophobicContact CG-CG2 3.56Å; M129-K178 HydrophobicContact CE-CD 4.46Å; M129-K178 HydrophobicContact CE-CG 3.73Å; M129-K178 HydrophobicContact SD-CD 4.21Å; M129-K178 WeakPolarHBondContact SD-CE 3.26Å; M129-K178 HydrophobicContact SD-CG 3.84Å; M129-K184 HydrophobicContact CE-CB 4.2Å; M129-K184 HydrophobicContact CE-CD 3.94Å; M129-K184 HydrophobicContact CE-CG 4.26Å; M129-K184 HydrophobicContact SD-CD 3.89Å
130	D	91.9	Very high	92.4	Very high	98 Å²	98	49.8 Å²	49.8	52%	0.524	25%	0.252	S	S	.	.	S	Bend	trans	-80.7	-38.2	-169.5	-61.5	-25.7	0	0	0	112	V177 K178 S179	D130-V177 PolarHBondContact N-O 2.85Å; D130-K178 VanDerWaalsContact OD2-CA 3.32Å; D130-K178 WeakPolarHBondContact OD2-CA 3.2Å; D130-S179 WeakPolarHBondContact OD2-CB 3.47Å; D130-S179 PolarHBondContact OD2-N 2.81Å; D130-S179 PolarHBondContact OD2-OG 3.09Å
131	A	90.5	Very high	92.3	Very high	25 Å²	25	45.1 Å²	45.1	21%	0.207	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	164.4	-173.8	0	0	0	0	0	111.8	Q135 V176 V177	A131-Q135 VanDerWaalsContact CA-OE1 3.29Å; A131-Q135 HydrophobicContact CB-CB 4.43Å; A131-V176 CarbonylContact O-C 3.57Å; A131-V176 VanDerWaalsContact O-CA 3.27Å; A131-V176 WeakPolarHBondContact O-CA 3.4Å; A131-V176 WeakPolarHBondContact O-CB 3.33Å; A131-V177 HydrophobicContact CB-CG2 4.02Å; A131-V177 PolarHBondContact N-O 3.01Å; A131-V177 VanDerWaalsContact N-O 3.12Å; A131-V177 PolarHBondContact O-N 3.22Å
132	N	90.9	Very high	92.4	Very high	51 Å²	51	46.2 Å²	46.2	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	165.4	162.3	66.2	47.7	0	0	0	110.9	C134 Q135 I175 V176	N132-C134 PolarHBondContact O-N 3.46Å; N132-C134 WeakPolarHBondContact OD1-CA 3.41Å; N132-C134 WeakPolarHBondContact OD1-CB 3.36Å; N132-C134 PolarHBondContact OD1-N 2.93Å; N132-Q135 PolarHBondContact O-N 3.37Å; N132-Q135 VanDerWaalsContact O-N 3.15Å; N132-Q135 PolarHBondContact OD1-N 3.18Å; N132-I175 CarbonylContact C-O 3.13Å; N132-I175 VanDerWaalsContact CA-O 3.28Å; N132-I175 WeakPolarHBondContact CA-O 3.31Å; N132-V176 HydrophobicContact CB-CG1 4.24Å
133	L	93.6	Very high	92.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.8	-17.2	-176	-163.5	73.7	0	0	0	112.8	Q135 V136 I137 L149 M153 P172 I175 V177 I232 M236	L133-Q135 PolarHBondContact O-N 3.27Å; L133-V136 HydrophobicContact CD1-CB 3.87Å; L133-V136 HydrophobicContact CD1-CG1 3.91Å; L133-V136 HydrophobicContact CD1-CG2 4.25Å; L133-V136 PolarHBondContact O-N 3.25Å; L133-I137 HydrophobicContact CG-CD1 4.42Å; L133-I137 HydrophobicContact CG-CG1 4.47Å; L133-I137 WeakPolarHBondContact O-CB 3.39Å; L133-I137 WeakPolarHBondContact O-CD1 3.45Å; L133-I137 VanDerWaalsContact O-CG1 3.28Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 3.23Å; L133-L149 HydrophobicContact CD1-CD1 4.37Å; L133-M153 HydrophobicContact CD2-CE 4.11Å; L133-M153 HydrophobicContact CD2-SD 4.45Å; L133-P172 HydrophobicContact CB-CB 4Å; L133-P172 WeakPolarHBondContact CB-O 3.28Å; L133-P172 HydrophobicContact CD2-CB 4.47Å; L133-P172 HydrophobicContact CG-CB 4.48Å; L133-P172 PolarHBondContact N-O 3.19Å; L133-I175 HydrophobicContact CB-CB 4.04Å; L133-I175 HydrophobicContact CB-CG2 4.1Å; L133-I175 HydrophobicContact CD2-CB 4.35Å; L133-I175 HydrophobicContact CD2-CD1 4.15Å; L133-I175 HydrophobicContact CD2-CG2 4.18Å; L133-I175 PolarHBondContact N-O 3.11Å; L133-V177 HydrophobicContact CD1-CG1 4.28Å; L133-I232 HydrophobicContact CD2-CG2 3.35Å; L133-M236 HydrophobicContact CD1-SD 4.33Å; L133-M236 HydrophobicContact CD2-SD 4.42Å
134	C	91.4	Very high	92.4	Very high	52 Å²	52	52.5 Å²	52.5	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-37.2	172.8	-53.3	0	0	0	0	111.7	N132	N132-C134 PolarHBondContact O-N 3.46Å; N132-C134 WeakPolarHBondContact OD1-CA 3.41Å; N132-C134 WeakPolarHBondContact OD1-CB 3.36Å; N132-C134 PolarHBondContact OD1-N 2.93Å
135	Q	90.3	Very high	92.5	Very high	113 Å²	113	58.5 Å²	58.5	53%	0.528	29%	0.288	S	S	.	.	H	α-helix	trans	-72.7	-40.8	178	-65.8	169	-59.6	0	0	110.7	A131 N132 L133 I137 Q138	A131-Q135 VanDerWaalsContact CA-OE1 3.29Å; A131-Q135 HydrophobicContact CB-CB 4.43Å; N132-Q135 PolarHBondContact O-N 3.37Å; N132-Q135 VanDerWaalsContact O-N 3.15Å; N132-Q135 PolarHBondContact OD1-N 3.18Å; L133-Q135 PolarHBondContact O-N 3.27Å; Q135-I137 VanDerWaalsContact C-N 3.33Å; Q135-I137 PolarHBondContact O-N 2.98Å; Q135-Q138 PolarHBondContact O-N 3.37Å
136	V	92.1	Very high	92.6	Very high	13 Å²	13	58.8 Å²	58.8	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-38.5	177.7	178.4	0	0	0	0	112.1	L133 Q138 M139 L141 L149 V177	L133-V136 HydrophobicContact CD1-CB 3.87Å; L133-V136 HydrophobicContact CD1-CG1 3.91Å; L133-V136 HydrophobicContact CD1-CG2 4.25Å; L133-V136 PolarHBondContact O-N 3.25Å; V136-Q138 PolarHBondContact O-N 3.09Å; V136-Q138 VanDerWaalsContact O-N 3.14Å; V136-M139 WeakPolarHBondContact O-CB 3.18Å; V136-M139 PolarHBondContact O-N 3Å; V136-L141 HydrophobicContact CG1-CD1 3.83Å; V136-L141 HydrophobicContact CG1-CD2 4.33Å; V136-L149 HydrophobicContact CG1-CD1 3.99Å; V136-V177 HydrophobicContact CG2-CG1 4.42Å; V136-V177 HydrophobicContact CG2-CG2 3.41Å; V136-V177 VanDerWaalsContact CG2-CG2 3.41Å
137	I	91.5	Very high	92.7	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.8	176.8	-80.4	164.1	0	0	0	112.6	L133 Q135 M139 P172 E235 M236 H239	L133-I137 HydrophobicContact CG-CD1 4.42Å; L133-I137 HydrophobicContact CG-CG1 4.47Å; L133-I137 WeakPolarHBondContact O-CB 3.39Å; L133-I137 WeakPolarHBondContact O-CD1 3.45Å; L133-I137 VanDerWaalsContact O-CG1 3.28Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 3.23Å; Q135-I137 VanDerWaalsContact C-N 3.33Å; Q135-I137 PolarHBondContact O-N 2.98Å; I137-M139 VanDerWaalsContact C-N 3.3Å; I137-P172 HydrophobicContact CD1-CB 3.65Å; I137-P172 HydrophobicContact CD1-CG 3.43Å; I137-P172 VanDerWaalsContact CD1-CG 3.43Å; I137-E235 HydrophobicContact CD1-CB 4.47Å; I137-E235 HydrophobicContact CD1-CG 3.99Å; I137-E235 HydrophobicContact CG1-CG 4.48Å; I137-E235 HydrophobicContact CG2-CG 3.72Å; I137-M236 HydrophobicContact CD1-CG 4.43Å; I137-M236 HydrophobicContact CG1-CG 3.6Å; I137-H239 PolarHBondContact O-ND1 2.87Å
138	Q	89.9	Confident	93	Very high	134 Å²	134	59.4 Å²	59.4	63%	0.626	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-5.9	178.3	-58.8	-59.8	-38	0	0	113	Q135 V136	Q135-Q138 PolarHBondContact O-N 3.37Å; V136-Q138 PolarHBondContact O-N 3.09Å; V136-Q138 VanDerWaalsContact O-N 3.14Å
139	M	90.8	Very high	93.2	Very high	110 Å²	110	57.7 Å²	57.7	54%	0.542	28%	0.282	S	S	.	.	S	Bend	trans	-94.3	148	179.1	-56.9	172.9	62.3	0	0	110	V136 I137 L141 H239	V136-M139 WeakPolarHBondContact O-CB 3.18Å; V136-M139 PolarHBondContact O-N 3Å; I137-M139 VanDerWaalsContact C-N 3.3Å; M139-L141 PolarHBondContact O-N 3.17Å; M139-H239 PolarHBondContact O-CE1 3.37Å
140	E	87.6	Confident	93.4	Very high	182 Å²	182	56.7 Å²	56.7	85%	0.85	28%	0.277	S	S	*	.			trans	-72.6	123.1	166.3	-67.4	-176.5	173.5	0	0	109.3
141	L	90.8	Very high	93.7	Very high	26 Å²	26	52 Å²	52	14%	0.136	25%	0.252	C	S	.	.			trans	-114.5	133.6	178.8	-62.4	177.7	0	0	0	109.9	V136 M139 R145 L146 L149 P299	V136-L141 HydrophobicContact CG1-CD1 3.83Å; V136-L141 HydrophobicContact CG1-CD2 4.33Å; M139-L141 PolarHBondContact O-N 3.17Å; L141-R145 HydrophobicContact CD2-CB 4.27Å; L141-L146 HydrophobicContact CB-CB 4.32Å; L141-L149 HydrophobicContact CD1-CD1 4.09Å; L141-P299 WeakPolarHBondContact O-CG 3.35Å
142	D	94	Very high	94.1	Very high	53 Å²	53	51 Å²	51	28%	0.283	24%	0.243	S	C	.	.			trans	-68.7	167.2	165.1	57.1	44.1	0	0	0	111.4	E144 R145 L146	D142-E144 PolarHBondContact O-N 2.98Å; D142-E144 WeakPolarHBondContact OD1-CB 3.39Å; D142-E144 PolarHBondContact OD1-N 3.46Å; D142-R145 WeakPolarHBondContact OD1-CB 3.35Å; D142-R145 VanDerWaalsContact OD1-CG 3.29Å; D142-R145 WeakPolarHBondContact OD1-CG 3.32Å; D142-R145 PolarHBondContact OD1-N 3.05Å; D142-R145 IonicContact OD2-CZ 3.93Å; D142-R145 IonicContact OD2-NE 3.36Å; D142-R145 IonicContact OD2-NH1 3.23Å; D142-R145 PolarHBondContact OD2-NH1 3.03Å; D142-L146 VanDerWaalsContact O-CB 3.24Å; D142-L146 WeakPolarHBondContact O-CB 3.25Å; D142-L146 PolarHBondContact O-N 3.41Å
143	H	95.2	Very high	94.4	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.032	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-29.8	178.3	-75.2	-65.1	0	0	0	113.3	S147 F298 P299 N305 K308 A309 Y338	H143-S147 WeakPolarHBondContact O-CB 3.41Å; H143-S147 PolarHBondContact O-N 3.32Å; H143-S147 PolarHBondContact O-OG 3.22Å; H143-F298 AromaticContact CE1-CD1 3.76Å; H143-P299 PolarHBondContact NE2-O 3.18Å; H143-N305 PolarHBondContact NE2-O 3.28Å; H143-K308 HydrophobicContact CB-CB 4Å; H143-K308 HydrophobicContact CB-CG 4.34Å; H143-A309 PolarHBondContact CE1-N 2.66Å; H143-Y338 HydrophobicContact CB-CE2 4.3Å; H143-Y338 AromaticContact ND1-CE2 3.51Å; H143-Y338 AromaticContact ND1-CZ 3.64Å; H143-Y338 PolarHBondContact ND1-OH 3.43Å
144	E	95.7	Very high	94.7	Very high	126 Å²	126	48.6 Å²	48.6	59%	0.589	23%	0.23	S	C	*	.	H	α-helix	trans	-65.8	-55.8	-179.1	-166.6	179.9	161.7	0	0	110.1	D142 L146 S147 Y148 W342	D142-E144 PolarHBondContact O-N 2.98Å; D142-E144 WeakPolarHBondContact OD1-CB 3.39Å; D142-E144 PolarHBondContact OD1-N 3.46Å; E144-L146 PolarHBondContact O-N 3.21Å; E144-S147 PolarHBondContact O-N 3.38Å; E144-S147 PolarHBondContact O-OG 3.46Å; E144-Y148 VanDerWaalsContact O-CB 3.25Å; E144-Y148 WeakPolarHBondContact O-CB 3.49Å; E144-Y148 PolarHBondContact O-N 2.9Å; E144-W342 HydrophobicContact CB-CZ2 4.43Å; E144-W342 HydrophobicContact CG-CH2 3.55Å; E144-W342 HydrophobicContact CG-CZ2 3.38Å
145	R	95.9	Very high	95	Very high	126 Å²	126	46.1 Å²	46.1	48%	0.475	21%	0.213	S	C	.	.	H	α-helix	trans	-61.5	-44.5	177.2	-69.4	168.7	170.3	129.7	-8.3	111.7	L141 D142 Y148 L149	L141-R145 HydrophobicContact CD2-CB 4.27Å; D142-R145 WeakPolarHBondContact OD1-CB 3.35Å; D142-R145 VanDerWaalsContact OD1-CG 3.29Å; D142-R145 WeakPolarHBondContact OD1-CG 3.32Å; D142-R145 PolarHBondContact OD1-N 3.05Å; D142-R145 IonicContact OD2-CZ 3.93Å; D142-R145 IonicContact OD2-NE 3.36Å; D142-R145 IonicContact OD2-NH1 3.23Å; D142-R145 PolarHBondContact OD2-NH1 3.03Å; R145-Y148 PolarHBondContact O-N 3.31Å; R145-L149 WeakPolarHBondContact O-CB 3.27Å; R145-L149 VanDerWaalsContact O-CG 3.26Å; R145-L149 WeakPolarHBondContact O-CG 3.24Å; R145-L149 PolarHBondContact O-N 3.36Å
146	L	96	Very high	95.2	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-46.2	-178.4	-170.2	163.5	0	0	0	111.1	L141 D142 E144 L150 L233 M236 V237 Y338	L141-L146 HydrophobicContact CB-CB 4.32Å; D142-L146 VanDerWaalsContact O-CB 3.24Å; D142-L146 WeakPolarHBondContact O-CB 3.25Å; D142-L146 PolarHBondContact O-N 3.41Å; E144-L146 PolarHBondContact O-N 3.21Å; L146-L150 PolarHBondContact O-N 2.92Å; L146-L150 VanDerWaalsContact O-N 3.16Å; L146-L233 HydrophobicContact CD1-CD1 4.38Å; L146-L233 HydrophobicContact CD2-CD1 3.21Å; L146-L233 HydrophobicContact CG-CD1 4.16Å; L146-M236 HydrophobicContact CG-CE 4.42Å; L146-V237 HydrophobicContact CD1-CG2 4.03Å; L146-Y338 HydrophobicContact CD2-CE1 3.65Å; L146-Y338 VanDerWaalsContact CD2-OH 3.28Å; L146-Y338 WeakPolarHBondContact CD2-OH 3.31Å
147	S	97.8	Very high	95.4	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.028	19%	0.185	C	C	.	.	H	α-helix	trans	-68.7	-35.7	177.2	60.3	0	0	0	0	112.5	H143 E144 L150 Y151 Y338 W342	H143-S147 WeakPolarHBondContact O-CB 3.41Å; H143-S147 PolarHBondContact O-N 3.32Å; H143-S147 PolarHBondContact O-OG 3.22Å; E144-S147 PolarHBondContact O-N 3.38Å; E144-S147 PolarHBondContact O-OG 3.46Å; S147-L150 PolarHBondContact O-N 3.18Å; S147-Y151 WeakPolarHBondContact O-CB 3.28Å; S147-Y151 PolarHBondContact O-N 3.23Å; S147-Y338 VanDerWaalsContact CB-O 3.23Å; S147-Y338 WeakPolarHBondContact CB-O 3.32Å; S147-W342 PolarHBondContact OG-NE1 2.96Å
148	Y	98.3	Very high	95.6	Very high	58 Å²	58	41.5 Å²	41.5	23%	0.227	19%	0.19	C	C	.	.	H	α-helix	trans	-68.5	-41	178.2	-172.9	-123.5	0	0	0	112.6	E144 R145 L150 Y151 Q152 C181 W342	E144-Y148 VanDerWaalsContact O-CB 3.25Å; E144-Y148 WeakPolarHBondContact O-CB 3.49Å; E144-Y148 PolarHBondContact O-N 2.9Å; R145-Y148 PolarHBondContact O-N 3.31Å; Y148-L150 VanDerWaalsContact C-N 3.31Å; Y148-L150 PolarHBondContact O-N 3.36Å; Y148-Y151 HydrophobicContact CD2-CD1 4.15Å; Y148-Y151 HydrophobicContact CE2-CD1 4.17Å; Y148-Y151 PolarHBondContact O-N 2.95Å; Y148-Q152 HydrophobicContact CE2-CG 4.37Å; Y148-Q152 VanDerWaalsContact O-CG 3.31Å; Y148-Q152 WeakPolarHBondContact O-CG 3.35Å; Y148-Q152 PolarHBondContact O-N 3Å; Y148-Q152 PolarHBondContact O-NE2 3.32Å; Y148-C181 HydrophobicContact CD1-CB 4.15Å; Y148-C181 HydrophobicContact CE1-CB 4.43Å; Y148-W342 HydrophobicContact CD2-CB 4.43Å; Y148-W342 AromaticContact CD2-CD2 3.6Å; Y148-W342 HydrophobicContact CD2-CD2 3.6Å; Y148-W342 AromaticContact CD2-CE2 3.97Å; Y148-W342 AromaticContact CD2-CE3 3.75Å; Y148-W342 HydrophobicContact CD2-CE3 3.75Å; Y148-W342 AromaticContact CD2-CG 3.91Å; Y148-W342 HydrophobicContact CD2-CG 3.91Å; Y148-W342 HydrophobicContact CD2-CZ2 4.43Å; Y148-W342 HydrophobicContact CD2-CZ3 4.24Å; Y148-W342 HydrophobicContact CE2-CD2 4.41Å; Y148-W342 HydrophobicContact CE2-CE3 4.19Å; Y148-W342 HydrophobicContact CG-CD2 4.36Å; Y148-W342 HydrophobicContact CG-CZ2 4.45Å
149	L	98.3	Very high	95.8	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-42.4	172.2	-70.2	171	0	0	0	110.7	L133 V136 L141 R145 Q152 M153 V177 L183	L133-L149 HydrophobicContact CD1-CD1 4.37Å; V136-L149 HydrophobicContact CG1-CD1 3.99Å; L141-L149 HydrophobicContact CD1-CD1 4.09Å; R145-L149 WeakPolarHBondContact O-CB 3.27Å; R145-L149 VanDerWaalsContact O-CG 3.26Å; R145-L149 WeakPolarHBondContact O-CG 3.24Å; R145-L149 PolarHBondContact O-N 3.36Å; L149-Q152 PolarHBondContact O-N 2.94Å; L149-M153 HydrophobicContact CB-CE 4Å; L149-M153 WeakPolarHBondContact O-CE 3.34Å; L149-M153 WeakPolarHBondContact O-CG 3.28Å; L149-M153 PolarHBondContact O-N 3.22Å; L149-V177 HydrophobicContact CD2-CG1 3.93Å; L149-L183 HydrophobicContact CB-CD1 4.25Å; L149-L183 HydrophobicContact CD2-CB 4.13Å; L149-L183 HydrophobicContact CD2-CD1 3.89Å
150	L	98.2	Very high	95.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-40.6	179.6	-146.4	78.6	0	0	0	112.6	L146 S147 Y148 Q152 M153 L154 V229 L233 M236 L315 M319 I339	L146-L150 PolarHBondContact O-N 2.92Å; L146-L150 VanDerWaalsContact O-N 3.16Å; S147-L150 PolarHBondContact O-N 3.18Å; Y148-L150 VanDerWaalsContact C-N 3.31Å; Y148-L150 PolarHBondContact O-N 3.36Å; L150-Q152 PolarHBondContact O-N 3.46Å; L150-M153 HydrophobicContact CD1-CE 3.9Å; L150-M153 HydrophobicContact CD1-SD 4.32Å; L150-M153 WeakPolarHBondContact O-CB 3.25Å; L150-M153 PolarHBondContact O-N 3.21Å; L150-L154 VanDerWaalsContact O-CG 3.3Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.3Å; L150-V229 HydrophobicContact CD1-CG1 3.58Å; L150-V229 HydrophobicContact CD2-CG1 4.39Å; L150-V229 HydrophobicContact CG-CG1 3.92Å; L150-L233 HydrophobicContact CD1-CB 4.01Å; L150-L233 HydrophobicContact CD1-CD1 4.38Å; L150-L233 HydrophobicContact CD2-CD1 4.37Å; L150-L233 HydrophobicContact CD2-CD2 3.78Å; L150-L233 HydrophobicContact CD2-CG 4.48Å; L150-M236 HydrophobicContact CD1-CE 3.92Å; L150-L315 HydrophobicContact CD2-CD2 3.72Å; L150-M319 HydrophobicContact CD2-CE 4.07Å; L150-I339 HydrophobicContact CB-CD1 3.86Å; L150-I339 HydrophobicContact CD2-CD1 3.81Å; L150-I339 HydrophobicContact CG-CD1 4.35Å
151	Y	98.8	Very high	96	Very high	1 Å²	1	23.2 Å²	23.2	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-54.4	-51.6	171.4	166.7	-107.5	0	0	0	111	S147 Y148 M153 L154 C155 L334 I339 W342 D344 E347 V348	S147-Y151 WeakPolarHBondContact O-CB 3.28Å; S147-Y151 PolarHBondContact O-N 3.23Å; Y148-Y151 HydrophobicContact CD2-CD1 4.15Å; Y148-Y151 HydrophobicContact CE2-CD1 4.17Å; Y148-Y151 PolarHBondContact O-N 2.95Å; Y151-M153 VanDerWaalsContact C-N 3.34Å; Y151-M153 PolarHBondContact O-N 3.47Å; Y151-L154 WeakPolarHBondContact O-CB 3.39Å; Y151-L154 PolarHBondContact O-N 3.14Å; Y151-L154 VanDerWaalsContact O-N 3.09Å; Y151-C155 WeakPolarHBondContact CE2-SG 3.45Å; Y151-C155 PolarHBondContact O-N 3.12Å; Y151-C155 PolarHBondContact O-SG 3.18Å; Y151-C155 VanDerWaalsContact O-SG 3.37Å; Y151-L334 HydrophobicContact CD2-CD2 3.89Å; Y151-L334 HydrophobicContact CE2-CD2 4.11Å; Y151-I339 HydrophobicContact CD2-CG2 4.01Å; Y151-I339 HydrophobicContact CG-CG2 4.49Å; Y151-W342 HydrophobicContact CD1-CB 3.6Å; Y151-W342 HydrophobicContact CD1-CG 4.36Å; Y151-W342 HydrophobicContact CD2-CB 3.81Å; Y151-W342 HydrophobicContact CE1-CB 4Å; Y151-W342 WeakPolarHBondContact CE1-O 3.44Å; Y151-W342 HydrophobicContact CE2-CB 4.2Å; Y151-W342 WeakPolarHBondContact CE2-O 3.39Å; Y151-W342 HydrophobicContact CG-CB 3.49Å; Y151-W342 VanDerWaalsContact CG-CB 3.49Å; Y151-W342 HydrophobicContact CG-CG 4.25Å; Y151-W342 PolarHBondContact OH-O 3.03Å; Y151-D344 PolarHBondContact OH-N 3.08Å; Y151-E347 VanDerWaalsContact CE1-OE2 3.22Å; Y151-E347 WeakPolarHBondContact CE1-OE2 3.45Å; Y151-E347 PolarHBondContact OH-OE2 3.3Å; Y151-V348 HydrophobicContact CE2-CG2 3.94Å
152	Q	98.6	Very high	96	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-38.7	179	-73.2	178.8	88.4	0	0	113.2	N102 Y148 L149 L150 C155 G156 C181 L183	N102-Q152 VanDerWaalsContact CB-O 3.27Å; N102-Q152 WeakPolarHBondContact CB-O 3.37Å; N102-Q152 WeakPolarHBondContact ND2-CB 3.41Å; N102-Q152 WeakPolarHBondContact ND2-CG 3.47Å; N102-Q152 PolarHBondContact ND2-OE1 2.8Å; N102-Q152 VanDerWaalsContact ND2-OE1 3.15Å; Y148-Q152 HydrophobicContact CE2-CG 4.37Å; Y148-Q152 VanDerWaalsContact O-CG 3.31Å; Y148-Q152 WeakPolarHBondContact O-CG 3.35Å; Y148-Q152 PolarHBondContact O-N 3Å; Y148-Q152 PolarHBondContact O-NE2 3.32Å; L149-Q152 PolarHBondContact O-N 2.94Å; L150-Q152 PolarHBondContact O-N 3.46Å; Q152-C155 PolarHBondContact O-N 3.4Å; Q152-G156 PolarHBondContact O-N 3.46Å; Q152-C181 PolarHBondContact NE2-O 3.43Å; Q152-L183 HydrophobicContact CB-CB 3.97Å; Q152-L183 HydrophobicContact CB-CD2 4.29Å
153	M	98.3	Very high	95.6	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-59.4	-47.6	172	-71.8	-180	-114.9	0	0	110.8	L133 L149 L150 Y151 G156 I157 I175 L183 I232 M236	L133-M153 HydrophobicContact CD2-CE 4.11Å; L133-M153 HydrophobicContact CD2-SD 4.45Å; L149-M153 HydrophobicContact CB-CE 4Å; L149-M153 WeakPolarHBondContact O-CE 3.34Å; L149-M153 WeakPolarHBondContact O-CG 3.28Å; L149-M153 PolarHBondContact O-N 3.22Å; L150-M153 HydrophobicContact CD1-CE 3.9Å; L150-M153 HydrophobicContact CD1-SD 4.32Å; L150-M153 WeakPolarHBondContact O-CB 3.25Å; L150-M153 PolarHBondContact O-N 3.21Å; Y151-M153 VanDerWaalsContact C-N 3.34Å; Y151-M153 PolarHBondContact O-N 3.47Å; M153-G156 PolarHBondContact O-N 3.21Å; M153-I157 WeakPolarHBondContact O-CB 3.45Å; M153-I157 WeakPolarHBondContact O-CD1 2.97Å; M153-I157 WeakPolarHBondContact O-CG1 3.3Å; M153-I157 PolarHBondContact O-N 3.29Å; M153-I175 HydrophobicContact CG-CD1 4.27Å; M153-I175 HydrophobicContact SD-CD1 3.82Å; M153-L183 HydrophobicContact CE-CD1 3.91Å; M153-L183 HydrophobicContact CG-CD1 3.57Å; M153-L183 HydrophobicContact CG-CD2 3.78Å; M153-L183 HydrophobicContact CG-CG 4.37Å; M153-L183 HydrophobicContact SD-CD1 4.34Å; M153-I232 HydrophobicContact CE-CG2 4.35Å; M153-I232 HydrophobicContact SD-CG2 4.23Å; M153-M236 HydrophobicContact CE-CE 4.04Å; M153-M236 HydrophobicContact CE-SD 4.46Å
154	L	98.5	Very high	95.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-40	-179.9	-69	167.6	0	0	0	112.3	L150 Y151 I157 K158 I226 M319 V330 A333 L334 I339	L150-L154 VanDerWaalsContact O-CG 3.3Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.3Å; Y151-L154 WeakPolarHBondContact O-CB 3.39Å; Y151-L154 PolarHBondContact O-N 3.14Å; Y151-L154 VanDerWaalsContact O-N 3.09Å; L154-I157 PolarHBondContact O-N 3.38Å; L154-K158 WeakPolarHBondContact O-CB 3.35Å; L154-K158 PolarHBondContact O-N 3.04Å; L154-I226 HydrophobicContact CD2-CD1 3.51Å; L154-M319 HydrophobicContact CD1-CE 4.37Å; L154-M319 HydrophobicContact CD2-CE 4.32Å; L154-V330 HydrophobicContact CD2-CG1 4.28Å; L154-A333 HydrophobicContact CD1-CB 3.94Å; L154-A333 HydrophobicContact CD2-CB 4.02Å; L154-L334 HydrophobicContact CB-CD2 3.58Å; L154-L334 HydrophobicContact CB-CG 3.91Å; L154-L334 HydrophobicContact CD1-CD2 4.33Å; L154-L334 HydrophobicContact CD1-CG 4.46Å; L154-I339 HydrophobicContact CD1-CG1 4.29Å; L154-I339 HydrophobicContact CD1-CG2 4.06Å
155	C	98	Very high	94.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62	-46.5	173.9	-65.7	0	0	0	0	111.8	Y151 Q152 I157 K158 H159	Y151-C155 WeakPolarHBondContact CE2-SG 3.45Å; Y151-C155 PolarHBondContact O-N 3.12Å; Y151-C155 PolarHBondContact O-SG 3.18Å; Y151-C155 VanDerWaalsContact O-SG 3.37Å; Q152-C155 PolarHBondContact O-N 3.4Å; C155-I157 VanDerWaalsContact C-N 3.33Å; C155-I157 PolarHBondContact O-N 3.23Å; C155-K158 PolarHBondContact O-N 3.28Å; C155-H159 WeakPolarHBondContact O-CB 3.42Å; C155-H159 PolarHBondContact O-N 3.03Å
156	G	96.1	Very high	94.3	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.3	-45.2	175.3	0	0	0	0	0	112.2	Q152 M153 H159 L160	Q152-G156 PolarHBondContact O-N 3.46Å; M153-G156 PolarHBondContact O-N 3.21Å; G156-H159 PolarHBondContact O-N 3.44Å; G156-L160 WeakPolarHBondContact O-CG 3.23Å; G156-L160 PolarHBondContact O-N 3.2Å; G156-L160 VanDerWaalsContact O-N 3.16Å
157	I	95.4	Very high	94	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-64.3	-46.8	178.3	-68.5	164.6	0	0	0	111.4	M153 L154 C155 H159 L160 H161 L170 I185 D225 V229 V330	M153-I157 WeakPolarHBondContact O-CB 3.45Å; M153-I157 WeakPolarHBondContact O-CD1 2.97Å; M153-I157 WeakPolarHBondContact O-CG1 3.3Å; M153-I157 PolarHBondContact O-N 3.29Å; L154-I157 PolarHBondContact O-N 3.38Å; C155-I157 VanDerWaalsContact C-N 3.33Å; C155-I157 PolarHBondContact O-N 3.23Å; I157-H159 VanDerWaalsContact C-N 3.29Å; I157-H159 PolarHBondContact O-N 3.18Å; I157-L160 WeakPolarHBondContact O-CB 3.33Å; I157-L160 PolarHBondContact O-N 3.33Å; I157-L160 VanDerWaalsContact O-N 3.15Å; I157-H161 WeakPolarHBondContact CG2-CE1 3.48Å; I157-H161 WeakPolarHBondContact CG2-NE2 2.99Å; I157-H161 PolarHBondContact O-CD2 2.67Å; I157-H161 VanDerWaalsContact O-CG 3.29Å; I157-H161 PolarHBondContact O-N 3.36Å; I157-L170 HydrophobicContact CD1-CD1 3.45Å; I157-L170 VanDerWaalsContact CD1-CD1 3.45Å; I157-L170 HydrophobicContact CG1-CD1 3.83Å; I157-I185 HydrophobicContact CG1-CD1 3.97Å; I157-D225 HydrophobicContact CD1-CB 4.48Å; I157-D225 HydrophobicContact CG2-CB 4.04Å; I157-V229 HydrophobicContact CD1-CG2 3.33Å; I157-V330 HydrophobicContact CG2-CG2 3.87Å
158	K	95.7	Very high	93.3	Very high	29 Å²	29	10.7 Å²	10.7	13%	0.126	7%	0.067	C	C	.	.	H	α-helix	trans	-58.2	-43.3	177.7	-176.2	179	160.1	91.8	0	111.3	L154 C155 L160 H161 G162 V330 D331 L334 V348 E349	L154-K158 WeakPolarHBondContact O-CB 3.35Å; L154-K158 PolarHBondContact O-N 3.04Å; C155-K158 PolarHBondContact O-N 3.28Å; K158-L160 VanDerWaalsContact C-N 3.33Å; K158-L160 PolarHBondContact O-N 3.28Å; K158-H161 PolarHBondContact O-N 3.24Å; K158-G162 PolarHBondContact O-N 2.86Å; K158-V330 HydrophobicContact CB-CG1 3.82Å; K158-D331 IonicContact NZ-OD1 2.93Å; K158-D331 PolarHBondContact NZ-OD1 3.09Å; K158-L334 HydrophobicContact CB-CD1 4.43Å; K158-L334 HydrophobicContact CD-CD1 3.69Å; K158-V348 HydrophobicContact CD-CG1 3.63Å; K158-V348 VanDerWaalsContact CD-O 3.3Å; K158-V348 WeakPolarHBondContact CD-O 3.28Å; K158-V348 VanDerWaalsContact CE-CG1 3.49Å; K158-V348 WeakPolarHBondContact CE-O 3.43Å; K158-E349 VanDerWaalsContact CE-CD 3.43Å; K158-E349 WeakPolarHBondContact CE-OE1 3.43Å; K158-E349 WeakPolarHBondContact CE-OE2 3.45Å; K158-E349 IonicContact NZ-OE1 3.18Å; K158-E349 PolarHBondContact NZ-OE1 3.22Å; K158-E349 IonicContact NZ-OE2 2.68Å; K158-E349 PolarHBondContact NZ-OE2 3.08Å
159	H	93.8	Very high	92.7	Very high	7 Å²	7	8.3 Å²	8.3	3%	0.032	6%	0.059	C	C	.	.	H	α-helix	trans	-62.4	-39.4	178.2	-172	82.7	0	0	0	112.3	N99 H100 C155 G156 I157 A163 A350 P351 P353	N99-H159 PolarHBondContact O-NE2 2.78Å; H100-H159 HydrophobicContact CB-CB 4.29Å; H100-H159 WeakPolarHBondContact CB-CD2 3.36Å; H100-H159 AromaticContact CD2-CG 3.89Å; H100-H159 AromaticContact CD2-ND1 3.82Å; H100-H159 AromaticContact CG-CG 3.78Å; C155-H159 WeakPolarHBondContact O-CB 3.42Å; C155-H159 PolarHBondContact O-N 3.03Å; G156-H159 PolarHBondContact O-N 3.44Å; I157-H159 VanDerWaalsContact C-N 3.29Å; I157-H159 PolarHBondContact O-N 3.18Å; H159-A163 PolarHBondContact O-N 3.15Å; H159-A350 PolarHBondContact ND1-O 2.8Å; H159-P351 PolarHBondContact CE1-O 2.87Å; H159-P351 VanDerWaalsContact CE1-O 3.23Å; H159-P353 VanDerWaalsContact NE2-CD 3.34Å; H159-P353 WeakPolarHBondContact NE2-CD 3.09Å
160	L	91.1	Very high	92.4	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.7	-46	172.7	-65.2	172.7	0	0	0	111.7	V98 I103 G156 I157 K158 G162 A163 G164 I165 F188	V98-L160 HydrophobicContact CG1-CD2 4.14Å; V98-L160 HydrophobicContact CG2-CD2 4.13Å; I103-L160 HydrophobicContact CD1-CD1 3.86Å; I103-L160 HydrophobicContact CD1-CD2 4.14Å; I103-L160 HydrophobicContact CD1-CG 3.9Å; G156-L160 WeakPolarHBondContact O-CG 3.23Å; G156-L160 PolarHBondContact O-N 3.2Å; G156-L160 VanDerWaalsContact O-N 3.16Å; I157-L160 WeakPolarHBondContact O-CB 3.33Å; I157-L160 PolarHBondContact O-N 3.33Å; I157-L160 VanDerWaalsContact O-N 3.15Å; K158-L160 VanDerWaalsContact C-N 3.33Å; K158-L160 PolarHBondContact O-N 3.28Å; L160-G162 VanDerWaalsContact C-N 3.3Å; L160-G162 PolarHBondContact O-N 3.16Å; L160-A163 WeakPolarHBondContact O-CA 3.4Å; L160-A163 WeakPolarHBondContact O-CB 3.45Å; L160-A163 PolarHBondContact O-N 3.38Å; L160-G164 PolarHBondContact O-N 3.36Å; L160-I165 CarbonylContact C-O 3.24Å; L160-I165 VanDerWaalsContact C-O 3.25Å; L160-I165 HydrophobicContact CB-CB 4.2Å; L160-I165 HydrophobicContact CB-CG2 4.46Å; L160-I165 HydrophobicContact CD2-CD1 4.24Å; L160-I165 HydrophobicContact CD2-CG2 4.41Å; L160-I165 WeakPolarHBondContact O-CB 3.24Å; L160-I165 PolarHBondContact O-N 3.05Å; L160-F188 HydrophobicContact CD1-CE1 3.82Å; L160-F188 HydrophobicContact CD2-CD1 4.21Å; L160-F188 HydrophobicContact CD2-CE1 3.53Å; L160-F188 HydrophobicContact CD2-CZ 4.2Å; L160-F188 HydrophobicContact CG-CE1 4.32Å
161	H	91.8	Very high	92.1	Very high	35 Å²	35	9 Å²	9	16%	0.162	6%	0.061	C	C	.	.	H	α-helix	trans	-62.5	-37.3	-179.8	-70	-177.8	0	0	0	111.9	I157 K158 A163 G164 I165 A222 D225	I157-H161 WeakPolarHBondContact CG2-CE1 3.48Å; I157-H161 WeakPolarHBondContact CG2-NE2 2.99Å; I157-H161 PolarHBondContact O-CD2 2.67Å; I157-H161 VanDerWaalsContact O-CG 3.29Å; I157-H161 PolarHBondContact O-N 3.36Å; K158-H161 PolarHBondContact O-N 3.24Å; H161-A163 PolarHBondContact O-N 2.94Å; H161-G164 WeakPolarHBondContact O-CA 3.35Å; H161-G164 PolarHBondContact O-N 2.93Å; H161-I165 PolarHBondContact CD2-O 3.42Å; H161-I165 VanDerWaalsContact CD2-O 3.29Å; H161-I165 PolarHBondContact N-O 3.3Å; H161-A222 PolarHBondContact CE1-O 2.67Å; H161-A222 PolarHBondContact NE2-O 2.92Å; H161-D225 IonicContact CD2-OD2 2.88Å; H161-D225 IonicContact CE1-OD2 2.99Å; H161-D225 IonicContact NE2-OD2 3.5Å; H161-D225 PolarHBondContact NE2-OD2 3.21Å
162	G	90.2	Very high	91.8	Very high	48 Å²	48	9 Å²	9	50%	0.495	6%	0.062	S	C	.	.	H	α-helix	trans	-61.7	-25.8	173.6	0	0	0	0	0	113.6	K158 L160 G164 P352	K158-G162 PolarHBondContact O-N 2.86Å; L160-G162 VanDerWaalsContact C-N 3.3Å; L160-G162 PolarHBondContact O-N 3.16Å; G162-G164 VanDerWaalsContact C-N 3.32Å; G162-P352 WeakPolarHBondContact O-CB 3.39Å
163	A	85.7	Confident	91.4	Very high	5 Å²	5	11.3 Å²	11.3	4%	0.041	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.7	171.8	0	0	0	0	0	113.5	H159 L160 H161 I165 P352 P353 I355	H159-A163 PolarHBondContact O-N 3.15Å; L160-A163 WeakPolarHBondContact O-CA 3.4Å; L160-A163 WeakPolarHBondContact O-CB 3.45Å; L160-A163 PolarHBondContact O-N 3.38Å; H161-A163 PolarHBondContact O-N 2.94Å; A163-I165 HydrophobicContact CB-CD1 3.87Å; A163-I165 HydrophobicContact CB-CG1 4.15Å; A163-P352 HydrophobicContact CB-CB 4.4Å; A163-P353 HydrophobicContact CB-CG 3.59Å; A163-I355 HydrophobicContact CB-CD1 4.01Å; A163-I355 HydrophobicContact CB-CG1 4.22Å; A163-I355 WeakPolarHBondContact O-CD1 3.41Å
164	G	85.6	Confident	91.1	Very high	23 Å²	23	11.6 Å²	11.6	24%	0.237	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	16.9	-173.2	0	0	0	0	0	113.8	L160 H161 G162 T193 A194	L160-G164 PolarHBondContact O-N 3.36Å; H161-G164 WeakPolarHBondContact O-CA 3.35Å; H161-G164 PolarHBondContact O-N 2.93Å; G162-G164 VanDerWaalsContact C-N 3.32Å; G164-T193 CarbonylContact O-C 3.45Å; G164-T193 WeakPolarHBondContact O-CA 3.5Å; G164-A194 PolarHBondContact O-N 3.24Å
165	I	85.9	Confident	90.9	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.9	179	-57.9	161.1	0	0	0	108.8	L94 V98 L160 H161 A163 A191 I355	L94-I165 HydrophobicContact CD2-CD1 3.62Å; L94-I165 HydrophobicContact CD2-CG1 4.11Å; V98-I165 HydrophobicContact CG2-CD1 4.08Å; L160-I165 CarbonylContact C-O 3.24Å; L160-I165 VanDerWaalsContact C-O 3.25Å; L160-I165 HydrophobicContact CB-CB 4.2Å; L160-I165 HydrophobicContact CB-CG2 4.46Å; L160-I165 HydrophobicContact CD2-CD1 4.24Å; L160-I165 HydrophobicContact CD2-CG2 4.41Å; L160-I165 WeakPolarHBondContact O-CB 3.24Å; L160-I165 PolarHBondContact O-N 3.05Å; H161-I165 PolarHBondContact CD2-O 3.42Å; H161-I165 VanDerWaalsContact CD2-O 3.29Å; H161-I165 PolarHBondContact N-O 3.3Å; A163-I165 HydrophobicContact CB-CD1 3.87Å; A163-I165 HydrophobicContact CB-CG1 4.15Å; I165-A191 HydrophobicContact CG2-CB 3.6Å; I165-I355 HydrophobicContact CD1-CD1 3.6Å; I165-I355 HydrophobicContact CD1-CG1 4.33Å; I165-I355 HydrophobicContact CG1-CD1 3.41Å; I165-I355 VanDerWaalsContact CG1-CD1 3.41Å
166	I	88.9	Confident	90.7	Very high	4 Å²	4	12.5 Å²	12.5	2%	0.021	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.4	172.3	-54.8	177.9	0	0	0	108.1	R168 A191 R192 A194 Y220 V224	I166-R168 HydrophobicContact CB-CG 4.3Å; I166-R168 HydrophobicContact CG2-CG 3.71Å; I166-A191 CarbonylContact O-C 3.55Å; I166-A191 VanDerWaalsContact O-C 3.24Å; I166-A191 WeakPolarHBondContact O-CA 3.47Å; I166-A191 WeakPolarHBondContact O-CB 3.33Å; I166-R192 PolarHBondContact N-O 3.39Å; I166-R192 PolarHBondContact O-N 3.15Å; I166-A194 HydrophobicContact CD1-CB 3.81Å; I166-A194 HydrophobicContact CG1-CB 4.21Å; I166-Y220 HydrophobicContact CD1-CD2 4.35Å; I166-Y220 HydrophobicContact CD1-CE2 4.31Å; I166-V224 HydrophobicContact CG2-CG1 3.28Å
167	H	88.5	Confident	90.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	9%	0.087	C	C	.	.			trans	-72.2	-49.2	-169	-172.2	-76.5	0	0	0	113.3	D169 L170 L186 D187 L190 A191 D225	H167-D169 VanDerWaalsContact CE1-C 3.41Å; H167-D169 PolarHBondContact CE1-O 2.83Å; H167-D169 VanDerWaalsContact ND1-C 3.29Å; H167-D169 PolarHBondContact ND1-N 2.94Å; H167-D169 PolarHBondContact O-N 3.5Å; H167-L170 HydrophobicContact CB-CD1 4.5Å; H167-L170 HydrophobicContact CB-CD2 4.32Å; H167-L170 HydrophobicContact CB-CG 4Å; H167-L170 WeakPolarHBondContact ND1-CG 3.44Å; H167-L170 PolarHBondContact ND1-N 3.38Å; H167-L170 VanDerWaalsContact ND1-N 3.13Å; H167-L186 PolarHBondContact NE2-O 3.45Å; H167-L186 VanDerWaalsContact NE2-O 3.07Å; H167-D187 PolarHBondContact NE2-O 2.93Å; H167-L190 CarbonylContact O-C 3.53Å; H167-A191 VanDerWaalsContact O-CA 3.32Å; H167-A191 WeakPolarHBondContact O-CA 2.96Å; H167-A191 PolarHBondContact O-N 3.37Å; H167-D225 PolarHBondContact N-OD2 2.91Å
168	R	84.6	Confident	90.7	Very high	6 Å²	6	16.1 Å²	16.1	2%	0.023	10%	0.101	C	C	.	.			trans	65.7	-13.9	174.8	-50.4	-174.5	-56.4	163.5	4.1	117.9	I166 L190 R192 L198 Y220 V224 D225	I166-R168 HydrophobicContact CB-CG 4.3Å; I166-R168 HydrophobicContact CG2-CG 3.71Å; R168-L190 VanDerWaalsContact CZ-O 3.32Å; R168-L190 PolarHBondContact NE-O 2.84Å; R168-L190 VanDerWaalsContact NE-O 3.08Å; R168-L190 PolarHBondContact NH2-O 3.22Å; R168-R192 VanDerWaalsContact CZ-CG 3.44Å; R168-L198 PolarHBondContact NH1-O 3.31Å; R168-Y220 HydrophobicContact CG-CE2 4.39Å; R168-Y220 PolarHBondContact NH1-OH 3.33Å; R168-V224 HydrophobicContact CG-CG1 4.36Å; R168-D225 PolarHBondContact N-OD1 3.15Å
169	D	84.5	Confident	90.5	Very high	8 Å²	8	20 Å²	20	4%	0.043	13%	0.132	C	C	.	.			trans	-126.6	38	175.8	-161.2	53.4	0	0	0	111.9	H167 K171 N174 L190	H167-D169 VanDerWaalsContact CE1-C 3.41Å; H167-D169 PolarHBondContact CE1-O 2.83Å; H167-D169 VanDerWaalsContact ND1-C 3.29Å; H167-D169 PolarHBondContact ND1-N 2.94Å; H167-D169 PolarHBondContact O-N 3.5Å; D169-K171 PolarHBondContact O-N 2.96Å; D169-K171 IonicContact OD1-NZ 2.72Å; D169-K171 IonicContact OD2-NZ 3.59Å; D169-K171 PolarHBondContact OD2-NZ 3.3Å; D169-N174 PolarHBondContact O-ND2 3.07Å; D169-L190 HydrophobicContact CB-CB 3.98Å; D169-L190 HydrophobicContact CB-CD1 3.65Å; D169-L190 HydrophobicContact CB-CG 4.41Å
170	L	92	Very high	90.4	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	16%	0.156	C	C	.	.			trans	-67.8	126.9	173.8	-75.9	175.7	0	0	0	109.4	I157 H167 I185 Y209 D225 V229	I157-L170 HydrophobicContact CD1-CD1 3.45Å; I157-L170 VanDerWaalsContact CD1-CD1 3.45Å; I157-L170 HydrophobicContact CG1-CD1 3.83Å; H167-L170 HydrophobicContact CB-CD1 4.5Å; H167-L170 HydrophobicContact CB-CD2 4.32Å; H167-L170 HydrophobicContact CB-CG 4Å; H167-L170 WeakPolarHBondContact ND1-CG 3.44Å; H167-L170 PolarHBondContact ND1-N 3.38Å; H167-L170 VanDerWaalsContact ND1-N 3.13Å; L170-I185 HydrophobicContact CD2-CD1 4.32Å; L170-I185 HydrophobicContact CD2-CG2 3.75Å; L170-Y209 VanDerWaalsContact O-CB 3.24Å; L170-Y209 WeakPolarHBondContact O-CB 3.49Å; L170-D225 HydrophobicContact CD1-CB 3.77Å; L170-V229 HydrophobicContact CD1-CG2 4.31Å
171	K	91.8	Very high	90.6	Very high	15 Å²	15	26 Å²	26	7%	0.065	17%	0.166	C	C	.	.			trans	-160.3	159.9	179	62.5	-169.7	-179.3	-143.6	0	109.4	D169 S173 N174 Y209	D169-K171 PolarHBondContact O-N 2.96Å; D169-K171 IonicContact OD1-NZ 2.72Å; D169-K171 IonicContact OD2-NZ 3.59Å; D169-K171 PolarHBondContact OD2-NZ 3.3Å; K171-S173 WeakPolarHBondContact CE-OG 3.28Å; K171-S173 WeakPolarHBondContact CG-OG 3.48Å; K171-S173 PolarHBondContact O-N 2.99Å; K171-S173 VanDerWaalsContact O-N 3.12Å; K171-N174 VanDerWaalsContact CE-OD1 3.25Å; K171-N174 WeakPolarHBondContact CE-OD1 3.47Å; K171-N174 HydrophobicContact CG-CB 4.15Å; K171-N174 PolarHBondContact O-N 3.38Å; K171-Y209 HydrophobicContact CB-CD2 3.42Å; K171-Y209 VanDerWaalsContact CB-CD2 3.42Å; K171-Y209 HydrophobicContact CB-CE2 3.8Å; K171-Y209 HydrophobicContact CB-CG 4.03Å
172	P	93.8	Very high	90.8	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.013	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-56.6	-33.2	-175.1	-29	37.2	0	0	0	114.9	L133 I137 N174 I175 Y209 I232	L133-P172 HydrophobicContact CB-CB 4Å; L133-P172 WeakPolarHBondContact CB-O 3.28Å; L133-P172 HydrophobicContact CD2-CB 4.47Å; L133-P172 HydrophobicContact CG-CB 4.48Å; L133-P172 PolarHBondContact N-O 3.19Å; I137-P172 HydrophobicContact CD1-CB 3.65Å; I137-P172 HydrophobicContact CD1-CG 3.43Å; I137-P172 VanDerWaalsContact CD1-CG 3.43Å; P172-N174 PolarHBondContact O-N 2.95Å; P172-I175 PolarHBondContact O-N 2.79Å; P172-Y209 VanDerWaalsContact CD-CE1 3.49Å; P172-Y209 VanDerWaalsContact CD-CE2 3.5Å; P172-Y209 WeakPolarHBondContact CD-OH 3.24Å; P172-Y209 HydrophobicContact CG-CE1 3.87Å; P172-Y209 HydrophobicContact CG-CE2 4.44Å; P172-Y209 WeakPolarHBondContact CG-OH 3.12Å; P172-I232 HydrophobicContact CG-CG1 4.16Å
173	S	89	Confident	91.1	Very high	50 Å²	50	24 Å²	24	35%	0.35	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-69.4	-19.8	177.6	69.8	0	0	0	0	114.2	K171	K171-S173 WeakPolarHBondContact CE-OG 3.28Å; K171-S173 WeakPolarHBondContact CG-OG 3.48Å; K171-S173 PolarHBondContact O-N 2.99Å; K171-S173 VanDerWaalsContact O-N 3.12Å
174	N	91.6	Very high	91.7	Very high	7 Å²	7	25 Å²	25	4%	0.037	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-99.6	12	179	-68.1	9.7	0	0	0	111.5	D169 K171 P172 L186	D169-N174 PolarHBondContact O-ND2 3.07Å; K171-N174 VanDerWaalsContact CE-OD1 3.25Å; K171-N174 WeakPolarHBondContact CE-OD1 3.47Å; K171-N174 HydrophobicContact CG-CB 4.15Å; K171-N174 PolarHBondContact O-N 3.38Å; P172-N174 PolarHBondContact O-N 2.95Å; N174-L186 WeakPolarHBondContact O-CB 3.43Å; N174-L186 PolarHBondContact O-N 2.81Å
175	I	94.5	Very high	92.1	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.9	177.2	-62.4	175	0	0	0	106.6	N132 L133 M153 P172 L183 I232	N132-I175 CarbonylContact C-O 3.13Å; N132-I175 VanDerWaalsContact CA-O 3.28Å; N132-I175 WeakPolarHBondContact CA-O 3.31Å; L133-I175 HydrophobicContact CB-CB 4.04Å; L133-I175 HydrophobicContact CB-CG2 4.1Å; L133-I175 HydrophobicContact CD2-CB 4.35Å; L133-I175 HydrophobicContact CD2-CD1 4.15Å; L133-I175 HydrophobicContact CD2-CG2 4.18Å; L133-I175 PolarHBondContact N-O 3.11Å; M153-I175 HydrophobicContact CG-CD1 4.27Å; M153-I175 HydrophobicContact SD-CD1 3.82Å; P172-I175 PolarHBondContact O-N 2.79Å; I175-L183 HydrophobicContact CG2-CD1 3.45Å; I175-L183 VanDerWaalsContact CG2-CD1 3.45Å; I175-L183 HydrophobicContact CG2-CD2 3.88Å; I175-L183 HydrophobicContact CG2-CG 3.55Å; I175-I232 HydrophobicContact CD1-CD1 3.73Å
176	V	94.8	Very high	92.2	Very high	16 Å²	16	25.4 Å²	25.4	10%	0.097	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	147.7	-178.3	-73.8	0	0	0	0	110.7	M129 A131 N132 L183 K184 L186	M129-V176 HydrophobicContact CB-CB 3.73Å; M129-V176 HydrophobicContact CB-CG1 4.48Å; M129-V176 HydrophobicContact CB-CG2 3.98Å; M129-V176 HydrophobicContact CE-CG2 4.28Å; M129-V176 HydrophobicContact CG-CB 3.93Å; M129-V176 HydrophobicContact CG-CG2 3.56Å; A131-V176 CarbonylContact O-C 3.57Å; A131-V176 VanDerWaalsContact O-CA 3.27Å; A131-V176 WeakPolarHBondContact O-CA 3.4Å; A131-V176 WeakPolarHBondContact O-CB 3.33Å; N132-V176 HydrophobicContact CB-CG1 4.24Å; V176-L183 WeakPolarHBondContact O-CA 3.4Å; V176-K184 HydrophobicContact CG2-CB 4.13Å; V176-K184 WeakPolarHBondContact CG2-O 3.48Å; V176-K184 PolarHBondContact N-O 2.69Å; V176-K184 PolarHBondContact O-N 3.17Å; V176-L186 HydrophobicContact CG1-CD1 3.54Å; V176-L186 HydrophobicContact CG1-CG 4.1Å; V176-L186 HydrophobicContact CG2-CD1 4.21Å; V176-L186 HydrophobicContact CG2-CD2 3.71Å; V176-L186 HydrophobicContact CG2-CG 3.84Å
177	V	96.3	Very high	91.5	Very high	8 Å²	8	26.5 Å²	26.5	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.2	-176.3	-58	0	0	0	0	111.5	D130 A131 L133 V136 L149 T182 L183	D130-V177 PolarHBondContact N-O 2.85Å; A131-V177 HydrophobicContact CB-CG2 4.02Å; A131-V177 PolarHBondContact N-O 3.01Å; A131-V177 VanDerWaalsContact N-O 3.12Å; A131-V177 PolarHBondContact O-N 3.22Å; L133-V177 HydrophobicContact CD1-CG1 4.28Å; V136-V177 HydrophobicContact CG2-CG1 4.42Å; V136-V177 HydrophobicContact CG2-CG2 3.41Å; V136-V177 VanDerWaalsContact CG2-CG2 3.41Å; L149-V177 HydrophobicContact CD2-CG1 3.93Å; V177-T182 CarbonylContact C-O 3.56Å; V177-T182 WeakPolarHBondContact CA-O 2.91Å; V177-L183 HydrophobicContact CG1-CB 4.25Å; V177-L183 HydrophobicContact CG1-CD1 4.26Å; V177-L183 HydrophobicContact CG1-CG 4.3Å
178	K	94.4	Very high	90.5	Very high	70 Å²	70	26.6 Å²	26.6	30%	0.304	15%	0.153	S	C	.	.			trans	-109.2	168	163.8	-68.2	-176.9	-177.4	-179.4	0	111.4	M129 D130 D180 C181 T182	M129-K178 HydrophobicContact CE-CD 4.46Å; M129-K178 HydrophobicContact CE-CG 3.73Å; M129-K178 HydrophobicContact SD-CD 4.21Å; M129-K178 WeakPolarHBondContact SD-CE 3.26Å; M129-K178 HydrophobicContact SD-CG 3.84Å; D130-K178 VanDerWaalsContact OD2-CA 3.32Å; D130-K178 WeakPolarHBondContact OD2-CA 3.2Å; K178-D180 WeakPolarHBondContact CB-OD1 3.02Å; K178-D180 PolarHBondContact O-N 2.89Å; K178-C181 PolarHBondContact O-N 2.81Å; K178-T182 WeakPolarHBondContact CB-OG1 3.37Å; K178-T182 PolarHBondContact N-O 3.34Å
179	S	91.4	Very high	89.1	Confident	110 Å²	110	26.3 Å²	26.3	77%	0.769	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.3	174.6	43.6	0	0	0	0	114.3	D130 C181	D130-S179 WeakPolarHBondContact OD2-CB 3.47Å; D130-S179 PolarHBondContact OD2-N 2.81Å; D130-S179 PolarHBondContact OD2-OG 3.09Å; S179-C181 PolarHBondContact O-N 2.97Å
180	D	92.8	Very high	87.9	Confident	99 Å²	99	27.2 Å²	27.2	53%	0.529	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	13.5	173.2	67.3	-1.3	0	0	0	113.7	K178 T182	K178-D180 WeakPolarHBondContact CB-OD1 3.02Å; K178-D180 PolarHBondContact O-N 2.89Å; D180-T182 PolarHBondContact O-N 2.94Å; D180-T182 VanDerWaalsContact OD1-CB 3.3Å; D180-T182 WeakPolarHBondContact OD1-CB 3.26Å; D180-T182 VanDerWaalsContact OD1-CG2 3.25Å; D180-T182 WeakPolarHBondContact OD1-CG2 3.23Å; D180-T182 PolarHBondContact OD1-N 3.35Å; D180-T182 PolarHBondContact OD1-OG1 3.04Å
181	C	94.1	Very high	86.2	Confident	34 Å²	34	27.1 Å²	27.1	23%	0.23	16%	0.157	C	C	.	.			trans	62.2	15.8	-175.7	-65.1	0	0	0	0	115.1	Y148 Q152 K178 S179	Y148-C181 HydrophobicContact CD1-CB 4.15Å; Y148-C181 HydrophobicContact CE1-CB 4.43Å; Q152-C181 PolarHBondContact NE2-O 3.43Å; K178-C181 PolarHBondContact O-N 2.81Å; S179-C181 PolarHBondContact O-N 2.97Å
182	T	96.1	Very high	84.6	Confident	41 Å²	41	29.3 Å²	29.3	25%	0.252	17%	0.165	S	C	.	.			trans	-71	138.4	169.3	57.9	0	0	0	0	111.1	V177 K178 D180	V177-T182 CarbonylContact C-O 3.56Å; V177-T182 WeakPolarHBondContact CA-O 2.91Å; K178-T182 WeakPolarHBondContact CB-OG1 3.37Å; K178-T182 PolarHBondContact N-O 3.34Å; D180-T182 PolarHBondContact O-N 2.94Å; D180-T182 VanDerWaalsContact OD1-CB 3.3Å; D180-T182 WeakPolarHBondContact OD1-CB 3.26Å; D180-T182 VanDerWaalsContact OD1-CG2 3.25Å; D180-T182 WeakPolarHBondContact OD1-CG2 3.23Å; D180-T182 PolarHBondContact OD1-N 3.35Å; D180-T182 PolarHBondContact OD1-OG1 3.04Å
183	L	97.6	Very high	82.6	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.2	-175.3	178.9	152.9	0	0	0	111.8	N102 L149 Q152 M153 I175 V176 V177 I185	N102-L183 VanDerWaalsContact CA-O 3.28Å; N102-L183 WeakPolarHBondContact CA-O 3.42Å; N102-L183 PolarHBondContact ND2-O 3.49Å; L149-L183 HydrophobicContact CB-CD1 4.25Å; L149-L183 HydrophobicContact CD2-CB 4.13Å; L149-L183 HydrophobicContact CD2-CD1 3.89Å; Q152-L183 HydrophobicContact CB-CB 3.97Å; Q152-L183 HydrophobicContact CB-CD2 4.29Å; M153-L183 HydrophobicContact CE-CD1 3.91Å; M153-L183 HydrophobicContact CG-CD1 3.57Å; M153-L183 HydrophobicContact CG-CD2 3.78Å; M153-L183 HydrophobicContact CG-CG 4.37Å; M153-L183 HydrophobicContact SD-CD1 4.34Å; I175-L183 HydrophobicContact CG2-CD1 3.45Å; I175-L183 VanDerWaalsContact CG2-CD1 3.45Å; I175-L183 HydrophobicContact CG2-CD2 3.88Å; I175-L183 HydrophobicContact CG2-CG 3.55Å; V176-L183 WeakPolarHBondContact O-CA 3.4Å; V177-L183 HydrophobicContact CG1-CB 4.25Å; V177-L183 HydrophobicContact CG1-CD1 4.26Å; V177-L183 HydrophobicContact CG1-CG 4.3Å; L183-I185 HydrophobicContact CD2-CG1 4.29Å
184	K	96.5	Very high	80.5	Confident	26 Å²	26	30.7 Å²	30.7	11%	0.113	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.6	173.1	-74.4	165.2	175.3	-88	0	112.5	K101 N102 I103 I104 E127 M129 V176	K101-K184 WeakPolarHBondContact O-CE 3.49Å; K101-K184 WeakPolarHBondContact O-CG 3.31Å; K101-K184 PolarHBondContact O-NZ 3.06Å; N102-K184 WeakPolarHBondContact O-CA 3.3Å; I103-K184 PolarHBondContact O-NZ 3.29Å; I103-K184 VanDerWaalsContact O-NZ 3.15Å; I104-K184 HydrophobicContact CD1-CD 4.36Å; E127-K184 VanDerWaalsContact CD-NZ 3.32Å; E127-K184 HydrophobicContact CG-CD 4.26Å; E127-K184 WeakPolarHBondContact OE1-CD 3.41Å; E127-K184 WeakPolarHBondContact OE1-CE 3.35Å; E127-K184 IonicContact OE1-NZ 3.42Å; E127-K184 PolarHBondContact OE1-NZ 3.41Å; E127-K184 WeakPolarHBondContact OE2-CD 3.39Å; E127-K184 WeakPolarHBondContact OE2-CE 3.36Å; E127-K184 IonicContact OE2-NZ 2.88Å; E127-K184 PolarHBondContact OE2-NZ 3.4Å; M129-K184 HydrophobicContact CE-CB 4.2Å; M129-K184 HydrophobicContact CE-CD 3.94Å; M129-K184 HydrophobicContact CE-CG 4.26Å; M129-K184 HydrophobicContact SD-CD 3.89Å; V176-K184 HydrophobicContact CG2-CB 4.13Å; V176-K184 WeakPolarHBondContact CG2-O 3.48Å; V176-K184 PolarHBondContact N-O 2.69Å; V176-K184 PolarHBondContact O-N 3.17Å
185	I	95.3	Very high	77.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.9	174.9	-56.4	172	0	0	0	109.6	N102 I103 I104 I157 L170 L183	N102-I185 PolarHBondContact O-N 2.92Å; I103-I185 HydrophobicContact CD1-CB 3.89Å; I103-I185 HydrophobicContact CD1-CD1 4.1Å; I103-I185 HydrophobicContact CD1-CG1 4.36Å; I104-I185 WeakPolarHBondContact CG2-O 3.35Å; I104-I185 PolarHBondContact N-O 2.82Å; I157-I185 HydrophobicContact CG1-CD1 3.97Å; L170-I185 HydrophobicContact CD2-CD1 4.32Å; L170-I185 HydrophobicContact CD2-CG2 3.75Å; L183-I185 HydrophobicContact CD2-CG1 4.29Å
186	L	88.1	Confident	75.4	Confident	32 Å²	32	35 Å²	35	17%	0.168	21%	0.213	C	C	.	.			trans	-101.8	174.5	176.6	-58.4	-179.1	0	0	0	112.5	I104 H167 N174 V176	I104-L186 HydrophobicContact CB-CD2 3.71Å; I104-L186 HydrophobicContact CD1-CD2 3.86Å; I104-L186 HydrophobicContact CG1-CD2 3.69Å; I104-L186 HydrophobicContact CG2-CD2 3.85Å; H167-L186 PolarHBondContact NE2-O 3.45Å; H167-L186 VanDerWaalsContact NE2-O 3.07Å; N174-L186 WeakPolarHBondContact O-CB 3.43Å; N174-L186 PolarHBondContact O-N 2.81Å; V176-L186 HydrophobicContact CG1-CD1 3.54Å; V176-L186 HydrophobicContact CG1-CG 4.1Å; V176-L186 HydrophobicContact CG2-CD1 4.21Å; V176-L186 HydrophobicContact CG2-CD2 3.71Å; V176-L186 HydrophobicContact CG2-CG 3.84Å
187	D	73.2	Confident	72.8	Confident	28 Å²	28	37.2 Å²	37.2	15%	0.15	24%	0.239	C	C	.	.			trans	58.7	80.1	156.9	-81.5	3.4	0	0	0	117.2	Q55 K73 H167 G189	Q55-D187 PolarHBondContact NE2-OD2 3.19Å; Q55-D187 PolarHBondContact OE1-OD2 3.37Å; K73-D187 IonicContact NZ-OD1 2.75Å; K73-D187 PolarHBondContact NZ-OD1 3.35Å; H167-D187 PolarHBondContact NE2-O 2.93Å; D187-G189 VanDerWaalsContact C-N 3.25Å; D187-G189 PolarHBondContact O-N 2.98Å
188	F	67.2	Low	70.1	Confident	1 Å²	1	41.3 Å²	41.3	0%	0.004	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	6.2	172.7	-53.2	-69	0	0	0	115.3	R90 L94 M95 I103 L160 L190 A191	R90-F188 PolarHBondContact NH2-O 3Å; L94-F188 HydrophobicContact CB-CB 4.07Å; L94-F188 HydrophobicContact CB-CD2 4.25Å; L94-F188 HydrophobicContact CB-CG 4.18Å; L94-F188 HydrophobicContact CD1-CB 3.58Å; L94-F188 HydrophobicContact CD1-CG 4.26Å; L94-F188 HydrophobicContact CG-CB 4.48Å; M95-F188 HydrophobicContact CG-CD2 3.91Å; M95-F188 HydrophobicContact CG-CE2 4.1Å; I103-F188 HydrophobicContact CD1-CZ 4.43Å; I103-F188 HydrophobicContact CG2-CE1 4.5Å; I103-F188 HydrophobicContact CG2-CE2 4.07Å; I103-F188 HydrophobicContact CG2-CZ 3.47Å; I103-F188 VanDerWaalsContact CG2-CZ 3.47Å; L160-F188 HydrophobicContact CD1-CE1 3.82Å; L160-F188 HydrophobicContact CD2-CD1 4.21Å; L160-F188 HydrophobicContact CD2-CE1 3.53Å; L160-F188 HydrophobicContact CD2-CZ 4.2Å; L160-F188 HydrophobicContact CG-CE1 4.32Å; F188-L190 PolarHBondContact O-N 3.42Å; F188-A191 HydrophobicContact CB-CB 4.16Å; F188-A191 HydrophobicContact CD1-CB 4.33Å; F188-A191 WeakPolarHBondContact O-CB 3.49Å; F188-A191 PolarHBondContact O-N 2.84Å
189	G	55.7	Low	67.7	Low	1 Å²	1	43.9 Å²	43.9	1%	0.01	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.6	-174.1	0	0	0	0	0	114.5	R87 R90 D187	R87-G189 WeakPolarHBondContact CG-O 3.44Å; R90-G189 VanDerWaalsContact NH2-C 3.26Å; R90-G189 PolarHBondContact NH2-O 3.14Å; D187-G189 VanDerWaalsContact C-N 3.25Å; D187-G189 PolarHBondContact O-N 2.98Å
190	L	60.1	Low	65.5	Low	27 Å²	27	40.4 Å²	40.4	14%	0.141	25%	0.249	C	C	.	.	S	Bend	trans	-115.6	-7.8	175.9	-65	175.9	0	0	0	114.6	R90 H167 R168 D169 F188 R192 M200	R90-L190 VanDerWaalsContact NH2-CA 3.27Å; R90-L190 PolarHBondContact NH2-O 3.19Å; H167-L190 CarbonylContact O-C 3.53Å; R168-L190 VanDerWaalsContact CZ-O 3.32Å; R168-L190 PolarHBondContact NE-O 2.84Å; R168-L190 VanDerWaalsContact NE-O 3.08Å; R168-L190 PolarHBondContact NH2-O 3.22Å; D169-L190 HydrophobicContact CB-CB 3.98Å; D169-L190 HydrophobicContact CB-CD1 3.65Å; D169-L190 HydrophobicContact CB-CG 4.41Å; F188-L190 PolarHBondContact O-N 3.42Å; L190-R192 PolarHBondContact O-N 3.42Å; L190-M200 HydrophobicContact CB-CE 3.77Å; L190-M200 HydrophobicContact CD1-CE 4Å; L190-M200 HydrophobicContact CD2-CE 3.77Å; L190-M200 HydrophobicContact CG-CE 4.03Å
191	A	56.3	Low	63	Low	1 Å²	1	40.1 Å²	40.1	1%	0.008	25%	0.251	C	S	.	.			trans	-63.5	105.5	176.4	0	0	0	0	0	117.5	R90 L94 I165 I166 H167 F188	R90-A191 VanDerWaalsContact CZ-C 3.47Å; R90-A191 PolarHBondContact NE-O 3.37Å; R90-A191 PolarHBondContact NH1-O 2.87Å; R90-A191 PolarHBondContact NH2-O 2.96Å; L94-A191 HydrophobicContact CD1-CB 4.47Å; I165-A191 HydrophobicContact CG2-CB 3.6Å; I166-A191 CarbonylContact O-C 3.55Å; I166-A191 VanDerWaalsContact O-C 3.24Å; I166-A191 WeakPolarHBondContact O-CA 3.47Å; I166-A191 WeakPolarHBondContact O-CB 3.33Å; H167-A191 VanDerWaalsContact O-CA 3.32Å; H167-A191 WeakPolarHBondContact O-CA 2.96Å; H167-A191 PolarHBondContact O-N 3.37Å; F188-A191 HydrophobicContact CB-CB 4.16Å; F188-A191 HydrophobicContact CD1-CB 4.33Å; F188-A191 WeakPolarHBondContact O-CB 3.49Å; F188-A191 PolarHBondContact O-N 2.84Å
192	R	57.5	Low	60.2	Low	60 Å²	60	43.3 Å²	43.3	23%	0.226	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	155.3	-178.4	-103.6	22.4	159.4	-162.3	-2.8	111.7	I166 R168 L190 T196	I166-R192 PolarHBondContact N-O 3.39Å; I166-R192 PolarHBondContact O-N 3.15Å; R168-R192 VanDerWaalsContact CZ-CG 3.44Å; L190-R192 PolarHBondContact O-N 3.42Å; R192-T196 WeakPolarHBondContact CG-OG1 3.49Å
193	T	52.4	Low	57.5	Low	19 Å²	19	50 Å²	50	12%	0.117	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	137.4	161.4	48.8	0	0	0	0	110	G164 A195 T196 D361	G164-T193 CarbonylContact O-C 3.45Å; G164-T193 WeakPolarHBondContact O-CA 3.5Å; T193-A195 PolarHBondContact O-N 3.49Å; T193-T196 PolarHBondContact O-N 2.89Å; T193-T196 PolarHBondContact O-OG1 3.16Å; T193-T196 PolarHBondContact OG1-OG1 2.92Å; T193-D361 WeakPolarHBondContact CB-OD2 3.39Å; T193-D361 PolarHBondContact N-OD2 3.46Å; T193-D361 PolarHBondContact OG1-OD2 3.28Å
194	A	44.8	Very low	54.9	Low	63 Å²	63	56.6 Å²	56.6	52%	0.521	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-18.8	-174.6	0	0	0	0	0	115	G164 I166 T196	G164-A194 PolarHBondContact O-N 3.24Å; I166-A194 HydrophobicContact CD1-CB 3.81Å; I166-A194 HydrophobicContact CG1-CB 4.21Å; A194-T196 VanDerWaalsContact C-N 3.34Å
195	A	36.3	Very low	53.3	Low	87 Å²	87	57.9 Å²	57.9	72%	0.719	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-20.7	178.7	0	0	0	0	0	114.1	T193 G197	T193-A195 PolarHBondContact O-N 3.49Å; A195-G197 PolarHBondContact O-N 3.49Å
196	T	41.6	Very low	52.1	Low	11 Å²	11	60.8 Å²	60.8	7%	0.067	36%	0.361	C	S	.	.			trans	-97.6	90.5	-172.9	43.2	0	0	0	0	110.8	R192 T193 A194 L198 Y220 D361 E362	R192-T196 WeakPolarHBondContact CG-OG1 3.49Å; T193-T196 PolarHBondContact O-N 2.89Å; T193-T196 PolarHBondContact O-OG1 3.16Å; T193-T196 PolarHBondContact OG1-OG1 2.92Å; A194-T196 VanDerWaalsContact C-N 3.34Å; T196-L198 HydrophobicContact CG2-CD1 4.26Å; T196-L198 PolarHBondContact O-N 3.33Å; T196-Y220 PolarHBondContact O-OH 2.73Å; T196-D361 HydrophobicContact CG2-CB 4.05Å; T196-E362 HydrophobicContact CG2-CG 4.1Å
197	G	40.2	Very low	52	Low	63 Å²	63	60.6 Å²	60.6	65%	0.649	36%	0.358	S	S	*	.			trans	-63.7	31.4	171.8	0	0	0	0	0	115	A195	A195-G197 PolarHBondContact O-N 3.49Å
198	L	40.2	Very low	53	Low	95 Å²	95	62.4 Å²	62.4	50%	0.497	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-80	132.5	-175.4	-66.6	174.1	0	0	0	111.6	R168 T196 Y220	R168-L198 PolarHBondContact NH1-O 3.31Å; T196-L198 HydrophobicContact CG2-CD1 4.26Å; T196-L198 PolarHBondContact O-N 3.33Å; L198-Y220 PolarHBondContact O-OH 3.43Å
199	L	44.1	Very low	54.4	Low	124 Å²	124	63.2 Å²	63.2	65%	0.649	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-63.4	145.5	175.1	-62.1	170.1	0	0	0	111.3	G217	L199-G217 WeakPolarHBondContact CD2-O 3.17Å
200	M	44.6	Very low	56.2	Low	37 Å²	37	63.7 Å²	63.7	18%	0.182	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-73.9	141.9	171.1	-68.6	-146.6	110.2	0	0	110.9	L190 V214	L190-M200 HydrophobicContact CB-CE 3.77Å; L190-M200 HydrophobicContact CD1-CE 4Å; L190-M200 HydrophobicContact CD2-CE 3.77Å; L190-M200 HydrophobicContact CG-CE 4.03Å; M200-V214 HydrophobicContact CG-CG1 4.09Å; M200-V214 HydrophobicContact SD-CG1 4.21Å
201	T	40.9	Very low	57.8	Low	92 Å²	92	62.4 Å²	62.4	56%	0.564	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-67.9	137.2	170.4	47.5	0	0	0	0	110.3	Y203	T201-Y203 VanDerWaalsContact C-N 3.34Å; T201-Y203 PolarHBondContact O-N 2.9Å
202	P	36	Very low	59.6	Low	102 Å²	102	62.4 Å²	62.4	66%	0.662	36%	0.361	S	S	*	.			trans	-77.6	82.8	179.5	30.7	-33.2	0	0	0	110.2	Y248	P202-Y248 HydrophobicContact CB-CE2 3.86Å
203	Y	38	Very low	61.3	Low	182 Å²	182	59.7 Å²	59.7	71%	0.714	35%	0.351	S	S	*	.			trans	-112.7	149.6	168.3	-97	-90.7	0	0	0	111.6	T201 V205	T201-Y203 VanDerWaalsContact C-N 3.34Å; T201-Y203 PolarHBondContact O-N 2.9Å; Y203-V205 PolarHBondContact O-N 3.33Å
204	V	44.2	Very low	63	Low	138 Å²	138	59.7 Å²	59.7	84%	0.836	35%	0.351	S	S	*	.	S	Bend	trans	-64.3	87.9	-177.3	-175.2	0	0	0	0	110.1
205	V	62.3	Low	65.1	Low	52 Å²	52	57.6 Å²	57.6	32%	0.315	33%	0.331	S	S	.	.	S	Bend	trans	-133.4	153.1	173.3	-176.4	0	0	0	0	107.4	Y203 R207	Y203-V205 PolarHBondContact O-N 3.33Å; V205-R207 PolarHBondContact O-N 2.99Å
206	T	70.4	Confident	67.6	Low	62 Å²	62	54.1 Å²	54.1	38%	0.38	30%	0.3	S	S	.	.			trans	-47.9	109.9	172.6	-46.3	0	0	0	0	110.7	Y208 Y209	T206-Y208 HydrophobicContact CG2-CD2 3.43Å; T206-Y208 VanDerWaalsContact CG2-CD2 3.43Å; T206-Y208 HydrophobicContact CG2-CE2 3.84Å; T206-Y208 HydrophobicContact CG2-CG 4.04Å; T206-Y209 HydrophobicContact CG2-CD2 4.31Å; T206-Y209 HydrophobicContact CG2-CE2 3.93Å
207	R	86.4	Confident	69.6	Low	28 Å²	28	55 Å²	55	11%	0.106	31%	0.311	C	S	.	.			trans	-99.7	-3.6	-175.7	67.9	-176.6	64.4	81.3	-1.6	114	V205 Y209 R210 G245 R246 D247 Q251	V205-R207 PolarHBondContact O-N 2.99Å; R207-Y209 PolarHBondContact O-N 2.92Å; R207-Y209 VanDerWaalsContact O-N 3.09Å; R207-R210 WeakPolarHBondContact O-CB 3.49Å; R207-R210 PolarHBondContact O-N 2.68Å; R207-G245 PolarHBondContact NH1-O 3.37Å; R207-R246 PolarHBondContact NH1-O 3.33Å; R207-D247 WeakPolarHBondContact CD-O 3.47Å; R207-Q251 HydrophobicContact CG-CB 4.42Å; R207-Q251 HydrophobicContact CG-CG 4.23Å
208	Y	94.5	Very high	71.9	Confident	66 Å²	66	53.4 Å²	53.4	26%	0.259	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.7	-167.7	-50.5	-34.6	0	0	0	114.3	T206 I241 F243 P244 G245 Q251	T206-Y208 HydrophobicContact CG2-CD2 3.43Å; T206-Y208 VanDerWaalsContact CG2-CD2 3.43Å; T206-Y208 HydrophobicContact CG2-CE2 3.84Å; T206-Y208 HydrophobicContact CG2-CG 4.04Å; Y208-I241 HydrophobicContact CD2-CD1 3.73Å; Y208-I241 HydrophobicContact CD2-CG1 4.37Å; Y208-I241 HydrophobicContact CD2-CG2 3.77Å; Y208-I241 HydrophobicContact CE2-CD1 3.79Å; Y208-I241 HydrophobicContact CG-CG2 3.78Å; Y208-F243 VanDerWaalsContact CD1-O 3.26Å; Y208-F243 WeakPolarHBondContact CD1-O 3.48Å; Y208-P244 HydrophobicContact CE1-CB 4.47Å; Y208-G245 WeakPolarHBondContact CE1-O 3.41Å; Y208-Q251 PolarHBondContact O-NE2 3.34Å
209	Y	95.3	Very high	73.9	Confident	17 Å²	17	52 Å²	52	7%	0.067	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	2.8	-178.2	-46.6	-85.9	0	0	0	113	L170 K171 P172 T206 R207 S228 C231 I232 E235	L170-Y209 VanDerWaalsContact O-CB 3.24Å; L170-Y209 WeakPolarHBondContact O-CB 3.49Å; K171-Y209 HydrophobicContact CB-CD2 3.42Å; K171-Y209 VanDerWaalsContact CB-CD2 3.42Å; K171-Y209 HydrophobicContact CB-CE2 3.8Å; K171-Y209 HydrophobicContact CB-CG 4.03Å; P172-Y209 VanDerWaalsContact CD-CE1 3.49Å; P172-Y209 VanDerWaalsContact CD-CE2 3.5Å; P172-Y209 WeakPolarHBondContact CD-OH 3.24Å; P172-Y209 HydrophobicContact CG-CE1 3.87Å; P172-Y209 HydrophobicContact CG-CE2 4.44Å; P172-Y209 WeakPolarHBondContact CG-OH 3.12Å; T206-Y209 HydrophobicContact CG2-CD2 4.31Å; T206-Y209 HydrophobicContact CG2-CE2 3.93Å; R207-Y209 PolarHBondContact O-N 2.92Å; R207-Y209 VanDerWaalsContact O-N 3.09Å; Y209-S228 WeakPolarHBondContact O-CA 3.46Å; Y209-S228 WeakPolarHBondContact O-CB 3.48Å; Y209-S228 PolarHBondContact O-OG 2.82Å; Y209-C231 HydrophobicContact CD1-CB 3.7Å; Y209-C231 HydrophobicContact CE1-CB 4.48Å; Y209-I232 HydrophobicContact CD1-CG1 3.84Å; Y209-I232 HydrophobicContact CE1-CG1 4.09Å; Y209-E235 WeakPolarHBondContact CE1-OE2 3.39Å; Y209-E235 PolarHBondContact OH-OE1 3.35Å; Y209-E235 PolarHBondContact OH-OE2 2.92Å
210	R	93.1	Very high	75.8	Confident	11 Å²	11	47.6 Å²	47.6	4%	0.042	27%	0.27	C	S	.	.			trans	-76.8	137.8	179.5	-67.6	-176.2	178.7	178.3	-0.2	110.3	R207 V214 I215 W227 Y248	R207-R210 WeakPolarHBondContact O-CB 3.49Å; R207-R210 PolarHBondContact O-N 2.68Å; R210-V214 HydrophobicContact CB-CG1 4.48Å; R210-I215 HydrophobicContact CB-CD1 4.23Å; R210-I215 HydrophobicContact CB-CG1 4.08Å; R210-I215 VanDerWaalsContact O-CD1 3.3Å; R210-I215 WeakPolarHBondContact O-CD1 3.28Å; R210-W227 PolarHBondContact O-NE1 3.46Å; R210-Y248 PolarHBondContact NH1-OH 3.01Å
211	A	94.7	Very high	77.9	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.008	29%	0.293	C	S	.	.			trans	-67.8	154.3	178.7	0	0	0	0	0	112.6	E213 V214 I215 V224 W227	A211-E213 VanDerWaalsContact C-N 3.29Å; A211-E213 VanDerWaalsContact CB-CD 3.45Å; A211-E213 HydrophobicContact CB-CG 4.2Å; A211-E213 WeakPolarHBondContact CB-OE1 3.38Å; A211-E213 WeakPolarHBondContact CB-OE2 2.86Å; A211-E213 PolarHBondContact O-N 3.39Å; A211-V214 HydrophobicContact CB-CG2 4.35Å; A211-V214 WeakPolarHBondContact O-CB 3.47Å; A211-V214 PolarHBondContact O-N 3.33Å; A211-I215 PolarHBondContact O-N 3.49Å; A211-I215 VanDerWaalsContact O-N 3.07Å; A211-V224 HydrophobicContact CB-CG2 3.51Å; A211-W227 HydrophobicContact CB-CB 3.73Å; A211-W227 HydrophobicContact CB-CD2 4.47Å; A211-W227 HydrophobicContact CB-CG 3.75Å
212	P	94.4	Very high	80.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-51.5	-45.2	176.5	-33	40.6	0	0	0	113.6	V214 I215 L216 W227 W252 I322	P212-V214 PolarHBondContact O-N 2.94Å; P212-I215 PolarHBondContact O-N 3.18Å; P212-I215 VanDerWaalsContact O-N 3.14Å; P212-L216 VanDerWaalsContact O-CB 3.28Å; P212-L216 WeakPolarHBondContact O-CB 3.45Å; P212-L216 VanDerWaalsContact O-CG 3.25Å; P212-L216 WeakPolarHBondContact O-CG 3.38Å; P212-L216 PolarHBondContact O-N 3.26Å; P212-W227 HydrophobicContact CG-CD2 4.36Å; P212-W227 HydrophobicContact CG-CE3 4.17Å; P212-W227 HydrophobicContact CG-CH2 3.7Å; P212-W227 HydrophobicContact CG-CZ2 3.91Å; P212-W227 HydrophobicContact CG-CZ3 3.85Å; P212-W252 HydrophobicContact CB-CZ3 4.03Å; P212-I322 HydrophobicContact CB-CG2 4.09Å; P212-I322 HydrophobicContact CG-CB 4.48Å; P212-I322 HydrophobicContact CG-CG2 4.15Å
213	E	92.4	Very high	83	Confident	3 Å²	3	46.1 Å²	46.1	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-30.5	178.4	59	-88.1	-155.6	0	0	112.8	A211 G217 M218 V224 R327	A211-E213 VanDerWaalsContact C-N 3.29Å; A211-E213 VanDerWaalsContact CB-CD 3.45Å; A211-E213 HydrophobicContact CB-CG 4.2Å; A211-E213 WeakPolarHBondContact CB-OE1 3.38Å; A211-E213 WeakPolarHBondContact CB-OE2 2.86Å; A211-E213 PolarHBondContact O-N 3.39Å; E213-G217 PolarHBondContact O-N 2.72Å; E213-M218 HydrophobicContact CB-CB 3.9Å; E213-M218 HydrophobicContact CB-CG 4.49Å; E213-M218 HydrophobicContact CB-SD 4.14Å; E213-M218 PolarHBondContact O-N 3.01Å; E213-V224 HydrophobicContact CG-CG2 4.24Å; E213-R327 IonicContact OE1-CZ 2.79Å; E213-R327 IonicContact OE1-NH1 2.68Å; E213-R327 PolarHBondContact OE1-NH1 3.31Å; E213-R327 IonicContact OE1-NH2 3.81Å; E213-R327 PolarHBondContact OE1-NH2 3.34Å; E213-R327 IonicContact OE2-CZ 3.87Å; E213-R327 IonicContact OE2-NH1 2.85Å; E213-R327 IonicContact OE2-NH2 2.69Å; E213-R327 PolarHBondContact OE2-NH2 2.87Å
214	V	89	Confident	85.7	Confident	19 Å²	19	37.6 Å²	37.6	12%	0.115	22%	0.221	C	C	.	.	H	α-helix	trans	-76	-41.9	175.1	-179.8	0	0	0	0	110.9	M200 R210 A211 P212 V224	M200-V214 HydrophobicContact CG-CG1 4.09Å; M200-V214 HydrophobicContact SD-CG1 4.21Å; R210-V214 HydrophobicContact CB-CG1 4.48Å; A211-V214 HydrophobicContact CB-CG2 4.35Å; A211-V214 WeakPolarHBondContact O-CB 3.47Å; A211-V214 PolarHBondContact O-N 3.33Å; P212-V214 PolarHBondContact O-N 2.94Å; V214-V224 HydrophobicContact CG2-CG2 3.48Å; V214-V224 VanDerWaalsContact CG2-CG2 3.48Å
215	I	88.4	Confident	88.2	Confident	19 Å²	19	31 Å²	31	10%	0.097	18%	0.182	C	C	.	.	H	α-helix	trans	-67.4	-38.3	179.5	-69.8	159.2	0	0	0	111.4	R210 A211 P212 Y248 Q251	R210-I215 HydrophobicContact CB-CD1 4.23Å; R210-I215 HydrophobicContact CB-CG1 4.08Å; R210-I215 VanDerWaalsContact O-CD1 3.3Å; R210-I215 WeakPolarHBondContact O-CD1 3.28Å; A211-I215 PolarHBondContact O-N 3.49Å; A211-I215 VanDerWaalsContact O-N 3.07Å; P212-I215 PolarHBondContact O-N 3.18Å; P212-I215 VanDerWaalsContact O-N 3.14Å; I215-Y248 HydrophobicContact CB-CD1 4.4Å; I215-Y248 HydrophobicContact CG1-CD1 4.3Å; I215-Y248 HydrophobicContact CG2-CD1 4.06Å; I215-Q251 HydrophobicContact CD1-CB 4.46Å; I215-Q251 HydrophobicContact CD1-CG 3.45Å; I215-Q251 VanDerWaalsContact CD1-CG 3.45Å; I215-Q251 HydrophobicContact CG1-CG 4.33Å
216	L	88.6	Confident	89.9	Confident	15 Å²	15	28.5 Å²	28.5	8%	0.079	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-1.9	-177.4	-61.3	176.1	0	0	0	113.2	P212 M218 W252 F266 L270 V274 V278	P212-L216 VanDerWaalsContact O-CB 3.28Å; P212-L216 WeakPolarHBondContact O-CB 3.45Å; P212-L216 VanDerWaalsContact O-CG 3.25Å; P212-L216 WeakPolarHBondContact O-CG 3.38Å; P212-L216 PolarHBondContact O-N 3.26Å; L216-M218 HydrophobicContact CB-CG 4.12Å; L216-M218 HydrophobicContact CB-SD 4.3Å; L216-M218 HydrophobicContact CD1-SD 4.36Å; L216-W252 HydrophobicContact CD1-CD2 4.48Å; L216-W252 HydrophobicContact CD1-CE3 4Å; L216-W252 HydrophobicContact CD1-CH2 3.92Å; L216-W252 HydrophobicContact CD1-CZ2 4.4Å; L216-W252 HydrophobicContact CD1-CZ3 3.73Å; L216-W252 HydrophobicContact CD2-CD2 4.08Å; L216-W252 HydrophobicContact CD2-CE3 4.17Å; L216-W252 HydrophobicContact CD2-CG 4.37Å; L216-W252 HydrophobicContact CG-CE3 4.27Å; L216-W252 HydrophobicContact CG-CZ3 4.47Å; L216-F266 HydrophobicContact CD1-CE1 4.1Å; L216-F266 HydrophobicContact CD1-CZ 4.01Å; L216-L270 HydrophobicContact CB-CD2 4.11Å; L216-L270 HydrophobicContact CD1-CD2 3.82Å; L216-V274 HydrophobicContact CB-CG1 4.15Å; L216-V274 HydrophobicContact CD2-CG1 3.7Å; L216-V274 HydrophobicContact CG-CG1 4.44Å; L216-V278 HydrophobicContact CD2-CG2 4.22Å
217	G	84.7	Confident	91.2	Very high	28 Å²	28	25.6 Å²	25.6	29%	0.289	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	38.2	178.2	0	0	0	0	0	113.9	L199 E213	L199-G217 WeakPolarHBondContact CD2-O 3.17Å; E213-G217 PolarHBondContact O-N 2.72Å
218	M	87.9	Confident	91.8	Very high	30 Å²	30	24.3 Å²	24.3	15%	0.148	14%	0.144	C	C	.	.			trans	-89.2	166	174.1	-54.5	170	72.2	0	0	110.7	E213 L216 F266 K269 L270	E213-M218 HydrophobicContact CB-CB 3.9Å; E213-M218 HydrophobicContact CB-CG 4.49Å; E213-M218 HydrophobicContact CB-SD 4.14Å; E213-M218 PolarHBondContact O-N 3.01Å; L216-M218 HydrophobicContact CB-CG 4.12Å; L216-M218 HydrophobicContact CB-SD 4.3Å; L216-M218 HydrophobicContact CD1-SD 4.36Å; M218-F266 HydrophobicContact CE-CD2 4.49Å; M218-F266 HydrophobicContact CE-CE2 3.88Å; M218-F266 HydrophobicContact CE-CZ 4.15Å; M218-F266 HydrophobicContact SD-CE2 3.99Å; M218-F266 HydrophobicContact SD-CZ 3.75Å; M218-K269 HydrophobicContact CE-CB 3.79Å; M218-L270 HydrophobicContact CE-CD2 3.95Å; M218-L270 HydrophobicContact CG-CD2 3.7Å; M218-L270 HydrophobicContact SD-CD2 3.36Å; M218-L270 WeakPolarHBondContact SD-CD2 3.44Å
219	G	82.4	Confident	91.9	Very high	65 Å²	65	21.2 Å²	21.2	67%	0.67	13%	0.132	S	C	*	.			trans	-62.6	146.2	161.9	0	0	0	0	0	110.7
220	Y	84.1	Confident	92.1	Very high	32 Å²	32	20.4 Å²	20.4	13%	0.125	13%	0.129	C	C	.	.			trans	-133.3	161.5	-176.6	56.2	-92	0	0	0	110.9	I166 R168 T196 L198 V224	I166-Y220 HydrophobicContact CD1-CD2 4.35Å; I166-Y220 HydrophobicContact CD1-CE2 4.31Å; R168-Y220 HydrophobicContact CG-CE2 4.39Å; R168-Y220 PolarHBondContact NH1-OH 3.33Å; T196-Y220 PolarHBondContact O-OH 2.73Å; L198-Y220 PolarHBondContact O-OH 3.43Å; Y220-V224 HydrophobicContact CD2-CG1 4.4Å
221	Q	87.5	Confident	92.4	Very high	144 Å²	144	20 Å²	20	67%	0.673	13%	0.128	S	C	*	.			trans	-126.8	-177.6	178.1	-61.1	-176	11.8	0	0	110	N223 V224	Q221-N223 PolarHBondContact O-N 2.96Å; Q221-V224 VanDerWaalsContact O-CB 3.28Å; Q221-V224 WeakPolarHBondContact O-CB 3.38Å; Q221-V224 WeakPolarHBondContact O-CG1 3.34Å; Q221-V224 PolarHBondContact O-N 2.83Å
222	A	89.9	Confident	92.5	Very high	38 Å²	38	20 Å²	20	31%	0.314	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.9	-178.9	0	0	0	0	0	113.5	H161 V224 D225	H161-A222 PolarHBondContact CE1-O 2.67Å; H161-A222 PolarHBondContact NE2-O 2.92Å; A222-V224 PolarHBondContact O-N 3.33Å; A222-D225 PolarHBondContact O-N 2.95Å
223	N	94.3	Very high	92.7	Very high	19 Å²	19	20 Å²	20	10%	0.102	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	6.7	178.7	73.2	-13.7	0	0	0	114.9	Q221 D225 I226 A324 R327	Q221-N223 PolarHBondContact O-N 2.96Å; N223-D225 PolarHBondContact O-N 3.03Å; N223-I226 HydrophobicContact CB-CB 4.48Å; N223-I226 HydrophobicContact CB-CG1 4.36Å; N223-I226 WeakPolarHBondContact O-CB 3.4Å; N223-I226 PolarHBondContact O-N 3.36Å; N223-A324 PolarHBondContact ND2-O 3.29Å; N223-R327 PolarHBondContact ND2-O 3.35Å; N223-R327 WeakPolarHBondContact O-CD 3.45Å; N223-R327 PolarHBondContact O-NH1 3.14Å
224	V	94.9	Very high	93	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.012	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-36.5	164	73.7	0	0	0	0	111.3	I166 R168 A211 E213 V214 Y220 Q221 A222 I226 W227	I166-V224 HydrophobicContact CG2-CG1 3.28Å; R168-V224 HydrophobicContact CG-CG1 4.36Å; A211-V224 HydrophobicContact CB-CG2 3.51Å; E213-V224 HydrophobicContact CG-CG2 4.24Å; V214-V224 HydrophobicContact CG2-CG2 3.48Å; V214-V224 VanDerWaalsContact CG2-CG2 3.48Å; Y220-V224 HydrophobicContact CD2-CG1 4.4Å; Q221-V224 VanDerWaalsContact O-CB 3.28Å; Q221-V224 WeakPolarHBondContact O-CB 3.38Å; Q221-V224 WeakPolarHBondContact O-CG1 3.34Å; Q221-V224 PolarHBondContact O-N 2.83Å; A222-V224 PolarHBondContact O-N 3.33Å; V224-I226 VanDerWaalsContact C-N 3.28Å; V224-I226 PolarHBondContact O-N 2.94Å; V224-W227 WeakPolarHBondContact O-CB 3.27Å; V224-W227 PolarHBondContact O-N 3.11Å
225	D	96.3	Very high	93.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71.3	-25.8	-179.9	-71.1	-32.1	0	0	0	111.4	I157 H161 H167 R168 L170 A222 N223 W227 S228 V229	I157-D225 HydrophobicContact CD1-CB 4.48Å; I157-D225 HydrophobicContact CG2-CB 4.04Å; H161-D225 IonicContact CD2-OD2 2.88Å; H161-D225 IonicContact CE1-OD2 2.99Å; H161-D225 IonicContact NE2-OD2 3.5Å; H161-D225 PolarHBondContact NE2-OD2 3.21Å; H167-D225 PolarHBondContact N-OD2 2.91Å; R168-D225 PolarHBondContact N-OD1 3.15Å; L170-D225 HydrophobicContact CD1-CB 3.77Å; A222-D225 PolarHBondContact O-N 2.95Å; N223-D225 PolarHBondContact O-N 3.03Å; D225-W227 VanDerWaalsContact C-N 3.32Å; D225-W227 PolarHBondContact O-N 2.99Å; D225-S228 WeakPolarHBondContact O-CB 3.39Å; D225-S228 PolarHBondContact O-N 3.41Å; D225-V229 WeakPolarHBondContact O-CG2 3.14Å; D225-V229 PolarHBondContact O-N 3.44Å
226	I	98.5	Very high	93.7	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.4	-35.2	175.3	-69.6	-67.8	0	0	0	112	L154 N223 V224 S228 V229 G230 M319 R327 I328 V330 A333	L154-I226 HydrophobicContact CD2-CD1 3.51Å; N223-I226 HydrophobicContact CB-CB 4.48Å; N223-I226 HydrophobicContact CB-CG1 4.36Å; N223-I226 WeakPolarHBondContact O-CB 3.4Å; N223-I226 PolarHBondContact O-N 3.36Å; V224-I226 VanDerWaalsContact C-N 3.28Å; V224-I226 PolarHBondContact O-N 2.94Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.36Å; I226-V229 PolarHBondContact O-N 3.49Å; I226-G230 PolarHBondContact O-N 3.19Å; I226-M319 HydrophobicContact CG2-CB 3.93Å; I226-M319 HydrophobicContact CG2-CG 3.76Å; I226-R327 HydrophobicContact CG2-CG 4.07Å; I226-I328 HydrophobicContact CG2-CG2 3.74Å; I226-V330 HydrophobicContact CD1-CB 4.39Å; I226-V330 HydrophobicContact CD1-CG2 3.83Å; I226-V330 HydrophobicContact CG1-CG2 3.89Å; I226-A333 HydrophobicContact CD1-CB 4.3Å
227	W	98.4	Very high	94.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-44.4	173	174.7	-84.7	0	0	0	111.3	R210 A211 P212 V224 D225 G230 C231 F243 V255 L259 I322	R210-W227 PolarHBondContact O-NE1 3.46Å; A211-W227 HydrophobicContact CB-CB 3.73Å; A211-W227 HydrophobicContact CB-CD2 4.47Å; A211-W227 HydrophobicContact CB-CG 3.75Å; P212-W227 HydrophobicContact CG-CD2 4.36Å; P212-W227 HydrophobicContact CG-CE3 4.17Å; P212-W227 HydrophobicContact CG-CH2 3.7Å; P212-W227 HydrophobicContact CG-CZ2 3.91Å; P212-W227 HydrophobicContact CG-CZ3 3.85Å; V224-W227 WeakPolarHBondContact O-CB 3.27Å; V224-W227 PolarHBondContact O-N 3.11Å; D225-W227 VanDerWaalsContact C-N 3.32Å; D225-W227 PolarHBondContact O-N 2.99Å; W227-G230 PolarHBondContact O-N 3.05Å; W227-C231 PolarHBondContact NE1-SG 3.31Å; W227-C231 PolarHBondContact O-N 2.89Å; W227-C231 PolarHBondContact O-SG 3.1Å; W227-F243 HydrophobicContact CH2-CE2 4.07Å; W227-F243 HydrophobicContact CH2-CZ 4.29Å; W227-F243 HydrophobicContact CZ2-CD2 4.07Å; W227-F243 AromaticContact CZ2-CE2 3.51Å; W227-F243 HydrophobicContact CZ2-CE2 3.51Å; W227-F243 HydrophobicContact CZ2-CZ 4.15Å; W227-V255 HydrophobicContact CH2-CG1 3.77Å; W227-V255 HydrophobicContact CH2-CG2 4.41Å; W227-V255 HydrophobicContact CZ2-CG1 4.16Å; W227-V255 HydrophobicContact CZ2-CG2 3.97Å; W227-L259 HydrophobicContact CH2-CD1 3.57Å; W227-L259 HydrophobicContact CZ3-CD1 3.93Å; W227-I322 HydrophobicContact CH2-CG1 4.47Å; W227-I322 HydrophobicContact CZ3-CG1 4.46Å
228	S	97.7	Very high	94.6	Very high	2 Å²	2	21 Å²	21	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-62.3	-43.7	178.2	-55.6	0	0	0	0	111.3	Y209 D225 I226 G230 C231 I232	Y209-S228 WeakPolarHBondContact O-CA 3.46Å; Y209-S228 WeakPolarHBondContact O-CB 3.48Å; Y209-S228 PolarHBondContact O-OG 2.82Å; D225-S228 WeakPolarHBondContact O-CB 3.39Å; D225-S228 PolarHBondContact O-N 3.41Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.36Å; S228-G230 VanDerWaalsContact C-N 3.34Å; S228-G230 PolarHBondContact O-N 3.39Å; S228-C231 PolarHBondContact O-N 2.81Å; S228-I232 WeakPolarHBondContact O-CD1 3.49Å; S228-I232 VanDerWaalsContact O-CG1 3.26Å; S228-I232 WeakPolarHBondContact O-CG1 3.42Å; S228-I232 PolarHBondContact O-N 2.93Å
229	V	98.4	Very high	94.9	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-43.1	173.7	176.5	0	0	0	0	111.3	L150 I157 L170 D225 I226 C231 I232 L233 M319	L150-V229 HydrophobicContact CD1-CG1 3.58Å; L150-V229 HydrophobicContact CD2-CG1 4.39Å; L150-V229 HydrophobicContact CG-CG1 3.92Å; I157-V229 HydrophobicContact CD1-CG2 3.33Å; L170-V229 HydrophobicContact CD1-CG2 4.31Å; D225-V229 WeakPolarHBondContact O-CG2 3.14Å; D225-V229 PolarHBondContact O-N 3.44Å; I226-V229 PolarHBondContact O-N 3.49Å; V229-C231 VanDerWaalsContact C-N 3.34Å; V229-C231 PolarHBondContact O-N 3.24Å; V229-I232 PolarHBondContact O-N 3.12Å; V229-L233 WeakPolarHBondContact O-CB 3.28Å; V229-L233 PolarHBondContact O-N 2.76Å; V229-M319 HydrophobicContact CG1-CE 3.97Å; V229-M319 HydrophobicContact CG1-SD 3.98Å
230	G	98.6	Very high	95.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-40.2	175.2	0	0	0	0	0	113	I226 W227 S228 A234 L316	I226-G230 PolarHBondContact O-N 3.19Å; W227-G230 PolarHBondContact O-N 3.05Å; S228-G230 VanDerWaalsContact C-N 3.34Å; S228-G230 PolarHBondContact O-N 3.39Å; G230-A234 VanDerWaalsContact O-CB 3.29Å; G230-A234 WeakPolarHBondContact O-CB 3.45Å; G230-A234 PolarHBondContact O-N 3.35Å; G230-L316 WeakPolarHBondContact O-CD2 3.28Å
231	C	98.6	Very high	96.1	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.014	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-40	175.1	-67	0	0	0	0	112	Y209 W227 S228 V229 A234 E235	Y209-C231 HydrophobicContact CD1-CB 3.7Å; Y209-C231 HydrophobicContact CE1-CB 4.48Å; W227-C231 PolarHBondContact NE1-SG 3.31Å; W227-C231 PolarHBondContact O-N 2.89Å; W227-C231 PolarHBondContact O-SG 3.1Å; S228-C231 PolarHBondContact O-N 2.81Å; V229-C231 VanDerWaalsContact C-N 3.34Å; V229-C231 PolarHBondContact O-N 3.24Å; C231-A234 PolarHBondContact O-N 3.15Å; C231-E235 WeakPolarHBondContact O-CB 3.4Å; C231-E235 PolarHBondContact O-N 3.39Å
232	I	98.2	Very high	96.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.5	-46.3	176.5	-68.4	163.1	0	0	0	110.3	L133 M153 P172 I175 Y209 S228 V229 A234 E235 M236	L133-I232 HydrophobicContact CD2-CG2 3.35Å; M153-I232 HydrophobicContact CE-CG2 4.35Å; M153-I232 HydrophobicContact SD-CG2 4.23Å; P172-I232 HydrophobicContact CG-CG1 4.16Å; I175-I232 HydrophobicContact CD1-CD1 3.73Å; Y209-I232 HydrophobicContact CD1-CG1 3.84Å; Y209-I232 HydrophobicContact CE1-CG1 4.09Å; S228-I232 WeakPolarHBondContact O-CD1 3.49Å; S228-I232 VanDerWaalsContact O-CG1 3.26Å; S228-I232 WeakPolarHBondContact O-CG1 3.42Å; S228-I232 PolarHBondContact O-N 2.93Å; V229-I232 PolarHBondContact O-N 3.12Å; I232-A234 VanDerWaalsContact C-N 3.34Å; I232-A234 PolarHBondContact O-N 2.91Å; I232-E235 PolarHBondContact O-N 3.29Å; I232-M236 HydrophobicContact CG2-CE 4.12Å; I232-M236 HydrophobicContact CG2-SD 4.42Å; I232-M236 WeakPolarHBondContact O-CG 3.49Å; I232-M236 PolarHBondContact O-N 3.16Å
233	L	98.2	Very high	97	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.4	-46.1	174.6	176.8	59	0	0	0	111.6	L146 L150 V229 E235 M236 V237 L315 L316	L146-L233 HydrophobicContact CD1-CD1 4.38Å; L146-L233 HydrophobicContact CD2-CD1 3.21Å; L146-L233 HydrophobicContact CG-CD1 4.16Å; L150-L233 HydrophobicContact CD1-CB 4.01Å; L150-L233 HydrophobicContact CD1-CD1 4.38Å; L150-L233 HydrophobicContact CD2-CD1 4.37Å; L150-L233 HydrophobicContact CD2-CD2 3.78Å; L150-L233 HydrophobicContact CD2-CG 4.48Å; V229-L233 WeakPolarHBondContact O-CB 3.28Å; V229-L233 PolarHBondContact O-N 2.76Å; L233-E235 VanDerWaalsContact C-N 3.27Å; L233-E235 PolarHBondContact O-N 3.2Å; L233-M236 HydrophobicContact CB-CE 4.35Å; L233-M236 HydrophobicContact CD1-CE 4.08Å; L233-M236 PolarHBondContact O-N 3.13Å; L233-V237 HydrophobicContact CD1-CG2 4.34Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 3.24Å; L233-L315 HydrophobicContact CD2-CD2 4.5Å; L233-L316 HydrophobicContact CB-CD2 3.98Å; L233-L316 HydrophobicContact CD2-CD1 4.42Å; L233-L316 HydrophobicContact CD2-CD2 3.72Å; L233-L316 HydrophobicContact CD2-CG 3.6Å; L233-L316 HydrophobicContact CG-CD1 4.33Å; L233-L316 HydrophobicContact CG-CD2 3.67Å; L233-L316 HydrophobicContact CG-CG 3.89Å
234	A	98.1	Very high	97	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.3	-39.5	177.3	0	0	0	0	0	112.1	G230 C231 I232 V237 R238 L242 F293 L316 L320	G230-A234 VanDerWaalsContact O-CB 3.29Å; G230-A234 WeakPolarHBondContact O-CB 3.45Å; G230-A234 PolarHBondContact O-N 3.35Å; C231-A234 PolarHBondContact O-N 3.15Å; I232-A234 VanDerWaalsContact C-N 3.34Å; I232-A234 PolarHBondContact O-N 2.91Å; A234-V237 PolarHBondContact O-N 3.47Å; A234-R238 VanDerWaalsContact O-CB 3.25Å; A234-R238 WeakPolarHBondContact O-CB 3.5Å; A234-R238 WeakPolarHBondContact O-CG 3.28Å; A234-R238 PolarHBondContact O-N 3.33Å; A234-L242 HydrophobicContact CB-CB 4.22Å; A234-L242 HydrophobicContact CB-CD2 3.66Å; A234-L242 HydrophobicContact CB-CG 4.37Å; A234-F293 HydrophobicContact CB-CE1 3.52Å; A234-F293 HydrophobicContact CB-CZ 3.56Å; A234-L316 HydrophobicContact CB-CD2 3.94Å; A234-L320 HydrophobicContact CB-CD1 4.18Å
235	E	97.6	Very high	96.9	Very high	15 Å²	15	21.3 Å²	21.3	7%	0.07	10%	0.101	C	C	.	.	H	α-helix	trans	-71.5	-37.6	177.6	-175.4	171.6	173	0	0	112.5	I137 Y209 C231 I232 L233 V237 R238 H239 I241	I137-E235 HydrophobicContact CD1-CB 4.47Å; I137-E235 HydrophobicContact CD1-CG 3.99Å; I137-E235 HydrophobicContact CG1-CG 4.48Å; I137-E235 HydrophobicContact CG2-CG 3.72Å; Y209-E235 WeakPolarHBondContact CE1-OE2 3.39Å; Y209-E235 PolarHBondContact OH-OE1 3.35Å; Y209-E235 PolarHBondContact OH-OE2 2.92Å; C231-E235 WeakPolarHBondContact O-CB 3.4Å; C231-E235 PolarHBondContact O-N 3.39Å; I232-E235 PolarHBondContact O-N 3.29Å; L233-E235 VanDerWaalsContact C-N 3.27Å; L233-E235 PolarHBondContact O-N 3.2Å; E235-V237 VanDerWaalsContact C-N 3.27Å; E235-V237 PolarHBondContact O-N 3.19Å; E235-R238 PolarHBondContact O-N 3.07Å; E235-H239 VanDerWaalsContact O-CA 3.23Å; E235-H239 WeakPolarHBondContact O-CA 3.25Å; E235-H239 PolarHBondContact O-N 2.97Å; E235-I241 WeakPolarHBondContact OE1-CG1 3.4Å
236	M	96	Very high	96.6	Very high	7 Å²	7	30.5 Å²	30.5	3%	0.034	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-35.9	172.8	-72.4	-173.9	-60.4	0	0	112	L133 I137 L146 L150 M153 I232 L233	L133-M236 HydrophobicContact CD1-SD 4.33Å; L133-M236 HydrophobicContact CD2-SD 4.42Å; I137-M236 HydrophobicContact CD1-CG 4.43Å; I137-M236 HydrophobicContact CG1-CG 3.6Å; L146-M236 HydrophobicContact CG-CE 4.42Å; L150-M236 HydrophobicContact CD1-CE 3.92Å; M153-M236 HydrophobicContact CE-CE 4.04Å; M153-M236 HydrophobicContact CE-SD 4.46Å; I232-M236 HydrophobicContact CG2-CE 4.12Å; I232-M236 HydrophobicContact CG2-SD 4.42Å; I232-M236 WeakPolarHBondContact O-CG 3.49Å; I232-M236 PolarHBondContact O-N 3.16Å; L233-M236 HydrophobicContact CB-CE 4.35Å; L233-M236 HydrophobicContact CD1-CE 4.08Å; L233-M236 PolarHBondContact O-N 3.13Å
237	V	95.4	Very high	96.1	Very high	5 Å²	5	34 Å²	34	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-79.2	-37.7	177.6	172.8	0	0	0	0	112.1	L146 L233 A234 E235 F293 L297 F298	L146-V237 HydrophobicContact CD1-CG2 4.03Å; L233-V237 HydrophobicContact CD1-CG2 4.34Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 3.24Å; A234-V237 PolarHBondContact O-N 3.47Å; E235-V237 VanDerWaalsContact C-N 3.27Å; E235-V237 PolarHBondContact O-N 3.19Å; V237-F293 HydrophobicContact CG1-CD1 4.12Å; V237-L297 HydrophobicContact CG1-CB 3.8Å; V237-L297 HydrophobicContact CG1-CD1 4.43Å; V237-F298 HydrophobicContact CB-CE1 4.3Å; V237-F298 HydrophobicContact CG1-CD1 4.12Å; V237-F298 HydrophobicContact CG1-CE1 3.64Å; V237-F298 HydrophobicContact CG1-CE2 4.1Å; V237-F298 HydrophobicContact CG1-CZ 3.64Å; V237-F298 HydrophobicContact CG2-CD1 4.27Å; V237-F298 HydrophobicContact CG2-CE1 3.58Å; V237-F298 HydrophobicContact CG2-CZ 4.18Å
238	R	95.2	Very high	95.5	Very high	78 Å²	78	36.9 Å²	36.9	29%	0.294	17%	0.166	S	C	.	.	H	α-helix	trans	-93	-10.9	-174	-65.4	-176.2	68.1	165	5.9	114.1	A234 E235 K240 F293 L297	A234-R238 VanDerWaalsContact O-CB 3.25Å; A234-R238 WeakPolarHBondContact O-CB 3.5Å; A234-R238 WeakPolarHBondContact O-CG 3.28Å; A234-R238 PolarHBondContact O-N 3.33Å; E235-R238 PolarHBondContact O-N 3.07Å; R238-K240 PolarHBondContact O-N 3.3Å; R238-F293 HydrophobicContact CG-CD1 3.91Å; R238-F293 HydrophobicContact CG-CE1 3.84Å; R238-L297 HydrophobicContact CG-CD1 3.89Å
239	H	95.3	Very high	95.1	Very high	78 Å²	78	40.8 Å²	40.8	36%	0.361	19%	0.185	S	C	.	.	S	Bend	trans	50.7	22.9	-166.3	-54.2	-67.4	0	0	0	113.6	I137 M139 E235	I137-H239 PolarHBondContact O-ND1 2.87Å; M139-H239 PolarHBondContact O-CE1 3.37Å; E235-H239 VanDerWaalsContact O-CA 3.23Å; E235-H239 WeakPolarHBondContact O-CA 3.25Å; E235-H239 PolarHBondContact O-N 2.97Å
240	K	95.2	Very high	94.8	Very high	140 Å²	140	41.5 Å²	41.5	61%	0.609	19%	0.189	S	C	*	.	S	Bend	trans	-149.6	135.2	-174.5	-174.3	174.6	-179.2	174.4	0	110.5	R238 L242	R238-K240 PolarHBondContact O-N 3.3Å; K240-L242 PolarHBondContact O-N 3.17Å
241	I	96.7	Very high	94.5	Very high	51 Å²	51	41.5 Å²	41.5	26%	0.262	19%	0.189	S	C	.	.			trans	-50.8	125.6	174	-63.6	162.7	0	0	0	109.9	Y208 E235 P244	Y208-I241 HydrophobicContact CD2-CD1 3.73Å; Y208-I241 HydrophobicContact CD2-CG1 4.37Å; Y208-I241 HydrophobicContact CD2-CG2 3.77Å; Y208-I241 HydrophobicContact CE2-CD1 3.79Å; Y208-I241 HydrophobicContact CG-CG2 3.78Å; E235-I241 WeakPolarHBondContact OE1-CG1 3.4Å; I241-P244 HydrophobicContact CB-CB 4.5Å; I241-P244 HydrophobicContact CG2-CB 4.02Å
242	L	97.5	Very high	94.3	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.079	19%	0.189	C	C	.	.	S	Bend	trans	-69.2	-42.6	-176.2	-176.8	60.7	0	0	0	112.5	A234 K240 F293 L320	A234-L242 HydrophobicContact CB-CB 4.22Å; A234-L242 HydrophobicContact CB-CD2 3.66Å; A234-L242 HydrophobicContact CB-CG 4.37Å; K240-L242 PolarHBondContact O-N 3.17Å; L242-F293 HydrophobicContact CD1-CZ 4.44Å; L242-F293 HydrophobicContact CD2-CZ 4.42Å; L242-L320 HydrophobicContact CD2-CD1 3.55Å; L242-L320 HydrophobicContact CD2-CD2 4.23Å
243	F	97.5	Very high	94.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.197	C	C	.	.			trans	-128.1	78.2	-175.4	-50.6	-60.2	0	0	0	112.1	Y208 W227 G245 Q251 K254 V255 Q258 L259 L320	Y208-F243 VanDerWaalsContact CD1-O 3.26Å; Y208-F243 WeakPolarHBondContact CD1-O 3.48Å; W227-F243 HydrophobicContact CH2-CE2 4.07Å; W227-F243 HydrophobicContact CH2-CZ 4.29Å; W227-F243 HydrophobicContact CZ2-CD2 4.07Å; W227-F243 AromaticContact CZ2-CE2 3.51Å; W227-F243 HydrophobicContact CZ2-CE2 3.51Å; W227-F243 HydrophobicContact CZ2-CZ 4.15Å; F243-G245 PolarHBondContact O-N 2.9Å; F243-G245 VanDerWaalsContact O-N 3.13Å; F243-Q251 PolarHBondContact O-NE2 2.76Å; F243-Q251 PolarHBondContact O-OE1 3.22Å; F243-K254 HydrophobicContact CB-CB 4.26Å; F243-K254 HydrophobicContact CD1-CB 4.42Å; F243-K254 WeakPolarHBondContact CD1-O 3.15Å; F243-V255 HydrophobicContact CB-CG2 4.34Å; F243-V255 HydrophobicContact CD1-CB 4.48Å; F243-V255 HydrophobicContact CD1-CG2 3.93Å; F243-V255 HydrophobicContact CD2-CG2 4.09Å; F243-V255 HydrophobicContact CE1-CB 4.47Å; F243-V255 HydrophobicContact CE1-CG2 4.2Å; F243-V255 HydrophobicContact CE2-CG2 4.34Å; F243-V255 HydrophobicContact CG-CG2 3.87Å; F243-V255 HydrophobicContact CZ-CG2 4.39Å; F243-Q258 HydrophobicContact CD1-CG 4.46Å; F243-Q258 HydrophobicContact CE1-CB 4.02Å; F243-Q258 HydrophobicContact CE1-CG 4.15Å; F243-L259 HydrophobicContact CE1-CG 4.47Å; F243-L259 HydrophobicContact CZ-CD1 3.97Å; F243-L259 HydrophobicContact CZ-CG 4.18Å; F243-L320 HydrophobicContact CE2-CD2 4.27Å
244	P	95.6	Very high	94	Very high	54 Å²	54	46 Å²	46	35%	0.351	21%	0.21	S	C	.	.			trans	-86.2	75.1	-176.8	34.2	-35.2	0	0	0	112.3	Y208 I241	Y208-P244 HydrophobicContact CE1-CB 4.47Å; I241-P244 HydrophobicContact CB-CB 4.5Å; I241-P244 HydrophobicContact CG2-CB 4.02Å
245	G	93	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.21	C	C	.	.			trans	-87.6	130.4	180	0	0	0	0	0	114.9	R207 Y208 F243 D247 Q251	R207-G245 PolarHBondContact NH1-O 3.37Å; Y208-G245 WeakPolarHBondContact CE1-O 3.41Å; F243-G245 PolarHBondContact O-N 2.9Å; F243-G245 VanDerWaalsContact O-N 3.13Å; G245-D247 VanDerWaalsContact C-N 3.32Å; G245-D247 PolarHBondContact O-N 3.07Å; G245-Q251 VanDerWaalsContact CA-OE1 3.25Å
246	R	89	Confident	93.9	Very high	193 Å²	193	45.4 Å²	45.4	73%	0.728	21%	0.207	S	C	*	.	S	Bend	trans	-65.7	-32	179.3	-67.7	169.2	-69.1	166.8	2.8	113.7	R207 D250	R207-R246 PolarHBondContact NH1-O 3.33Å; R246-D250 HydrophobicContact CB-CB 4.35Å; R246-D250 WeakPolarHBondContact CB-OD2 3.47Å; R246-D250 WeakPolarHBondContact CG-OD2 3.35Å; R246-D250 IonicContact CZ-OD1 3.86Å; R246-D250 IonicContact CZ-OD2 3.73Å; R246-D250 PolarHBondContact N-OD2 3.31Å; R246-D250 IonicContact NE-OD1 3.78Å; R246-D250 IonicContact NE-OD2 2.91Å; R246-D250 PolarHBondContact NE-OD2 2.98Å; R246-D250 IonicContact NH2-OD1 3.03Å; R246-D250 PolarHBondContact NH2-OD1 3.14Å; R246-D250 IonicContact NH2-OD2 3.64Å
247	D	87.4	Confident	93.9	Very high	72 Å²	72	47.6 Å²	47.6	39%	0.385	22%	0.217	S	C	.	.	S	Bend	trans	-146.1	-174.6	175.6	57.8	44.4	0	0	0	109.9	R207 G245 I249 D250 Q251	R207-D247 WeakPolarHBondContact CD-O 3.47Å; G245-D247 VanDerWaalsContact C-N 3.32Å; G245-D247 PolarHBondContact O-N 3.07Å; D247-I249 VanDerWaalsContact C-N 3.28Å; D247-I249 PolarHBondContact O-N 3.33Å; D247-I249 WeakPolarHBondContact OD1-CA 3.33Å; D247-I249 VanDerWaalsContact OD1-CB 3.29Å; D247-I249 WeakPolarHBondContact OD1-CB 3.5Å; D247-I249 PolarHBondContact OD1-N 2.93Å; D247-D250 WeakPolarHBondContact OD1-CB 3.49Å; D247-D250 PolarHBondContact OD1-N 2.85Å; D247-Q251 WeakPolarHBondContact O-CB 3.1Å; D247-Q251 PolarHBondContact O-N 3.43Å
248	Y	87.4	Confident	94	Very high	61 Å²	61	49.4 Å²	49.4	24%	0.239	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-31.6	-179.1	-68.7	-73.7	0	0	0	113.5	P202 R210 I215 W252	P202-Y248 HydrophobicContact CB-CE2 3.86Å; R210-Y248 PolarHBondContact NH1-OH 3.01Å; I215-Y248 HydrophobicContact CB-CD1 4.4Å; I215-Y248 HydrophobicContact CG1-CD1 4.3Å; I215-Y248 HydrophobicContact CG2-CD1 4.06Å; Y248-W252 PolarHBondContact O-N 3.01Å; Y248-W252 VanDerWaalsContact O-N 3.08Å
249	I	88.3	Confident	94.1	Very high	84 Å²	84	47.3 Å²	47.3	43%	0.431	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-51.8	179.4	-77.7	175.3	0	0	0	109.5	D247 Q251 W252 N253 Y277	D247-I249 VanDerWaalsContact C-N 3.28Å; D247-I249 PolarHBondContact O-N 3.33Å; D247-I249 WeakPolarHBondContact OD1-CA 3.33Å; D247-I249 VanDerWaalsContact OD1-CB 3.29Å; D247-I249 WeakPolarHBondContact OD1-CB 3.5Å; D247-I249 PolarHBondContact OD1-N 2.93Å; I249-Q251 VanDerWaalsContact C-N 3.29Å; I249-Q251 PolarHBondContact O-N 3.28Å; I249-W252 PolarHBondContact O-N 3.47Å; I249-N253 PolarHBondContact O-N 3.22Å; I249-N253 PolarHBondContact O-ND2 3.01Å; I249-Y277 WeakPolarHBondContact CB-OH 3.46Å; I249-Y277 HydrophobicContact CD1-CE2 3.88Å; I249-Y277 HydrophobicContact CG1-CE1 4.47Å; I249-Y277 HydrophobicContact CG1-CE2 3.97Å; I249-Y277 VanDerWaalsContact CG1-OH 3.3Å; I249-Y277 WeakPolarHBondContact CG1-OH 3.42Å; I249-Y277 WeakPolarHBondContact CG2-OH 3.4Å
250	D	91.6	Very high	94.2	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-39.1	178.2	-162.4	52.5	0	0	0	110.4	R246 D247 W252 N253 K254	R246-D250 HydrophobicContact CB-CB 4.35Å; R246-D250 WeakPolarHBondContact CB-OD2 3.47Å; R246-D250 WeakPolarHBondContact CG-OD2 3.35Å; R246-D250 IonicContact CZ-OD1 3.86Å; R246-D250 IonicContact CZ-OD2 3.73Å; R246-D250 PolarHBondContact N-OD2 3.31Å; R246-D250 IonicContact NE-OD1 3.78Å; R246-D250 IonicContact NE-OD2 2.91Å; R246-D250 PolarHBondContact NE-OD2 2.98Å; R246-D250 IonicContact NH2-OD1 3.03Å; R246-D250 PolarHBondContact NH2-OD1 3.14Å; R246-D250 IonicContact NH2-OD2 3.64Å; D247-D250 WeakPolarHBondContact OD1-CB 3.49Å; D247-D250 PolarHBondContact OD1-N 2.85Å; D250-W252 PolarHBondContact O-N 3.4Å; D250-N253 PolarHBondContact O-N 2.78Å; D250-K254 WeakPolarHBondContact O-CG 3.43Å; D250-K254 PolarHBondContact O-N 2.82Å
251	Q	93.9	Very high	94.2	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-48	174.2	-173.1	67.2	30.5	0	0	111.9	R207 Y208 I215 F243 G245 D247 I249 N253 K254 V255	R207-Q251 HydrophobicContact CG-CB 4.42Å; R207-Q251 HydrophobicContact CG-CG 4.23Å; Y208-Q251 PolarHBondContact O-NE2 3.34Å; I215-Q251 HydrophobicContact CD1-CB 4.46Å; I215-Q251 HydrophobicContact CD1-CG 3.45Å; I215-Q251 VanDerWaalsContact CD1-CG 3.45Å; I215-Q251 HydrophobicContact CG1-CG 4.33Å; F243-Q251 PolarHBondContact O-NE2 2.76Å; F243-Q251 PolarHBondContact O-OE1 3.22Å; G245-Q251 VanDerWaalsContact CA-OE1 3.25Å; D247-Q251 WeakPolarHBondContact O-CB 3.1Å; D247-Q251 PolarHBondContact O-N 3.43Å; I249-Q251 VanDerWaalsContact C-N 3.29Å; I249-Q251 PolarHBondContact O-N 3.28Å; Q251-N253 VanDerWaalsContact C-N 3.35Å; Q251-N253 PolarHBondContact O-N 2.95Å; Q251-K254 PolarHBondContact O-N 3.29Å; Q251-V255 WeakPolarHBondContact O-CG2 3.44Å; Q251-V255 PolarHBondContact O-N 2.87Å; Q251-V255 VanDerWaalsContact O-N 3.14Å
252	W	93.7	Very high	94	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-43.8	176.7	174.9	-110	0	0	0	111.9	P212 L216 Y248 I249 D250 K254 V255 I256 P262 F266 V278 I322	P212-W252 HydrophobicContact CB-CZ3 4.03Å; L216-W252 HydrophobicContact CD1-CD2 4.48Å; L216-W252 HydrophobicContact CD1-CE3 4Å; L216-W252 HydrophobicContact CD1-CH2 3.92Å; L216-W252 HydrophobicContact CD1-CZ2 4.4Å; L216-W252 HydrophobicContact CD1-CZ3 3.73Å; L216-W252 HydrophobicContact CD2-CD2 4.08Å; L216-W252 HydrophobicContact CD2-CE3 4.17Å; L216-W252 HydrophobicContact CD2-CG 4.37Å; L216-W252 HydrophobicContact CG-CE3 4.27Å; L216-W252 HydrophobicContact CG-CZ3 4.47Å; Y248-W252 PolarHBondContact O-N 3.01Å; Y248-W252 VanDerWaalsContact O-N 3.08Å; I249-W252 PolarHBondContact O-N 3.47Å; D250-W252 PolarHBondContact O-N 3.4Å; W252-K254 VanDerWaalsContact C-N 3.35Å; W252-K254 PolarHBondContact O-N 3.4Å; W252-V255 HydrophobicContact CZ3-CG1 4.42Å; W252-V255 WeakPolarHBondContact O-CB 3.44Å; W252-V255 PolarHBondContact O-N 3.45Å; W252-V255 VanDerWaalsContact O-N 3.1Å; W252-I256 HydrophobicContact CD2-CG2 4.09Å; W252-I256 HydrophobicContact CE3-CG2 4.36Å; W252-I256 HydrophobicContact CH2-CG2 3.7Å; W252-I256 HydrophobicContact CZ2-CG2 3.37Å; W252-I256 HydrophobicContact CZ3-CG2 4.15Å; W252-I256 PolarHBondContact O-N 3.02Å; W252-P262 HydrophobicContact CH2-CG 3.97Å; W252-P262 HydrophobicContact CZ2-CG 4.12Å; W252-F266 HydrophobicContact CH2-CE1 4.19Å; W252-V278 HydrophobicContact CZ2-CG1 3.64Å; W252-V278 HydrophobicContact CZ2-CG2 4.21Å; W252-I322 HydrophobicContact CH2-CG2 4.03Å; W252-I322 HydrophobicContact CZ3-CG2 4.17Å
253	N	93.6	Very high	93.8	Very high	29 Å²	29	39.1 Å²	39.1	16%	0.155	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-45.9	176.6	-68.2	-23.2	0	0	0	111.4	I249 D250 Q251 V255 I256 E257	I249-N253 PolarHBondContact O-N 3.22Å; I249-N253 PolarHBondContact O-ND2 3.01Å; D250-N253 PolarHBondContact O-N 2.78Å; Q251-N253 VanDerWaalsContact C-N 3.35Å; Q251-N253 PolarHBondContact O-N 2.95Å; N253-V255 PolarHBondContact O-N 2.64Å; N253-I256 WeakPolarHBondContact O-CG1 3.14Å; N253-I256 PolarHBondContact O-N 2.91Å; N253-E257 VanDerWaalsContact O-CB 3.28Å; N253-E257 WeakPolarHBondContact O-CB 3.32Å; N253-E257 WeakPolarHBondContact O-CG 3.34Å; N253-E257 PolarHBondContact O-N 3.45Å
254	K	96.4	Very high	93.5	Very high	64 Å²	64	42.6 Å²	42.6	28%	0.278	21%	0.21	S	C	.	.	H	α-helix	trans	-58.9	-35.5	175.9	-65.4	-55.4	171.2	-159.2	0	112.9	F243 D250 Q251 W252 E257 Q258	F243-K254 HydrophobicContact CB-CB 4.26Å; F243-K254 HydrophobicContact CD1-CB 4.42Å; F243-K254 WeakPolarHBondContact CD1-O 3.15Å; D250-K254 WeakPolarHBondContact O-CG 3.43Å; D250-K254 PolarHBondContact O-N 2.82Å; Q251-K254 PolarHBondContact O-N 3.29Å; W252-K254 VanDerWaalsContact C-N 3.35Å; W252-K254 PolarHBondContact O-N 3.4Å; K254-E257 IonicContact NZ-OE2 3.49Å; K254-E257 PolarHBondContact NZ-OE2 3.06Å; K254-Q258 VanDerWaalsContact O-CG 3.27Å; K254-Q258 WeakPolarHBondContact O-CG 3.48Å
255	V	97.1	Very high	93.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-67.1	-53.7	177	171.1	0	0	0	0	111.2	W227 F243 Q251 W252 N253 E257 Q258 L259 I322	W227-V255 HydrophobicContact CH2-CG1 3.77Å; W227-V255 HydrophobicContact CH2-CG2 4.41Å; W227-V255 HydrophobicContact CZ2-CG1 4.16Å; W227-V255 HydrophobicContact CZ2-CG2 3.97Å; F243-V255 HydrophobicContact CB-CG2 4.34Å; F243-V255 HydrophobicContact CD1-CB 4.48Å; F243-V255 HydrophobicContact CD1-CG2 3.93Å; F243-V255 HydrophobicContact CD2-CG2 4.09Å; F243-V255 HydrophobicContact CE1-CB 4.47Å; F243-V255 HydrophobicContact CE1-CG2 4.2Å; F243-V255 HydrophobicContact CE2-CG2 4.34Å; F243-V255 HydrophobicContact CG-CG2 3.87Å; F243-V255 HydrophobicContact CZ-CG2 4.39Å; Q251-V255 WeakPolarHBondContact O-CG2 3.44Å; Q251-V255 PolarHBondContact O-N 2.87Å; Q251-V255 VanDerWaalsContact O-N 3.14Å; W252-V255 HydrophobicContact CZ3-CG1 4.42Å; W252-V255 WeakPolarHBondContact O-CB 3.44Å; W252-V255 PolarHBondContact O-N 3.45Å; W252-V255 VanDerWaalsContact O-N 3.1Å; N253-V255 PolarHBondContact O-N 2.64Å; V255-E257 PolarHBondContact O-N 3.16Å; V255-Q258 PolarHBondContact O-N 3.49Å; V255-L259 HydrophobicContact CG1-CD1 4.2Å; V255-L259 PolarHBondContact O-N 3.42Å; V255-I322 HydrophobicContact CG1-CD1 3.95Å; V255-I322 HydrophobicContact CG1-CG1 4Å
256	I	95.9	Very high	93.4	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-72.4	-28.5	-175.7	62.5	174.3	0	0	0	113.3	W252 N253 Q258 G260 R281 Y284 I322	W252-I256 HydrophobicContact CD2-CG2 4.09Å; W252-I256 HydrophobicContact CE3-CG2 4.36Å; W252-I256 HydrophobicContact CH2-CG2 3.7Å; W252-I256 HydrophobicContact CZ2-CG2 3.37Å; W252-I256 HydrophobicContact CZ3-CG2 4.15Å; W252-I256 PolarHBondContact O-N 3.02Å; N253-I256 WeakPolarHBondContact O-CG1 3.14Å; N253-I256 PolarHBondContact O-N 2.91Å; I256-Q258 PolarHBondContact O-N 3.49Å; I256-G260 CarbonylContact O-C 3.44Å; I256-G260 WeakPolarHBondContact O-CA 3.5Å; I256-G260 PolarHBondContact O-N 3.29Å; I256-R281 HydrophobicContact CD1-CB 4.32Å; I256-Y284 HydrophobicContact CB-CD2 4.39Å; I256-Y284 HydrophobicContact CD1-CD2 3.93Å; I256-Y284 HydrophobicContact CD1-CE2 4.06Å; I256-Y284 HydrophobicContact CG1-CD2 3.86Å; I256-Y284 HydrophobicContact CG1-CE2 4.16Å; I256-Y284 VanDerWaalsContact O-CB 3.26Å; I256-Y284 WeakPolarHBondContact O-CB 3.45Å; I256-I322 HydrophobicContact CG2-CD1 4.37Å
257	E	96.4	Very high	93.5	Very high	53 Å²	53	36.6 Å²	36.6	25%	0.248	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-32.1	173.1	-79.8	168.3	-163.2	0	0	111.7	N253 K254 V255 Y284 Y287	N253-E257 VanDerWaalsContact O-CB 3.28Å; N253-E257 WeakPolarHBondContact O-CB 3.32Å; N253-E257 WeakPolarHBondContact O-CG 3.34Å; N253-E257 PolarHBondContact O-N 3.45Å; K254-E257 IonicContact NZ-OE2 3.49Å; K254-E257 PolarHBondContact NZ-OE2 3.06Å; V255-E257 PolarHBondContact O-N 3.16Å; E257-Y284 HydrophobicContact CG-CD1 4.42Å; E257-Y284 HydrophobicContact CG-CD2 4.41Å; E257-Y284 HydrophobicContact CG-CE1 4Å; E257-Y284 HydrophobicContact CG-CE2 3.96Å; E257-Y287 WeakPolarHBondContact O-CE2 3.26Å
258	Q	97.7	Very high	93.7	Very high	43 Å²	43	38.3 Å²	38.3	20%	0.201	20%	0.196	C	C	.	.	H	α-helix	trans	-94.8	-46.6	-178	-58.4	-63.1	-50	0	0	112.4	F243 K254 V255 I256 G286 Y287 L292	F243-Q258 HydrophobicContact CD1-CG 4.46Å; F243-Q258 HydrophobicContact CE1-CB 4.02Å; F243-Q258 HydrophobicContact CE1-CG 4.15Å; K254-Q258 VanDerWaalsContact O-CG 3.27Å; K254-Q258 WeakPolarHBondContact O-CG 3.48Å; V255-Q258 PolarHBondContact O-N 3.49Å; I256-Q258 PolarHBondContact O-N 3.49Å; Q258-G286 WeakPolarHBondContact O-CA 3Å; Q258-Y287 PolarHBondContact O-N 2.95Å; Q258-L292 HydrophobicContact CB-CD2 4.22Å
259	L	97.9	Very high	93.9	Very high	34 Å²	34	40.3 Å²	40.3	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-98	-7.8	-172.4	-57.8	-176.7	0	0	0	114	W227 F243 V255 F289 L292 L320 I322	W227-L259 HydrophobicContact CH2-CD1 3.57Å; W227-L259 HydrophobicContact CZ3-CD1 3.93Å; F243-L259 HydrophobicContact CE1-CG 4.47Å; F243-L259 HydrophobicContact CZ-CD1 3.97Å; F243-L259 HydrophobicContact CZ-CG 4.18Å; V255-L259 HydrophobicContact CG1-CD1 4.2Å; V255-L259 PolarHBondContact O-N 3.42Å; L259-F289 HydrophobicContact CD2-CE2 4.45Å; L259-F289 HydrophobicContact CD2-CZ 3.97Å; L259-L292 HydrophobicContact CD2-CD1 4Å; L259-L320 HydrophobicContact CD1-CB 4.42Å; L259-L320 WeakPolarHBondContact CD1-O 3.22Å; L259-I322 HydrophobicContact CB-CD1 4.18Å; L259-I322 HydrophobicContact CB-CG1 4.47Å; L259-I322 HydrophobicContact CD1-CG1 4.13Å
260	G	96.4	Very high	94	Very high	5 Å²	5	36.5 Å²	36.5	5%	0.052	19%	0.187	C	C	.	.			trans	89.9	163	-177	0	0	0	0	0	113.7	I256 Y284 G286 I322	I256-G260 CarbonylContact O-C 3.44Å; I256-G260 WeakPolarHBondContact O-CA 3.5Å; I256-G260 PolarHBondContact O-N 3.29Å; G260-Y284 CarbonylContact C-O 3.55Å; G260-Y284 VanDerWaalsContact CA-O 3.25Å; G260-Y284 WeakPolarHBondContact CA-O 3.43Å; G260-G286 VanDerWaalsContact N-CA 3.32Å; G260-I322 WeakPolarHBondContact O-CD1 3.39Å
261	T	94.7	Very high	93.8	Very high	38 Å²	38	39.6 Å²	39.6	23%	0.233	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-71	129.3	175.1	-57.3	0	0	0	0	109.5	R283 Y284	T261-R283 HydrophobicContact CG2-CG 4.41Å; T261-R283 WeakPolarHBondContact OG1-CA 3.18Å; T261-Y284 PolarHBondContact N-O 2.83Å; T261-Y284 PolarHBondContact OG1-N 2.91Å
262	P	93.6	Very high	93.5	Very high	20 Å²	20	46.6 Å²	46.6	13%	0.13	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.9	163.4	-177.5	30.5	-38.8	0	0	0	112.6	W252 F266 L267 I322	W252-P262 HydrophobicContact CH2-CG 3.97Å; W252-P262 HydrophobicContact CZ2-CG 4.12Å; P262-F266 HydrophobicContact CB-CB 4.05Å; P262-F266 HydrophobicContact CB-CD1 3.5Å; P262-F266 HydrophobicContact CB-CE1 4.18Å; P262-F266 HydrophobicContact CB-CG 3.9Å; P262-F266 HydrophobicContact CG-CD1 3.46Å; P262-F266 VanDerWaalsContact CG-CD1 3.46Å; P262-F266 HydrophobicContact CG-CE1 3.85Å; P262-F266 HydrophobicContact CG-CG 4.35Å; P262-L267 HydrophobicContact CG-CD2 4Å; P262-I322 HydrophobicContact CB-CG2 4.07Å; P262-I322 HydrophobicContact CG-CG2 4.41Å
263	S	93	Very high	93.2	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-64.6	159.2	-178.9	64.5	0	0	0	0	112.9	D265 F266 L267	S263-D265 PolarHBondContact O-N 2.86Å; S263-F266 WeakPolarHBondContact O-CB 3.4Å; S263-F266 PolarHBondContact O-N 3.23Å; S263-L267 PolarHBondContact O-N 2.91Å
264	Q	91.9	Very high	92.8	Very high	73 Å²	73	50.7 Å²	50.7	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-57.7	-36.8	177.2	-164.2	63.4	30.7	0	0	111.9	F266 L267 M268 E279	Q264-F266 PolarHBondContact O-N 2.88Å; Q264-L267 PolarHBondContact O-N 3.15Å; Q264-L267 VanDerWaalsContact O-N 3.1Å; Q264-M268 HydrophobicContact CG-CE 4.28Å; Q264-M268 HydrophobicContact CG-CG 4.5Å; Q264-M268 WeakPolarHBondContact O-CG 3.38Å; Q264-M268 PolarHBondContact O-N 3.09Å; Q264-E279 PolarHBondContact NE2-OE1 3.48Å
265	D	92.5	Very high	92.5	Very high	115 Å²	115	50.2 Å²	50.2	62%	0.615	26%	0.262	S	S	*	.	H	α-helix	trans	-57.4	-37.3	175.8	-58.5	-23	0	0	0	112.8	S263 K269	S263-D265 PolarHBondContact O-N 2.86Å; D265-K269 WeakPolarHBondContact O-CG 3.46Å
266	F	93.3	Very high	92.1	Very high	3 Å²	3	52.8 Å²	52.8	1%	0.013	28%	0.277	C	S	.	.	H	α-helix	trans	-70.7	-44.7	175.3	173.5	-91.2	0	0	0	111	L216 M218 W252 P262 S263 Q264 M268 K269 L270 I322 D323	L216-F266 HydrophobicContact CD1-CE1 4.1Å; L216-F266 HydrophobicContact CD1-CZ 4.01Å; M218-F266 HydrophobicContact CE-CD2 4.49Å; M218-F266 HydrophobicContact CE-CE2 3.88Å; M218-F266 HydrophobicContact CE-CZ 4.15Å; M218-F266 HydrophobicContact SD-CE2 3.99Å; M218-F266 HydrophobicContact SD-CZ 3.75Å; W252-F266 HydrophobicContact CH2-CE1 4.19Å; P262-F266 HydrophobicContact CB-CB 4.05Å; P262-F266 HydrophobicContact CB-CD1 3.5Å; P262-F266 HydrophobicContact CB-CE1 4.18Å; P262-F266 HydrophobicContact CB-CG 3.9Å; P262-F266 HydrophobicContact CG-CD1 3.46Å; P262-F266 VanDerWaalsContact CG-CD1 3.46Å; P262-F266 HydrophobicContact CG-CE1 3.85Å; P262-F266 HydrophobicContact CG-CG 4.35Å; S263-F266 WeakPolarHBondContact O-CB 3.4Å; S263-F266 PolarHBondContact O-N 3.23Å; Q264-F266 PolarHBondContact O-N 2.88Å; F266-M268 PolarHBondContact O-N 2.57Å; F266-K269 VanDerWaalsContact O-CB 3.31Å; F266-K269 WeakPolarHBondContact O-CB 3.34Å; F266-K269 PolarHBondContact O-N 2.98Å; F266-L270 HydrophobicContact CE1-CD1 4.39Å; F266-L270 HydrophobicContact CE1-CD2 4.27Å; F266-L270 HydrophobicContact CE1-CG 4.49Å; F266-L270 HydrophobicContact CZ-CD2 4.43Å; F266-I322 HydrophobicContact CD1-CG2 4.5Å; F266-I322 HydrophobicContact CE1-CG2 4Å; F266-I322 HydrophobicContact CE2-CG2 4.02Å; F266-I322 HydrophobicContact CZ-CG2 3.74Å; F266-D323 HydrophobicContact CD2-CB 3.82Å
267	L	91.4	Very high	91.6	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-34.8	179.1	-61.5	178	0	0	0	111.8	P262 S263 Q264 K269 L270 R275 V278 E279	P262-L267 HydrophobicContact CG-CD2 4Å; S263-L267 PolarHBondContact O-N 2.91Å; Q264-L267 PolarHBondContact O-N 3.15Å; Q264-L267 VanDerWaalsContact O-N 3.1Å; L267-K269 PolarHBondContact O-N 2.89Å; L267-L270 HydrophobicContact CD2-CD1 3.85Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 3.23Å; L267-L270 VanDerWaalsContact O-N 3.08Å; L267-R275 HydrophobicContact CB-CG 4.49Å; L267-R275 PolarHBondContact O-NE 3.02Å; L267-V278 HydrophobicContact CD2-CB 4.2Å; L267-V278 HydrophobicContact CD2-CG1 3.41Å; L267-V278 VanDerWaalsContact CD2-CG1 3.41Å; L267-E279 HydrophobicContact CD1-CG 3.94Å
268	M	91.6	Very high	91.1	Very high	108 Å²	108	53.1 Å²	53.1	53%	0.532	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-16.3	175	-69.3	-61.7	-171.3	0	0	114.1	Q264 F266 R275	Q264-M268 HydrophobicContact CG-CE 4.28Å; Q264-M268 HydrophobicContact CG-CG 4.5Å; Q264-M268 WeakPolarHBondContact O-CG 3.38Å; Q264-M268 PolarHBondContact O-N 3.09Å; F266-M268 PolarHBondContact O-N 2.57Å; M268-R275 VanDerWaalsContact C-NH2 3.3Å; M268-R275 PolarHBondContact O-NH2 3.11Å; M268-R275 PolarHBondContact SD-NH1 2.81Å
269	K	91	Very high	90.6	Very high	103 Å²	103	55 Å²	55	45%	0.448	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-15.2	173.3	-59.3	168.2	-174.1	173.3	0	112.7	M218 D265 F266 L267 D323 S325	M218-K269 HydrophobicContact CE-CB 3.79Å; D265-K269 WeakPolarHBondContact O-CG 3.46Å; F266-K269 VanDerWaalsContact O-CB 3.31Å; F266-K269 WeakPolarHBondContact O-CB 3.34Å; F266-K269 PolarHBondContact O-N 2.98Å; L267-K269 PolarHBondContact O-N 2.89Å; K269-D323 VanDerWaalsContact NZ-CG 3.34Å; K269-D323 IonicContact NZ-OD1 3.08Å; K269-D323 PolarHBondContact NZ-OD1 3.48Å; K269-D323 VanDerWaalsContact NZ-OD1 3.08Å; K269-D323 IonicContact NZ-OD2 2.8Å; K269-D323 PolarHBondContact NZ-OD2 2.85Å; K269-S325 PolarHBondContact NZ-OG 3.48Å; K269-S325 VanDerWaalsContact NZ-OG 3.17Å
270	L	89.9	Confident	90.1	Very high	5 Å²	5	59 Å²	59	3%	0.026	31%	0.308	C	S	.	.	S	Bend	trans	-76.2	152.5	179.6	-58.5	175.1	0	0	0	111.4	L216 M218 F266 L267 V274 R275 V278	L216-L270 HydrophobicContact CB-CD2 4.11Å; L216-L270 HydrophobicContact CD1-CD2 3.82Å; M218-L270 HydrophobicContact CE-CD2 3.95Å; M218-L270 HydrophobicContact CG-CD2 3.7Å; M218-L270 HydrophobicContact SD-CD2 3.36Å; M218-L270 WeakPolarHBondContact SD-CD2 3.44Å; F266-L270 HydrophobicContact CE1-CD1 4.39Å; F266-L270 HydrophobicContact CE1-CD2 4.27Å; F266-L270 HydrophobicContact CE1-CG 4.49Å; F266-L270 HydrophobicContact CZ-CD2 4.43Å; L267-L270 HydrophobicContact CD2-CD1 3.85Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 3.23Å; L267-L270 VanDerWaalsContact O-N 3.08Å; L270-V274 HydrophobicContact CD1-CG1 4.38Å; L270-V274 HydrophobicContact CD2-CG1 4.43Å; L270-R275 HydrophobicContact CB-CB 4Å; L270-R275 PolarHBondContact O-NH2 3.27Å; L270-V278 HydrophobicContact CD1-CB 4.28Å; L270-V278 HydrophobicContact CD1-CG2 4.08Å
271	N	87.9	Confident	89.7	Confident	81 Å²	81	62.7 Å²	62.7	43%	0.433	32%	0.32	S	S	.	.			trans	-63.9	161.1	167.5	71.6	21.9	0	0	0	110.6	S273 V274 R275	N271-S273 PolarHBondContact O-N 2.98Å; N271-S273 PolarHBondContact OD1-OG 3Å; N271-V274 PolarHBondContact O-N 3.14Å; N271-V274 WeakPolarHBondContact OD1-CA 3.22Å; N271-V274 WeakPolarHBondContact OD1-CB 3.48Å; N271-V274 WeakPolarHBondContact OD1-CG2 3.44Å; N271-V274 PolarHBondContact OD1-N 3.38Å; N271-R275 VanDerWaalsContact O-CB 3.23Å; N271-R275 WeakPolarHBondContact O-CB 3.41Å; N271-R275 PolarHBondContact O-N 3.4Å
272	H	87.8	Confident	89.5	Confident	148 Å²	148	64.6 Å²	64.6	69%	0.685	33%	0.333	S	S	*	.	H	α-helix	trans	-61.8	-42.8	-170.7	-173.4	62	0	0	0	113.4	R275 T276	H272-R275 PolarHBondContact O-N 3.46Å; H272-T276 WeakPolarHBondContact O-CB 3.49Å; H272-T276 PolarHBondContact O-N 2.87Å; H272-T276 PolarHBondContact O-OG1 3.44Å
273	S	86.6	Confident	89.4	Confident	85 Å²	85	73 Å²	73	59%	0.594	36%	0.362	S	S	*	.	H	α-helix	trans	-67.3	-44.2	-178.6	51.9	0	0	0	0	112.7	N271 Y277	N271-S273 PolarHBondContact O-N 2.98Å; N271-S273 PolarHBondContact OD1-OG 3Å; S273-Y277 PolarHBondContact O-N 2.68Å; S273-Y277 VanDerWaalsContact O-N 3.14Å
274	V	86.4	Confident	89.5	Confident	31 Å²	31	74.5 Å²	74.5	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-70	-39	177.5	179.3	0	0	0	0	110.4	L216 L270 N271 Y277 V278	L216-V274 HydrophobicContact CB-CG1 4.15Å; L216-V274 HydrophobicContact CD2-CG1 3.7Å; L216-V274 HydrophobicContact CG-CG1 4.44Å; L270-V274 HydrophobicContact CD1-CG1 4.38Å; L270-V274 HydrophobicContact CD2-CG1 4.43Å; N271-V274 PolarHBondContact O-N 3.14Å; N271-V274 WeakPolarHBondContact OD1-CA 3.22Å; N271-V274 WeakPolarHBondContact OD1-CB 3.48Å; N271-V274 WeakPolarHBondContact OD1-CG2 3.44Å; N271-V274 PolarHBondContact OD1-N 3.38Å; V274-Y277 WeakPolarHBondContact O-CB 3.43Å; V274-Y277 PolarHBondContact O-N 2.91Å; V274-V278 HydrophobicContact CG1-CG2 4.16Å; V274-V278 VanDerWaalsContact O-CG2 3.29Å; V274-V278 WeakPolarHBondContact O-CG2 3.25Å; V274-V278 PolarHBondContact O-N 3.05Å
275	R	89.4	Confident	89.7	Confident	54 Å²	54	76.2 Å²	76.2	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-57.7	-53.3	175.3	-173.3	-175.7	-55	169.5	7.5	111.6	L267 M268 L270 N271 H272 Y277 V278 E279	L267-R275 HydrophobicContact CB-CG 4.49Å; L267-R275 PolarHBondContact O-NE 3.02Å; M268-R275 VanDerWaalsContact C-NH2 3.3Å; M268-R275 PolarHBondContact O-NH2 3.11Å; M268-R275 PolarHBondContact SD-NH1 2.81Å; L270-R275 HydrophobicContact CB-CB 4Å; L270-R275 PolarHBondContact O-NH2 3.27Å; N271-R275 VanDerWaalsContact O-CB 3.23Å; N271-R275 WeakPolarHBondContact O-CB 3.41Å; N271-R275 PolarHBondContact O-N 3.4Å; H272-R275 PolarHBondContact O-N 3.46Å; R275-Y277 PolarHBondContact O-N 2.8Å; R275-V278 PolarHBondContact O-N 3.33Å; R275-E279 HydrophobicContact CG-CG 4.16Å; R275-E279 WeakPolarHBondContact O-CB 3.21Å; R275-E279 WeakPolarHBondContact O-CG 3.23Å; R275-E279 PolarHBondContact O-N 3.46Å
276	T	88.4	Confident	89.8	Confident	55 Å²	55	71.9 Å²	71.9	34%	0.337	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-39.1	178.7	-60.2	0	0	0	0	111.1	H272 N280	H272-T276 WeakPolarHBondContact O-CB 3.49Å; H272-T276 PolarHBondContact O-N 2.87Å; H272-T276 PolarHBondContact O-OG1 3.44Å; T276-N280 WeakPolarHBondContact O-CB 3.12Å; T276-N280 VanDerWaalsContact O-CG 3.29Å; T276-N280 PolarHBondContact O-N 3.37Å; T276-N280 PolarHBondContact O-ND2 2.51Å
277	Y	85.6	Confident	90	Very high	59 Å²	59	76.9 Å²	76.9	23%	0.231	39%	0.39	C	S	.	.	H	α-helix	trans	-62.2	-48.1	174.5	173.1	-85	0	0	0	112.3	I249 S273 V274 R275 N280 R281	I249-Y277 WeakPolarHBondContact CB-OH 3.46Å; I249-Y277 HydrophobicContact CD1-CE2 3.88Å; I249-Y277 HydrophobicContact CG1-CE1 4.47Å; I249-Y277 HydrophobicContact CG1-CE2 3.97Å; I249-Y277 VanDerWaalsContact CG1-OH 3.3Å; I249-Y277 WeakPolarHBondContact CG1-OH 3.42Å; I249-Y277 WeakPolarHBondContact CG2-OH 3.4Å; S273-Y277 PolarHBondContact O-N 2.68Å; S273-Y277 VanDerWaalsContact O-N 3.14Å; V274-Y277 WeakPolarHBondContact O-CB 3.43Å; V274-Y277 PolarHBondContact O-N 2.91Å; R275-Y277 PolarHBondContact O-N 2.8Å; Y277-N280 PolarHBondContact O-N 3.18Å; Y277-R281 PolarHBondContact OH-NE 3.25Å; Y277-R281 VanDerWaalsContact OH-NE 3.14Å; Y277-R281 PolarHBondContact OH-NH2 2.97Å
278	V	85.6	Confident	90.3	Very high	4 Å²	4	79.8 Å²	79.8	2%	0.024	41%	0.41	C	S	.	.	H	α-helix	trans	-69.4	-39.8	-177.3	174.9	0	0	0	0	111.8	L216 W252 L267 L270 V274 R275 N280 R281	L216-V278 HydrophobicContact CD2-CG2 4.22Å; W252-V278 HydrophobicContact CZ2-CG1 3.64Å; W252-V278 HydrophobicContact CZ2-CG2 4.21Å; L267-V278 HydrophobicContact CD2-CB 4.2Å; L267-V278 HydrophobicContact CD2-CG1 3.41Å; L267-V278 VanDerWaalsContact CD2-CG1 3.41Å; L270-V278 HydrophobicContact CD1-CB 4.28Å; L270-V278 HydrophobicContact CD1-CG2 4.08Å; V274-V278 HydrophobicContact CG1-CG2 4.16Å; V274-V278 VanDerWaalsContact O-CG2 3.29Å; V274-V278 WeakPolarHBondContact O-CG2 3.25Å; V274-V278 PolarHBondContact O-N 3.05Å; R275-V278 PolarHBondContact O-N 3.33Å; V278-N280 VanDerWaalsContact C-N 3.28Å; V278-N280 PolarHBondContact O-N 3.19Å; V278-R281 WeakPolarHBondContact O-CB 3.43Å; V278-R281 PolarHBondContact O-N 2.98Å
279	E	87.8	Confident	90.6	Very high	83 Å²	83	76.3 Å²	76.3	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-66.4	-29.5	179	-76.3	178.8	159.1	0	0	112.7	Q264 L267 R275 R281	Q264-E279 PolarHBondContact NE2-OE1 3.48Å; L267-E279 HydrophobicContact CD1-CG 3.94Å; R275-E279 HydrophobicContact CG-CG 4.16Å; R275-E279 WeakPolarHBondContact O-CB 3.21Å; R275-E279 WeakPolarHBondContact O-CG 3.23Å; R275-E279 PolarHBondContact O-N 3.46Å; E279-R281 PolarHBondContact O-N 3.46Å
280	N	88.1	Confident	90.9	Very high	118 Å²	118	76.7 Å²	76.7	63%	0.631	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	9.9	176.8	-73.4	-43.8	0	0	0	113.8	T276 Y277 V278	T276-N280 WeakPolarHBondContact O-CB 3.12Å; T276-N280 VanDerWaalsContact O-CG 3.29Å; T276-N280 PolarHBondContact O-N 3.37Å; T276-N280 PolarHBondContact O-ND2 2.51Å; Y277-N280 PolarHBondContact O-N 3.18Å; V278-N280 VanDerWaalsContact C-N 3.28Å; V278-N280 PolarHBondContact O-N 3.19Å
281	R	86.1	Confident	91.3	Very high	82 Å²	82	83.1 Å²	83.1	31%	0.309	42%	0.423	S	S	.	.	S	Bend	trans	-93.2	154.3	174.8	-68.3	-73.8	170.6	-107.6	12.4	111.1	I256 Y277 V278 E279 R283	I256-R281 HydrophobicContact CD1-CB 4.32Å; Y277-R281 PolarHBondContact OH-NE 3.25Å; Y277-R281 VanDerWaalsContact OH-NE 3.14Å; Y277-R281 PolarHBondContact OH-NH2 2.97Å; V278-R281 WeakPolarHBondContact O-CB 3.43Å; V278-R281 PolarHBondContact O-N 2.98Å; E279-R281 PolarHBondContact O-N 3.46Å; R281-R283 PolarHBondContact O-N 3.45Å
282	P	90.5	Very high	91.7	Very high	78 Å²	78	79.7 Å²	79.7	51%	0.506	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-52.9	137.6	171.7	-23.9	33.5	0	0	0	110.8	Y284	P282-Y284 HydrophobicContact CB-CE2 3.95Å; P282-Y284 VanDerWaalsContact O-CD2 3.23Å; P282-Y284 WeakPolarHBondContact O-CD2 3.39Å; P282-Y284 WeakPolarHBondContact O-CE2 3.38Å
283	R	92.1	Very high	92.2	Very high	196 Å²	196	72.7 Å²	72.7	74%	0.74	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-78.4	122.7	173.3	-76.1	-170.9	163.2	172	-4.1	109.5	T261 R281	T261-R283 HydrophobicContact CG2-CG 4.41Å; T261-R283 WeakPolarHBondContact OG1-CA 3.18Å; R281-R283 PolarHBondContact O-N 3.45Å
284	Y	95.2	Very high	92.6	Very high	81 Å²	81	71 Å²	71	32%	0.318	36%	0.359	S	S	.	.			trans	-107.1	135.2	176.3	-63.8	-77.5	0	0	0	109.2	I256 E257 G260 T261 P282	I256-Y284 HydrophobicContact CB-CD2 4.39Å; I256-Y284 HydrophobicContact CD1-CD2 3.93Å; I256-Y284 HydrophobicContact CD1-CE2 4.06Å; I256-Y284 HydrophobicContact CG1-CD2 3.86Å; I256-Y284 HydrophobicContact CG1-CE2 4.16Å; I256-Y284 VanDerWaalsContact O-CB 3.26Å; I256-Y284 WeakPolarHBondContact O-CB 3.45Å; E257-Y284 HydrophobicContact CG-CD1 4.42Å; E257-Y284 HydrophobicContact CG-CD2 4.41Å; E257-Y284 HydrophobicContact CG-CE1 4Å; E257-Y284 HydrophobicContact CG-CE2 3.96Å; G260-Y284 CarbonylContact C-O 3.55Å; G260-Y284 VanDerWaalsContact CA-O 3.25Å; G260-Y284 WeakPolarHBondContact CA-O 3.43Å; T261-Y284 PolarHBondContact N-O 2.83Å; T261-Y284 PolarHBondContact OG1-N 2.91Å; P282-Y284 HydrophobicContact CB-CE2 3.95Å; P282-Y284 VanDerWaalsContact O-CD2 3.23Å; P282-Y284 WeakPolarHBondContact O-CD2 3.39Å; P282-Y284 WeakPolarHBondContact O-CE2 3.38Å
285	A	95.5	Very high	92.9	Very high	109 Å²	109	74.2 Å²	74.2	90%	0.901	38%	0.375	S	S	*	.			trans	-72.5	-21.8	173	0	0	0	0	0	112.4
286	G	95.9	Very high	93.1	Very high	24 Å²	24	77.7 Å²	77.7	25%	0.247	40%	0.402	C	S	.	.			trans	78.3	174.9	-168.8	0	0	0	0	0	112.3	Q258 G260	Q258-G286 WeakPolarHBondContact O-CA 3Å; G260-G286 VanDerWaalsContact N-CA 3.32Å
287	Y	97.6	Very high	93.3	Very high	108 Å²	108	78 Å²	78	42%	0.424	40%	0.402	S	S	.	.			trans	-108.6	150.3	171.9	-60	-72.8	0	0	0	109.7	E257 Q258 K291 L292	E257-Y287 WeakPolarHBondContact O-CE2 3.26Å; Q258-Y287 PolarHBondContact O-N 2.95Å; Y287-K291 HydrophobicContact CD1-CD 3.63Å; Y287-K291 VanDerWaalsContact CD1-CE 3.46Å; Y287-K291 HydrophobicContact CD1-CG 4.26Å; Y287-K291 HydrophobicContact CE1-CD 4.32Å; Y287-K291 HydrophobicContact CG-CD 4.37Å; Y287-L292 HydrophobicContact CD2-CD2 3.97Å; Y287-L292 HydrophobicContact CG-CD2 4.28Å
288	S	98.1	Very high	93.6	Very high	63 Å²	63	75.8 Å²	75.8	44%	0.441	39%	0.393	S	S	.	.			trans	-65.9	155.8	169.7	85.4	0	0	0	0	110.6	E290 K291 L292	S288-E290 WeakPolarHBondContact CB-OE2 3.42Å; S288-E290 PolarHBondContact O-N 3.46Å; S288-E290 PolarHBondContact OG-OE2 3.22Å; S288-K291 PolarHBondContact O-N 2.95Å; S288-K291 PolarHBondContact OG-N 3.47Å; S288-L292 PolarHBondContact O-N 3.37Å
289	F	98	Very high	93.4	Very high	35 Å²	35	77.8 Å²	77.8	15%	0.154	41%	0.407	C	S	.	.	H	α-helix	trans	-66.5	-24.8	-179.9	-84.5	-98.6	0	0	0	112.4	L259 K291 L292 F293 R313 L316 S317 L320	L259-F289 HydrophobicContact CD2-CE2 4.45Å; L259-F289 HydrophobicContact CD2-CZ 3.97Å; F289-K291 VanDerWaalsContact C-N 3.3Å; F289-L292 PolarHBondContact O-N 2.75Å; F289-F293 AromaticContact CD1-CD2 3.74Å; F289-F293 HydrophobicContact CD1-CD2 3.74Å; F289-F293 AromaticContact CD1-CE2 3.61Å; F289-F293 HydrophobicContact CD1-CE2 3.61Å; F289-F293 HydrophobicContact CE1-CD2 4.43Å; F289-F293 AromaticContact CE1-CE2 3.84Å; F289-F293 HydrophobicContact CE1-CE2 3.84Å; F289-F293 WeakPolarHBondContact O-CA 3.43Å; F289-F293 WeakPolarHBondContact O-CB 3.44Å; F289-F293 PolarHBondContact O-N 3Å; F289-R313 HydrophobicContact CB-CG 3.82Å; F289-L316 HydrophobicContact CD1-CB 4.04Å; F289-L316 HydrophobicContact CE1-CB 4.1Å; F289-L316 WeakPolarHBondContact CE1-O 3.24Å; F289-S317 VanDerWaalsContact CE1-CA 3.43Å; F289-S317 VanDerWaalsContact CZ-CA 3.47Å; F289-L320 HydrophobicContact CE1-CB 4.08Å; F289-L320 HydrophobicContact CE1-CD1 4.13Å; F289-L320 HydrophobicContact CZ-CB 3.96Å
290	E	97	Very high	92.8	Very high	111 Å²	111	75.9 Å²	75.9	52%	0.519	41%	0.405	S	S	.	.	H	α-helix	trans	-66.9	-34	172	-57.7	69.7	-148.5	0	0	111.3	S288 F293 P294	S288-E290 WeakPolarHBondContact CB-OE2 3.42Å; S288-E290 PolarHBondContact O-N 3.46Å; S288-E290 PolarHBondContact OG-OE2 3.22Å; E290-F293 CarbonylContact O-C 3.4Å; E290-P294 WeakPolarHBondContact O-CA 3.48Å; E290-P294 VanDerWaalsContact O-N 3.14Å
291	K	97.3	Very high	92.5	Very high	141 Å²	141	76.8 Å²	76.8	61%	0.613	41%	0.41	S	S	*	.	H	α-helix	trans	-80	-35	176	-178.3	164.2	174.1	177.7	0	112.4	Y287 S288 F289	Y287-K291 HydrophobicContact CD1-CD 3.63Å; Y287-K291 VanDerWaalsContact CD1-CE 3.46Å; Y287-K291 HydrophobicContact CD1-CG 4.26Å; Y287-K291 HydrophobicContact CE1-CD 4.32Å; Y287-K291 HydrophobicContact CG-CD 4.37Å; S288-K291 PolarHBondContact O-N 2.95Å; S288-K291 PolarHBondContact OG-N 3.47Å; F289-K291 VanDerWaalsContact C-N 3.3Å
292	L	97.3	Very high	92.5	Very high	9 Å²	9	75 Å²	75	5%	0.047	41%	0.41	C	S	.	.	H	α-helix	trans	-70.8	-36.7	175.4	-68	175.9	0	0	0	112.1	Q258 L259 Y287 S288 F289	Q258-L292 HydrophobicContact CB-CD2 4.22Å; L259-L292 HydrophobicContact CD2-CD1 4Å; Y287-L292 HydrophobicContact CD2-CD2 3.97Å; Y287-L292 HydrophobicContact CG-CD2 4.28Å; S288-L292 PolarHBondContact O-N 3.37Å; F289-L292 PolarHBondContact O-N 2.75Å
293	F	97.2	Very high	92.2	Very high	0 Å²	0	77 Å²	77	0%	0	42%	0.416	C	S	.	.	S	Bend	trans	-132.3	72.3	-176.7	-51.2	-79.3	0	0	0	109.8	A234 V237 R238 L242 F289 E290 F298 R313 L316 L320	A234-F293 HydrophobicContact CB-CE1 3.52Å; A234-F293 HydrophobicContact CB-CZ 3.56Å; V237-F293 HydrophobicContact CG1-CD1 4.12Å; R238-F293 HydrophobicContact CG-CD1 3.91Å; R238-F293 HydrophobicContact CG-CE1 3.84Å; L242-F293 HydrophobicContact CD1-CZ 4.44Å; L242-F293 HydrophobicContact CD2-CZ 4.42Å; F289-F293 AromaticContact CD1-CD2 3.74Å; F289-F293 HydrophobicContact CD1-CD2 3.74Å; F289-F293 AromaticContact CD1-CE2 3.61Å; F289-F293 HydrophobicContact CD1-CE2 3.61Å; F289-F293 HydrophobicContact CE1-CD2 4.43Å; F289-F293 AromaticContact CE1-CE2 3.84Å; F289-F293 HydrophobicContact CE1-CE2 3.84Å; F289-F293 WeakPolarHBondContact O-CA 3.43Å; F289-F293 WeakPolarHBondContact O-CB 3.44Å; F289-F293 PolarHBondContact O-N 3Å; E290-F293 CarbonylContact O-C 3.4Å; F293-F298 HydrophobicContact CB-CE2 3.83Å; F293-F298 HydrophobicContact CB-CZ 4.02Å; F293-R313 VanDerWaalsContact O-CZ 3.25Å; F293-R313 PolarHBondContact O-NE 2.72Å; F293-R313 PolarHBondContact O-NH2 3.08Å; F293-L316 HydrophobicContact CD1-CD1 3.85Å; F293-L316 HydrophobicContact CD2-CD1 3.9Å; F293-L316 HydrophobicContact CE1-CD1 3.94Å; F293-L316 HydrophobicContact CE2-CB 4.37Å; F293-L316 HydrophobicContact CE2-CD1 4Å; F293-L316 HydrophobicContact CE2-CD2 4.48Å; F293-L316 HydrophobicContact CG-CD1 3.83Å; F293-L316 HydrophobicContact CZ-CD1 4.01Å; F293-L316 HydrophobicContact CZ-CD2 4.14Å; F293-L320 HydrophobicContact CE2-CD1 4.31Å; F293-L320 HydrophobicContact CZ-CD1 4.04Å
294	P	95.9	Very high	92	Very high	49 Å²	49	73.3 Å²	73.3	32%	0.318	41%	0.407	S	S	.	.			trans	-66.2	158.5	178.9	26.8	-34	0	0	0	111.8	E290 V296 L297	E290-P294 WeakPolarHBondContact O-CA 3.48Å; E290-P294 VanDerWaalsContact O-N 3.14Å; P294-V296 HydrophobicContact CB-CG1 4.21Å; P294-V296 HydrophobicContact CG-CG1 3.97Å; P294-V296 PolarHBondContact O-N 3.33Å; P294-V296 VanDerWaalsContact O-N 3.11Å; P294-L297 HydrophobicContact CG-CD1 4.2Å; P294-L297 HydrophobicContact CG-CG 4.05Å; P294-L297 WeakPolarHBondContact O-CB 3.42Å; P294-L297 PolarHBondContact O-N 2.94Å
295	D	92.3	Very high	91.6	Very high	99 Å²	99	71 Å²	71	53%	0.529	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-57	-29.5	-176	-66.3	-27.4	0	0	0	113.3	L297 F298 R313	D295-L297 PolarHBondContact O-N 3.43Å; D295-L297 VanDerWaalsContact O-N 3.14Å; D295-F298 PolarHBondContact O-N 2.96Å; D295-F298 VanDerWaalsContact O-O 3.11Å; D295-R313 IonicContact OD1-CZ 3.88Å; D295-R313 IonicContact OD1-NH1 4Å; D295-R313 PolarHBondContact OD1-NH1 3.27Å; D295-R313 IonicContact OD1-NH2 2.63Å; D295-R313 PolarHBondContact OD1-NH2 3.19Å
296	V	93	Very high	91.4	Very high	127 Å²	127	71.2 Å²	71.2	77%	0.77	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-61.5	-19.6	177	69.8	0	0	0	0	113.9	P294 F298	P294-V296 HydrophobicContact CB-CG1 4.21Å; P294-V296 HydrophobicContact CG-CG1 3.97Å; P294-V296 PolarHBondContact O-N 3.33Å; P294-V296 VanDerWaalsContact O-N 3.11Å; V296-F298 VanDerWaalsContact C-N 3.34Å
297	L	93.6	Very high	91.3	Very high	63 Å²	63	74.8 Å²	74.8	33%	0.33	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-86.6	-8.1	176.2	-59.4	-173.8	0	0	0	113.2	V237 R238 P294 D295	V237-L297 HydrophobicContact CG1-CB 3.8Å; V237-L297 HydrophobicContact CG1-CD1 4.43Å; R238-L297 HydrophobicContact CG-CD1 3.89Å; P294-L297 HydrophobicContact CG-CD1 4.2Å; P294-L297 HydrophobicContact CG-CG 4.05Å; P294-L297 WeakPolarHBondContact O-CB 3.42Å; P294-L297 PolarHBondContact O-N 2.94Å; D295-L297 PolarHBondContact O-N 3.43Å; D295-L297 VanDerWaalsContact O-N 3.14Å
298	F	90.7	Very high	91.2	Very high	11 Å²	11	70.7 Å²	70.7	5%	0.048	38%	0.378	C	S	.	.	S	Bend	trans	-108.8	148.1	178.5	-64.1	-80.5	0	0	0	109.9	H143 V237 F293 D295 V296 A300 A309 A312 L316	H143-F298 AromaticContact CE1-CD1 3.76Å; V237-F298 HydrophobicContact CB-CE1 4.3Å; V237-F298 HydrophobicContact CG1-CD1 4.12Å; V237-F298 HydrophobicContact CG1-CE1 3.64Å; V237-F298 HydrophobicContact CG1-CE2 4.1Å; V237-F298 HydrophobicContact CG1-CZ 3.64Å; V237-F298 HydrophobicContact CG2-CD1 4.27Å; V237-F298 HydrophobicContact CG2-CE1 3.58Å; V237-F298 HydrophobicContact CG2-CZ 4.18Å; F293-F298 HydrophobicContact CB-CE2 3.83Å; F293-F298 HydrophobicContact CB-CZ 4.02Å; D295-F298 PolarHBondContact O-N 2.96Å; D295-F298 VanDerWaalsContact O-O 3.11Å; V296-F298 VanDerWaalsContact C-N 3.34Å; F298-A300 PolarHBondContact O-N 3.46Å; F298-A300 VanDerWaalsContact O-N 3.15Å; F298-A309 HydrophobicContact CB-CB 3.57Å; F298-A309 HydrophobicContact CD1-CB 4.3Å; F298-A309 HydrophobicContact CD2-CB 4.01Å; F298-A309 HydrophobicContact CG-CB 3.71Å; F298-A312 HydrophobicContact CD1-CB 4.33Å; F298-A312 HydrophobicContact CE1-CB 3.65Å; F298-A312 HydrophobicContact CZ-CB 4.26Å; F298-L316 HydrophobicContact CZ-CD1 4.45Å
299	P	83.1	Confident	91.1	Very high	47 Å²	47	67.8 Å²	67.8	31%	0.305	36%	0.358	S	S	.	.			trans	-57.2	118.7	164.5	-18.8	30.4	0	0	0	109	L141 H143 N305	L141-P299 WeakPolarHBondContact O-CG 3.35Å; H143-P299 PolarHBondContact NE2-O 3.18Å; P299-N305 WeakPolarHBondContact O-CB 3.42Å
300	A	74.9	Confident	91	Very high	42 Å²	42	69.2 Å²	69.2	35%	0.347	37%	0.372	S	S	.	.			trans	-137.8	28.3	-172.2	0	0	0	0	0	113.8	F298 S302 K306	F298-A300 PolarHBondContact O-N 3.46Å; F298-A300 VanDerWaalsContact O-N 3.15Å; A300-S302 VanDerWaalsContact C-N 3.27Å; A300-S302 PolarHBondContact O-N 3.44Å; A300-K306 HydrophobicContact CB-CG 4.43Å
301	D	81.8	Confident	91.1	Very high	138 Å²	138	65.6 Å²	65.6	74%	0.738	36%	0.355	S	S	*	.	S	Bend	trans	-69.1	-15.7	-179.6	61.6	-29.6	0	0	0	114.5	N305	D301-N305 PolarHBondContact OD1-ND2 2.69Å
302	S	85.7	Confident	91.1	Very high	44 Å²	44	58.9 Å²	58.9	31%	0.308	33%	0.326	S	S	.	.	S	Bend	trans	-138.4	159.9	178.3	68.2	0	0	0	0	112.6	A300 H304 N305 K306	A300-S302 VanDerWaalsContact C-N 3.27Å; A300-S302 PolarHBondContact O-N 3.44Å; S302-H304 PolarHBondContact O-N 3.22Å; S302-N305 PolarHBondContact O-N 2.92Å; S302-N305 WeakPolarHBondContact OG-CB 3.42Å; S302-N305 PolarHBondContact OG-N 3.47Å; S302-N305 PolarHBondContact OG-ND2 3.22Å; S302-K306 PolarHBondContact O-N 2.88Å
303	D	84.9	Confident	91.1	Very high	121 Å²	121	59.4 Å²	59.4	65%	0.647	33%	0.327	S	S	*	.	H	α-helix	trans	-63.2	-31.1	176.3	-70.1	-27.2	0	0	0	112.7	N305 K306 L307	D303-N305 VanDerWaalsContact C-N 3.33Å; D303-K306 PolarHBondContact O-N 3.02Å; D303-K306 IonicContact OD1-NZ 3.73Å; D303-K306 PolarHBondContact OD1-NZ 3.35Å; D303-L307 PolarHBondContact O-N 3.13Å; D303-L307 VanDerWaalsContact O-N 3.1Å
304	H	86.3	Confident	91.2	Very high	117 Å²	117	62.4 Å²	62.4	54%	0.542	34%	0.343	S	S	.	.	H	α-helix	trans	-60.5	-44.1	170.4	176.7	-92.7	0	0	0	111.3	S302 L307 K308	S302-H304 PolarHBondContact O-N 3.22Å; H304-L307 WeakPolarHBondContact O-CB 3.4Å; H304-L307 PolarHBondContact O-N 3.19Å; H304-K308 WeakPolarHBondContact O-CG 3.44Å; H304-K308 PolarHBondContact O-N 3.47Å
305	N	88.4	Confident	91.3	Very high	33 Å²	33	60 Å²	60	18%	0.176	33%	0.328	C	S	.	.	H	α-helix	trans	-72.5	-31.6	179.9	-71.2	-15.3	0	0	0	112.4	H143 P299 D301 S302 D303 L307 K308 A309	H143-N305 PolarHBondContact NE2-O 3.28Å; P299-N305 WeakPolarHBondContact O-CB 3.42Å; D301-N305 PolarHBondContact OD1-ND2 2.69Å; S302-N305 PolarHBondContact O-N 2.92Å; S302-N305 WeakPolarHBondContact OG-CB 3.42Å; S302-N305 PolarHBondContact OG-N 3.47Å; S302-N305 PolarHBondContact OG-ND2 3.22Å; D303-N305 VanDerWaalsContact C-N 3.33Å; N305-L307 PolarHBondContact O-N 3.5Å; N305-K308 CarbonylContact O-C 3.51Å; N305-K308 PolarHBondContact O-N 2.86Å; N305-A309 WeakPolarHBondContact O-CB 3.2Å; N305-A309 PolarHBondContact O-N 3.43Å
306	K	90.8	Very high	91.6	Very high	114 Å²	114	55.3 Å²	55.3	50%	0.496	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-42.7	168.6	-66.8	176.3	-166.1	156.7	0	112.6	A300 S302 D303 K308 A309 S310	A300-K306 HydrophobicContact CB-CG 4.43Å; S302-K306 PolarHBondContact O-N 2.88Å; D303-K306 PolarHBondContact O-N 3.02Å; D303-K306 IonicContact OD1-NZ 3.73Å; D303-K306 PolarHBondContact OD1-NZ 3.35Å; K306-K308 VanDerWaalsContact C-N 3.32Å; K306-K308 PolarHBondContact O-N 3.02Å; K306-A309 PolarHBondContact O-N 2.69Å; K306-S310 PolarHBondContact O-N 3.4Å
307	L	93.7	Very high	91.9	Very high	98 Å²	98	51.1 Å²	51.1	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-43.2	174.4	177.8	62.9	0	0	0	110.8	D303 H304 N305 S310 Q311	D303-L307 PolarHBondContact O-N 3.13Å; D303-L307 VanDerWaalsContact O-N 3.1Å; H304-L307 WeakPolarHBondContact O-CB 3.4Å; H304-L307 PolarHBondContact O-N 3.19Å; N305-L307 PolarHBondContact O-N 3.5Å; L307-S310 WeakPolarHBondContact O-CB 3.24Å; L307-S310 PolarHBondContact O-N 3.46Å; L307-Q311 WeakPolarHBondContact O-CG 3.47Å; L307-Q311 PolarHBondContact O-N 3.32Å
308	K	95	Very high	92.2	Very high	23 Å²	23	51.8 Å²	51.8	10%	0.1	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-38.6	177.2	-69.6	-72.8	174	-172.6	0	112.7	H143 H304 N305 K306 Q311 A312 Y338	H143-K308 HydrophobicContact CB-CB 4Å; H143-K308 HydrophobicContact CB-CG 4.34Å; H304-K308 WeakPolarHBondContact O-CG 3.44Å; H304-K308 PolarHBondContact O-N 3.47Å; N305-K308 CarbonylContact O-C 3.51Å; N305-K308 PolarHBondContact O-N 2.86Å; K306-K308 VanDerWaalsContact C-N 3.32Å; K306-K308 PolarHBondContact O-N 3.02Å; K308-Q311 PolarHBondContact O-N 3.47Å; K308-A312 WeakPolarHBondContact O-CB 3.48Å; K308-A312 PolarHBondContact O-N 2.93Å; K308-Y338 HydrophobicContact CB-CE2 4.23Å; K308-Y338 HydrophobicContact CD-CD2 4.19Å; K308-Y338 HydrophobicContact CD-CE2 4.27Å; K308-Y338 WeakPolarHBondContact O-CE2 3.33Å
309	A	95.8	Very high	92.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-45	172.2	0	0	0	0	0	111.7	H143 F298 N305 K306 Q311 A312 R313	H143-A309 PolarHBondContact CE1-N 2.66Å; F298-A309 HydrophobicContact CB-CB 3.57Å; F298-A309 HydrophobicContact CD1-CB 4.3Å; F298-A309 HydrophobicContact CD2-CB 4.01Å; F298-A309 HydrophobicContact CG-CB 3.71Å; N305-A309 WeakPolarHBondContact O-CB 3.2Å; N305-A309 PolarHBondContact O-N 3.43Å; K306-A309 PolarHBondContact O-N 2.69Å; A309-Q311 PolarHBondContact O-N 3.15Å; A309-A312 PolarHBondContact O-N 2.96Å; A309-R313 WeakPolarHBondContact O-CB 3.41Å; A309-R313 PolarHBondContact O-N 3.12Å
310	S	96.6	Very high	93.3	Very high	65 Å²	65	49.3 Å²	49.3	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-42	174.1	-172.2	0	0	0	0	112.2	K306 L307 R313 D314	K306-S310 PolarHBondContact O-N 3.4Å; L307-S310 WeakPolarHBondContact O-CB 3.24Å; L307-S310 PolarHBondContact O-N 3.46Å; S310-R313 PolarHBondContact O-N 3.33Å; S310-D314 WeakPolarHBondContact O-CB 3.31Å; S310-D314 PolarHBondContact O-N 3.42Å
311	Q	97.9	Very high	94.4	Very high	35 Å²	35	48.9 Å²	48.9	16%	0.164	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-40.5	176.9	-70.8	175.8	-6.6	0	0	111.9	L307 K308 A309 D314 L315 H336 P337 Y338	L307-Q311 WeakPolarHBondContact O-CG 3.47Å; L307-Q311 PolarHBondContact O-N 3.32Å; K308-Q311 PolarHBondContact O-N 3.47Å; A309-Q311 PolarHBondContact O-N 3.15Å; Q311-D314 PolarHBondContact O-N 3.21Å; Q311-L315 PolarHBondContact O-N 3.04Å; Q311-H336 PolarHBondContact O-CE1 3.48Å; Q311-P337 HydrophobicContact CG-CB 4.38Å; Q311-Y338 HydrophobicContact CB-CD2 3.87Å; Q311-Y338 HydrophobicContact CB-CG 4.32Å
312	A	97.8	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-43.3	176.4	0	0	0	0	0	111.4	F298 K308 A309 L315 L316 Y338	F298-A312 HydrophobicContact CD1-CB 4.33Å; F298-A312 HydrophobicContact CE1-CB 3.65Å; F298-A312 HydrophobicContact CZ-CB 4.26Å; K308-A312 WeakPolarHBondContact O-CB 3.48Å; K308-A312 PolarHBondContact O-N 2.93Å; A309-A312 PolarHBondContact O-N 2.96Å; A312-L315 PolarHBondContact O-N 2.99Å; A312-L316 PolarHBondContact O-N 3.24Å; A312-Y338 HydrophobicContact CB-CD1 4.32Å; A312-Y338 HydrophobicContact CB-CD2 4.08Å; A312-Y338 HydrophobicContact CB-CE1 3.93Å; A312-Y338 HydrophobicContact CB-CE2 3.69Å; A312-Y338 HydrophobicContact CB-CG 4.39Å
313	R	98.2	Very high	95.6	Very high	20 Å²	20	41.6 Å²	41.6	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-41.8	176.7	-172.4	-177.4	-63	116.2	5.8	112.4	F289 F293 D295 A309 S310 L316 S317	F289-R313 HydrophobicContact CB-CG 3.82Å; F293-R313 VanDerWaalsContact O-CZ 3.25Å; F293-R313 PolarHBondContact O-NE 2.72Å; F293-R313 PolarHBondContact O-NH2 3.08Å; D295-R313 IonicContact OD1-CZ 3.88Å; D295-R313 IonicContact OD1-NH1 4Å; D295-R313 PolarHBondContact OD1-NH1 3.27Å; D295-R313 IonicContact OD1-NH2 2.63Å; D295-R313 PolarHBondContact OD1-NH2 3.19Å; A309-R313 WeakPolarHBondContact O-CB 3.41Å; A309-R313 PolarHBondContact O-N 3.12Å; S310-R313 PolarHBondContact O-N 3.33Å; R313-L316 WeakPolarHBondContact O-CB 3.35Å; R313-L316 PolarHBondContact O-N 2.8Å; R313-S317 PolarHBondContact O-N 2.97Å
314	D	98.7	Very high	96.1	Very high	63 Å²	63	36.9 Å²	36.9	34%	0.337	19%	0.192	S	C	.	.	H	α-helix	trans	-60.6	-45.2	174.2	-178.9	50.1	0	0	0	111	S310 Q311 L316 S317 K318 H336	S310-D314 WeakPolarHBondContact O-CB 3.31Å; S310-D314 PolarHBondContact O-N 3.42Å; Q311-D314 PolarHBondContact O-N 3.21Å; D314-L316 PolarHBondContact O-N 2.78Å; D314-S317 WeakPolarHBondContact O-CB 3.46Å; D314-S317 PolarHBondContact O-N 2.76Å; D314-S317 VanDerWaalsContact O-N 3.13Å; D314-S317 PolarHBondContact O-OG 2.81Å; D314-K318 WeakPolarHBondContact O-CG 3.43Å; D314-K318 PolarHBondContact O-N 2.99Å; D314-K318 VanDerWaalsContact O-N 3.15Å; D314-K318 VanDerWaalsContact OD1-CE 3.31Å; D314-K318 WeakPolarHBondContact OD1-CE 3.21Å; D314-K318 IonicContact OD1-NZ 2.8Å; D314-K318 PolarHBondContact OD1-NZ 3.05Å; D314-K318 WeakPolarHBondContact OD2-CE 3.33Å; D314-K318 IonicContact OD2-NZ 3.32Å; D314-K318 PolarHBondContact OD2-NZ 2.92Å; D314-H336 IonicContact OD2-CE1 2.7Å; D314-H336 IonicContact OD2-NE2 3.89Å; D314-H336 PolarHBondContact OD2-NE2 2.94Å
315	L	98.8	Very high	96.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-45.1	175.5	-172.8	55.9	0	0	0	112.2	L150 L233 Q311 A312 S317 K318 M319 I328 A333 H336 Y338 I339	L150-L315 HydrophobicContact CD2-CD2 3.72Å; L233-L315 HydrophobicContact CD2-CD2 4.5Å; Q311-L315 PolarHBondContact O-N 3.04Å; A312-L315 PolarHBondContact O-N 2.99Å; L315-S317 VanDerWaalsContact C-N 3.26Å; L315-S317 PolarHBondContact O-N 2.86Å; L315-K318 PolarHBondContact O-N 3.21Å; L315-K318 VanDerWaalsContact O-N 3.12Å; L315-M319 HydrophobicContact CD1-CE 3.76Å; L315-M319 HydrophobicContact CD1-CG 4.23Å; L315-M319 HydrophobicContact CD1-SD 4.4Å; L315-M319 HydrophobicContact CD2-CE 3.96Å; L315-M319 HydrophobicContact CG-CE 3.81Å; L315-M319 HydrophobicContact CG-CG 4.34Å; L315-M319 HydrophobicContact CG-SD 4.08Å; L315-M319 WeakPolarHBondContact O-CG 3.47Å; L315-M319 PolarHBondContact O-N 2.99Å; L315-I328 HydrophobicContact CD1-CD1 4.28Å; L315-A333 HydrophobicContact CD1-CB 4.45Å; L315-H336 HydrophobicContact CD1-CB 3.91Å; L315-Y338 HydrophobicContact CD2-CD1 4.07Å; L315-I339 HydrophobicContact CD2-CD1 3.92Å; L315-I339 HydrophobicContact CD2-CG1 3.63Å
316	L	98.7	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55	-43.2	173.7	-83.9	165.4	0	0	0	111.6	G230 L233 A234 F289 F293 F298 A312 R313 D314 K318 M319 L320	G230-L316 WeakPolarHBondContact O-CD2 3.28Å; L233-L316 HydrophobicContact CB-CD2 3.98Å; L233-L316 HydrophobicContact CD2-CD1 4.42Å; L233-L316 HydrophobicContact CD2-CD2 3.72Å; L233-L316 HydrophobicContact CD2-CG 3.6Å; L233-L316 HydrophobicContact CG-CD1 4.33Å; L233-L316 HydrophobicContact CG-CD2 3.67Å; L233-L316 HydrophobicContact CG-CG 3.89Å; A234-L316 HydrophobicContact CB-CD2 3.94Å; F289-L316 HydrophobicContact CD1-CB 4.04Å; F289-L316 HydrophobicContact CE1-CB 4.1Å; F289-L316 WeakPolarHBondContact CE1-O 3.24Å; F293-L316 HydrophobicContact CD1-CD1 3.85Å; F293-L316 HydrophobicContact CD2-CD1 3.9Å; F293-L316 HydrophobicContact CE1-CD1 3.94Å; F293-L316 HydrophobicContact CE2-CB 4.37Å; F293-L316 HydrophobicContact CE2-CD1 4Å; F293-L316 HydrophobicContact CE2-CD2 4.48Å; F293-L316 HydrophobicContact CG-CD1 3.83Å; F293-L316 HydrophobicContact CZ-CD1 4.01Å; F293-L316 HydrophobicContact CZ-CD2 4.14Å; F298-L316 HydrophobicContact CZ-CD1 4.45Å; A312-L316 PolarHBondContact O-N 3.24Å; R313-L316 WeakPolarHBondContact O-CB 3.35Å; R313-L316 PolarHBondContact O-N 2.8Å; D314-L316 PolarHBondContact O-N 2.78Å; L316-K318 PolarHBondContact O-N 2.72Å; L316-M319 PolarHBondContact O-N 2.79Å; L316-L320 HydrophobicContact CD2-CD1 3.86Å; L316-L320 HydrophobicContact CD2-CG 4.48Å; L316-L320 WeakPolarHBondContact O-CB 3.22Å; L316-L320 PolarHBondContact O-N 3.34Å
317	S	98.7	Very high	97.2	Very high	39 Å²	39	35.2 Å²	35.2	27%	0.273	19%	0.193	S	C	.	.	H	α-helix	trans	-64.1	-29.7	179.6	83.8	0	0	0	0	113.8	F289 R313 D314 L315 V321	F289-S317 VanDerWaalsContact CE1-CA 3.43Å; F289-S317 VanDerWaalsContact CZ-CA 3.47Å; R313-S317 PolarHBondContact O-N 2.97Å; D314-S317 WeakPolarHBondContact O-CB 3.46Å; D314-S317 PolarHBondContact O-N 2.76Å; D314-S317 VanDerWaalsContact O-N 3.13Å; D314-S317 PolarHBondContact O-OG 2.81Å; L315-S317 VanDerWaalsContact C-N 3.26Å; L315-S317 PolarHBondContact O-N 2.86Å; S317-V321 WeakPolarHBondContact O-CG2 3.35Å
318	K	98.8	Very high	97.5	Very high	77 Å²	77	31.4 Å²	31.4	34%	0.335	17%	0.173	S	C	.	.	H	α-helix	trans	-85.5	-28.7	178.8	-70.1	172.3	-179.5	165.3	0	113	D314 L315 L316 V321 I328	D314-K318 WeakPolarHBondContact O-CG 3.43Å; D314-K318 PolarHBondContact O-N 2.99Å; D314-K318 VanDerWaalsContact O-N 3.15Å; D314-K318 VanDerWaalsContact OD1-CE 3.31Å; D314-K318 WeakPolarHBondContact OD1-CE 3.21Å; D314-K318 IonicContact OD1-NZ 2.8Å; D314-K318 PolarHBondContact OD1-NZ 3.05Å; D314-K318 WeakPolarHBondContact OD2-CE 3.33Å; D314-K318 IonicContact OD2-NZ 3.32Å; D314-K318 PolarHBondContact OD2-NZ 2.92Å; L315-K318 PolarHBondContact O-N 3.21Å; L315-K318 VanDerWaalsContact O-N 3.12Å; L316-K318 PolarHBondContact O-N 2.72Å; K318-V321 WeakPolarHBondContact O-CG2 3.14Å; K318-I328 HydrophobicContact CB-CB 4Å; K318-I328 HydrophobicContact CB-CD1 4.1Å; K318-I328 HydrophobicContact CB-CG2 4.09Å; K318-I328 HydrophobicContact CD-CD1 4.18Å; K318-I328 VanDerWaalsContact O-CG2 3.32Å; K318-I328 WeakPolarHBondContact O-CG2 3.43Å; K318-I328 PolarHBondContact O-N 2.7Å; K318-I328 VanDerWaalsContact O-N 3.09Å
319	M	98.7	Very high	97.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-83.5	-43.6	176.8	-67.1	-174.2	165.5	0	0	112.9	L150 L154 I226 V229 L315 L316 V321 R327 I328 A333	L150-M319 HydrophobicContact CD2-CE 4.07Å; L154-M319 HydrophobicContact CD1-CE 4.37Å; L154-M319 HydrophobicContact CD2-CE 4.32Å; I226-M319 HydrophobicContact CG2-CB 3.93Å; I226-M319 HydrophobicContact CG2-CG 3.76Å; V229-M319 HydrophobicContact CG1-CE 3.97Å; V229-M319 HydrophobicContact CG1-SD 3.98Å; L315-M319 HydrophobicContact CD1-CE 3.76Å; L315-M319 HydrophobicContact CD1-CG 4.23Å; L315-M319 HydrophobicContact CD1-SD 4.4Å; L315-M319 HydrophobicContact CD2-CE 3.96Å; L315-M319 HydrophobicContact CG-CE 3.81Å; L315-M319 HydrophobicContact CG-CG 4.34Å; L315-M319 HydrophobicContact CG-SD 4.08Å; L315-M319 WeakPolarHBondContact O-CG 3.47Å; L315-M319 PolarHBondContact O-N 2.99Å; L316-M319 PolarHBondContact O-N 2.79Å; M319-V321 PolarHBondContact O-N 2.9Å; M319-R327 VanDerWaalsContact O-CD 3.31Å; M319-R327 WeakPolarHBondContact O-CD 3.29Å; M319-R327 WeakPolarHBondContact O-CG 3.19Å; M319-I328 HydrophobicContact CG-CG2 3.84Å; M319-A333 HydrophobicContact CE-CB 3.93Å
320	L	98.7	Very high	97.7	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.026	18%	0.183	C	C	.	.	S	Bend	trans	-86	56.9	-177.2	-66.5	176	0	0	0	111.6	A234 L242 F243 L259 F289 F293 L316	A234-L320 HydrophobicContact CB-CD1 4.18Å; L242-L320 HydrophobicContact CD2-CD1 3.55Å; L242-L320 HydrophobicContact CD2-CD2 4.23Å; F243-L320 HydrophobicContact CE2-CD2 4.27Å; L259-L320 HydrophobicContact CD1-CB 4.42Å; L259-L320 WeakPolarHBondContact CD1-O 3.22Å; F289-L320 HydrophobicContact CE1-CB 4.08Å; F289-L320 HydrophobicContact CE1-CD1 4.13Å; F289-L320 HydrophobicContact CZ-CB 3.96Å; F293-L320 HydrophobicContact CE2-CD1 4.31Å; F293-L320 HydrophobicContact CZ-CD1 4.04Å; L316-L320 HydrophobicContact CD2-CD1 3.86Å; L316-L320 HydrophobicContact CD2-CG 4.48Å; L316-L320 WeakPolarHBondContact O-CB 3.22Å; L316-L320 PolarHBondContact O-N 3.34Å
321	V	98.4	Very high	97.8	Very high	34 Å²	34	33 Å²	33	21%	0.206	18%	0.18	C	C	.	.			trans	-109.2	125.4	178.4	-178.6	0	0	0	0	109.6	S317 K318 M319 K326 R327	S317-V321 WeakPolarHBondContact O-CG2 3.35Å; K318-V321 WeakPolarHBondContact O-CG2 3.14Å; M319-V321 PolarHBondContact O-N 2.9Å; V321-K326 HydrophobicContact CG1-CB 3.87Å; V321-R327 HydrophobicContact CB-CB 4.05Å; V321-R327 HydrophobicContact CB-CG 4.24Å; V321-R327 PolarHBondContact O-NE 3.13Å; V321-R327 PolarHBondContact O-NH2 3.32Å
322	I	97.3	Very high	97.8	Very high	14 Å²	14	36.8 Å²	36.8	7%	0.072	20%	0.198	C	C	.	.	S	Bend	trans	-63	-49.7	-176.9	-65.1	176.3	0	0	0	111.3	P212 W227 W252 V255 I256 L259 G260 P262 F266 A324 R327	P212-I322 HydrophobicContact CB-CG2 4.09Å; P212-I322 HydrophobicContact CG-CB 4.48Å; P212-I322 HydrophobicContact CG-CG2 4.15Å; W227-I322 HydrophobicContact CH2-CG1 4.47Å; W227-I322 HydrophobicContact CZ3-CG1 4.46Å; W252-I322 HydrophobicContact CH2-CG2 4.03Å; W252-I322 HydrophobicContact CZ3-CG2 4.17Å; V255-I322 HydrophobicContact CG1-CD1 3.95Å; V255-I322 HydrophobicContact CG1-CG1 4Å; I256-I322 HydrophobicContact CG2-CD1 4.37Å; L259-I322 HydrophobicContact CB-CD1 4.18Å; L259-I322 HydrophobicContact CB-CG1 4.47Å; L259-I322 HydrophobicContact CD1-CG1 4.13Å; G260-I322 WeakPolarHBondContact O-CD1 3.39Å; P262-I322 HydrophobicContact CB-CG2 4.07Å; P262-I322 HydrophobicContact CG-CG2 4.41Å; F266-I322 HydrophobicContact CD1-CG2 4.5Å; F266-I322 HydrophobicContact CE1-CG2 4Å; F266-I322 HydrophobicContact CE2-CG2 4.02Å; F266-I322 HydrophobicContact CZ-CG2 3.74Å; I322-A324 PolarHBondContact O-N 2.83Å; I322-R327 PolarHBondContact O-NH2 3.06Å
323	D	95.8	Very high	97.8	Very high	15 Å²	15	36.8 Å²	36.8	8%	0.08	20%	0.198	C	C	.	.	S	Bend	trans	-76.2	108.4	178.3	-169.5	-22.7	0	0	0	110.1	F266 K269 S325 K326 R327	F266-D323 HydrophobicContact CD2-CB 3.82Å; K269-D323 VanDerWaalsContact NZ-CG 3.34Å; K269-D323 IonicContact NZ-OD1 3.08Å; K269-D323 PolarHBondContact NZ-OD1 3.48Å; K269-D323 VanDerWaalsContact NZ-OD1 3.08Å; K269-D323 IonicContact NZ-OD2 2.8Å; K269-D323 PolarHBondContact NZ-OD2 2.85Å; D323-S325 PolarHBondContact O-N 2.76Å; D323-S325 VanDerWaalsContact O-N 3.07Å; D323-S325 WeakPolarHBondContact OD1-CB 3.43Å; D323-S325 PolarHBondContact OD1-N 3.43Å; D323-S325 PolarHBondContact OD1-OG 3.25Å; D323-S325 PolarHBondContact OD2-OG 3.09Å; D323-K326 HydrophobicContact CB-CD 4.34Å; D323-K326 HydrophobicContact CB-CG 4.43Å; D323-K326 PolarHBondContact O-N 2.79Å; D323-R327 PolarHBondContact O-N 3Å
324	A	95.3	Very high	97.9	Very high	22 Å²	22	35.8 Å²	35.8	18%	0.182	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-55.4	-26.4	179.1	0	0	0	0	0	113.3	N223 I322 K326 R327	N223-A324 PolarHBondContact ND2-O 3.29Å; I322-A324 PolarHBondContact O-N 2.83Å; A324-K326 PolarHBondContact O-N 3.46Å; A324-R327 PolarHBondContact O-N 2.88Å
325	S	94.5	Very high	97.9	Very high	88 Å²	88	37.7 Å²	37.7	62%	0.615	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-71.5	-14.4	176.4	63.9	0	0	0	0	114.3	K269 D323	K269-S325 PolarHBondContact NZ-OG 3.48Å; K269-S325 VanDerWaalsContact NZ-OG 3.17Å; D323-S325 PolarHBondContact O-N 2.76Å; D323-S325 VanDerWaalsContact O-N 3.07Å; D323-S325 WeakPolarHBondContact OD1-CB 3.43Å; D323-S325 PolarHBondContact OD1-N 3.43Å; D323-S325 PolarHBondContact OD1-OG 3.25Å; D323-S325 PolarHBondContact OD2-OG 3.09Å
326	K	96.7	Very high	97.8	Very high	130 Å²	130	38 Å²	38	57%	0.565	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-110.3	-3.4	177.8	-60.7	178.4	-177.4	176.3	0	112.4	V321 D323 A324	V321-K326 HydrophobicContact CG1-CB 3.87Å; D323-K326 HydrophobicContact CB-CD 4.34Å; D323-K326 HydrophobicContact CB-CG 4.43Å; D323-K326 PolarHBondContact O-N 2.79Å; A324-K326 PolarHBondContact O-N 3.46Å
327	R	98.3	Very high	97.8	Very high	10 Å²	10	41.4 Å²	41.4	4%	0.038	22%	0.224	C	C	.	.	S	Bend	trans	-82.2	136.1	-178.8	-168	-175.4	-56.1	143.4	4.2	109.4	E213 N223 I226 M319 V321 I322 D323 A324	E213-R327 IonicContact OE1-CZ 2.79Å; E213-R327 IonicContact OE1-NH1 2.68Å; E213-R327 PolarHBondContact OE1-NH1 3.31Å; E213-R327 IonicContact OE1-NH2 3.81Å; E213-R327 PolarHBondContact OE1-NH2 3.34Å; E213-R327 IonicContact OE2-CZ 3.87Å; E213-R327 IonicContact OE2-NH1 2.85Å; E213-R327 IonicContact OE2-NH2 2.69Å; E213-R327 PolarHBondContact OE2-NH2 2.87Å; N223-R327 PolarHBondContact ND2-O 3.35Å; N223-R327 WeakPolarHBondContact O-CD 3.45Å; N223-R327 PolarHBondContact O-NH1 3.14Å; I226-R327 HydrophobicContact CG2-CG 4.07Å; M319-R327 VanDerWaalsContact O-CD 3.31Å; M319-R327 WeakPolarHBondContact O-CD 3.29Å; M319-R327 WeakPolarHBondContact O-CG 3.19Å; V321-R327 HydrophobicContact CB-CB 4.05Å; V321-R327 HydrophobicContact CB-CG 4.24Å; V321-R327 PolarHBondContact O-NE 3.13Å; V321-R327 PolarHBondContact O-NH2 3.32Å; I322-R327 PolarHBondContact O-NH2 3.06Å; D323-R327 PolarHBondContact O-N 3Å; A324-R327 PolarHBondContact O-N 2.88Å
328	I	98.6	Very high	97.8	Very high	18 Å²	18	39.5 Å²	39.5	9%	0.092	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-52.6	140.4	177.6	-163.4	172.2	0	0	0	111.5	I226 L315 K318 M319 E332 A333	I226-I328 HydrophobicContact CG2-CG2 3.74Å; L315-I328 HydrophobicContact CD1-CD1 4.28Å; K318-I328 HydrophobicContact CB-CB 4Å; K318-I328 HydrophobicContact CB-CD1 4.1Å; K318-I328 HydrophobicContact CB-CG2 4.09Å; K318-I328 HydrophobicContact CD-CD1 4.18Å; K318-I328 VanDerWaalsContact O-CG2 3.32Å; K318-I328 WeakPolarHBondContact O-CG2 3.43Å; K318-I328 PolarHBondContact O-N 2.7Å; K318-I328 VanDerWaalsContact O-N 3.09Å; M319-I328 HydrophobicContact CG-CG2 3.84Å; I328-E332 HydrophobicContact CD1-CB 3.87Å; I328-E332 HydrophobicContact CG1-CB 3.37Å; I328-E332 HydrophobicContact CG1-CG 4.48Å; I328-A333 HydrophobicContact CD1-CB 4.12Å; I328-A333 HydrophobicContact CG1-CB 4.42Å; I328-A333 HydrophobicContact CG2-CB 4.46Å
329	S	98.2	Very high	97.8	Very high	38 Å²	38	35.9 Å²	35.9	27%	0.266	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-76.8	168.3	171.9	65.5	0	0	0	0	111.8	D331 E332 A333	S329-D331 VanDerWaalsContact C-N 3.33Å; S329-E332 WeakPolarHBondContact CB-OE2 3.33Å; S329-E332 PolarHBondContact N-OE2 3.01Å; S329-E332 WeakPolarHBondContact OG-CB 3.26Å; S329-E332 WeakPolarHBondContact OG-CG 3.47Å; S329-E332 PolarHBondContact OG-N 2.9Å; S329-E332 PolarHBondContact OG-OE2 3.01Å; S329-A333 WeakPolarHBondContact O-CB 3.3Å; S329-A333 PolarHBondContact O-N 3.3Å
330	V	97.9	Very high	97.8	Very high	10 Å²	10	39.4 Å²	39.4	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-42.3	175.3	-178.5	0	0	0	0	111.1	L154 I157 K158 I226 A333 L334	L154-V330 HydrophobicContact CD2-CG1 4.28Å; I157-V330 HydrophobicContact CG2-CG2 3.87Å; K158-V330 HydrophobicContact CB-CG1 3.82Å; I226-V330 HydrophobicContact CD1-CB 4.39Å; I226-V330 HydrophobicContact CD1-CG2 3.83Å; I226-V330 HydrophobicContact CG1-CG2 3.89Å; V330-A333 PolarHBondContact O-N 2.88Å; V330-L334 HydrophobicContact CG1-CD1 4.14Å; V330-L334 WeakPolarHBondContact O-CG 3.41Å; V330-L334 PolarHBondContact O-N 3.36Å
331	D	97.6	Very high	97.7	Very high	75 Å²	75	43.3 Å²	43.3	40%	0.401	24%	0.238	S	C	.	.	H	α-helix	trans	-65.4	-44.9	-179.8	-66	-43.6	0	0	0	111.7	K158 S329 A333 L334 H335	K158-D331 IonicContact NZ-OD1 2.93Å; K158-D331 PolarHBondContact NZ-OD1 3.09Å; S329-D331 VanDerWaalsContact C-N 3.33Å; D331-A333 VanDerWaalsContact C-N 3.3Å; D331-A333 PolarHBondContact O-N 3.42Å; D331-L334 PolarHBondContact O-N 3.3Å; D331-H335 PolarHBondContact O-N 2.75Å; D331-H335 PolarHBondContact O-ND1 2.94Å
332	E	98.4	Very high	97.7	Very high	114 Å²	114	45 Å²	45	53%	0.533	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-36.3	175.5	-70.2	164.3	140.7	0	0	111.9	I328 S329 H335 H336	I328-E332 HydrophobicContact CD1-CB 3.87Å; I328-E332 HydrophobicContact CG1-CB 3.37Å; I328-E332 HydrophobicContact CG1-CG 4.48Å; S329-E332 WeakPolarHBondContact CB-OE2 3.33Å; S329-E332 PolarHBondContact N-OE2 3.01Å; S329-E332 WeakPolarHBondContact OG-CB 3.26Å; S329-E332 WeakPolarHBondContact OG-CG 3.47Å; S329-E332 PolarHBondContact OG-N 2.9Å; S329-E332 PolarHBondContact OG-OE2 3.01Å; E332-H335 PolarHBondContact O-N 3.31Å; E332-H336 PolarHBondContact O-N 2.7Å; E332-H336 VanDerWaalsContact O-N 3.14Å
333	A	98.6	Very high	97.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.2	-37.6	176.7	0	0	0	0	0	112.5	L154 I226 L315 M319 I328 S329 V330 D331 H335 H336 I339	L154-A333 HydrophobicContact CD1-CB 3.94Å; L154-A333 HydrophobicContact CD2-CB 4.02Å; I226-A333 HydrophobicContact CD1-CB 4.3Å; L315-A333 HydrophobicContact CD1-CB 4.45Å; M319-A333 HydrophobicContact CE-CB 3.93Å; I328-A333 HydrophobicContact CD1-CB 4.12Å; I328-A333 HydrophobicContact CG1-CB 4.42Å; I328-A333 HydrophobicContact CG2-CB 4.46Å; S329-A333 WeakPolarHBondContact O-CB 3.3Å; S329-A333 PolarHBondContact O-N 3.3Å; V330-A333 PolarHBondContact O-N 2.88Å; D331-A333 VanDerWaalsContact C-N 3.3Å; D331-A333 PolarHBondContact O-N 3.42Å; A333-H335 VanDerWaalsContact C-N 3.29Å; A333-H335 PolarHBondContact O-N 3.01Å; A333-H336 WeakPolarHBondContact O-CB 3.45Å; A333-H336 PolarHBondContact O-N 3.35Å; A333-I339 WeakPolarHBondContact O-CB 3.46Å
334	L	98.5	Very high	97.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-33.1	174.6	-77.2	164.8	0	0	0	112.6	Y151 L154 K158 V330 D331 H336 I339 N340 Y343 V348	Y151-L334 HydrophobicContact CD2-CD2 3.89Å; Y151-L334 HydrophobicContact CE2-CD2 4.11Å; L154-L334 HydrophobicContact CB-CD2 3.58Å; L154-L334 HydrophobicContact CB-CG 3.91Å; L154-L334 HydrophobicContact CD1-CD2 4.33Å; L154-L334 HydrophobicContact CD1-CG 4.46Å; K158-L334 HydrophobicContact CB-CD1 4.43Å; K158-L334 HydrophobicContact CD-CD1 3.69Å; V330-L334 HydrophobicContact CG1-CD1 4.14Å; V330-L334 WeakPolarHBondContact O-CG 3.41Å; V330-L334 PolarHBondContact O-N 3.36Å; D331-L334 PolarHBondContact O-N 3.3Å; L334-H336 VanDerWaalsContact C-N 3.31Å; L334-I339 HydrophobicContact CD2-CG2 4.37Å; L334-N340 WeakPolarHBondContact O-CA 3.33Å; L334-Y343 HydrophobicContact CB-CD2 4.31Å; L334-Y343 HydrophobicContact CB-CE2 4.28Å; L334-V348 HydrophobicContact CD1-CG1 3.85Å; L334-V348 HydrophobicContact CD1-CG2 4.46Å; L334-V348 HydrophobicContact CD2-CG2 4.33Å
335	H	98.5	Very high	97.9	Very high	102 Å²	102	52.3 Å²	52.3	47%	0.472	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.6	175.8	-67.6	86.6	0	0	0	113.5	D331 E332 A333 Y343	D331-H335 PolarHBondContact O-N 2.75Å; D331-H335 PolarHBondContact O-ND1 2.94Å; E332-H335 PolarHBondContact O-N 3.31Å; A333-H335 VanDerWaalsContact C-N 3.29Å; A333-H335 PolarHBondContact O-N 3.01Å; H335-Y343 AromaticContact CE1-CE2 3.79Å; H335-Y343 AromaticContact NE2-CE2 3.89Å
336	H	98.8	Very high	97.9	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.037	28%	0.277	C	S	.	.	S	Bend	trans	-64.4	139	178.6	-168.8	-91.6	0	0	0	110.9	Q311 D314 L315 E332 A333 L334 Y338 I339 N340	Q311-H336 PolarHBondContact O-CE1 3.48Å; D314-H336 IonicContact OD2-CE1 2.7Å; D314-H336 IonicContact OD2-NE2 3.89Å; D314-H336 PolarHBondContact OD2-NE2 2.94Å; L315-H336 HydrophobicContact CD1-CB 3.91Å; E332-H336 PolarHBondContact O-N 2.7Å; E332-H336 VanDerWaalsContact O-N 3.14Å; A333-H336 WeakPolarHBondContact O-CB 3.45Å; A333-H336 PolarHBondContact O-N 3.35Å; L334-H336 VanDerWaalsContact C-N 3.31Å; H336-Y338 WeakPolarHBondContact ND1-CB 3.18Å; H336-Y338 PolarHBondContact ND1-N 3.41Å; H336-Y338 PolarHBondContact O-N 2.73Å; H336-I339 PolarHBondContact O-N 3.38Å; H336-N340 WeakPolarHBondContact O-CB 3.45Å; H336-N340 PolarHBondContact O-N 2.73Å
337	P	98.4	Very high	97.8	Very high	70 Å²	70	47.7 Å²	47.7	46%	0.455	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-27	-177	-29.2	35.6	0	0	0	115.6	Q311 I339	Q311-P337 HydrophobicContact CG-CB 4.38Å; P337-I339 VanDerWaalsContact C-N 3.33Å
338	Y	98.3	Very high	97.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-28.6	174.9	-163.7	-117.1	0	0	0	113.4	H143 L146 S147 K308 Q311 A312 L315 H336	H143-Y338 HydrophobicContact CB-CE2 4.3Å; H143-Y338 AromaticContact ND1-CE2 3.51Å; H143-Y338 AromaticContact ND1-CZ 3.64Å; H143-Y338 PolarHBondContact ND1-OH 3.43Å; L146-Y338 HydrophobicContact CD2-CE1 3.65Å; L146-Y338 VanDerWaalsContact CD2-OH 3.28Å; L146-Y338 WeakPolarHBondContact CD2-OH 3.31Å; S147-Y338 VanDerWaalsContact CB-O 3.23Å; S147-Y338 WeakPolarHBondContact CB-O 3.32Å; K308-Y338 HydrophobicContact CB-CE2 4.23Å; K308-Y338 HydrophobicContact CD-CD2 4.19Å; K308-Y338 HydrophobicContact CD-CE2 4.27Å; K308-Y338 WeakPolarHBondContact O-CE2 3.33Å; Q311-Y338 HydrophobicContact CB-CD2 3.87Å; Q311-Y338 HydrophobicContact CB-CG 4.32Å; A312-Y338 HydrophobicContact CB-CD1 4.32Å; A312-Y338 HydrophobicContact CB-CD2 4.08Å; A312-Y338 HydrophobicContact CB-CE1 3.93Å; A312-Y338 HydrophobicContact CB-CE2 3.69Å; A312-Y338 HydrophobicContact CB-CG 4.39Å; L315-Y338 HydrophobicContact CD2-CD1 4.07Å; H336-Y338 WeakPolarHBondContact ND1-CB 3.18Å; H336-Y338 PolarHBondContact ND1-N 3.41Å; H336-Y338 PolarHBondContact O-N 2.73Å
339	I	98.5	Very high	97.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-37.5	-171.9	-57.4	-54.6	0	0	0	112	L150 Y151 L154 L315 A333 L334 H336 P337 V341 W342	L150-I339 HydrophobicContact CB-CD1 3.86Å; L150-I339 HydrophobicContact CD2-CD1 3.81Å; L150-I339 HydrophobicContact CG-CD1 4.35Å; Y151-I339 HydrophobicContact CD2-CG2 4.01Å; Y151-I339 HydrophobicContact CG-CG2 4.49Å; L154-I339 HydrophobicContact CD1-CG1 4.29Å; L154-I339 HydrophobicContact CD1-CG2 4.06Å; L315-I339 HydrophobicContact CD2-CD1 3.92Å; L315-I339 HydrophobicContact CD2-CG1 3.63Å; A333-I339 WeakPolarHBondContact O-CB 3.46Å; L334-I339 HydrophobicContact CD2-CG2 4.37Å; H336-I339 PolarHBondContact O-N 3.38Å; P337-I339 VanDerWaalsContact C-N 3.33Å; I339-V341 PolarHBondContact O-N 2.97Å; I339-W342 PolarHBondContact O-N 3.39Å
340	N	97.9	Very high	97	Very high	74 Å²	74	51.1 Å²	51.1	40%	0.396	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-58.7	-17.3	-172.2	-169.9	49.3	0	0	0	114.2	L334 H336 W342 Y343	L334-N340 WeakPolarHBondContact O-CA 3.33Å; H336-N340 WeakPolarHBondContact O-CB 3.45Å; H336-N340 PolarHBondContact O-N 2.73Å; N340-W342 PolarHBondContact O-N 3.13Å; N340-Y343 WeakPolarHBondContact O-CB 3.45Å; N340-Y343 PolarHBondContact O-N 2.75Å; N340-Y343 WeakPolarHBondContact OD1-CB 3.13Å
341	V	97.7	Very high	96.5	Very high	87 Å²	87	55.8 Å²	55.8	53%	0.527	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-60.3	-22.3	173.1	-59.5	0	0	0	0	113.1	I339	I339-V341 PolarHBondContact O-N 2.97Å
342	W	98.2	Very high	95.8	Very high	71 Å²	71	55.4 Å²	55.4	27%	0.269	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-102.4	-1.3	179.6	-56.5	115	0	0	0	113.9	E144 S147 Y148 Y151 I339 N340 D344	E144-W342 HydrophobicContact CB-CZ2 4.43Å; E144-W342 HydrophobicContact CG-CH2 3.55Å; E144-W342 HydrophobicContact CG-CZ2 3.38Å; S147-W342 PolarHBondContact OG-NE1 2.96Å; Y148-W342 HydrophobicContact CD2-CB 4.43Å; Y148-W342 AromaticContact CD2-CD2 3.6Å; Y148-W342 HydrophobicContact CD2-CD2 3.6Å; Y148-W342 AromaticContact CD2-CE2 3.97Å; Y148-W342 AromaticContact CD2-CE3 3.75Å; Y148-W342 HydrophobicContact CD2-CE3 3.75Å; Y148-W342 AromaticContact CD2-CG 3.91Å; Y148-W342 HydrophobicContact CD2-CG 3.91Å; Y148-W342 HydrophobicContact CD2-CZ2 4.43Å; Y148-W342 HydrophobicContact CD2-CZ3 4.24Å; Y148-W342 HydrophobicContact CE2-CD2 4.41Å; Y148-W342 HydrophobicContact CE2-CE3 4.19Å; Y148-W342 HydrophobicContact CG-CD2 4.36Å; Y148-W342 HydrophobicContact CG-CZ2 4.45Å; Y151-W342 HydrophobicContact CD1-CB 3.6Å; Y151-W342 HydrophobicContact CD1-CG 4.36Å; Y151-W342 HydrophobicContact CD2-CB 3.81Å; Y151-W342 HydrophobicContact CE1-CB 4Å; Y151-W342 WeakPolarHBondContact CE1-O 3.44Å; Y151-W342 HydrophobicContact CE2-CB 4.2Å; Y151-W342 WeakPolarHBondContact CE2-O 3.39Å; Y151-W342 HydrophobicContact CG-CB 3.49Å; Y151-W342 VanDerWaalsContact CG-CB 3.49Å; Y151-W342 HydrophobicContact CG-CG 4.25Å; Y151-W342 PolarHBondContact OH-O 3.03Å; I339-W342 PolarHBondContact O-N 3.39Å; N340-W342 PolarHBondContact O-N 3.13Å; W342-D344 PolarHBondContact O-N 2.76Å; W342-D344 VanDerWaalsContact O-N 3.11Å
343	Y	97.8	Very high	94.7	Very high	62 Å²	62	50.7 Å²	50.7	24%	0.243	29%	0.288	C	S	.	.			trans	-62.6	116.5	-168.6	-171.3	-81.2	0	0	0	111.5	L334 H335 N340 P345 V348	L334-Y343 HydrophobicContact CB-CD2 4.31Å; L334-Y343 HydrophobicContact CB-CE2 4.28Å; H335-Y343 AromaticContact CE1-CE2 3.79Å; H335-Y343 AromaticContact NE2-CE2 3.89Å; N340-Y343 WeakPolarHBondContact O-CB 3.45Å; N340-Y343 PolarHBondContact O-N 2.75Å; N340-Y343 WeakPolarHBondContact OD1-CB 3.13Å; Y343-P345 HydrophobicContact CD1-CG 4.37Å; Y343-P345 HydrophobicContact CE1-CB 4.45Å; Y343-P345 HydrophobicContact CE1-CG 3.93Å; Y343-V348 HydrophobicContact CD2-CG2 4.02Å; Y343-V348 HydrophobicContact CE2-CB 4.15Å; Y343-V348 HydrophobicContact CE2-CG1 3.73Å; Y343-V348 HydrophobicContact CE2-CG2 3.85Å; Y343-V348 HydrophobicContact CG-CG2 4.5Å
344	D	97.6	Very high	93.7	Very high	64 Å²	64	60 Å²	60	34%	0.342	33%	0.329	S	S	.	.			trans	-120.4	116.2	170.1	-175.7	-14.1	0	0	0	109.7	Y151 W342 A346 E347 V348	Y151-D344 PolarHBondContact OH-N 3.08Å; W342-D344 PolarHBondContact O-N 2.76Å; W342-D344 VanDerWaalsContact O-N 3.11Å; D344-A346 PolarHBondContact O-N 2.96Å; D344-A346 WeakPolarHBondContact OD1-CB 3.27Å; D344-A346 PolarHBondContact OD1-N 2.94Å; D344-E347 HydrophobicContact CB-CB 4.26Å; D344-E347 HydrophobicContact CB-CG 3.83Å; D344-E347 PolarHBondContact O-N 2.94Å; D344-V348 WeakPolarHBondContact O-CB 3.25Å; D344-V348 WeakPolarHBondContact O-CG2 3.39Å; D344-V348 PolarHBondContact O-N 2.82Å
345	P	95.9	Very high	92.5	Very high	78 Å²	78	61.1 Å²	61.1	51%	0.506	34%	0.335	S	S	.	.	H	α-helix	trans	-53.9	-33.9	176.2	-21.8	29	0	0	0	114	Y343 E347 E349	Y343-P345 HydrophobicContact CD1-CG 4.37Å; Y343-P345 HydrophobicContact CE1-CB 4.45Å; Y343-P345 HydrophobicContact CE1-CG 3.93Å; P345-E347 PolarHBondContact O-N 3.14Å; P345-E349 WeakPolarHBondContact O-CA 3.5Å; P345-E349 WeakPolarHBondContact O-CB 3.15Å; P345-E349 PolarHBondContact O-N 3.42Å
346	A	94.8	Very high	90.8	Very high	75 Å²	75	61.5 Å²	61.5	62%	0.62	35%	0.346	S	S	*	.	H	α-helix	trans	-66.6	-28	-179.3	0	0	0	0	0	112.4	D344	D344-A346 PolarHBondContact O-N 2.96Å; D344-A346 WeakPolarHBondContact OD1-CB 3.27Å; D344-A346 PolarHBondContact OD1-N 2.94Å
347	E	94.6	Very high	89.3	Confident	46 Å²	46	62.5 Å²	62.5	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-90.1	-44.5	178.6	-54.6	-177.5	162.6	0	0	110.9	H100 K101 Y151 D344 P345	H100-E347 PolarHBondContact NE2-O 3.07Å; K101-E347 WeakPolarHBondContact CE-OE1 3.49Å; K101-E347 WeakPolarHBondContact CE-OE2 3.43Å; K101-E347 IonicContact NZ-OE1 3.79Å; K101-E347 PolarHBondContact NZ-OE1 3.26Å; K101-E347 IonicContact NZ-OE2 3.81Å; K101-E347 PolarHBondContact NZ-OE2 2.99Å; Y151-E347 VanDerWaalsContact CE1-OE2 3.22Å; Y151-E347 WeakPolarHBondContact CE1-OE2 3.45Å; Y151-E347 PolarHBondContact OH-OE2 3.3Å; D344-E347 HydrophobicContact CB-CB 4.26Å; D344-E347 HydrophobicContact CB-CG 3.83Å; D344-E347 PolarHBondContact O-N 2.94Å; P345-E347 PolarHBondContact O-N 3.14Å
348	V	95.2	Very high	87.8	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.03	36%	0.364	C	S	.	.	H	α-helix	trans	-70.7	-42.8	-175.9	171.9	0	0	0	0	111.7	Y151 K158 L334 Y343 D344	Y151-V348 HydrophobicContact CE2-CG2 3.94Å; K158-V348 HydrophobicContact CD-CG1 3.63Å; K158-V348 VanDerWaalsContact CD-O 3.3Å; K158-V348 WeakPolarHBondContact CD-O 3.28Å; K158-V348 VanDerWaalsContact CE-CG1 3.49Å; K158-V348 WeakPolarHBondContact CE-O 3.43Å; L334-V348 HydrophobicContact CD1-CG1 3.85Å; L334-V348 HydrophobicContact CD1-CG2 4.46Å; L334-V348 HydrophobicContact CD2-CG2 4.33Å; Y343-V348 HydrophobicContact CD2-CG2 4.02Å; Y343-V348 HydrophobicContact CE2-CB 4.15Å; Y343-V348 HydrophobicContact CE2-CG1 3.73Å; Y343-V348 HydrophobicContact CE2-CG2 3.85Å; Y343-V348 HydrophobicContact CG-CG2 4.5Å; D344-V348 WeakPolarHBondContact O-CB 3.25Å; D344-V348 WeakPolarHBondContact O-CG2 3.39Å; D344-V348 PolarHBondContact O-N 2.82Å
349	E	92.9	Very high	86.2	Confident	108 Å²	108	70.8 Å²	70.8	51%	0.505	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	22.8	-176.6	-55.4	-59.8	155.8	0	0	112.5	K158 P345	K158-E349 VanDerWaalsContact CE-CD 3.43Å; K158-E349 WeakPolarHBondContact CE-OE1 3.43Å; K158-E349 WeakPolarHBondContact CE-OE2 3.45Å; K158-E349 IonicContact NZ-OE1 3.18Å; K158-E349 PolarHBondContact NZ-OE1 3.22Å; K158-E349 IonicContact NZ-OE2 2.68Å; K158-E349 PolarHBondContact NZ-OE2 3.08Å; P345-E349 WeakPolarHBondContact O-CA 3.5Å; P345-E349 WeakPolarHBondContact O-CB 3.15Å; P345-E349 PolarHBondContact O-N 3.42Å
350	A	90.8	Very high	84.8	Confident	24 Å²	24	71.2 Å²	71.2	20%	0.198	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-54.8	130.1	174.2	0	0	0	0	0	110.3	H159	H159-A350 PolarHBondContact ND1-O 2.8Å
351	P	88.3	Confident	83.4	Confident	109 Å²	109	68 Å²	68	71%	0.708	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-58.9	130.1	-169.6	22.1	-33.1	0	0	0	110.9	H159	H159-P351 PolarHBondContact CE1-O 2.87Å; H159-P351 VanDerWaalsContact CE1-O 3.23Å
352	P	81.8	Confident	82.2	Confident	66 Å²	66	69.8 Å²	69.8	43%	0.429	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-67.9	150.3	-174.8	27.4	-34.5	0	0	0	111.1	G162 A163 K354	G162-P352 WeakPolarHBondContact O-CB 3.39Å; A163-P352 HydrophobicContact CB-CB 4.4Å; P352-K354 PolarHBondContact O-N 2.6Å
353	P	76.2	Confident	81.3	Confident	16 Å²	16	71.3 Å²	71.3	10%	0.104	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-67.1	135.9	178.5	27.9	-35.8	0	0	0	110	C97 V98 H159 A163 I355	C97-P353 HydrophobicContact CB-CB 4.34Å; C97-P353 WeakPolarHBondContact O-CB 3.38Å; V98-P353 HydrophobicContact CB-CG 4.27Å; V98-P353 HydrophobicContact CG1-CG 4.32Å; V98-P353 HydrophobicContact CG2-CG 3.88Å; H159-P353 VanDerWaalsContact NE2-CD 3.34Å; H159-P353 WeakPolarHBondContact NE2-CD 3.09Å; A163-P353 HydrophobicContact CB-CG 3.59Å; P353-I355 PolarHBondContact O-N 2.96Å; P353-I355 VanDerWaalsContact O-N 3.14Å
354	K	77.4	Confident	80.6	Confident	195 Å²	195	76.5 Å²	76.5	85%	0.848	40%	0.4	S	S	*	.			trans	-76.9	102.1	172.8	-67.4	-177.8	-177.9	178.3	0	108.1	P352 P356	P352-K354 PolarHBondContact O-N 2.6Å; K354-P356 VanDerWaalsContact O-CD 3.23Å; K354-P356 WeakPolarHBondContact O-CD 3.28Å
355	I	72.9	Confident	80.1	Confident	24 Å²	24	75.5 Å²	75.5	12%	0.123	39%	0.393	C	S	.	.			trans	-70	116.6	171.8	-54.1	177.6	0	0	0	107.3	L94 A163 I165 P353 D357	L94-I355 HydrophobicContact CD2-CD1 4.36Å; A163-I355 HydrophobicContact CB-CD1 4.01Å; A163-I355 HydrophobicContact CB-CG1 4.22Å; A163-I355 WeakPolarHBondContact O-CD1 3.41Å; I165-I355 HydrophobicContact CD1-CD1 3.6Å; I165-I355 HydrophobicContact CD1-CG1 4.33Å; I165-I355 HydrophobicContact CG1-CD1 3.41Å; I165-I355 VanDerWaalsContact CG1-CD1 3.41Å; P353-I355 PolarHBondContact O-N 2.96Å; P353-I355 VanDerWaalsContact O-N 3.14Å; I355-D357 PolarHBondContact O-N 2.91Å
356	P	63.3	Low	80.1	Confident	109 Å²	109	74.6 Å²	74.6	71%	0.708	39%	0.386	S	S	*	.	S	Bend	trans	-61.4	-28.2	-175.7	-22.9	33.3	0	0	0	112.6	C97 K354	C97-P356 VanDerWaalsContact SG-CD 3.5Å; K354-P356 VanDerWaalsContact O-CD 3.23Å; K354-P356 WeakPolarHBondContact O-CD 3.28Å
357	D	67.7	Low	80	Confident	29 Å²	29	72.3 Å²	72.3	16%	0.155	36%	0.364	C	S	.	.			trans	-138.8	102.7	-172.8	-174.3	5.4	0	0	0	112.3	I355 T359 L360 R363	I355-D357 PolarHBondContact O-N 2.91Å; D357-T359 VanDerWaalsContact C-N 3.27Å; D357-T359 PolarHBondContact O-N 3.07Å; D357-T359 WeakPolarHBondContact OD1-CA 3.42Å; D357-T359 WeakPolarHBondContact OD1-CB 3.19Å; D357-T359 PolarHBondContact OD1-N 3.49Å; D357-T359 PolarHBondContact OD1-OG1 3.03Å; D357-L360 HydrophobicContact CB-CB 4.48Å; D357-L360 WeakPolarHBondContact O-CB 3.37Å; D357-L360 PolarHBondContact OD1-N 3.24Å; D357-R363 IonicContact OD1-CZ 3.42Å; D357-R363 IonicContact OD1-NH2 2.7Å; D357-R363 PolarHBondContact OD1-NH2 2.81Å; D357-R363 IonicContact OD2-CZ 2.66Å; D357-R363 IonicContact OD2-NE 3.8Å; D357-R363 IonicContact OD2-NH1 2.78Å; D357-R363 PolarHBondContact OD2-NH1 3.33Å; D357-R363 IonicContact OD2-NH2 3.43Å; D357-R363 PolarHBondContact OD2-NH2 3.17Å
358	R	65.7	Low	80	Confident	188 Å²	188	76 Å²	76	71%	0.709	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.9	174.9	-68.9	-177.5	168.7	-175.4	-4.4	113.2	L360	R358-L360 VanDerWaalsContact C-N 3.31Å
359	T	66.1	Low	79.9	Confident	56 Å²	56	79.8 Å²	79.8	34%	0.344	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.6	178.6	67.9	0	0	0	0	113	D357 D361 E362 R363	D357-T359 VanDerWaalsContact C-N 3.27Å; D357-T359 PolarHBondContact O-N 3.07Å; D357-T359 WeakPolarHBondContact OD1-CA 3.42Å; D357-T359 WeakPolarHBondContact OD1-CB 3.19Å; D357-T359 PolarHBondContact OD1-N 3.49Å; D357-T359 PolarHBondContact OD1-OG1 3.03Å; T359-D361 PolarHBondContact O-N 3.48Å; T359-D361 VanDerWaalsContact O-N 3.09Å; T359-E362 PolarHBondContact O-N 2.91Å; T359-R363 PolarHBondContact O-N 2.87Å; T359-R363 PolarHBondContact OG1-NE 2.86Å; T359-R363 VanDerWaalsContact OG1-NE 3.15Å; T359-R363 PolarHBondContact OG1-NH2 3.33Å
360	L	69	Low	80	Confident	10 Å²	10	74.9 Å²	74.9	5%	0.052	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.2	-176.1	-174.2	147.9	0	0	0	113.2	Y89 R90 V93 D357 R358	Y89-L360 HydrophobicContact CD1-CD1 3.98Å; Y89-L360 HydrophobicContact CD1-CG 4.3Å; Y89-L360 HydrophobicContact CE1-CD1 3.53Å; Y89-L360 HydrophobicContact CE1-CG 4.1Å; R90-L360 HydrophobicContact CB-CD2 3.73Å; R90-L360 HydrophobicContact CG-CD2 3.43Å; R90-L360 VanDerWaalsContact CG-CD2 3.43Å; V93-L360 HydrophobicContact CB-CD1 4.08Å; V93-L360 HydrophobicContact CG1-CD1 3.85Å; V93-L360 HydrophobicContact CG2-CD1 4.1Å; D357-L360 HydrophobicContact CB-CB 4.48Å; D357-L360 WeakPolarHBondContact O-CB 3.37Å; D357-L360 PolarHBondContact OD1-N 3.24Å; R358-L360 VanDerWaalsContact C-N 3.31Å
361	D	67.4	Low	80.2	Confident	6 Å²	6	75.6 Å²	75.6	3%	0.032	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.9	176.8	-74.1	-41	0	0	0	113.9	K86 R90 T193 T196 T359	K86-D361 WeakPolarHBondContact CE-O 2.97Å; K86-D361 PolarHBondContact NZ-O 3.22Å; R90-D361 WeakPolarHBondContact CD-OD1 3.48Å; R90-D361 IonicContact CZ-OD1 2.7Å; R90-D361 IonicContact NH1-OD1 3.65Å; R90-D361 PolarHBondContact NH1-OD1 2.9Å; R90-D361 IonicContact NH1-OD2 3.36Å; T193-D361 WeakPolarHBondContact CB-OD2 3.39Å; T193-D361 PolarHBondContact N-OD2 3.46Å; T193-D361 PolarHBondContact OG1-OD2 3.28Å; T196-D361 HydrophobicContact CG2-CB 4.05Å; T359-D361 PolarHBondContact O-N 3.48Å; T359-D361 VanDerWaalsContact O-N 3.09Å
362	E	73.1	Confident	80.6	Confident	125 Å²	125	75.4 Å²	75.4	58%	0.584	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-23.1	-177.4	-65.8	176.5	176.9	0	0	112.7	T196 T359 E364	T196-E362 HydrophobicContact CG2-CG 4.1Å; T359-E362 PolarHBondContact O-N 2.91Å; E362-E364 PolarHBondContact O-N 3.14Å
363	R	78.1	Confident	81.1	Confident	102 Å²	102	74.7 Å²	74.7	39%	0.385	36%	0.356	S	S	.	.			trans	-67.3	131.8	179.9	-65.9	-179.8	-169.8	175.3	7.7	111.7	K86 D357 T359	K86-R363 PolarHBondContact NZ-O 2.79Å; D357-R363 IonicContact OD1-CZ 3.42Å; D357-R363 IonicContact OD1-NH2 2.7Å; D357-R363 PolarHBondContact OD1-NH2 2.81Å; D357-R363 IonicContact OD2-CZ 2.66Å; D357-R363 IonicContact OD2-NE 3.8Å; D357-R363 IonicContact OD2-NH1 2.78Å; D357-R363 PolarHBondContact OD2-NH1 3.33Å; D357-R363 IonicContact OD2-NH2 3.43Å; D357-R363 PolarHBondContact OD2-NH2 3.17Å; T359-R363 PolarHBondContact O-N 2.87Å; T359-R363 PolarHBondContact OG1-NE 2.86Å; T359-R363 VanDerWaalsContact OG1-NE 3.15Å; T359-R363 PolarHBondContact OG1-NH2 3.33Å
364	E	83.3	Confident	82	Confident	171 Å²	171	74 Å²	74	80%	0.799	35%	0.352	S	S	*	.			trans	-106.9	126.8	166.8	-62.8	-164.4	160.3	0	0	108.1	E362	E362-E364 PolarHBondContact O-N 3.14Å
365	H	88.4	Confident	82.8	Confident	43 Å²	43	66.6 Å²	66.6	20%	0.199	32%	0.319	C	S	.	.			trans	-134.5	151.8	178	-66.7	-64	0	0	0	108.5	E369 W370	H365-E369 WeakPolarHBondContact CA-OE2 3.29Å; H365-E369 HydrophobicContact CB-CB 3.85Å; H365-E369 IonicContact ND1-OE2 2.57Å; H365-W370 HydrophobicContact CB-CD2 3.99Å; H365-W370 HydrophobicContact CB-CG 4.09Å; H365-W370 HydrophobicContact CB-CZ2 4.16Å; H365-W370 AromaticContact CD2-CE2 3.89Å; H365-W370 AromaticContact CD2-CH2 3.55Å; H365-W370 AromaticContact CD2-CZ2 3.57Å; H365-W370 AromaticContact CD2-CZ3 3.84Å; H365-W370 PolarHBondContact O-NE1 2.88Å
366	T	94.3	Very high	83.8	Confident	60 Å²	60	71.4 Å²	71.4	37%	0.368	34%	0.339	S	S	.	.			trans	-62.3	165.8	166.8	60.8	0	0	0	0	110.8	E368 E369 W370	T366-E368 PolarHBondContact O-N 3.32Å; T366-E369 PolarHBondContact N-OE2 3.1Å; T366-E369 PolarHBondContact O-N 3.43Å; T366-E369 WeakPolarHBondContact OG1-CB 3.46Å; T366-E369 VanDerWaalsContact OG1-CD 3.27Å; T366-E369 WeakPolarHBondContact OG1-CG 3.44Å; T366-E369 PolarHBondContact OG1-N 3.26Å; T366-E369 PolarHBondContact OG1-OE2 2.95Å; T366-W370 PolarHBondContact O-N 3.03Å
367	V	93.6	Very high	85.1	Confident	26 Å²	26	68 Å²	68	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-37.2	178.9	172.6	0	0	0	0	110.4	F79 Q82 W370 K371	F79-V367 HydrophobicContact CB-CG1 3.88Å; F79-V367 WeakPolarHBondContact O-CG1 3.48Å; Q82-V367 HydrophobicContact CG-CG2 3.9Å; V367-W370 PolarHBondContact O-N 3.32Å; V367-K371 VanDerWaalsContact O-CB 3.28Å; V367-K371 WeakPolarHBondContact O-CB 3.25Å; V367-K371 PolarHBondContact O-N 3.5Å
368	E	94.1	Very high	86.3	Confident	125 Å²	125	66.6 Å²	66.6	58%	0.584	31%	0.306	S	S	*	.	H	α-helix	trans	-64.6	-47.5	179.8	-67	67.6	-151.4	0	0	111.1	T366 W370 K371 E372	T366-E368 PolarHBondContact O-N 3.32Å; E368-W370 PolarHBondContact O-N 3.44Å; E368-K371 WeakPolarHBondContact O-CB 3.15Å; E368-K371 PolarHBondContact O-N 3.48Å; E368-K371 VanDerWaalsContact O-N 3.16Å; E368-E372 PolarHBondContact O-N 3.26Å
369	E	94.6	Very high	87.5	Confident	84 Å²	84	59.2 Å²	59.2	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-41.8	174.7	-73.3	167.3	143.9	0	0	111.9	H365 T366 K371 E372 L373	H365-E369 WeakPolarHBondContact CA-OE2 3.29Å; H365-E369 HydrophobicContact CB-CB 3.85Å; H365-E369 IonicContact ND1-OE2 2.57Å; T366-E369 PolarHBondContact N-OE2 3.1Å; T366-E369 PolarHBondContact O-N 3.43Å; T366-E369 WeakPolarHBondContact OG1-CB 3.46Å; T366-E369 VanDerWaalsContact OG1-CD 3.27Å; T366-E369 WeakPolarHBondContact OG1-CG 3.44Å; T366-E369 PolarHBondContact OG1-N 3.26Å; T366-E369 PolarHBondContact OG1-OE2 2.95Å; E369-K371 VanDerWaalsContact C-N 3.31Å; E369-K371 PolarHBondContact O-N 2.79Å; E369-E372 WeakPolarHBondContact O-CB 3.26Å; E369-E372 PolarHBondContact O-N 3.41Å; E369-L373 WeakPolarHBondContact O-CG 3.41Å; E369-L373 PolarHBondContact O-N 2.93Å
370	W	94.5	Very high	88.6	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-39.2	173.5	-78.9	123.7	0	0	0	112.2	A85 K86 Y89 H365 T366 V367 E368 E372 L373 I374	A85-W370 HydrophobicContact CB-CB 3.53Å; A85-W370 HydrophobicContact CB-CG 3.86Å; K86-W370 HydrophobicContact CB-CD2 4.45Å; K86-W370 HydrophobicContact CB-CZ2 3.86Å; K86-W370 HydrophobicContact CD-CZ2 3.8Å; K86-W370 HydrophobicContact CG-CH2 4.13Å; K86-W370 HydrophobicContact CG-CZ2 3.63Å; Y89-W370 AromaticContact CD1-CE3 3.91Å; Y89-W370 HydrophobicContact CD1-CE3 3.91Å; Y89-W370 HydrophobicContact CD1-CH2 4.2Å; Y89-W370 AromaticContact CD1-CZ3 3.3Å; Y89-W370 HydrophobicContact CD1-CZ3 3.3Å; Y89-W370 AromaticContact CE1-CZ3 3.81Å; Y89-W370 HydrophobicContact CE1-CZ3 3.81Å; Y89-W370 AromaticContact CG-CE3 3.86Å; Y89-W370 HydrophobicContact CG-CE3 3.86Å; Y89-W370 AromaticContact CG-CZ3 3.76Å; Y89-W370 HydrophobicContact CG-CZ3 3.76Å; H365-W370 HydrophobicContact CB-CD2 3.99Å; H365-W370 HydrophobicContact CB-CG 4.09Å; H365-W370 HydrophobicContact CB-CZ2 4.16Å; H365-W370 AromaticContact CD2-CE2 3.89Å; H365-W370 AromaticContact CD2-CH2 3.55Å; H365-W370 AromaticContact CD2-CZ2 3.57Å; H365-W370 AromaticContact CD2-CZ3 3.84Å; H365-W370 PolarHBondContact O-NE1 2.88Å; T366-W370 PolarHBondContact O-N 3.03Å; V367-W370 PolarHBondContact O-N 3.32Å; E368-W370 PolarHBondContact O-N 3.44Å; W370-E372 VanDerWaalsContact C-N 3.33Å; W370-L373 HydrophobicContact CE3-CD1 3.68Å; W370-L373 HydrophobicContact CZ3-CD1 3.75Å; W370-L373 PolarHBondContact O-N 2.89Å; W370-I374 WeakPolarHBondContact O-CB 3.43Å; W370-I374 VanDerWaalsContact O-CG1 3.24Å; W370-I374 WeakPolarHBondContact O-CG1 3.31Å; W370-I374 PolarHBondContact O-N 2.91Å
371	K	95.3	Very high	89.3	Confident	40 Å²	40	61 Å²	61	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-42.1	177.3	-179.5	176.4	161.8	173.7	0	110.7	F79 L116 E117 F119 V367 E368 E369 Y375	F79-K371 HydrophobicContact CD1-CB 3.72Å; F79-K371 HydrophobicContact CD1-CD 4.49Å; F79-K371 HydrophobicContact CD1-CG 3.97Å; F79-K371 HydrophobicContact CD2-CD 4.2Å; F79-K371 HydrophobicContact CD2-CG 4.27Å; F79-K371 HydrophobicContact CE1-CB 3.89Å; F79-K371 HydrophobicContact CE1-CG 3.93Å; F79-K371 HydrophobicContact CE2-CG 4.23Å; F79-K371 HydrophobicContact CG-CB 4.25Å; F79-K371 HydrophobicContact CG-CD 4.21Å; F79-K371 HydrophobicContact CG-CG 4.17Å; F79-K371 HydrophobicContact CZ-CG 4.1Å; L116-K371 HydrophobicContact CD1-CG 4.13Å; L116-K371 WeakPolarHBondContact O-CE 3.45Å; L116-K371 PolarHBondContact O-NZ 3.46Å; E117-K371 PolarHBondContact O-NZ 2.83Å; F119-K371 HydrophobicContact CD1-CD 4.49Å; F119-K371 HydrophobicContact CD1-CG 3.68Å; F119-K371 HydrophobicContact CE1-CG 4.28Å; F119-K371 WeakPolarHBondContact O-CE 3.29Å; F119-K371 PolarHBondContact O-NZ 2.93Å; V367-K371 VanDerWaalsContact O-CB 3.28Å; V367-K371 WeakPolarHBondContact O-CB 3.25Å; V367-K371 PolarHBondContact O-N 3.5Å; E368-K371 WeakPolarHBondContact O-CB 3.15Å; E368-K371 PolarHBondContact O-N 3.48Å; E368-K371 VanDerWaalsContact O-N 3.16Å; E369-K371 VanDerWaalsContact C-N 3.31Å; E369-K371 PolarHBondContact O-N 2.79Å; K371-Y375 VanDerWaalsContact O-CB 3.25Å; K371-Y375 WeakPolarHBondContact O-CB 3.49Å; K371-Y375 PolarHBondContact O-N 3.01Å
372	E	95.1	Very high	90	Very high	105 Å²	105	61.7 Å²	61.7	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-59.6	-49.1	172.2	-78.7	176.7	-164.2	0	0	112.8	L116 E368 E369 W370 I374 Y375 K376	L116-E372 HydrophobicContact CD1-CB 4.49Å; L116-E372 HydrophobicContact CD1-CG 3.93Å; L116-E372 HydrophobicContact CD2-CG 3.45Å; L116-E372 VanDerWaalsContact CD2-CG 3.45Å; L116-E372 HydrophobicContact CG-CG 4.28Å; E368-E372 PolarHBondContact O-N 3.26Å; E369-E372 WeakPolarHBondContact O-CB 3.26Å; E369-E372 PolarHBondContact O-N 3.41Å; W370-E372 VanDerWaalsContact C-N 3.33Å; E372-I374 PolarHBondContact O-N 3.07Å; E372-Y375 PolarHBondContact O-N 3.28Å; E372-K376 WeakPolarHBondContact O-CB 3.39Å; E372-K376 PolarHBondContact O-N 2.8Å
373	L	93.9	Very high	90.3	Very high	50 Å²	50	62.4 Å²	62.4	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-46.3	179.3	-71.3	172.6	0	0	0	111.7	Y89 E369 W370 K376 E377	Y89-L373 HydrophobicContact CD2-CB 3.95Å; Y89-L373 HydrophobicContact CE2-CB 3.66Å; E369-L373 WeakPolarHBondContact O-CG 3.41Å; E369-L373 PolarHBondContact O-N 2.93Å; W370-L373 HydrophobicContact CE3-CD1 3.68Å; W370-L373 HydrophobicContact CZ3-CD1 3.75Å; W370-L373 PolarHBondContact O-N 2.89Å; L373-K376 PolarHBondContact O-N 2.86Å; L373-E377 WeakPolarHBondContact O-CG 3.23Å; L373-E377 PolarHBondContact O-N 2.93Å; L373-E377 VanDerWaalsContact O-N 3.08Å
374	I	94.1	Very high	90.4	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-46.1	177.2	-65.6	165.5	0	0	0	110	F79 A85 A88 Y89 L92 F119 V122 W370 E372 K376 E377 V378	F79-I374 HydrophobicContact CD1-CD1 4.43Å; F79-I374 HydrophobicContact CE1-CB 4.32Å; F79-I374 HydrophobicContact CE1-CD1 3.62Å; F79-I374 HydrophobicContact CZ-CD1 4.46Å; F79-I374 HydrophobicContact CZ-CG2 4.43Å; A85-I374 WeakPolarHBondContact O-CD1 3.36Å; A88-I374 HydrophobicContact CB-CD1 3.99Å; Y89-I374 HydrophobicContact CD2-CG1 3.65Å; Y89-I374 HydrophobicContact CG-CG1 4.11Å; L92-I374 HydrophobicContact CD2-CG2 4.32Å; F119-I374 HydrophobicContact CE1-CB 4.18Å; F119-I374 HydrophobicContact CE1-CG2 3.97Å; F119-I374 HydrophobicContact CZ-CB 4.48Å; F119-I374 HydrophobicContact CZ-CG2 3.77Å; V122-I374 HydrophobicContact CG2-CG2 3.97Å; W370-I374 WeakPolarHBondContact O-CB 3.43Å; W370-I374 VanDerWaalsContact O-CG1 3.24Å; W370-I374 WeakPolarHBondContact O-CG1 3.31Å; W370-I374 PolarHBondContact O-N 2.91Å; E372-I374 PolarHBondContact O-N 3.07Å; I374-K376 VanDerWaalsContact C-N 3.31Å; I374-K376 PolarHBondContact O-N 3.08Å; I374-E377 PolarHBondContact O-N 3.19Å; I374-V378 HydrophobicContact CG2-CG2 4.28Å; I374-V378 VanDerWaalsContact O-CG2 3.28Å; I374-V378 WeakPolarHBondContact O-CG2 2.86Å; I374-V378 PolarHBondContact O-N 2.91Å
375	Y	94.7	Very high	89.8	Confident	41 Å²	41	57 Å²	57	16%	0.161	26%	0.262	C	S	.	.	H	α-helix	trans	-57.1	-47.2	180	-174.4	-108.5	0	0	0	111.1	T111 K114 L116 F119 K371 E372 E377 V378 I379	T111-Y375 HydrophobicContact CG2-CE2 4.28Å; K114-Y375 PolarHBondContact O-OH 3.27Å; L116-Y375 HydrophobicContact CB-CD1 4.19Å; L116-Y375 HydrophobicContact CB-CE1 4.3Å; L116-Y375 HydrophobicContact CD1-CD1 4.18Å; L116-Y375 HydrophobicContact CD1-CG 4Å; F119-Y375 HydrophobicContact CB-CD2 3.84Å; F119-Y375 HydrophobicContact CB-CE2 4.21Å; F119-Y375 AromaticContact CD1-CD2 3.68Å; F119-Y375 HydrophobicContact CD1-CD2 3.68Å; F119-Y375 HydrophobicContact CD1-CG 4.08Å; F119-Y375 AromaticContact CD2-CD2 3.85Å; F119-Y375 HydrophobicContact CD2-CD2 3.85Å; F119-Y375 HydrophobicContact CD2-CE2 4.43Å; F119-Y375 HydrophobicContact CE1-CD2 4.09Å; F119-Y375 HydrophobicContact CE1-CG 4.38Å; F119-Y375 HydrophobicContact CE2-CD2 4.27Å; F119-Y375 AromaticContact CG-CD2 3.53Å; F119-Y375 HydrophobicContact CG-CD2 3.53Å; F119-Y375 HydrophobicContact CG-CE2 4.26Å; F119-Y375 HydrophobicContact CG-CG 4.36Å; F119-Y375 HydrophobicContact CZ-CD2 4.36Å; K371-Y375 VanDerWaalsContact O-CB 3.25Å; K371-Y375 WeakPolarHBondContact O-CB 3.49Å; K371-Y375 PolarHBondContact O-N 3.01Å; E372-Y375 PolarHBondContact O-N 3.28Å; Y375-E377 PolarHBondContact O-N 2.94Å; Y375-V378 PolarHBondContact O-N 3.14Å; Y375-I379 HydrophobicContact CD1-CG1 4.19Å; Y375-I379 HydrophobicContact CD2-CG1 4.39Å; Y375-I379 HydrophobicContact CE1-CD1 4.5Å; Y375-I379 HydrophobicContact CE1-CG1 3.82Å; Y375-I379 HydrophobicContact CE2-CD1 4.09Å; Y375-I379 HydrophobicContact CE2-CG1 4.06Å; Y375-I379 HydrophobicContact CG-CG1 4.46Å; Y375-I379 WeakPolarHBondContact O-CG1 3.37Å; Y375-I379 PolarHBondContact O-N 3.24Å
376	K	93	Very high	88.9	Confident	124 Å²	124	62.5 Å²	62.5	54%	0.539	29%	0.286	S	S	.	.	H	α-helix	trans	-58.1	-47.8	176.7	-176.9	176	173.7	178.7	0	112.1	E372 L373 I374 V378 I379 E380	E372-K376 WeakPolarHBondContact O-CB 3.39Å; E372-K376 PolarHBondContact O-N 2.8Å; L373-K376 PolarHBondContact O-N 2.86Å; I374-K376 VanDerWaalsContact C-N 3.31Å; I374-K376 PolarHBondContact O-N 3.08Å; K376-V378 VanDerWaalsContact C-N 3.27Å; K376-V378 PolarHBondContact O-N 2.91Å; K376-I379 PolarHBondContact O-N 3.18Å; K376-E380 WeakPolarHBondContact CE-OE1 3.41Å; K376-E380 HydrophobicContact CG-CG 4.32Å; K376-E380 WeakPolarHBondContact CG-OE1 3.29Å; K376-E380 IonicContact NZ-OE1 3.73Å; K376-E380 WeakPolarHBondContact O-CB 3.39Å; K376-E380 VanDerWaalsContact O-CG 3.31Å; K376-E380 WeakPolarHBondContact O-CG 3.3Å; K376-E380 PolarHBondContact O-N 2.84Å
377	E	91.6	Very high	87.5	Confident	37 Å²	37	60.8 Å²	60.8	17%	0.173	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-34.6	178.7	-71.7	-66.4	161	0	0	113.4	Y89 L92 K96 L373 I374 Y375 W381	Y89-E377 HydrophobicContact CD2-CG 4.37Å; Y89-E377 HydrophobicContact CE2-CG 3.57Å; L92-E377 HydrophobicContact CD2-CB 3.6Å; L92-E377 HydrophobicContact CG-CB 4.4Å; K96-E377 PolarHBondContact NZ-O 2.8Å; K96-E377 IonicContact NZ-OE2 3.75Å; K96-E377 PolarHBondContact NZ-OE2 2.84Å; L373-E377 WeakPolarHBondContact O-CG 3.23Å; L373-E377 PolarHBondContact O-N 2.93Å; L373-E377 VanDerWaalsContact O-N 3.08Å; I374-E377 PolarHBondContact O-N 3.19Å; Y375-E377 PolarHBondContact O-N 2.94Å; E377-W381 WeakPolarHBondContact O-CB 3.02Å; E377-W381 PolarHBondContact O-N 3.08Å
378	V	93	Very high	85.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-70.9	-49.8	177.2	174.2	0	0	0	0	110.6	L92 V109 T111 V122 I374 Y375 K376 W381 E382	L92-V378 HydrophobicContact CD2-CG2 3.98Å; V109-V378 HydrophobicContact CG2-CG1 4.29Å; V109-V378 HydrophobicContact CG2-CG2 3.84Å; T111-V378 HydrophobicContact CG2-CG1 3.93Å; V122-V378 HydrophobicContact CG1-CG2 4.3Å; I374-V378 HydrophobicContact CG2-CG2 4.28Å; I374-V378 VanDerWaalsContact O-CG2 3.28Å; I374-V378 WeakPolarHBondContact O-CG2 2.86Å; I374-V378 PolarHBondContact O-N 2.91Å; Y375-V378 PolarHBondContact O-N 3.14Å; K376-V378 VanDerWaalsContact C-N 3.27Å; K376-V378 PolarHBondContact O-N 2.91Å; V378-W381 WeakPolarHBondContact O-CB 3.48Å; V378-W381 PolarHBondContact O-N 3.24Å; V378-E382 PolarHBondContact O-N 3.49Å
379	I	90.1	Very high	83.5	Confident	33 Å²	33	59 Å²	59	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-43.9	-179.7	-62.4	-57.8	0	0	0	111.2	Y375 K376 W381 E382 E383	Y375-I379 HydrophobicContact CD1-CG1 4.19Å; Y375-I379 HydrophobicContact CD2-CG1 4.39Å; Y375-I379 HydrophobicContact CE1-CD1 4.5Å; Y375-I379 HydrophobicContact CE1-CG1 3.82Å; Y375-I379 HydrophobicContact CE2-CD1 4.09Å; Y375-I379 HydrophobicContact CE2-CG1 4.06Å; Y375-I379 HydrophobicContact CG-CG1 4.46Å; Y375-I379 WeakPolarHBondContact O-CG1 3.37Å; Y375-I379 PolarHBondContact O-N 3.24Å; K376-I379 PolarHBondContact O-N 3.18Å; I379-W381 PolarHBondContact O-N 3.1Å; I379-E382 PolarHBondContact O-N 3.37Å; I379-E382 VanDerWaalsContact O-N 3.14Å; I379-E383 HydrophobicContact CG2-CG 4.34Å; I379-E383 WeakPolarHBondContact O-CG 3.04Å; I379-E383 PolarHBondContact O-N 3.46Å
380	E	88.6	Confident	81.3	Confident	65 Å²	65	60.1 Å²	60.1	30%	0.304	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-28.5	176	-75.5	-178.5	-174.7	0	0	113.1	K376 R384	K376-E380 WeakPolarHBondContact CE-OE1 3.41Å; K376-E380 HydrophobicContact CG-CG 4.32Å; K376-E380 WeakPolarHBondContact CG-OE1 3.29Å; K376-E380 IonicContact NZ-OE1 3.73Å; K376-E380 WeakPolarHBondContact O-CB 3.39Å; K376-E380 VanDerWaalsContact O-CG 3.31Å; K376-E380 WeakPolarHBondContact O-CG 3.3Å; K376-E380 PolarHBondContact O-N 2.84Å; E380-R384 WeakPolarHBondContact O-CB 3.33Å; E380-R384 VanDerWaalsContact O-CG 3.31Å; E380-R384 WeakPolarHBondContact O-CG 3.23Å; E380-R384 PolarHBondContact O-N 3.34Å; E380-R384 PolarHBondContact O-NE 3.25Å; E380-R384 IonicContact OE2-NH2 3.38Å
381	W	85.4	Confident	78.4	Confident	38 Å²	38	71.9 Å²	71.9	14%	0.144	33%	0.327	C	S	.	.	H	α-helix	trans	-77.2	-44.4	174.1	-173.6	-84.7	0	0	0	111.6	K96 L106 N108 V109 E377 V378 I379 E383 R384 T385	K96-W381 HydrophobicContact CB-CZ3 4.18Å; K96-W381 HydrophobicContact CD-CE3 3.97Å; K96-W381 HydrophobicContact CD-CZ3 4.24Å; K96-W381 HydrophobicContact CG-CE3 3.87Å; K96-W381 HydrophobicContact CG-CH2 4.41Å; K96-W381 HydrophobicContact CG-CZ3 3.66Å; L106-W381 HydrophobicContact CD2-CH2 4.22Å; L106-W381 HydrophobicContact CD2-CZ2 4.08Å; L106-W381 HydrophobicContact CG-CZ2 4.28Å; N108-W381 PolarHBondContact OD1-NE1 2.9Å; V109-W381 HydrophobicContact CG1-CB 3.57Å; V109-W381 HydrophobicContact CG1-CD2 4Å; V109-W381 HydrophobicContact CG1-CG 3.34Å; E377-W381 WeakPolarHBondContact O-CB 3.02Å; E377-W381 PolarHBondContact O-N 3.08Å; V378-W381 WeakPolarHBondContact O-CB 3.48Å; V378-W381 PolarHBondContact O-N 3.24Å; I379-W381 PolarHBondContact O-N 3.1Å; W381-E383 VanDerWaalsContact C-N 3.3Å; W381-E383 PolarHBondContact O-N 2.87Å; W381-R384 PolarHBondContact O-N 2.87Å; W381-T385 HydrophobicContact CD2-CG2 4.26Å; W381-T385 HydrophobicContact CG-CG2 4.32Å; W381-T385 HydrophobicContact CZ2-CG2 4.34Å; W381-T385 WeakPolarHBondContact O-CB 3.33Å; W381-T385 WeakPolarHBondContact O-CG2 3.41Å; W381-T385 PolarHBondContact O-N 2.92Å; W381-T385 PolarHBondContact O-OG1 2.82Å
382	E	81.8	Confident	75.7	Confident	22 Å²	22	73.3 Å²	73.3	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-56.1	-45	175.5	174.2	167.8	-156.2	0	0	110.9	R24 V378 I379 K386 N387	R24-E382 IonicContact NH2-OE1 2.82Å; R24-E382 IonicContact NH2-OE2 2.69Å; R24-E382 PolarHBondContact NH2-OE2 2.82Å; V378-E382 PolarHBondContact O-N 3.49Å; I379-E382 PolarHBondContact O-N 3.37Å; I379-E382 VanDerWaalsContact O-N 3.14Å; E382-K386 VanDerWaalsContact O-CA 3.22Å; E382-K386 WeakPolarHBondContact O-CA 3.45Å; E382-K386 PolarHBondContact O-N 3.4Å; E382-N387 WeakPolarHBondContact CG-OD1 3.48Å; E382-N387 PolarHBondContact O-N 3.34Å; E382-N387 PolarHBondContact OE1-ND2 3.22Å
383	E	79.6	Confident	72.8	Confident	140 Å²	140	74.4 Å²	74.4	65%	0.654	36%	0.358	S	S	*	.	H	α-helix	trans	-65.6	-44.3	177.7	-72.2	-179.4	169	0	0	112.8	I379 W381	I379-E383 HydrophobicContact CG2-CG 4.34Å; I379-E383 WeakPolarHBondContact O-CG 3.04Å; I379-E383 PolarHBondContact O-N 3.46Å; W381-E383 VanDerWaalsContact C-N 3.3Å; W381-E383 PolarHBondContact O-N 2.87Å
384	R	78.6	Confident	69.8	Low	150 Å²	150	77.9 Å²	77.9	57%	0.566	38%	0.384	S	S	*	.	H	α-helix	trans	-64.4	-41.3	178.5	-84.4	-175.7	-78	179.5	-20.2	112.7	E380 W381	E380-R384 WeakPolarHBondContact O-CB 3.33Å; E380-R384 VanDerWaalsContact O-CG 3.31Å; E380-R384 WeakPolarHBondContact O-CG 3.23Å; E380-R384 PolarHBondContact O-N 3.34Å; E380-R384 PolarHBondContact O-NE 3.25Å; E380-R384 IonicContact OE2-NH2 3.38Å; W381-R384 PolarHBondContact O-N 2.87Å
385	T	71.8	Confident	66.7	Low	8 Å²	8	84.2 Å²	84.2	5%	0.049	42%	0.423	C	S	.	.	H	α-helix	trans	-91.2	-12.7	-175.5	61.5	0	0	0	0	112.8	W381 N387 G388 V389 I390	W381-T385 HydrophobicContact CD2-CG2 4.26Å; W381-T385 HydrophobicContact CG-CG2 4.32Å; W381-T385 HydrophobicContact CZ2-CG2 4.34Å; W381-T385 WeakPolarHBondContact O-CB 3.33Å; W381-T385 WeakPolarHBondContact O-CG2 3.41Å; W381-T385 PolarHBondContact O-N 2.92Å; W381-T385 PolarHBondContact O-OG1 2.82Å; T385-N387 PolarHBondContact O-N 2.78Å; T385-G388 CarbonylContact O-C 3.53Å; T385-G388 WeakPolarHBondContact O-CA 3.5Å; T385-G388 PolarHBondContact O-N 3.49Å; T385-V389 PolarHBondContact O-N 2.84Å; T385-I390 HydrophobicContact CG2-CD1 3.89Å
386	K	69.6	Low	63.6	Low	160 Å²	160	87 Å²	87	70%	0.696	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	44.7	-169.3	-62.6	-175.5	178.9	180	0	111.9	E382 G388	E382-K386 VanDerWaalsContact O-CA 3.22Å; E382-K386 WeakPolarHBondContact O-CA 3.45Å; E382-K386 PolarHBondContact O-N 3.4Å; K386-G388 PolarHBondContact O-N 3.41Å
387	N	64.2	Low	60.7	Low	24 Å²	24	90 Å²	90	13%	0.128	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	39.8	-172	-75.4	-39.3	0	0	0	113.6	L41 R43 E382 T385	L41-N387 HydrophobicContact CD1-CB 4.01Å; R43-N387 PolarHBondContact NH1-O 2.84Å; E382-N387 WeakPolarHBondContact CG-OD1 3.48Å; E382-N387 PolarHBondContact O-N 3.34Å; E382-N387 PolarHBondContact OE1-ND2 3.22Å; T385-N387 PolarHBondContact O-N 2.78Å
388	G	55.6	Low	57.8	Low	16 Å²	16	91.2 Å²	91.2	17%	0.165	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	39.9	169.8	0	0	0	0	0	116.1	R43 I65 T385 K386	R43-G388 PolarHBondContact NH1-O 3.28Å; I65-G388 WeakPolarHBondContact CG2-O 3.4Å; T385-G388 CarbonylContact O-C 3.53Å; T385-G388 WeakPolarHBondContact O-CA 3.5Å; T385-G388 PolarHBondContact O-N 3.49Å; K386-G388 PolarHBondContact O-N 3.41Å
389	V	48.5	Very low	54.8	Low	97 Å²	97	95.8 Å²	95.8	59%	0.588	54%	0.536	S	S	*	.			trans	-104.2	70.8	161.5	-170.4	0	0	0	0	108.7	T385	T385-V389 PolarHBondContact O-N 2.84Å
390	I	47.9	Very low	51.8	Low	108 Å²	108	98.9 Å²	98.9	55%	0.554	57%	0.566	S	S	*	*			trans	-105.5	103.6	163.6	-60.1	-179.3	0	0	0	107.2	T385 G392	T385-I390 HydrophobicContact CG2-CD1 3.89Å; I390-G392 PolarHBondContact O-N 3.05Å
391	R	34.7	Very low	48.9	Very low	251 Å²	251	102 Å²	102	95%	0.947	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	110.6	161.6	-80.5	-175.3	-178.9	-168.2	-0.3	107.2
392	G	37.8	Very low	46.4	Very low	69 Å²	69	107.6 Å²	107.6	71%	0.711	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.6	37.6	165.7	0	0	0	0	0	117.9	I390	I390-G392 PolarHBondContact O-N 3.05Å
393	Q	35.3	Very low	43.8	Very low	129 Å²	129	113.9 Å²	113.9	60%	0.603	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-73.2	132.4	150	-88.8	-171.1	-14.4	0	0	108.3	T395	Q393-T395 PolarHBondContact O-N 3.27Å
394	P	30	Very low	41.4	Very low	123 Å²	123	111.6 Å²	111.6	80%	0.799	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.8	176.4	-16.5	28.4	0	0	0	109.2	A396	P394-A396 PolarHBondContact O-N 3.14Å
395	T	29.6	Very low	39.1	Very low	134 Å²	134	110.1 Å²	110.1	82%	0.822	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-48.6	132.7	161.6	27.1	0	0	0	0	109.2	Q393 L397	Q393-T395 PolarHBondContact O-N 3.27Å; T395-L397 PolarHBondContact O-N 2.78Å
396	A	29.8	Very low	37.2	Very low	99 Å²	99	115.6 Å²	115.6	82%	0.818	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-48.3	128	169.7	0	0	0	0	0	109.2	P394 G398	P394-A396 PolarHBondContact O-N 3.14Å; A396-G398 PolarHBondContact O-N 2.94Å
397	L	32.3	Very low	35.2	Very low	186 Å²	186	117 Å²	117	97%	0.974	71%	0.709	S	S	*	*			trans	-59.4	106.3	179.8	-89.1	146.7	0	0	0	110.3	T395	T395-L397 PolarHBondContact O-N 2.78Å
398	G	30	Very low	33.6	Very low	64 Å²	64	121.6 Å²	121.6	66%	0.66	74%	0.74	S	S	*	*				74.9	89.8	126	0	0	0	0	0	118	A396 A400	A396-G398 PolarHBondContact O-N 2.94Å; G398-A400 PolarHBondContact O-N 2.99Å
399	A	29.8	Very low	32.3	Very low	96 Å²	96	127 Å²	127	79%	0.793	77%	0.77	S	S	*	*			trans	-60.1	116.7	140.6	0	0	0	0	0	108	V401	A399-V401 PolarHBondContact O-N 3.04Å
400	A	26.9	Very low	31.4	Very low	98 Å²	98	127.7 Å²	127.7	81%	0.81	78%	0.779	S	S	*	*			trans	-67.4	103.9	175.3	0	0	0	0	0	109.5	G398	G398-A400 PolarHBondContact O-N 2.99Å
401	V	28.8	Very low	30.5	Very low	130 Å²	130	127.4 Å²	127.4	79%	0.788	79%	0.787	S	S	*	*			trans	-87.1	115	161.8	-178.4	0	0	0	0	106.4	A399 D403	A399-V401 PolarHBondContact O-N 3.04Å; V401-D403 PolarHBondContact O-N 3.3Å
402	I	31.7	Very low	30.2	Very low	155 Å²	155	120.5 Å²	120.5	80%	0.795	78%	0.777	S	S	*	*			trans	-69	111.1	172.3	-61	167.8	0	0	0	106.8
403	D	27.6	Very low	29.7	Very low	154 Å²	154	122.6 Å²	122.6	82%	0.824	78%	0.78	S	S	*	*			trans	-117.5	119.2	166.5	-154.1	9.7	0	0	0	108.6	V401	V401-D403 PolarHBondContact O-N 3.3Å
404	S	28.7	Very low	29.3	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-88.4	135.3	-177.4	-61.1	0	0	0	0	109.4
405	P	31.6	Very low	29.3	Very low	118 Å²	118	121.4 Å²	121.4	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.7	148.2	177.7	29.3	-30.7	0	0	0	111.7
406	P	31.6	Very low	29.2	Very low	123 Å²	123	120.3 Å²	120.3	80%	0.799	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.5	137.2	-178	30.6	-31.8	0	0	0	111.7
407	Q	27.6	Very low	29.1	Very low	190 Å²	190	120.5 Å²	120.5	89%	0.888	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.9	143.6	169.2	-80.9	-157.4	-29	0	0	112
408	P	30.4	Very low	29	Very low	120 Å²	120	116.8 Å²	116.8	78%	0.779	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-93.4	141.4	158	33.5	-25.9	0	0	0	111.8
409	T	28.7	Very low	28.9	Very low	131 Å²	131	118.5 Å²	118.5	80%	0.804	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.9	140.2	176.1	51.6	0	0	0	0	113.2
410	S	28.7	Very low	28.9	Very low	110 Å²	110	118 Å²	118	77%	0.769	77%	0.769	S	S	*	*				167.5	128.2	117.9	50	0	0	0	0	114.7
411	S	28.8	Very low	29.1	Very low	103 Å²	103	119.6 Å²	119.6	72%	0.72	76%	0.764	S	S	*	*			trans	53.8	117.5	139.9	61.1	0	0	0	0	123.5
412	S	27.9	Very low	29.1	Very low	106 Å²	106	119.2 Å²	119.2	74%	0.741	76%	0.758	S	S	*	*			trans	67.3	114.7	130.6	65.9	0	0	0	0	120.5
413	S	28.4	Very low	29	Very low	112 Å²	112	117.9 Å²	117.9	78%	0.783	76%	0.757	S	S	*	*				175.2	138.8	96	44.3	0	0	0	0	112.6
414	S	27.4	Very low	29.1	Very low	106 Å²	106	116 Å²	116	74%	0.741	76%	0.756	S	S	*	*			trans	-2	134.1	158	54.1	0	0	0	0	120.2
415	S	28.2	Very low	29.1	Very low	121 Å²	121	116.9 Å²	116.9	85%	0.846	76%	0.762	S	S	*	*				178.5	150.7	99.4	44.7	0	0	0	0	112.8
416	S	28.1	Very low	29	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	77%	0.771	S	S	*	*			trans	-79.3	149.3	-172.5	45.6	0	0	0	0	115.7
417	S	28.6	Very low	28.8	Very low	103 Å²	103	119.7 Å²	119.7	72%	0.72	77%	0.768	S	S	*	*			trans	170.2	111.1	135.4	55.1	0	0	0	0	108.9
418	S	28.6	Very low	29	Very low	107 Å²	107	116.7 Å²	116.7	75%	0.748	76%	0.763	S	S	*	*				50.9	128.1	97	70.6	0	0	0	0	112.8
419	S	30	Very low	28.9	Very low	101 Å²	101	119.5 Å²	119.5	71%	0.706	77%	0.765	S	S	*	*			cis	-170.9	152.4	39.3	-33.7	0	0	0	0	107.4
420	A	28.4	Very low	30	Very low	84 Å²	84	118 Å²	118	69%	0.694	76%	0.758	S	S	*	*				50.5	123.3	108.9	0	0	0	0	0	113.9
421	N	31.6	Very low	30.2	Very low	132 Å²	132	120 Å²	120	71%	0.706	77%	0.766	S	S	*	*			cis	-178.7	162.5	46.2	-121.9	16.4	0	0	0	111.3
422	D	29.2	Very low	30.3	Very low	122 Å²	122	122.2 Å²	122.2	65%	0.652	77%	0.77	S	S	*	*			trans	72.2	107.3	144.1	-58.1	-28.9	0	0	0	120
423	V	28.8	Very low	31.5	Very low	128 Å²	128	122.4 Å²	122.4	78%	0.776	77%	0.768	S	S	*	*				78.5	108.1	67.9	176.4	0	0	0	0	112.1
424	S	30.2	Very low	31.5	Very low	114 Å²	114	120.6 Å²	120.6	80%	0.797	77%	0.767	S	S	*	*				-174.6	108.2	119.4	59.9	0	0	0	0	110.9
425	S	29.2	Very low	31.6	Very low	111 Å²	111	121.4 Å²	121.4	78%	0.776	77%	0.773	S	S	*	*			trans	-74	150.1	157	27.8	0	0	0	0	110.3
426	M	28.4	Very low	31.9	Very low	196 Å²	196	123.1 Å²	123.1	97%	0.966	77%	0.773	S	S	*	*			trans	-158.1	119.4	140.4	-110.7	-173.9	179	0	0	110.7
427	S	28.3	Very low	33	Very low	105 Å²	105	123.4 Å²	123.4	73%	0.734	77%	0.772	S	S	*	*			trans	-113.8	153.6	165	-55.6	0	0	0	0	107.8
428	T	31.1	Very low	33.1	Very low	126 Å²	126	122.5 Å²	122.5	77%	0.773	77%	0.77	S	S	*	*			trans	143.8	106.9	136.3	49.1	0	0	0	0	112.7
429	E	29.5	Very low	33.3	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	78%	0.779	S	S	*	*				47.9	175	116.7	-73.6	-166.1	166.8	0	0	121.8
430	P	50.9	Low	33.1	Very low	99 Å²	99	124 Å²	124	64%	0.643	78%	0.775	S	S	*	*			cis	-137.4	177.1	-45.6	37.1	-20.6	0	0	0	112
431	T	31.8	Very low	33.2	Very low	153 Å²	153	125 Å²	125	94%	0.939	78%	0.778	S	S	*	*			trans	-176.1	141.7	138.3	15.1	0	0	0	0	113.5
432	D	31.1	Very low	33.2	Very low	150 Å²	150	127.4 Å²	127.4	80%	0.802	79%	0.785	S	S	*	*			trans	-106.4	-155.8	-169.8	-155	16.4	0	0	0	109.7
433	P	52.8	Low	33.3	Very low	109 Å²	109	127.2 Å²	127.2	71%	0.708	79%	0.788	S	S	*	*				-126.9	179.4	-57.7	21.8	0.1	0	0	0	114.6
434	G	28.8	Very low	33.2	Very low	74 Å²	74	127.6 Å²	127.6	76%	0.763	79%	0.786	S	S	*	*			trans	111.4	142.5	149.2	0	0	0	0	0	115.7
435	S	31.1	Very low	33.1	Very low	124 Å²	124	126.6 Å²	126.6	87%	0.867	78%	0.779	S	S	*	*			cis	-176.3	144.5	7.4	40.1	0	0	0	0	108.8
436	D	32.9	Very low	33.1	Very low	157 Å²	157	126.5 Å²	126.5	84%	0.84	78%	0.778	S	S	*	*			trans	-58.6	-174.4	163.9	-85.1	-33.4	0	0	0	113.6
437	P	51.8	Low	33.2	Very low	118 Å²	118	124 Å²	124	77%	0.766	77%	0.768	S	S	*	*			cis	-142.6	178.6	-3	22.9	4.4	0	0	0	117.5
438	A	31.1	Very low	33.1	Very low	83 Å²	83	125.7 Å²	125.7	69%	0.686	77%	0.768	S	S	*	*			trans	83.8	142.9	133.5	0	0	0	0	0	125.9
439	L	31.5	Very low	33	Very low	179 Å²	179	125 Å²	125	94%	0.937	77%	0.769	S	S	*	*			trans	77.7	135.6	152.6	-68.9	140.2	0	0	0	117.9
440	G	27.7	Very low	32.9	Very low	60 Å²	60	125.3 Å²	125.3	62%	0.619	77%	0.77	S	S	*	*			cis	162.8	173.8	5.4	0	0	0	0	0	110.5
441	S	30.5	Very low	31.9	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	78%	0.777	S	S	*	*			trans	79.7	109.5	164.6	72.1	0	0	0	0	117.8
442	E	30.2	Very low	31.6	Very low	182 Å²	182	124.9 Å²	124.9	85%	0.85	77%	0.77	S	S	*	*				81.8	137.6	88.2	-78.9	-178.5	168.9	0	0	110.5
443	T	31.1	Very low	31.5	Very low	117 Å²	117	124.7 Å²	124.7	72%	0.718	77%	0.769	S	S	*	*			cis	-167.9	155.6	22.9	32.3	0	0	0	0	104
444	D	27.7	Very low	30.3	Very low	137 Å²	137	124.1 Å²	124.1	73%	0.733	77%	0.767	S	S	*	*				174.8	123.5	60.7	-127.8	-19.8	0	0	0	103.6
445	S	28.4	Very low	30.3	Very low	93 Å²	93	125.2 Å²	125.2	65%	0.65	77%	0.769	S	S	*	*				79.4	143.5	84.1	86.2	0	0	0	0	116.5
446	S	28.8	Very low	30.1	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	77%	0.772	S	S	*	*			trans	80.3	135.2	174.7	76.2	0	0	0	0	117.5
447	L	29.3	Very low	29.8	Very low	143 Å²	143	124.6 Å²	124.6	75%	0.749	77%	0.767	S	S	*	*			cis	161.8	138.5	-16.6	-112.4	150.5	0	0	0	104.3
448	D	27.2	Very low	28.5	Very low	140 Å²	140	124.2 Å²	124.2	75%	0.749	77%	0.766	S	S	*	*			trans	64.6	126.6	158.6	-57	-27.6	0	0	0	118.4
449	S	29	Very low	28.3	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	77%	0.768	S	S	*	*				-170.3	142.8	54.4	38	0	0	0	0	111.6
450	H	27.9	Very low	28.4	Very low	186 Å²	186	132.5 Å²	132.5	86%	0.861	78%	0.782	S	S	*	*			trans	-54.8	140.7	160.3	-76.3	-88.6	0	0	0	111.7
451	T	28.9	Very low	28.4	Very low	129 Å²	129	136.1 Å²	136.1	79%	0.791	79%	0.791	S	S	*	*			trans	-161.3	111.7	134.4	14.5	0	0	0	0	110.8
452	S	26.2	Very low	28.3	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	79%	0.793	S	S	*	*			trans	-76.1	133.3	155.9	60.4	0	0	0	0	109.4
453	L	28.4	Very low	28.2	Very low	147 Å²	147	135.2 Å²	135.2	77%	0.77	79%	0.79	S	S	*	*			trans	-153.2	93.4	159.9	-91.7	158.6	0	0	0	105.5
454	S	27.3	Very low	28	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	79%	0.794	S	S	*	*				46.8	112.6	89.4	75.3	0	0	0	0	115
455	A	28.7	Very low	28.1	Very low	97 Å²	97	136.2 Å²	136.2	80%	0.802	80%	0.798	S	S	*	*			trans	33.3	117.7	133.9	0	0	0	0	0	118.5
456	L	27.5	Very low	28	Very low	180 Å²	180	139.1 Å²	139.1	94%	0.942	81%	0.808	S	S	*	*			trans	-136.5	109	150	-104.4	158	0	0	0	110
457	A	26.1	Very low	28	Very low	89 Å²	89	141.2 Å²	141.2	74%	0.736	81%	0.811	S	S	*	*			trans	-79.9	151.8	161.7	0	0	0	0	0	110.2
458	C	25	Very low	27.9	Very low	109 Å²	109	141.1 Å²	141.1	74%	0.736	82%	0.816	S	S	*	*			trans	100.6	129.4	142.1	-138.2	0	0	0	0	121.8
459	C	27.6	Very low	27.9	Very low	109 Å²	109	141.2 Å²	141.2	74%	0.736	82%	0.821	S	S	*	*				88.2	95.3	129.4	-65.1	0	0	0	0	118.1
460	R	32.6	Very low	27.8	Very low	327 Å²	327	143.8 Å²	143.8	100%	1.234	83%	0.825	S	S	*	*				-172.9	0	99.6	-103	-174.5	-177.9	-163.4	1.2	112

Retrieved 460 of 460 residues in 146.6 ms (Link to these results)

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