A0A3Q0KCC9_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KCC9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 348 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	32.2	Very low	32.7	Very low	235 Å²	235	145.5 Å²	145.5	100%	1.158	80%	0.802	S	S	*	*				0	69.4	0	-57.8	-175.2	-177.7	0	0	105.5
2	D	34.3	Very low	32.2	Very low	155 Å²	155	153.1 Å²	153.1	83%	0.829	81%	0.813	S	S	*	*				66.9	121.6	96.7	-85.8	-7.5	0	0	0	110.7
3	T	39	Very low	32.2	Very low	131 Å²	131	150.5 Å²	150.5	80%	0.804	82%	0.815	S	S	*	*			cis	-161.7	142.2	8.8	34.1	0	0	0	0	105
4	G	32.2	Very low	32.2	Very low	72 Å²	72	154.2 Å²	154.2	74%	0.742	82%	0.819	S	S	*	*				97.9	78.9	75.9	0	0	0	0	0	111.6
5	N	31.9	Very low	32.1	Very low	166 Å²	166	153.3 Å²	153.3	89%	0.888	83%	0.825	S	S	*	*			trans	-122.1	92.5	164.2	-108.4	-8.4	0	0	0	108
6	T	36.3	Very low	31.8	Very low	133 Å²	133	147.6 Å²	147.6	82%	0.816	81%	0.814	S	S	*	*			trans	-88.8	105.9	172.8	40.2	0	0	0	0	110
7	V	30.1	Very low	31.6	Very low	116 Å²	116	146.6 Å²	146.6	70%	0.703	81%	0.813	S	S	*	*			trans	-72.9	124.6	161.6	174.7	0	0	0	0	108
8	F	31.5	Very low	31.4	Very low	186 Å²	186	147.7 Å²	147.7	82%	0.816	82%	0.815	S	S	*	*			trans	-130.6	101.8	157.8	-99.6	-83	0	0	0	109.8
9	S	27.3	Very low	31.5	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	80%	0.802	S	S	*	*			trans	-91.2	109.2	167	19.1	0	0	0	0	108.9
10	E	33.1	Very low	32	Very low	144 Å²	144	143.6 Å²	143.6	67%	0.673	80%	0.804	S	S	*	*			trans	-158.3	144.9	160.5	-71.6	-162	138.6	0	0	108.8
11	K	31.8	Very low	33.3	Very low	165 Å²	165	138 Å²	138	72%	0.717	78%	0.778	S	S	*	*			cis	-165	144	-14.3	-108.7	161.7	-177.4	163.7	0	103.6	S13	K11-S13 PolarHBondContact O-N 3.4Å
12	Y	27.2	Very low	34.9	Very low	237 Å²	237	130.5 Å²	130.5	93%	0.929	74%	0.74	S	S	*	*			trans	-55.2	131.8	172	-78.1	-103.1	0	0	0	110.9
13	S	32.2	Very low	36.7	Very low	120 Å²	120	129.5 Å²	129.5	84%	0.839	73%	0.728	S	S	*	*			trans	-139.3	127.7	161	-77.5	0	0	0	0	109.3	K11	K11-S13 PolarHBondContact O-N 3.4Å
14	K	31.5	Very low	38.1	Very low	202 Å²	202	123.7 Å²	123.7	88%	0.878	69%	0.693	S	S	*	*			trans	-60.7	152.4	-169.8	-71.5	170.1	173.3	175.5	0	113	G16	K14-G16 PolarHBondContact O-N 2.78Å
15	P	30.9	Very low	39.7	Very low	140 Å²	140	125.1 Å²	125.1	91%	0.909	69%	0.689	S	S	*	*			trans	-78	115.2	-179.4	30.8	-29.5	0	0	0	110.5
16	G	26.9	Very low	41.3	Very low	63 Å²	63	119.6 Å²	119.6	65%	0.649	66%	0.662	S	S	*	*			trans	-126.4	137.8	167.7	0	0	0	0	0	109.7	K14	K14-G16 PolarHBondContact O-N 2.78Å
17	V	29.3	Very low	43.2	Very low	130 Å²	130	115.1 Å²	115.1	79%	0.788	64%	0.635	S	S	*	*			trans	84.1	95.3	172.7	-158.1	0	0	0	0	115.9	V19	V17-V19 HydrophobicContact CG1-CG2 3.63Å; V17-V19 PolarHBondContact O-N 3.35Å; V17-V19 VanDerWaalsContact O-N 3.1Å
18	I	27.1	Very low	45.7	Very low	167 Å²	167	115.9 Å²	115.9	86%	0.856	64%	0.643	S	S	*	*			trans	-65.2	98.6	161.2	-56.4	166	0	0	0	107.2
19	V	32.8	Very low	47.9	Very low	93 Å²	93	111.8 Å²	111.8	56%	0.564	63%	0.626	S	S	*	*			trans	-102.5	98.8	164.4	-172.9	0	0	0	0	106.8	V17 G21	V17-V19 HydrophobicContact CG1-CG2 3.63Å; V17-V19 PolarHBondContact O-N 3.35Å; V17-V19 VanDerWaalsContact O-N 3.1Å; V19-G21 VanDerWaalsContact C-N 3.26Å; V19-G21 PolarHBondContact O-N 2.75Å
20	S	42.2	Very low	50.4	Low	120 Å²	120	110 Å²	110	84%	0.839	61%	0.613	S	S	*	*			trans	-70.2	73.8	-177.2	54.7	0	0	0	0	112.1
21	G	58.7	Low	52.5	Low	26 Å²	26	103.7 Å²	103.7	27%	0.268	59%	0.585	S	S	.	*	S	Bend	trans	-158.2	133	171.8	0	0	0	0	0	110.9	V19 K23	V19-G21 VanDerWaalsContact C-N 3.26Å; V19-G21 PolarHBondContact O-N 2.75Å; G21-K23 PolarHBondContact O-N 3.16Å; G21-K23 VanDerWaalsContact O-N 3.1Å
22	H	66.9	Low	54.7	Low	78 Å²	78	101 Å²	101	36%	0.361	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.6	93.4	176.1	-66.8	79.8	0	0	0	108.7	C31 L37	H22-C31 HydrophobicContact CB-CB 4.43Å; H22-C31 PolarHBondContact N-O 2.91Å; H22-C31 PolarHBondContact O-N 2.96Å; H22-L37 HydrophobicContact CB-CB 3.96Å; H22-L37 HydrophobicContact CB-CD2 3.94Å
23	K	72	Confident	56.8	Low	133 Å²	133	92.3 Å²	92.3	58%	0.578	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.5	138.9	-177.6	-57.1	-168.8	175.7	178.5	0	111.5	G21	G21-K23 PolarHBondContact O-N 3.16Å; G21-K23 VanDerWaalsContact O-N 3.1Å
24	C	69.3	Low	58.4	Low	10 Å²	10	90.4 Å²	90.4	7%	0.068	55%	0.545	C	S	.	.			trans	-70.9	130.8	171.1	-178.4	0	0	0	0	110.2	V26 C27 H29 L37 H40 H45	C24-V26 PolarHBondContact O-N 2.94Å; C24-V26 PolarHBondContact SG-N 3.3Å; C24-V26 VanDerWaalsContact SG-N 3.37Å; C24-C27 WeakPolarHBondContact CB-O 3.48Å; C24-H29 HydrophobicContact CB-CB 4.34Å; C24-H29 WeakPolarHBondContact CB-O 3.35Å; C24-H29 PolarHBondContact N-O 3.41Å; C24-L37 HydrophobicContact CB-CD1 4.02Å; C24-H40 PolarHBondContact SG-CD2 3.14Å; C24-H40 PolarHBondContact SG-NE2 3.33Å; C24-H45 PolarHBondContact SG-CD2 3.06Å; C24-H45 PolarHBondContact SG-NE2 3.34Å; C24-H45 VanDerWaalsContact SG-NE2 3.41Å
25	P	64.4	Low	60.2	Low	101 Å²	101	85 Å²	85	66%	0.656	53%	0.533	S	S	*	.	S	Bend	trans	-74.4	-11.7	176.5	28.4	-34.6	0	0	0	113.8	L41	P25-L41 HydrophobicContact CG-CD2 4.31Å
26	V	65.7	Low	62.3	Low	51 Å²	51	79.6 Å²	79.6	31%	0.309	50%	0.503	S	S	.	.	S	Bend	trans	-106.7	-25.5	-174.3	-172.6	0	0	0	0	112.5	C24 L41 H45	C24-V26 PolarHBondContact O-N 2.94Å; C24-V26 PolarHBondContact SG-N 3.3Å; C24-V26 VanDerWaalsContact SG-N 3.37Å; V26-L41 HydrophobicContact CG2-CD2 4.25Å; V26-H45 HydrophobicContact CG1-CB 4.5Å; V26-H45 VanDerWaalsContact CG1-CE1 3.47Å; V26-H45 WeakPolarHBondContact CG1-CE1 3.17Å; V26-H45 VanDerWaalsContact CG1-ND1 3.27Å; V26-H45 WeakPolarHBondContact CG1-ND1 3.28Å; V26-H45 HydrophobicContact CG2-CB 4.41Å
27	C	76.4	Confident	64.3	Low	38 Å²	38	77.2 Å²	77.2	26%	0.257	48%	0.475	S	S	.	.	S	Bend	trans	-145.2	170.1	180	77.9	0	0	0	0	112	C24 H29 H40 H45	C24-C27 WeakPolarHBondContact CB-O 3.48Å; C27-H29 PolarHBondContact O-N 2.8Å; C27-H29 WeakPolarHBondContact SG-CB 3.46Å; C27-H40 VanDerWaalsContact SG-CE1 3.53Å; C27-H40 PolarHBondContact SG-NE2 3.23Å; C27-H45 PolarHBondContact SG-NE2 2.92Å
28	P	82.3	Confident	66	Low	133 Å²	133	73.6 Å²	73.6	86%	0.864	45%	0.451	S	S	*	.	S	Bend	trans	-66	-3.8	-178.6	-20.8	33.4	0	0	0	115.3
29	H	76.9	Confident	68.1	Low	99 Å²	99	69.2 Å²	69.2	46%	0.458	43%	0.434	S	S	.	.			trans	-66.4	135.6	-176.2	-161.8	-40.7	0	0	0	111.2	C24 C27 H40	C24-H29 HydrophobicContact CB-CB 4.34Å; C24-H29 WeakPolarHBondContact CB-O 3.35Å; C24-H29 PolarHBondContact N-O 3.41Å; C27-H29 PolarHBondContact O-N 2.8Å; C27-H29 WeakPolarHBondContact SG-CB 3.46Å; H29-H40 AromaticContact CD2-CE1 3.49Å; H29-H40 PolarHBondContact CD2-CE1 2.73Å; H29-H40 VanDerWaalsContact CD2-CE1 3.49Å; H29-H40 AromaticContact CD2-ND1 3.41Å; H29-H40 PolarHBondContact CD2-ND1 2.97Å; H29-H40 AromaticContact CG-CE1 3.65Å; H29-H40 AromaticContact CG-ND1 3.75Å; H29-H40 AromaticContact NE2-ND1 3.96Å
30	S	81.6	Confident	70.1	Confident	59 Å²	59	65.5 Å²	65.5	41%	0.413	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.3	170.6	-61	0	0	0	0	110.4
31	C	76.5	Confident	71.2	Confident	13 Å²	13	60.1 Å²	60.1	9%	0.088	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	144.3	180	-61.6	0	0	0	0	110.9	H22 S33 G36 L37	H22-C31 HydrophobicContact CB-CB 4.43Å; H22-C31 PolarHBondContact N-O 2.91Å; H22-C31 PolarHBondContact O-N 2.96Å; C31-S33 PolarHBondContact O-N 3.45Å; C31-G36 VanDerWaalsContact SG-C 3.59Å; C31-L37 HydrophobicContact CB-CB 4.09Å
32	A	77.3	Confident	71.5	Confident	108 Å²	108	62.9 Å²	62.9	89%	0.893	38%	0.384	S	S	*	.	S	Bend	trans	-68.6	-20.5	178	0	0	0	0	0	113.3
33	S	71.8	Confident	71.9	Confident	55 Å²	55	63.4 Å²	63.4	39%	0.385	39%	0.393	S	S	.	.	S	Bend	trans	-140.7	158.9	-179.8	71.2	0	0	0	0	112.2	C31 S35 G36 L37	C31-S33 PolarHBondContact O-N 3.45Å; S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.28Å; S33-G36 PolarHBondContact O-N 3.17Å; S33-G36 VanDerWaalsContact O-N 3.15Å; S33-G36 PolarHBondContact OG-N 3Å; S33-G36 VanDerWaalsContact OG-N 3.13Å; S33-L37 PolarHBondContact O-N 3.12Å; S33-L37 VanDerWaalsContact O-N 3.08Å
34	Q	66.1	Low	72.2	Confident	79 Å²	79	64.5 Å²	64.5	37%	0.369	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-41.1	175.1	-172.7	173.8	-10.4	0	0	111.9	G36 L37 I38 Q57	Q34-G36 VanDerWaalsContact C-N 3.28Å; Q34-G36 PolarHBondContact O-N 2.84Å; Q34-L37 PolarHBondContact O-N 3.2Å; Q34-I38 HydrophobicContact CG-CD1 4.49Å; Q34-I38 WeakPolarHBondContact O-CG1 3.43Å; Q34-I38 PolarHBondContact O-N 3.13Å; Q34-Q57 PolarHBondContact NE2-O 3.3Å
35	S	70.2	Confident	72.3	Confident	90 Å²	90	65.3 Å²	65.3	63%	0.629	40%	0.4	S	S	*	.	H	α-helix	trans	-61	-38.2	174.9	-51.5	0	0	0	0	112	S33 I38 C39	S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.28Å; S35-I38 PolarHBondContact O-N 3.16Å; S35-C39 PolarHBondContact O-N 3.39Å
36	G	73.6	Confident	72.2	Confident	26 Å²	26	67.8 Å²	67.8	27%	0.268	40%	0.401	S	S	.	.	H	α-helix	trans	-63.5	-41.8	174.6	0	0	0	0	0	112.4	C31 S33 Q34 C39 H40	C31-G36 VanDerWaalsContact SG-C 3.59Å; S33-G36 PolarHBondContact O-N 3.17Å; S33-G36 VanDerWaalsContact O-N 3.15Å; S33-G36 PolarHBondContact OG-N 3Å; S33-G36 VanDerWaalsContact OG-N 3.13Å; Q34-G36 VanDerWaalsContact C-N 3.28Å; Q34-G36 PolarHBondContact O-N 2.84Å; G36-C39 PolarHBondContact O-N 3.09Å; G36-H40 WeakPolarHBondContact O-CB 3.44Å; G36-H40 PolarHBondContact O-N 3.04Å
37	L	69.3	Low	71.8	Confident	13 Å²	13	74.5 Å²	74.5	7%	0.068	43%	0.429	C	S	.	.	H	α-helix	trans	-63.9	-41.2	175.8	176.7	60.1	0	0	0	111.8	H22 C24 C31 S33 Q34 H40 L41 I59	H22-L37 HydrophobicContact CB-CB 3.96Å; H22-L37 HydrophobicContact CB-CD2 3.94Å; C24-L37 HydrophobicContact CB-CD1 4.02Å; C31-L37 HydrophobicContact CB-CB 4.09Å; S33-L37 PolarHBondContact O-N 3.12Å; S33-L37 VanDerWaalsContact O-N 3.08Å; Q34-L37 PolarHBondContact O-N 3.2Å; L37-H40 PolarHBondContact O-N 2.81Å; L37-L41 HydrophobicContact CD1-CD1 3.94Å; L37-L41 HydrophobicContact CD1-CG 4.12Å; L37-L41 HydrophobicContact CG-CD1 3.96Å; L37-L41 WeakPolarHBondContact O-CG 3.45Å; L37-L41 PolarHBondContact O-N 3.35Å; L37-I59 HydrophobicContact CD2-CD1 3.85Å; L37-I59 HydrophobicContact CG-CD1 4.03Å
38	I	64.4	Low	70.8	Confident	54 Å²	54	81.5 Å²	81.5	28%	0.277	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-48.2	175.4	-66.7	168.6	0	0	0	110.4	Q34 S35 H40 L41 T42 V52 I59	Q34-I38 HydrophobicContact CG-CD1 4.49Å; Q34-I38 WeakPolarHBondContact O-CG1 3.43Å; Q34-I38 PolarHBondContact O-N 3.13Å; S35-I38 PolarHBondContact O-N 3.16Å; I38-H40 VanDerWaalsContact C-N 3.35Å; I38-H40 PolarHBondContact O-N 2.98Å; I38-L41 PolarHBondContact O-N 3.24Å; I38-T42 HydrophobicContact CG2-CG2 4.44Å; I38-T42 WeakPolarHBondContact O-CG2 3.18Å; I38-T42 PolarHBondContact O-N 3.1Å; I38-T42 PolarHBondContact O-OG1 3.22Å; I38-T42 VanDerWaalsContact O-OG1 3.11Å; I38-V52 HydrophobicContact CG1-CG2 4.47Å; I38-I59 HydrophobicContact CG1-CD1 4.17Å
39	C	72.1	Confident	69.5	Low	74 Å²	74	80.2 Å²	80.2	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-60.8	-42.4	177.6	-174.3	0	0	0	0	112.2	S35 G36 T42 T43	S35-C39 PolarHBondContact O-N 3.39Å; G36-C39 PolarHBondContact O-N 3.09Å; C39-T42 PolarHBondContact O-N 3.34Å; C39-T42 PolarHBondContact O-OG1 3.41Å; C39-T42 VanDerWaalsContact O-OG1 3.12Å; C39-T43 WeakPolarHBondContact O-CB 3.49Å; C39-T43 VanDerWaalsContact O-CG2 3.27Å; C39-T43 WeakPolarHBondContact O-CG2 3.16Å; C39-T43 PolarHBondContact O-N 2.86Å; C39-T43 VanDerWaalsContact O-N 3.08Å; C39-T43 PolarHBondContact O-OG1 3.24Å
40	H	75.1	Confident	68.6	Low	16 Å²	16	77.1 Å²	77.1	7%	0.074	43%	0.426	C	S	.	.	H	α-helix	trans	-60.7	-46.6	176.3	170.6	81.1	0	0	0	111.8	C24 C27 H29 G36 L37 I38 T43 K44 H45	C24-H40 PolarHBondContact SG-CD2 3.14Å; C24-H40 PolarHBondContact SG-NE2 3.33Å; C27-H40 VanDerWaalsContact SG-CE1 3.53Å; C27-H40 PolarHBondContact SG-NE2 3.23Å; H29-H40 AromaticContact CD2-CE1 3.49Å; H29-H40 PolarHBondContact CD2-CE1 2.73Å; H29-H40 VanDerWaalsContact CD2-CE1 3.49Å; H29-H40 AromaticContact CD2-ND1 3.41Å; H29-H40 PolarHBondContact CD2-ND1 2.97Å; H29-H40 AromaticContact CG-CE1 3.65Å; H29-H40 AromaticContact CG-ND1 3.75Å; H29-H40 AromaticContact NE2-ND1 3.96Å; G36-H40 WeakPolarHBondContact O-CB 3.44Å; G36-H40 PolarHBondContact O-N 3.04Å; L37-H40 PolarHBondContact O-N 2.81Å; I38-H40 VanDerWaalsContact C-N 3.35Å; I38-H40 PolarHBondContact O-N 2.98Å; H40-T43 PolarHBondContact O-N 3.11Å; H40-T43 PolarHBondContact O-OG1 3.28Å; H40-K44 WeakPolarHBondContact O-CB 3.35Å; H40-K44 PolarHBondContact O-N 2.75Å; H40-H45 AromaticContact CD2-CD2 3.87Å; H40-H45 AromaticContact CE1-NE2 3.9Å; H40-H45 AromaticContact NE2-CD2 3.39Å; H40-H45 PolarHBondContact NE2-CD2 2.87Å; H40-H45 AromaticContact NE2-NE2 3.18Å; H40-H45 PolarHBondContact NE2-NE2 3.11Å; H40-H45 VanDerWaalsContact NE2-NE2 3.18Å
41	L	63.6	Low	67.9	Low	6 Å²	6	75.3 Å²	75.3	3%	0.031	42%	0.416	C	S	.	.	H	α-helix	trans	-65.4	-41.9	179.5	-73.8	164.4	0	0	0	112.5	P25 V26 L37 I38 T43 H45 K46 A50 I59	P25-L41 HydrophobicContact CG-CD2 4.31Å; V26-L41 HydrophobicContact CG2-CD2 4.25Å; L37-L41 HydrophobicContact CD1-CD1 3.94Å; L37-L41 HydrophobicContact CD1-CG 4.12Å; L37-L41 HydrophobicContact CG-CD1 3.96Å; L37-L41 WeakPolarHBondContact O-CG 3.45Å; L37-L41 PolarHBondContact O-N 3.35Å; I38-L41 PolarHBondContact O-N 3.24Å; L41-T43 VanDerWaalsContact C-N 3.29Å; L41-T43 PolarHBondContact O-N 3.48Å; L41-H45 HydrophobicContact CD2-CB 4.2Å; L41-H45 CarbonylContact O-C 3.14Å; L41-H45 WeakPolarHBondContact O-CA 3.44Å; L41-H45 WeakPolarHBondContact O-CB 3.18Å; L41-H45 PolarHBondContact O-N 3.04Å; L41-K46 PolarHBondContact O-N 2.71Å; L41-A50 HydrophobicContact CB-CB 4.15Å; L41-A50 HydrophobicContact CD1-CB 3.93Å; L41-A50 HydrophobicContact CD2-CB 4.18Å; L41-A50 HydrophobicContact CG-CB 4.33Å; L41-I59 HydrophobicContact CD1-CD1 3.75Å; L41-I59 HydrophobicContact CD1-CG2 3.85Å
42	T	65.6	Low	67.4	Low	84 Å²	84	76.7 Å²	76.7	52%	0.515	42%	0.423	S	S	.	.	H	α-helix	trans	-72	-22.4	-179.7	56.6	0	0	0	0	113.3	I38 C39	I38-T42 HydrophobicContact CG2-CG2 4.44Å; I38-T42 WeakPolarHBondContact O-CG2 3.18Å; I38-T42 PolarHBondContact O-N 3.1Å; I38-T42 PolarHBondContact O-OG1 3.22Å; I38-T42 VanDerWaalsContact O-OG1 3.11Å; C39-T42 PolarHBondContact O-N 3.34Å; C39-T42 PolarHBondContact O-OG1 3.41Å; C39-T42 VanDerWaalsContact O-OG1 3.12Å
43	T	75.6	Confident	67	Low	89 Å²	89	71.6 Å²	71.6	55%	0.546	38%	0.381	S	S	.	.	H	α-helix	trans	-98.6	-42.5	-179.7	56.6	0	0	0	0	113.7	C39 H40 L41	C39-T43 WeakPolarHBondContact O-CB 3.49Å; C39-T43 VanDerWaalsContact O-CG2 3.27Å; C39-T43 WeakPolarHBondContact O-CG2 3.16Å; C39-T43 PolarHBondContact O-N 2.86Å; C39-T43 VanDerWaalsContact O-N 3.08Å; C39-T43 PolarHBondContact O-OG1 3.24Å; H40-T43 PolarHBondContact O-N 3.11Å; H40-T43 PolarHBondContact O-OG1 3.28Å; L41-T43 VanDerWaalsContact C-N 3.29Å; L41-T43 PolarHBondContact O-N 3.48Å
44	K	78.6	Confident	66.7	Low	156 Å²	156	77.7 Å²	77.7	68%	0.678	40%	0.401	S	S	*	.	H	α-helix	trans	-99.5	-22.1	-174.8	-61	-60.3	-175.4	179.6	0	114.1	H40	H40-K44 WeakPolarHBondContact O-CB 3.35Å; H40-K44 PolarHBondContact O-N 2.75Å
45	H	70.5	Confident	66.6	Low	27 Å²	27	76 Å²	76	13%	0.125	39%	0.394	C	S	.	.	S	Bend	trans	-123.8	28.3	-178.7	-59.2	-55.9	0	0	0	112	C24 V26 C27 H40 L41 E47 R48 L49	C24-H45 PolarHBondContact SG-CD2 3.06Å; C24-H45 PolarHBondContact SG-NE2 3.34Å; C24-H45 VanDerWaalsContact SG-NE2 3.41Å; V26-H45 HydrophobicContact CG1-CB 4.5Å; V26-H45 VanDerWaalsContact CG1-CE1 3.47Å; V26-H45 WeakPolarHBondContact CG1-CE1 3.17Å; V26-H45 VanDerWaalsContact CG1-ND1 3.27Å; V26-H45 WeakPolarHBondContact CG1-ND1 3.28Å; V26-H45 HydrophobicContact CG2-CB 4.41Å; C27-H45 PolarHBondContact SG-NE2 2.92Å; H40-H45 AromaticContact CD2-CD2 3.87Å; H40-H45 AromaticContact CE1-NE2 3.9Å; H40-H45 AromaticContact NE2-CD2 3.39Å; H40-H45 PolarHBondContact NE2-CD2 2.87Å; H40-H45 AromaticContact NE2-NE2 3.18Å; H40-H45 PolarHBondContact NE2-NE2 3.11Å; H40-H45 VanDerWaalsContact NE2-NE2 3.18Å; L41-H45 HydrophobicContact CD2-CB 4.2Å; L41-H45 CarbonylContact O-C 3.14Å; L41-H45 WeakPolarHBondContact O-CA 3.44Å; L41-H45 WeakPolarHBondContact O-CB 3.18Å; L41-H45 PolarHBondContact O-N 3.04Å; H45-E47 PolarHBondContact O-N 3.15Å; H45-E47 VanDerWaalsContact O-N 3.08Å; H45-R48 CarbonylContact O-C 3.49Å; H45-R48 PolarHBondContact O-N 2.81Å; H45-L49 PolarHBondContact O-N 3.08Å
46	K	63.7	Low	66.5	Low	154 Å²	154	73.3 Å²	73.3	67%	0.67	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-50.4	-36.1	179.1	-170.2	-178.5	177.2	-173.2	0	112.3	L41 L49	L41-K46 PolarHBondContact O-N 2.71Å; K46-L49 VanDerWaalsContact O-CD2 3.3Å; K46-L49 WeakPolarHBondContact O-CD2 3.42Å; K46-L49 VanDerWaalsContact O-CG 3.28Å; K46-L49 WeakPolarHBondContact O-CG 3.41Å
47	E	56.8	Low	66.3	Low	192 Å²	192	76.4 Å²	76.4	90%	0.897	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-80.1	-18.2	180	-61	-173.2	173.9	0	0	114	H45	H45-E47 PolarHBondContact O-N 3.15Å; H45-E47 VanDerWaalsContact O-N 3.08Å
48	R	54.6	Low	66.1	Low	184 Å²	184	81.1 Å²	81.1	69%	0.694	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-105	24.7	176.2	-60.7	-175.8	77.4	167.6	6.1	112.2	H45 A50	H45-R48 CarbonylContact O-C 3.49Å; H45-R48 PolarHBondContact O-N 2.81Å; R48-A50 PolarHBondContact O-N 3.4Å
49	L	54.7	Low	66	Low	106 Å²	106	80.9 Å²	80.9	56%	0.555	40%	0.402	S	S	*	.			trans	3.7	96.6	178	-70.8	165.8	0	0	0	115.1	H45 K46 S62	H45-L49 PolarHBondContact O-N 3.08Å; K46-L49 VanDerWaalsContact O-CD2 3.3Å; K46-L49 WeakPolarHBondContact O-CD2 3.42Å; K46-L49 VanDerWaalsContact O-CG 3.28Å; K46-L49 WeakPolarHBondContact O-CG 3.41Å; L49-S62 WeakPolarHBondContact O-CA 3.45Å; L49-S62 WeakPolarHBondContact O-CB 3.49Å; L49-S62 PolarHBondContact O-N 3.22Å
50	A	59.8	Low	65.6	Low	34 Å²	34	79.3 Å²	79.3	28%	0.281	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123	165.7	0	0	0	0	0	109.8	L41 R48 I59 F60	L41-A50 HydrophobicContact CB-CB 4.15Å; L41-A50 HydrophobicContact CD1-CB 3.93Å; L41-A50 HydrophobicContact CD2-CB 4.18Å; L41-A50 HydrophobicContact CG-CB 4.33Å; R48-A50 PolarHBondContact O-N 3.4Å; A50-I59 HydrophobicContact CB-CG2 3.66Å; A50-F60 CarbonylContact C-O 3.49Å; A50-F60 WeakPolarHBondContact CA-O 3.21Å
51	A	66.1	Low	65.1	Low	22 Å²	22	81.1 Å²	81.1	18%	0.182	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.1	174.6	0	0	0	0	0	110.3	F60 I65	A51-F60 PolarHBondContact N-O 3.2Å; A51-F60 PolarHBondContact O-N 3.34Å; A51-I65 HydrophobicContact CB-CB 3.76Å; A51-I65 HydrophobicContact CB-CD1 3.53Å; A51-I65 HydrophobicContact CB-CG1 4.22Å; A51-I65 HydrophobicContact CB-CG2 3.7Å
52	V	65.1	Low	65.1	Low	42 Å²	42	84 Å²	84	26%	0.255	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	124.5	-179.5	-173.6	0	0	0	0	110	I38 K54 I59 I65	I38-V52 HydrophobicContact CG1-CG2 4.47Å; V52-K54 PolarHBondContact O-N 2.91Å; V52-K54 VanDerWaalsContact O-N 3.17Å; V52-I59 HydrophobicContact CG2-CG1 4.24Å; V52-I65 VanDerWaalsContact C-CD1 3.46Å; V52-I65 WeakPolarHBondContact O-CD1 3.35Å
53	C	68.8	Low	65.1	Low	0 Å²	0	86.2 Å²	86.2	0%	0	43%	0.434	C	S	.	.			trans	-65.9	113.9	172.9	176.1	0	0	0	0	110.3	I55 Q57 Q58 F60 H68 C72	C53-I55 PolarHBondContact O-N 2.97Å; C53-I55 PolarHBondContact SG-N 3.48Å; C53-I55 VanDerWaalsContact SG-N 3.41Å; C53-Q57 WeakPolarHBondContact O-CA 3.44Å; C53-Q57 PolarHBondContact O-N 3.43Å; C53-Q58 PolarHBondContact N-O 3.43Å; C53-F60 HydrophobicContact CB-CD2 4.24Å; C53-F60 HydrophobicContact CB-CE2 3.84Å; C53-H68 VanDerWaalsContact CB-CD2 3.44Å; C53-H68 WeakPolarHBondContact CB-CD2 3.39Å; C53-H68 WeakPolarHBondContact CB-NE2 3.08Å; C53-H68 PolarHBondContact SG-CD2 2.73Å; C53-H68 PolarHBondContact SG-NE2 3.36Å; C53-C72 VanDerWaalsContact SG-SG 3.66Å
54	K	66.6	Low	64.7	Low	183 Å²	183	84 Å²	84	80%	0.796	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.4	179.2	-64.2	-178	-179.9	176.2	0	114.4	V52	V52-K54 PolarHBondContact O-N 2.91Å; V52-K54 VanDerWaalsContact O-N 3.17Å
55	I	64.2	Low	64.3	Low	44 Å²	44	78.4 Å²	78.4	23%	0.226	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-47.2	-175.8	-59.1	160	0	0	0	111.9	C53 V69 C72	C53-I55 PolarHBondContact O-N 2.97Å; C53-I55 PolarHBondContact SG-N 3.48Å; C53-I55 VanDerWaalsContact SG-N 3.41Å; I55-V69 HydrophobicContact CD1-CG1 4.05Å; I55-C72 HydrophobicContact CB-CB 4.43Å; I55-C72 HydrophobicContact CD1-CB 4.26Å; I55-C72 HydrophobicContact CG2-CB 4.28Å
56	C	68.8	Low	64	Low	33 Å²	33	79.1 Å²	79.1	22%	0.223	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-3.3	179.2	73.7	0	0	0	0	114.3	Q58 H68 C72 K73	C56-Q58 PolarHBondContact O-N 3.19Å; C56-Q58 VanDerWaalsContact SG-CB 3.53Å; C56-Q58 VanDerWaalsContact SG-CG 3.54Å; C56-Q58 PolarHBondContact SG-N 3.15Å; C56-H68 PolarHBondContact SG-CE1 3.45Å; C56-H68 PolarHBondContact SG-NE2 3.31Å; C56-C72 VanDerWaalsContact CB-SG 3.5Å; C56-K73 HydrophobicContact CB-CG 4.34Å
57	Q	67.7	Low	64.2	Low	91 Å²	91	75.9 Å²	75.9	43%	0.425	41%	0.413	S	S	.	.			trans	63.9	14.8	-178.5	-54.3	-67.3	-15.9	0	0	114.8	Q34 C53	Q34-Q57 PolarHBondContact NE2-O 3.3Å; C53-Q57 WeakPolarHBondContact O-CA 3.44Å; C53-Q57 PolarHBondContact O-N 3.43Å
58	Q	64.9	Low	64.9	Low	113 Å²	113	68 Å²	68	53%	0.528	38%	0.376	S	S	.	.			trans	-74.3	148.8	170.7	-70.3	-173.9	-4.7	0	0	111.5	C53 C56 F60	C53-Q58 PolarHBondContact N-O 3.43Å; C56-Q58 PolarHBondContact O-N 3.19Å; C56-Q58 VanDerWaalsContact SG-CB 3.53Å; C56-Q58 VanDerWaalsContact SG-CG 3.54Å; C56-Q58 PolarHBondContact SG-N 3.15Å; Q58-F60 HydrophobicContact CB-CE2 3.52Å; Q58-F60 HydrophobicContact CB-CZ 3.71Å; Q58-F60 WeakPolarHBondContact O-CD2 3.28Å; Q58-F60 WeakPolarHBondContact O-CE2 3.35Å
59	I	62.5	Low	65.5	Low	48 Å²	48	60.2 Å²	60.2	25%	0.246	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.8	-175.6	-52.1	-177.2	0	0	0	108.8	L37 I38 L41 A50 V52	L37-I59 HydrophobicContact CD2-CD1 3.85Å; L37-I59 HydrophobicContact CG-CD1 4.03Å; I38-I59 HydrophobicContact CG1-CD1 4.17Å; L41-I59 HydrophobicContact CD1-CD1 3.75Å; L41-I59 HydrophobicContact CD1-CG2 3.85Å; A50-I59 HydrophobicContact CB-CG2 3.66Å; V52-I59 HydrophobicContact CG2-CG1 4.24Å
60	F	63.9	Low	66.1	Low	41 Å²	41	59 Å²	59	18%	0.18	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	158.5	-179.4	-63.2	-85.4	0	0	0	109.9	A50 A51 C53 Q58 A64 I65 H68	A50-F60 CarbonylContact C-O 3.49Å; A50-F60 WeakPolarHBondContact CA-O 3.21Å; A51-F60 PolarHBondContact N-O 3.2Å; A51-F60 PolarHBondContact O-N 3.34Å; C53-F60 HydrophobicContact CB-CD2 4.24Å; C53-F60 HydrophobicContact CB-CE2 3.84Å; Q58-F60 HydrophobicContact CB-CE2 3.52Å; Q58-F60 HydrophobicContact CB-CZ 3.71Å; Q58-F60 WeakPolarHBondContact O-CD2 3.28Å; Q58-F60 WeakPolarHBondContact O-CE2 3.35Å; F60-A64 HydrophobicContact CB-CB 4.23Å; F60-A64 HydrophobicContact CD1-CB 4.41Å; F60-I65 HydrophobicContact CB-CB 4.03Å; F60-I65 HydrophobicContact CD2-CG1 4.29Å; F60-I65 HydrophobicContact CG-CB 4.45Å; F60-H68 HydrophobicContact CD1-CB 3.99Å; F60-H68 HydrophobicContact CD2-CB 4.29Å; F60-H68 HydrophobicContact CE1-CB 3.61Å; F60-H68 AromaticContact CE1-CG 3.59Å; F60-H68 AromaticContact CE1-ND1 3.69Å; F60-H68 HydrophobicContact CE2-CB 3.93Å; F60-H68 AromaticContact CE2-CD2 3.23Å; F60-H68 WeakPolarHBondContact CE2-CD2 3.45Å; F60-H68 AromaticContact CE2-CE1 3.78Å; F60-H68 AromaticContact CE2-CG 3.32Å; F60-H68 AromaticContact CE2-ND1 3.71Å; F60-H68 AromaticContact CE2-NE2 3.56Å; F60-H68 HydrophobicContact CG-CB 4.35Å; F60-H68 HydrophobicContact CZ-CB 3.62Å; F60-H68 AromaticContact CZ-CD2 3.48Å; F60-H68 VanDerWaalsContact CZ-CD2 3.48Å; F60-H68 WeakPolarHBondContact CZ-CD2 3.45Å; F60-H68 AromaticContact CZ-CE1 3.4Å; F60-H68 VanDerWaalsContact CZ-CE1 3.4Å; F60-H68 WeakPolarHBondContact CZ-CE1 3.41Å; F60-H68 AromaticContact CZ-CG 3.05Å; F60-H68 AromaticContact CZ-ND1 3.05Å; F60-H68 WeakPolarHBondContact CZ-ND1 3.49Å; F60-H68 AromaticContact CZ-NE2 3.69Å
61	A	64.2	Low	66.4	Low	55 Å²	55	61.2 Å²	61.2	46%	0.455	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	148.9	156.7	0	0	0	0	0	109.1	D63 A64 I65	A61-D63 WeakPolarHBondContact CB-OD1 3.36Å; A61-D63 PolarHBondContact O-N 3.12Å; A61-D63 VanDerWaalsContact O-N 3.09Å; A61-A64 HydrophobicContact CB-CB 4.39Å; A61-A64 PolarHBondContact O-N 2.83Å; A61-I65 PolarHBondContact O-N 3.48Å
62	S	65	Low	66.5	Low	66 Å²	66	60.2 Å²	60.2	46%	0.462	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.4	-173.9	50.4	0	0	0	0	113.8	L49 I65	L49-S62 WeakPolarHBondContact O-CA 3.45Å; L49-S62 WeakPolarHBondContact O-CB 3.49Å; L49-S62 PolarHBondContact O-N 3.22Å; S62-I65 WeakPolarHBondContact O-CG2 3.37Å
63	D	66	Low	66.6	Low	131 Å²	131	65.9 Å²	65.9	70%	0.701	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-33.4	177.2	57.8	-9.5	0	0	0	113.5	A61	A61-D63 WeakPolarHBondContact CB-OD1 3.36Å; A61-D63 PolarHBondContact O-N 3.12Å; A61-D63 VanDerWaalsContact O-N 3.09Å
64	A	66.1	Low	66.4	Low	42 Å²	42	69.4 Å²	69.4	35%	0.347	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-17.4	-176.4	0	0	0	0	0	114.6	F60 A61 G66 H68	F60-A64 HydrophobicContact CB-CB 4.23Å; F60-A64 HydrophobicContact CD1-CB 4.41Å; A61-A64 HydrophobicContact CB-CB 4.39Å; A61-A64 PolarHBondContact O-N 2.83Å; A64-G66 VanDerWaalsContact C-N 3.3Å; A64-G66 PolarHBondContact O-N 2.63Å; A64-H68 PolarHBondContact O-N 3.05Å
65	I	69.9	Low	66.7	Low	38 Å²	38	62 Å²	62	20%	0.195	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-33.3	-177.6	-168.3	168.4	0	0	0	113.1	A51 V52 F60 A61 S62 H68 V69	A51-I65 HydrophobicContact CB-CB 3.76Å; A51-I65 HydrophobicContact CB-CD1 3.53Å; A51-I65 HydrophobicContact CB-CG1 4.22Å; A51-I65 HydrophobicContact CB-CG2 3.7Å; V52-I65 VanDerWaalsContact C-CD1 3.46Å; V52-I65 WeakPolarHBondContact O-CD1 3.35Å; F60-I65 HydrophobicContact CB-CB 4.03Å; F60-I65 HydrophobicContact CD2-CG1 4.29Å; F60-I65 HydrophobicContact CG-CB 4.45Å; A61-I65 PolarHBondContact O-N 3.48Å; S62-I65 WeakPolarHBondContact O-CG2 3.37Å; I65-H68 PolarHBondContact O-N 3.2Å; I65-V69 HydrophobicContact CG1-CG2 3.93Å; I65-V69 WeakPolarHBondContact O-CG2 3.25Å; I65-V69 PolarHBondContact O-N 2.86Å
66	G	64.9	Low	67.3	Low	42 Å²	42	63.8 Å²	63.8	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-52.5	-177.7	0	0	0	0	0	112.1	A64 H68 V69 L70	A64-G66 VanDerWaalsContact C-N 3.3Å; A64-G66 PolarHBondContact O-N 2.63Å; G66-H68 VanDerWaalsContact C-N 3.33Å; G66-H68 PolarHBondContact O-N 3.33Å; G66-V69 PolarHBondContact O-N 3.06Å; G66-L70 WeakPolarHBondContact O-CG 3.19Å; G66-L70 PolarHBondContact O-N 3.04Å
67	S	68	Low	67.8	Low	86 Å²	86	62.2 Å²	62.2	60%	0.601	37%	0.368	S	S	*	.	H	α-helix	trans	-63.9	-36.5	178.4	-58.1	0	0	0	0	112.8	T71	S67-T71 PolarHBondContact O-OG1 3.4Å; S67-T71 VanDerWaalsContact O-OG1 3.11Å
68	H	72.5	Confident	68.2	Low	26 Å²	26	58 Å²	58	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-45.4	176	168.9	80.2	0	0	0	112.3	C53 C56 F60 A64 I65 G66 L70 T71 C72	C53-H68 VanDerWaalsContact CB-CD2 3.44Å; C53-H68 WeakPolarHBondContact CB-CD2 3.39Å; C53-H68 WeakPolarHBondContact CB-NE2 3.08Å; C53-H68 PolarHBondContact SG-CD2 2.73Å; C53-H68 PolarHBondContact SG-NE2 3.36Å; C56-H68 PolarHBondContact SG-CE1 3.45Å; C56-H68 PolarHBondContact SG-NE2 3.31Å; F60-H68 HydrophobicContact CD1-CB 3.99Å; F60-H68 HydrophobicContact CD2-CB 4.29Å; F60-H68 HydrophobicContact CE1-CB 3.61Å; F60-H68 AromaticContact CE1-CG 3.59Å; F60-H68 AromaticContact CE1-ND1 3.69Å; F60-H68 HydrophobicContact CE2-CB 3.93Å; F60-H68 AromaticContact CE2-CD2 3.23Å; F60-H68 WeakPolarHBondContact CE2-CD2 3.45Å; F60-H68 AromaticContact CE2-CE1 3.78Å; F60-H68 AromaticContact CE2-CG 3.32Å; F60-H68 AromaticContact CE2-ND1 3.71Å; F60-H68 AromaticContact CE2-NE2 3.56Å; F60-H68 HydrophobicContact CG-CB 4.35Å; F60-H68 HydrophobicContact CZ-CB 3.62Å; F60-H68 AromaticContact CZ-CD2 3.48Å; F60-H68 VanDerWaalsContact CZ-CD2 3.48Å; F60-H68 WeakPolarHBondContact CZ-CD2 3.45Å; F60-H68 AromaticContact CZ-CE1 3.4Å; F60-H68 VanDerWaalsContact CZ-CE1 3.4Å; F60-H68 WeakPolarHBondContact CZ-CE1 3.41Å; F60-H68 AromaticContact CZ-CG 3.05Å; F60-H68 AromaticContact CZ-ND1 3.05Å; F60-H68 WeakPolarHBondContact CZ-ND1 3.49Å; F60-H68 AromaticContact CZ-NE2 3.69Å; A64-H68 PolarHBondContact O-N 3.05Å; I65-H68 PolarHBondContact O-N 3.2Å; G66-H68 VanDerWaalsContact C-N 3.33Å; G66-H68 PolarHBondContact O-N 3.33Å; H68-L70 PolarHBondContact O-N 2.97Å; H68-T71 CarbonylContact O-C 3.29Å; H68-T71 PolarHBondContact O-N 3.31Å; H68-T71 PolarHBondContact O-OG1 3.38Å; H68-C72 PolarHBondContact NE2-SG 3.49Å; H68-C72 WeakPolarHBondContact O-CA 3.38Å; H68-C72 WeakPolarHBondContact O-CB 3.32Å; H68-C72 PolarHBondContact O-N 2.96Å
69	V	66.9	Low	68.5	Low	22 Å²	22	56 Å²	56	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-38.1	-179.6	169.9	0	0	0	0	110	I55 I65 G66 T71 S77	I55-V69 HydrophobicContact CD1-CG1 4.05Å; I65-V69 HydrophobicContact CG1-CG2 3.93Å; I65-V69 WeakPolarHBondContact O-CG2 3.25Å; I65-V69 PolarHBondContact O-N 2.86Å; G66-V69 PolarHBondContact O-N 3.06Å; V69-T71 PolarHBondContact O-N 2.9Å; V69-S77 WeakPolarHBondContact O-CB 3.49Å; V69-S77 PolarHBondContact O-OG 3.16Å
70	L	65.6	Low	69.2	Low	79 Å²	79	60.9 Å²	60.9	41%	0.414	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-20.4	176.4	-67.3	173.4	0	0	0	114.6	G66 H68 Y76 L91	G66-L70 WeakPolarHBondContact O-CG 3.19Å; G66-L70 PolarHBondContact O-N 3.04Å; H68-L70 PolarHBondContact O-N 2.97Å; L70-Y76 VanDerWaalsContact O-CA 3.32Å; L70-Y76 WeakPolarHBondContact O-CA 3.48Å; L70-L91 HydrophobicContact CD2-CD2 4.07Å
71	T	66	Low	69.8	Low	82 Å²	82	61.1 Å²	61.1	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-128.1	13	-175.3	54.4	0	0	0	0	113.3	S67 H68 V69 K73 G74 S75	S67-T71 PolarHBondContact O-OG1 3.4Å; S67-T71 VanDerWaalsContact O-OG1 3.11Å; H68-T71 CarbonylContact O-C 3.29Å; H68-T71 PolarHBondContact O-N 3.31Å; H68-T71 PolarHBondContact O-OG1 3.38Å; V69-T71 PolarHBondContact O-N 2.9Å; T71-K73 PolarHBondContact O-N 3.34Å; T71-G74 PolarHBondContact O-N 3.23Å; T71-S75 CarbonylContact C-O 3.47Å; T71-S75 VanDerWaalsContact C-O 3.29Å
72	C	68.8	Low	70.5	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.007	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-58	124.9	-171.8	-167.4	0	0	0	0	111.4	C53 I55 C56 H68 G74 S75	C53-C72 VanDerWaalsContact SG-SG 3.66Å; I55-C72 HydrophobicContact CB-CB 4.43Å; I55-C72 HydrophobicContact CD1-CB 4.26Å; I55-C72 HydrophobicContact CG2-CB 4.28Å; C56-C72 VanDerWaalsContact CB-SG 3.5Å; H68-C72 PolarHBondContact NE2-SG 3.49Å; H68-C72 WeakPolarHBondContact O-CA 3.38Å; H68-C72 WeakPolarHBondContact O-CB 3.32Å; H68-C72 PolarHBondContact O-N 2.96Å; C72-G74 VanDerWaalsContact C-N 3.27Å; C72-G74 PolarHBondContact O-N 3.21Å; C72-S75 PolarHBondContact N-O 3.15Å; C72-S75 PolarHBondContact O-N 2.86Å; C72-S75 VanDerWaalsContact O-N 3.09Å; C72-S75 VanDerWaalsContact O-O 3.07Å; C72-S75 PolarHBondContact O-OG 2.83Å
73	K	68.6	Low	71.1	Confident	160 Å²	160	67.8 Å²	67.8	70%	0.696	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	60.1	28.1	-175.5	-56.8	-177.6	175.9	179.9	0	114.6	C56 T71 S75	C56-K73 HydrophobicContact CB-CG 4.34Å; T71-K73 PolarHBondContact O-N 3.34Å; K73-S75 PolarHBondContact O-N 3.06Å
74	G	63.5	Low	71.8	Confident	75 Å²	75	65 Å²	65	77%	0.773	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	69.6	8.8	-174.7	0	0	0	0	0	113.3	T71 C72	T71-G74 PolarHBondContact O-N 3.23Å; C72-G74 VanDerWaalsContact C-N 3.27Å; C72-G74 PolarHBondContact O-N 3.21Å
75	S	72.6	Confident	72.5	Confident	26 Å²	26	65.2 Å²	65.2	18%	0.182	36%	0.359	C	S	.	.	S	Bend	trans	-110.6	144.7	177.5	70.7	0	0	0	0	110.4	T71 C72 K73 S77	T71-S75 CarbonylContact C-O 3.47Å; T71-S75 VanDerWaalsContact C-O 3.29Å; C72-S75 PolarHBondContact N-O 3.15Å; C72-S75 PolarHBondContact O-N 2.86Å; C72-S75 VanDerWaalsContact O-N 3.09Å; C72-S75 VanDerWaalsContact O-O 3.07Å; C72-S75 PolarHBondContact O-OG 2.83Å; K73-S75 PolarHBondContact O-N 3.06Å; S75-S77 PolarHBondContact O-N 3.22Å; S75-S77 PolarHBondContact O-OG 3.4Å
76	Y	77.7	Confident	73.2	Confident	82 Å²	82	68.3 Å²	68.3	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	103.7	178.7	-63.2	-84.5	0	0	0	109.1	L70 T84 F85 P88	L70-Y76 VanDerWaalsContact O-CA 3.32Å; L70-Y76 WeakPolarHBondContact O-CA 3.48Å; Y76-T84 CarbonylContact O-C 3.41Å; Y76-F85 PolarHBondContact N-O 3.18Å; Y76-F85 WeakPolarHBondContact O-CB 3.18Å; Y76-F85 WeakPolarHBondContact O-CD2 3.49Å; Y76-F85 PolarHBondContact O-N 2.9Å; Y76-P88 HydrophobicContact CD1-CB 4.17Å; Y76-P88 HydrophobicContact CD1-CG 4.06Å; Y76-P88 HydrophobicContact CD2-CG 4.49Å; Y76-P88 HydrophobicContact CE1-CB 4.05Å; Y76-P88 HydrophobicContact CE1-CG 3.5Å; Y76-P88 VanDerWaalsContact CE1-CG 3.5Å; Y76-P88 HydrophobicContact CE2-CG 3.98Å; Y76-P88 VanDerWaalsContact CZ-CD 3.41Å; Y76-P88 VanDerWaalsContact CZ-CG 3.43Å
77	S	78.6	Confident	74	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	144.2	-173.9	-42.2	0	0	0	0	112	V69 S75 T84 L91	V69-S77 WeakPolarHBondContact O-CB 3.49Å; V69-S77 PolarHBondContact O-OG 3.16Å; S75-S77 PolarHBondContact O-N 3.22Å; S75-S77 PolarHBondContact O-OG 3.4Å; S77-T84 WeakPolarHBondContact OG-CG2 3.2Å; S77-L91 WeakPolarHBondContact O-CD2 3.45Å
78	C	76.2	Confident	74.7	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.02	36%	0.362	C	S	.	.			trans	-70.4	129.6	176.7	-175.3	0	0	0	0	110.7	Y80 A83 F85 L91 H94 H99	C78-Y80 PolarHBondContact O-N 2.83Å; C78-Y80 PolarHBondContact SG-N 3.42Å; C78-Y80 VanDerWaalsContact SG-N 3.39Å; C78-A83 HydrophobicContact CB-CB 4.44Å; C78-A83 PolarHBondContact N-O 3.2Å; C78-F85 HydrophobicContact CB-CE2 4.42Å; C78-L91 VanDerWaalsContact CA-CD1 3.49Å; C78-L91 HydrophobicContact CB-CD1 3.92Å; C78-H94 VanDerWaalsContact SG-CD2 3.55Å; C78-H94 PolarHBondContact SG-NE2 3.22Å; C78-H99 PolarHBondContact SG-CD2 3.25Å; C78-H99 PolarHBondContact SG-NE2 2.98Å
79	P	71.9	Confident	75.2	Confident	71 Å²	71	69.3 Å²	69.3	46%	0.461	39%	0.386	S	S	.	.	S	Bend	trans	-69.5	-21.7	176.2	26.2	-32.6	0	0	0	112.8
80	Y	75.6	Confident	76.1	Confident	150 Å²	150	73.4 Å²	73.4	59%	0.588	40%	0.399	S	S	*	.	S	Bend	trans	-100.1	-14.7	-174.8	-49.5	-69.6	0	0	0	113.8	C78 V95 H99	C78-Y80 PolarHBondContact O-N 2.83Å; C78-Y80 PolarHBondContact SG-N 3.42Å; C78-Y80 VanDerWaalsContact SG-N 3.39Å; Y80-V95 HydrophobicContact CD2-CG1 4.19Å; Y80-V95 HydrophobicContact CD2-CG2 4.47Å; Y80-V95 HydrophobicContact CE2-CG1 3.76Å; Y80-H99 VanDerWaalsContact CB-CG 3.44Å; Y80-H99 WeakPolarHBondContact CB-ND1 3.35Å; Y80-H99 HydrophobicContact CD2-CB 3.47Å; Y80-H99 VanDerWaalsContact CD2-CB 3.47Å; Y80-H99 AromaticContact CD2-CD2 3.68Å; Y80-H99 AromaticContact CD2-CG 3.58Å; Y80-H99 HydrophobicContact CE2-CB 4.13Å; Y80-H99 HydrophobicContact CG-CB 3.87Å; Y80-H99 AromaticContact CG-CG 3.8Å
81	C	77.8	Confident	76.9	Confident	46 Å²	46	70 Å²	70	31%	0.311	38%	0.382	S	S	.	.	S	Bend	trans	-152.1	173.7	177.7	79.6	0	0	0	0	112.7	A83 H94 H99	C81-A83 PolarHBondContact O-N 3.34Å; C81-A83 VanDerWaalsContact O-N 3.1Å; C81-A83 VanDerWaalsContact SG-CB 3.52Å; C81-A83 PolarHBondContact SG-N 3.23Å; C81-H94 VanDerWaalsContact SG-CE1 3.59Å; C81-H94 PolarHBondContact SG-NE2 3.33Å; C81-H99 PolarHBondContact SG-NE2 3.47Å; C81-H99 VanDerWaalsContact SG-NE2 3.4Å
82	R	78.1	Confident	77.6	Confident	231 Å²	231	72 Å²	72	87%	0.872	39%	0.385	S	S	*	.	S	Bend	trans	-76	7.8	-176.7	-61.2	-177.2	-178.2	170.7	0.6	114.8
83	A	77	Confident	78.2	Confident	30 Å²	30	77.5 Å²	77.5	25%	0.248	41%	0.406	C	S	.	.			trans	-74.9	135.6	-178.1	0	0	0	0	0	111.2	C78 C81 F85	C78-A83 HydrophobicContact CB-CB 4.44Å; C78-A83 PolarHBondContact N-O 3.2Å; C81-A83 PolarHBondContact O-N 3.34Å; C81-A83 VanDerWaalsContact O-N 3.1Å; C81-A83 VanDerWaalsContact SG-CB 3.52Å; C81-A83 PolarHBondContact SG-N 3.23Å; A83-F85 HydrophobicContact CB-CE2 3.66Å; A83-F85 HydrophobicContact CB-CZ 3.63Å
84	T	80.9	Confident	78.8	Confident	73 Å²	73	71.4 Å²	71.4	45%	0.448	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.5	174.7	60.9	0	0	0	0	110.2	Y76 S77	Y76-T84 CarbonylContact O-C 3.41Å; S77-T84 WeakPolarHBondContact OG-CG2 3.2Å
85	F	82.6	Confident	79.6	Confident	47 Å²	47	68.3 Å²	68.3	21%	0.206	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.4	-174.1	-59.6	-81.3	0	0	0	110.8	Y76 C78 A83 S87 L91 H94	Y76-F85 PolarHBondContact N-O 3.18Å; Y76-F85 WeakPolarHBondContact O-CB 3.18Å; Y76-F85 WeakPolarHBondContact O-CD2 3.49Å; Y76-F85 PolarHBondContact O-N 2.9Å; C78-F85 HydrophobicContact CB-CE2 4.42Å; A83-F85 HydrophobicContact CB-CE2 3.66Å; A83-F85 HydrophobicContact CB-CZ 3.63Å; F85-S87 VanDerWaalsContact C-N 3.33Å; F85-L91 HydrophobicContact CB-CB 4.16Å; F85-L91 HydrophobicContact CD2-CB 3.83Å; F85-L91 HydrophobicContact CD2-CD1 3.77Å; F85-L91 HydrophobicContact CD2-CG 4.41Å; F85-L91 HydrophobicContact CE2-CD1 4.05Å; F85-L91 HydrophobicContact CG-CB 4.19Å; F85-H94 HydrophobicContact CD2-CB 4.36Å; F85-H94 HydrophobicContact CE1-CB 3.71Å; F85-H94 HydrophobicContact CE2-CB 3.54Å; F85-H94 AromaticContact CE2-CD2 3.59Å; F85-H94 AromaticContact CE2-CG 3.43Å; F85-H94 VanDerWaalsContact CE2-CG 3.43Å; F85-H94 AromaticContact CE2-ND1 4Å; F85-H94 HydrophobicContact CZ-CB 3.2Å; F85-H94 AromaticContact CZ-CD2 3.73Å; F85-H94 AromaticContact CZ-CE1 3.96Å; F85-H94 AromaticContact CZ-CG 3.11Å; F85-H94 AromaticContact CZ-ND1 3.31Å; F85-H94 VanDerWaalsContact CZ-ND1 3.31Å; F85-H94 WeakPolarHBondContact CZ-ND1 3.42Å
86	S	83.1	Confident	79.8	Confident	102 Å²	102	69.2 Å²	69.2	71%	0.713	35%	0.352	S	S	*	.	S	Bend	trans	-79.6	-12.5	178.8	53.6	0	0	0	0	114
87	S	81.5	Confident	79.7	Confident	28 Å²	28	69.7 Å²	69.7	20%	0.196	35%	0.353	C	S	.	.	S	Bend	trans	-146.1	155.9	179.5	77	0	0	0	0	112.3	F85 S89 Y90 L91	F85-S87 VanDerWaalsContact C-N 3.33Å; S87-S89 VanDerWaalsContact C-N 3.25Å; S87-S89 PolarHBondContact O-N 3.18Å; S87-Y90 PolarHBondContact O-N 2.91Å; S87-Y90 WeakPolarHBondContact OG-CD2 3.25Å; S87-Y90 PolarHBondContact OG-N 3.06Å; S87-L91 PolarHBondContact O-N 3.12Å; S87-L91 VanDerWaalsContact O-N 3.17Å
88	P	82.9	Confident	79.6	Confident	61 Å²	61	78.9 Å²	78.9	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-38.1	175.7	-10.4	20.1	0	0	0	111.4	Y76 Y90 L91 Q92	Y76-P88 HydrophobicContact CD1-CB 4.17Å; Y76-P88 HydrophobicContact CD1-CG 4.06Å; Y76-P88 HydrophobicContact CD2-CG 4.49Å; Y76-P88 HydrophobicContact CE1-CB 4.05Å; Y76-P88 HydrophobicContact CE1-CG 3.5Å; Y76-P88 VanDerWaalsContact CE1-CG 3.5Å; Y76-P88 HydrophobicContact CE2-CG 3.98Å; Y76-P88 VanDerWaalsContact CZ-CD 3.41Å; Y76-P88 VanDerWaalsContact CZ-CG 3.43Å; P88-Y90 VanDerWaalsContact C-N 3.31Å; P88-Y90 PolarHBondContact O-N 3.28Å; P88-L91 PolarHBondContact O-N 2.84Å; P88-Q92 WeakPolarHBondContact O-CB 3.47Å; P88-Q92 WeakPolarHBondContact O-CG 3.33Å; P88-Q92 PolarHBondContact O-N 3.48Å
89	S	83.6	Confident	79.6	Confident	87 Å²	87	81.6 Å²	81.6	61%	0.608	40%	0.4	S	S	*	.	H	α-helix	trans	-62.4	-37.7	-179.8	-45.1	0	0	0	0	112.3	S87 R93	S87-S89 VanDerWaalsContact C-N 3.25Å; S87-S89 PolarHBondContact O-N 3.18Å; S89-R93 VanDerWaalsContact O-CB 3.23Å; S89-R93 WeakPolarHBondContact O-CB 3.03Å; S89-R93 PolarHBondContact O-N 2.87Å
90	Y	84.7	Confident	79.3	Confident	108 Å²	108	81 Å²	81	42%	0.424	39%	0.391	S	S	.	.	H	α-helix	trans	-73	-37	175.7	-70.1	-41.5	0	0	0	112.6	S87 P88 R93 H94	S87-Y90 PolarHBondContact O-N 2.91Å; S87-Y90 WeakPolarHBondContact OG-CD2 3.25Å; S87-Y90 PolarHBondContact OG-N 3.06Å; P88-Y90 VanDerWaalsContact C-N 3.31Å; P88-Y90 PolarHBondContact O-N 3.28Å; Y90-R93 PolarHBondContact O-N 3.19Å; Y90-H94 WeakPolarHBondContact O-CB 3.13Å; Y90-H94 PolarHBondContact O-N 3.15Å
91	L	83.2	Confident	78.4	Confident	8 Å²	8	80.9 Å²	80.9	4%	0.042	41%	0.406	C	S	.	.	H	α-helix	trans	-62.1	-49.9	171.9	169.9	59.8	0	0	0	111.2	L70 S77 C78 F85 S87 P88 R93 H94 V95	L70-L91 HydrophobicContact CD2-CD2 4.07Å; S77-L91 WeakPolarHBondContact O-CD2 3.45Å; C78-L91 VanDerWaalsContact CA-CD1 3.49Å; C78-L91 HydrophobicContact CB-CD1 3.92Å; F85-L91 HydrophobicContact CB-CB 4.16Å; F85-L91 HydrophobicContact CD2-CB 3.83Å; F85-L91 HydrophobicContact CD2-CD1 3.77Å; F85-L91 HydrophobicContact CD2-CG 4.41Å; F85-L91 HydrophobicContact CE2-CD1 4.05Å; F85-L91 HydrophobicContact CG-CB 4.19Å; S87-L91 PolarHBondContact O-N 3.12Å; S87-L91 VanDerWaalsContact O-N 3.17Å; P88-L91 PolarHBondContact O-N 2.84Å; L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 3.47Å; L91-H94 CarbonylContact O-C 3.58Å; L91-H94 WeakPolarHBondContact O-CA 3.24Å; L91-H94 WeakPolarHBondContact O-CB 3.29Å; L91-H94 PolarHBondContact O-N 3.16Å; L91-V95 HydrophobicContact CD1-CG2 3.75Å; L91-V95 HydrophobicContact CG-CG2 4.36Å; L91-V95 WeakPolarHBondContact O-CG2 3.42Å; L91-V95 PolarHBondContact O-N 3.47Å
92	Q	81.1	Confident	77.7	Confident	122 Å²	122	85.5 Å²	85.5	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-57.7	-44.3	177.1	-74.4	-64.2	-18.2	0	0	111.6	P88 H94 V95 S96	P88-Q92 WeakPolarHBondContact O-CB 3.47Å; P88-Q92 WeakPolarHBondContact O-CG 3.33Å; P88-Q92 PolarHBondContact O-N 3.48Å; Q92-H94 VanDerWaalsContact C-N 3.28Å; Q92-H94 PolarHBondContact O-N 3.31Å; Q92-V95 PolarHBondContact O-N 3Å; Q92-S96 WeakPolarHBondContact O-CB 3.14Å; Q92-S96 PolarHBondContact O-N 3.44Å; Q92-S96 PolarHBondContact O-OG 2.77Å
93	R	81	Confident	77	Confident	118 Å²	118	82.7 Å²	82.7	45%	0.445	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-32.5	174	-172.5	171.9	72.9	169.5	2.9	112.8	S89 Y90 L91 S96 R97	S89-R93 VanDerWaalsContact O-CB 3.23Å; S89-R93 WeakPolarHBondContact O-CB 3.03Å; S89-R93 PolarHBondContact O-N 2.87Å; Y90-R93 PolarHBondContact O-N 3.19Å; L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 3.47Å; R93-S96 WeakPolarHBondContact CA-OG 3.39Å; R93-S96 PolarHBondContact O-OG 2.59Å; R93-R97 VanDerWaalsContact CG-NE 3.31Å; R93-R97 WeakPolarHBondContact O-CB 3.38Å; R93-R97 VanDerWaalsContact O-CD 3.23Å; R93-R97 WeakPolarHBondContact O-CD 3.36Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.33Å
94	H	82.3	Confident	76.8	Confident	31 Å²	31	85.7 Å²	85.7	14%	0.144	43%	0.428	C	S	.	.	H	α-helix	trans	-71.7	-47.6	174.8	167.2	86.3	0	0	0	111.5	C78 C81 F85 Y90 L91 Q92 R97 R98 H99	C78-H94 VanDerWaalsContact SG-CD2 3.55Å; C78-H94 PolarHBondContact SG-NE2 3.22Å; C81-H94 VanDerWaalsContact SG-CE1 3.59Å; C81-H94 PolarHBondContact SG-NE2 3.33Å; F85-H94 HydrophobicContact CD2-CB 4.36Å; F85-H94 HydrophobicContact CE1-CB 3.71Å; F85-H94 HydrophobicContact CE2-CB 3.54Å; F85-H94 AromaticContact CE2-CD2 3.59Å; F85-H94 AromaticContact CE2-CG 3.43Å; F85-H94 VanDerWaalsContact CE2-CG 3.43Å; F85-H94 AromaticContact CE2-ND1 4Å; F85-H94 HydrophobicContact CZ-CB 3.2Å; F85-H94 AromaticContact CZ-CD2 3.73Å; F85-H94 AromaticContact CZ-CE1 3.96Å; F85-H94 AromaticContact CZ-CG 3.11Å; F85-H94 AromaticContact CZ-ND1 3.31Å; F85-H94 VanDerWaalsContact CZ-ND1 3.31Å; F85-H94 WeakPolarHBondContact CZ-ND1 3.42Å; Y90-H94 WeakPolarHBondContact O-CB 3.13Å; Y90-H94 PolarHBondContact O-N 3.15Å; L91-H94 CarbonylContact O-C 3.58Å; L91-H94 WeakPolarHBondContact O-CA 3.24Å; L91-H94 WeakPolarHBondContact O-CB 3.29Å; L91-H94 PolarHBondContact O-N 3.16Å; Q92-H94 VanDerWaalsContact C-N 3.28Å; Q92-H94 PolarHBondContact O-N 3.31Å; H94-R97 CarbonylContact O-C 3.58Å; H94-R97 PolarHBondContact O-N 3.16Å; H94-R97 VanDerWaalsContact O-N 3.16Å; H94-R98 VanDerWaalsContact O-CB 3.32Å; H94-R98 WeakPolarHBondContact O-CB 3.35Å; H94-R98 PolarHBondContact O-N 2.91Å; H94-H99 AromaticContact CD2-CD2 3.89Å; H94-H99 AromaticContact CD2-NE2 3.71Å; H94-H99 AromaticContact CE1-NE2 3.83Å; H94-H99 AromaticContact NE2-CD2 3.61Å; H94-H99 AromaticContact NE2-NE2 2.96Å; H94-H99 PolarHBondContact NE2-NE2 3.1Å
95	V	79.8	Confident	76.8	Confident	11 Å²	11	83.9 Å²	83.9	7%	0.067	42%	0.417	C	S	.	.	H	α-helix	trans	-59.4	-52.9	-179.3	172.4	0	0	0	0	110.7	Y80 L91 Q92 R97 R98 H99 E100	Y80-V95 HydrophobicContact CD2-CG1 4.19Å; Y80-V95 HydrophobicContact CD2-CG2 4.47Å; Y80-V95 HydrophobicContact CE2-CG1 3.76Å; L91-V95 HydrophobicContact CD1-CG2 3.75Å; L91-V95 HydrophobicContact CG-CG2 4.36Å; L91-V95 WeakPolarHBondContact O-CG2 3.42Å; L91-V95 PolarHBondContact O-N 3.47Å; Q92-V95 PolarHBondContact O-N 3Å; V95-R97 PolarHBondContact O-N 3.46Å; V95-R98 PolarHBondContact O-N 3.28Å; V95-H99 PolarHBondContact O-N 3.19Å; V95-E100 HydrophobicContact CG1-CG 3.98Å; V95-E100 PolarHBondContact O-N 3.27Å
96	S	77.1	Confident	76.9	Confident	44 Å²	44	85.5 Å²	85.5	31%	0.308	43%	0.431	S	S	.	.	H	α-helix	trans	-57.2	-32.5	175	54.3	0	0	0	0	114	Q92 R93 E100 R104	Q92-S96 WeakPolarHBondContact O-CB 3.14Å; Q92-S96 PolarHBondContact O-N 3.44Å; Q92-S96 PolarHBondContact O-OG 2.77Å; R93-S96 WeakPolarHBondContact CA-OG 3.39Å; R93-S96 PolarHBondContact O-OG 2.59Å; S96-E100 WeakPolarHBondContact CA-OE2 3.44Å; S96-R104 PolarHBondContact O-NH2 2.98Å
97	R	74.3	Confident	77.2	Confident	93 Å²	93	80.7 Å²	80.7	35%	0.351	40%	0.397	S	S	.	.	H	α-helix	trans	-89.7	-18.6	-179.4	-71.1	176.9	-174.7	-159.9	-3.4	114.4	R93 H94 V95 R104 S115	R93-R97 VanDerWaalsContact CG-NE 3.31Å; R93-R97 WeakPolarHBondContact O-CB 3.38Å; R93-R97 VanDerWaalsContact O-CD 3.23Å; R93-R97 WeakPolarHBondContact O-CD 3.36Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.33Å; H94-R97 CarbonylContact O-C 3.58Å; H94-R97 PolarHBondContact O-N 3.16Å; H94-R97 VanDerWaalsContact O-N 3.16Å; V95-R97 PolarHBondContact O-N 3.46Å; R97-R104 PolarHBondContact O-NH1 3.33Å; R97-R104 PolarHBondContact O-NH2 3.46Å; R97-S115 VanDerWaalsContact NE-CB 3.28Å; R97-S115 PolarHBondContact NH2-OG 2.81Å
98	R	76.4	Confident	77.6	Confident	192 Å²	192	84.4 Å²	84.4	73%	0.725	42%	0.424	S	S	*	.	H	α-helix	trans	-124.8	-27.6	-169.8	-68	-64.1	-170.4	142.4	0.7	114.2	H94 V95	H94-R98 VanDerWaalsContact O-CB 3.32Å; H94-R98 WeakPolarHBondContact O-CB 3.35Å; H94-R98 PolarHBondContact O-N 2.91Å; V95-R98 PolarHBondContact O-N 3.28Å
99	H	76.9	Confident	77.8	Confident	61 Å²	61	86.3 Å²	86.3	28%	0.282	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-33.1	-172.1	-56.5	-56.7	0	0	0	112.2	C78 Y80 C81 H94 V95	C78-H99 PolarHBondContact SG-CD2 3.25Å; C78-H99 PolarHBondContact SG-NE2 2.98Å; Y80-H99 VanDerWaalsContact CB-CG 3.44Å; Y80-H99 WeakPolarHBondContact CB-ND1 3.35Å; Y80-H99 HydrophobicContact CD2-CB 3.47Å; Y80-H99 VanDerWaalsContact CD2-CB 3.47Å; Y80-H99 AromaticContact CD2-CD2 3.68Å; Y80-H99 AromaticContact CD2-CG 3.58Å; Y80-H99 HydrophobicContact CE2-CB 4.13Å; Y80-H99 HydrophobicContact CG-CB 3.87Å; Y80-H99 AromaticContact CG-CG 3.8Å; C81-H99 PolarHBondContact SG-NE2 3.47Å; C81-H99 VanDerWaalsContact SG-NE2 3.4Å; H94-H99 AromaticContact CD2-CD2 3.89Å; H94-H99 AromaticContact CD2-NE2 3.71Å; H94-H99 AromaticContact CE1-NE2 3.83Å; H94-H99 AromaticContact NE2-CD2 3.61Å; H94-H99 AromaticContact NE2-NE2 2.96Å; H94-H99 PolarHBondContact NE2-NE2 3.1Å; V95-H99 PolarHBondContact O-N 3.19Å
100	E	65	Low	78	Confident	58 Å²	58	85.3 Å²	85.3	27%	0.271	43%	0.426	S	S	.	.			trans	-88.6	132	176.2	-60.5	172.5	156.7	0	0	111.2	V95 S96 F102 R104	V95-E100 HydrophobicContact CG1-CG 3.98Å; V95-E100 PolarHBondContact O-N 3.27Å; S96-E100 WeakPolarHBondContact CA-OE2 3.44Å; E100-F102 HydrophobicContact CB-CD2 3.41Å; E100-F102 VanDerWaalsContact CB-CD2 3.41Å; E100-F102 HydrophobicContact CB-CE2 3.8Å; E100-F102 HydrophobicContact CB-CG 4.39Å; E100-F102 HydrophobicContact CG-CD2 4.01Å; E100-F102 HydrophobicContact CG-CE2 3.89Å; E100-F102 PolarHBondContact O-N 3.09Å; E100-F102 VanDerWaalsContact OE2-CD2 3.25Å; E100-F102 WeakPolarHBondContact OE2-CD2 3.19Å; E100-F102 VanDerWaalsContact OE2-CE2 3.27Å; E100-F102 WeakPolarHBondContact OE2-CE2 3.43Å; E100-R104 PolarHBondContact O-NH2 2.81Å; E100-R104 VanDerWaalsContact O-NH2 3.09Å
101	V	58	Low	78	Confident	148 Å²	148	82.8 Å²	82.8	90%	0.897	43%	0.433	S	S	*	.			trans	-90.1	51.5	169.9	-166.7	0	0	0	0	108
102	F	61.9	Low	78.1	Confident	143 Å²	143	88.7 Å²	88.7	63%	0.627	46%	0.458	S	S	*	.			trans	-76	149.6	167.8	-78.1	-64.9	0	0	0	109.7	E100 R104	E100-F102 HydrophobicContact CB-CD2 3.41Å; E100-F102 VanDerWaalsContact CB-CD2 3.41Å; E100-F102 HydrophobicContact CB-CE2 3.8Å; E100-F102 HydrophobicContact CB-CG 4.39Å; E100-F102 HydrophobicContact CG-CD2 4.01Å; E100-F102 HydrophobicContact CG-CE2 3.89Å; E100-F102 PolarHBondContact O-N 3.09Å; E100-F102 VanDerWaalsContact OE2-CD2 3.25Å; E100-F102 WeakPolarHBondContact OE2-CD2 3.19Å; E100-F102 VanDerWaalsContact OE2-CE2 3.27Å; E100-F102 WeakPolarHBondContact OE2-CE2 3.43Å; F102-R104 VanDerWaalsContact C-N 3.25Å; F102-R104 PolarHBondContact O-N 3.32Å
103	D	63.7	Low	78.2	Confident	171 Å²	171	84.8 Å²	84.8	91%	0.914	45%	0.451	S	S	*	.			trans	-53.3	86.4	175.6	-93.3	-30.7	0	0	0	110.7
104	R	72.9	Confident	78.4	Confident	94 Å²	94	80.6 Å²	80.6	36%	0.355	44%	0.436	S	S	.	.			trans	-64.7	139.7	171.3	-70.5	168.1	-151.1	-129.7	-1.1	106.5	S96 R97 E100 F102 T106	S96-R104 PolarHBondContact O-NH2 2.98Å; R97-R104 PolarHBondContact O-NH1 3.33Å; R97-R104 PolarHBondContact O-NH2 3.46Å; E100-R104 PolarHBondContact O-NH2 2.81Å; E100-R104 VanDerWaalsContact O-NH2 3.09Å; F102-R104 VanDerWaalsContact C-N 3.25Å; F102-R104 PolarHBondContact O-N 3.32Å; R104-T106 WeakPolarHBondContact O-CG2 3.49Å; R104-T106 PolarHBondContact O-N 3.49Å
105	P	80.2	Confident	78.3	Confident	34 Å²	34	81.9 Å²	81.9	22%	0.221	45%	0.449	C	S	.	.			trans	-54.5	108.3	167	-25.6	34.3	0	0	0	109.1	F114 T117 L120	P105-F114 WeakPolarHBondContact CD-O 3.39Å; P105-F114 WeakPolarHBondContact O-CB 3.36Å; P105-F114 PolarHBondContact O-N 3.43Å; P105-T117 HydrophobicContact CB-CG2 4.35Å; P105-T117 HydrophobicContact CG-CG2 3.73Å; P105-L120 HydrophobicContact CB-CB 3.94Å; P105-L120 HydrophobicContact CB-CD2 3.54Å; P105-L120 HydrophobicContact CB-CG 4.36Å
106	T	85.3	Confident	78.4	Confident	81 Å²	81	83.4 Å²	83.4	50%	0.497	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-98.5	147.9	178.6	49.5	0	0	0	0	110	R104 S108 K112 L120	R104-T106 WeakPolarHBondContact O-CG2 3.49Å; R104-T106 PolarHBondContact O-N 3.49Å; T106-S108 PolarHBondContact O-N 3.38Å; T106-K112 CarbonylContact C-O 3.59Å; T106-K112 WeakPolarHBondContact CA-O 3.41Å; T106-L120 VanDerWaalsContact O-CD2 3.3Å; T106-L120 WeakPolarHBondContact O-CD2 3.39Å
107	C	88.9	Confident	78.9	Confident	1 Å²	1	86.5 Å²	86.5	1%	0.007	48%	0.477	C	S	.	.			trans	-77	120.1	169.6	-171.7	0	0	0	0	109.7	V109 C110 G111 K112 F114 L120 H123 H127	C107-V109 PolarHBondContact O-N 2.77Å; C107-V109 VanDerWaalsContact O-N 3.17Å; C107-C110 PolarHBondContact O-N 3.39Å; C107-G111 WeakPolarHBondContact O-CA 3.16Å; C107-G111 PolarHBondContact O-N 3.24Å; C107-K112 PolarHBondContact N-O 2.82Å; C107-F114 HydrophobicContact CB-CE2 4.18Å; C107-L120 HydrophobicContact CB-CD1 3.8Å; C107-H123 WeakPolarHBondContact CB-NE2 3.26Å; C107-H123 PolarHBondContact SG-NE2 2.99Å; C107-H123 VanDerWaalsContact SG-NE2 3.37Å; C107-H127 PolarHBondContact SG-CD2 2.87Å; C107-H127 PolarHBondContact SG-NE2 3.46Å
108	S	89.5	Confident	79.6	Confident	107 Å²	107	87.4 Å²	87.4	75%	0.748	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18	175.5	55.5	0	0	0	0	113.8	T106	T106-S108 PolarHBondContact O-N 3.38Å
109	V	87.7	Confident	80.2	Confident	101 Å²	101	80.3 Å²	80.3	61%	0.612	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-37.6	-178.8	-177.1	0	0	0	0	112.3	C107	C107-V109 PolarHBondContact O-N 2.77Å; C107-V109 VanDerWaalsContact O-N 3.17Å
110	C	87.6	Confident	80.9	Confident	66 Å²	66	78.3 Å²	78.3	45%	0.446	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	3	-175.2	68.9	0	0	0	0	115.1	C107 K112 H123	C107-C110 PolarHBondContact O-N 3.39Å; C110-K112 PolarHBondContact O-N 2.91Å; C110-K112 VanDerWaalsContact SG-CB 3.6Å; C110-H123 PolarHBondContact SG-NE2 3.46Å
111	G	85.6	Confident	82.1	Confident	55 Å²	55	77.8 Å²	77.8	57%	0.567	47%	0.466	S	S	*	.			trans	70	-3.3	-179	0	0	0	0	0	115.4	C107 G113	C107-G111 WeakPolarHBondContact O-CA 3.16Å; C107-G111 PolarHBondContact O-N 3.24Å; G111-G113 PolarHBondContact O-N 3.17Å
112	K	84.5	Confident	83.6	Confident	131 Å²	131	71.7 Å²	71.7	57%	0.57	43%	0.429	S	S	*	.			trans	-64.7	127.3	-175.6	-168.4	169.6	-175.7	175.5	0	111.4	T106 C107 C110 F114	T106-K112 CarbonylContact C-O 3.59Å; T106-K112 WeakPolarHBondContact CA-O 3.41Å; C107-K112 PolarHBondContact N-O 2.82Å; C110-K112 PolarHBondContact O-N 2.91Å; C110-K112 VanDerWaalsContact SG-CB 3.6Å; K112-F114 HydrophobicContact CB-CE2 3.91Å; K112-F114 HydrophobicContact CB-CZ 4.17Å; K112-F114 HydrophobicContact CD-CE2 4.47Å; K112-F114 HydrophobicContact CD-CZ 3.9Å; K112-F114 HydrophobicContact CG-CE2 4Å; K112-F114 HydrophobicContact CG-CZ 3.9Å; K112-F114 WeakPolarHBondContact O-CD2 3.48Å; K112-F114 WeakPolarHBondContact O-CE2 3.39Å
113	G	83.7	Confident	85	Confident	41 Å²	41	66 Å²	66	42%	0.423	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-84.8	138.8	177.1	0	0	0	0	0	113.1	G111	G111-G113 PolarHBondContact O-N 3.17Å
114	F	84.9	Confident	86.2	Confident	30 Å²	30	62 Å²	62	13%	0.132	38%	0.379	C	S	.	.			trans	-118.7	154.9	-178.7	-67.9	-89.9	0	0	0	112.1	P105 C107 K112 S116 L120 H123	P105-F114 WeakPolarHBondContact CD-O 3.39Å; P105-F114 WeakPolarHBondContact O-CB 3.36Å; P105-F114 PolarHBondContact O-N 3.43Å; C107-F114 HydrophobicContact CB-CE2 4.18Å; K112-F114 HydrophobicContact CB-CE2 3.91Å; K112-F114 HydrophobicContact CB-CZ 4.17Å; K112-F114 HydrophobicContact CD-CE2 4.47Å; K112-F114 HydrophobicContact CD-CZ 3.9Å; K112-F114 HydrophobicContact CG-CE2 4Å; K112-F114 HydrophobicContact CG-CZ 3.9Å; K112-F114 WeakPolarHBondContact O-CD2 3.48Å; K112-F114 WeakPolarHBondContact O-CE2 3.39Å; F114-S116 VanDerWaalsContact C-N 3.33Å; F114-L120 HydrophobicContact CB-CB 4.05Å; F114-L120 HydrophobicContact CD2-CB 3.96Å; F114-L120 HydrophobicContact CD2-CD1 3.57Å; F114-L120 HydrophobicContact CD2-CG 4.35Å; F114-L120 HydrophobicContact CE2-CD1 3.81Å; F114-L120 HydrophobicContact CG-CB 4.03Å; F114-L120 HydrophobicContact CG-CD1 4.45Å; F114-H123 HydrophobicContact CD1-CB 4.32Å; F114-H123 HydrophobicContact CE1-CB 3.48Å; F114-H123 VanDerWaalsContact CE1-CB 3.48Å; F114-H123 AromaticContact CE1-CG 3.73Å; F114-H123 HydrophobicContact CE2-CB 3.99Å; F114-H123 AromaticContact CE2-CD2 3.27Å; F114-H123 WeakPolarHBondContact CE2-CD2 3.37Å; F114-H123 AromaticContact CE2-CG 3.62Å; F114-H123 AromaticContact CE2-NE2 3.8Å; F114-H123 HydrophobicContact CZ-CB 3.32Å; F114-H123 AromaticContact CZ-CD2 3.21Å; F114-H123 WeakPolarHBondContact CZ-CD2 3.45Å; F114-H123 AromaticContact CZ-CE1 3.87Å; F114-H123 AromaticContact CZ-CG 3.03Å; F114-H123 AromaticContact CZ-ND1 3.5Å; F114-H123 WeakPolarHBondContact CZ-ND1 3.38Å; F114-H123 AromaticContact CZ-NE2 3.7Å
115	S	80.2	Confident	87	Confident	58 Å²	58	61 Å²	61	41%	0.406	38%	0.375	S	S	.	.	S	Bend	trans	-84.1	-5.5	-178.7	63.8	0	0	0	0	115.5	R97	R97-S115 VanDerWaalsContact NE-CB 3.28Å; R97-S115 PolarHBondContact NH2-OG 2.81Å
116	S	83.2	Confident	87.2	Confident	43 Å²	43	63.4 Å²	63.4	30%	0.301	39%	0.385	S	S	.	.	S	Bend	trans	-158.6	155.8	175.9	73.3	0	0	0	0	109.3	F114 N118 S119 L120	F114-S116 VanDerWaalsContact C-N 3.33Å; S116-N118 VanDerWaalsContact C-N 3.27Å; S116-N118 PolarHBondContact O-N 3.21Å; S116-S119 PolarHBondContact O-N 3.32Å; S116-S119 WeakPolarHBondContact OG-CB 3.38Å; S116-S119 PolarHBondContact OG-N 3.32Å; S116-S119 PolarHBondContact OG-OG 3.46Å; S116-L120 PolarHBondContact O-N 3.04Å; S116-L120 VanDerWaalsContact O-N 3.14Å
117	T	87	Confident	87.3	Confident	108 Å²	108	63 Å²	63	66%	0.663	38%	0.378	S	S	*	.	H	α-helix	trans	-61.4	-36.7	174.5	49.3	0	0	0	0	111.6	P105 S119 L120 A121	P105-T117 HydrophobicContact CB-CG2 4.35Å; P105-T117 HydrophobicContact CG-CG2 3.73Å; T117-S119 PolarHBondContact O-N 3.08Å; T117-L120 WeakPolarHBondContact O-CB 3.21Å; T117-L120 PolarHBondContact O-N 3.18Å; T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.39Å
118	N	89.5	Confident	87.1	Confident	112 Å²	112	73 Å²	73	60%	0.599	42%	0.415	S	S	*	.	H	α-helix	trans	-63.7	-41	175.4	-169.6	47.3	0	0	0	112.2	S116 L120 A121 V122	S116-N118 VanDerWaalsContact C-N 3.27Å; S116-N118 PolarHBondContact O-N 3.21Å; N118-L120 VanDerWaalsContact C-N 3.33Å; N118-L120 PolarHBondContact O-N 3.29Å; N118-A121 PolarHBondContact O-N 2.95Å; N118-V122 WeakPolarHBondContact O-CG2 3.28Å; N118-V122 PolarHBondContact O-N 3.14Å
119	S	88.9	Confident	86.6	Confident	44 Å²	44	74.4 Å²	74.4	31%	0.308	41%	0.414	S	S	.	.	H	α-helix	trans	-63	-39.9	174.7	-56.6	0	0	0	0	111.9	S116 T117 H123	S116-S119 PolarHBondContact O-N 3.32Å; S116-S119 WeakPolarHBondContact OG-CB 3.38Å; S116-S119 PolarHBondContact OG-N 3.32Å; S116-S119 PolarHBondContact OG-OG 3.46Å; T117-S119 PolarHBondContact O-N 3.08Å; S119-H123 WeakPolarHBondContact O-CB 3.46Å; S119-H123 PolarHBondContact O-N 3.47Å
120	L	90.8	Very high	86.5	Confident	18 Å²	18	74.7 Å²	74.7	9%	0.094	41%	0.409	C	S	.	.	H	α-helix	trans	-64.8	-43.6	173.7	173.7	62.4	0	0	0	111.6	P105 T106 C107 F114 S116 T117 N118 V122 H123 K124	P105-L120 HydrophobicContact CB-CB 3.94Å; P105-L120 HydrophobicContact CB-CD2 3.54Å; P105-L120 HydrophobicContact CB-CG 4.36Å; T106-L120 VanDerWaalsContact O-CD2 3.3Å; T106-L120 WeakPolarHBondContact O-CD2 3.39Å; C107-L120 HydrophobicContact CB-CD1 3.8Å; F114-L120 HydrophobicContact CB-CB 4.05Å; F114-L120 HydrophobicContact CD2-CB 3.96Å; F114-L120 HydrophobicContact CD2-CD1 3.57Å; F114-L120 HydrophobicContact CD2-CG 4.35Å; F114-L120 HydrophobicContact CE2-CD1 3.81Å; F114-L120 HydrophobicContact CG-CB 4.03Å; F114-L120 HydrophobicContact CG-CD1 4.45Å; S116-L120 PolarHBondContact O-N 3.04Å; S116-L120 VanDerWaalsContact O-N 3.14Å; T117-L120 WeakPolarHBondContact O-CB 3.21Å; T117-L120 PolarHBondContact O-N 3.18Å; N118-L120 VanDerWaalsContact C-N 3.33Å; N118-L120 PolarHBondContact O-N 3.29Å; L120-V122 PolarHBondContact O-N 3.19Å; L120-H123 WeakPolarHBondContact O-CB 3.19Å; L120-H123 PolarHBondContact O-N 3.47Å; L120-H123 VanDerWaalsContact O-N 3.16Å; L120-K124 HydrophobicContact CD1-CG 4.17Å; L120-K124 HydrophobicContact CG-CD 4.43Å; L120-K124 HydrophobicContact CG-CG 4.47Å; L120-K124 WeakPolarHBondContact O-CG 3.43Å; L120-K124 PolarHBondContact O-N 3.49Å
121	A	90.6	Very high	86.4	Confident	48 Å²	48	74.3 Å²	74.3	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-43.3	179.5	0	0	0	0	0	112	T117 N118 K124	T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.39Å; N118-A121 PolarHBondContact O-N 2.95Å; A121-K124 PolarHBondContact O-N 3.42Å
122	V	89.3	Confident	86.4	Confident	20 Å²	20	74.1 Å²	74.1	12%	0.121	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-44.6	172.7	172.1	0	0	0	0	111	N118 L120 K124 R125 Q144	N118-V122 WeakPolarHBondContact O-CG2 3.28Å; N118-V122 PolarHBondContact O-N 3.14Å; L120-V122 PolarHBondContact O-N 3.19Å; V122-K124 VanDerWaalsContact C-N 3.33Å; V122-K124 PolarHBondContact O-N 3.18Å; V122-R125 WeakPolarHBondContact O-CB 3.47Å; V122-R125 WeakPolarHBondContact O-CG 3.21Å; V122-R125 PolarHBondContact O-N 3.14Å; V122-R125 VanDerWaalsContact O-N 3.15Å; V122-Q144 HydrophobicContact CG1-CG 3.41Å; V122-Q144 VanDerWaalsContact CG1-CG 3.41Å; V122-Q144 HydrophobicContact CG2-CG 4.47Å
123	H	90.5	Very high	86.6	Confident	24 Å²	24	71.6 Å²	71.6	11%	0.111	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-40.2	178.6	164.4	73	0	0	0	112.7	C107 C110 F114 S119 L120 R125 L126 H127	C107-H123 WeakPolarHBondContact CB-NE2 3.26Å; C107-H123 PolarHBondContact SG-NE2 2.99Å; C107-H123 VanDerWaalsContact SG-NE2 3.37Å; C110-H123 PolarHBondContact SG-NE2 3.46Å; F114-H123 HydrophobicContact CD1-CB 4.32Å; F114-H123 HydrophobicContact CE1-CB 3.48Å; F114-H123 VanDerWaalsContact CE1-CB 3.48Å; F114-H123 AromaticContact CE1-CG 3.73Å; F114-H123 HydrophobicContact CE2-CB 3.99Å; F114-H123 AromaticContact CE2-CD2 3.27Å; F114-H123 WeakPolarHBondContact CE2-CD2 3.37Å; F114-H123 AromaticContact CE2-CG 3.62Å; F114-H123 AromaticContact CE2-NE2 3.8Å; F114-H123 HydrophobicContact CZ-CB 3.32Å; F114-H123 AromaticContact CZ-CD2 3.21Å; F114-H123 WeakPolarHBondContact CZ-CD2 3.45Å; F114-H123 AromaticContact CZ-CE1 3.87Å; F114-H123 AromaticContact CZ-CG 3.03Å; F114-H123 AromaticContact CZ-ND1 3.5Å; F114-H123 WeakPolarHBondContact CZ-ND1 3.38Å; F114-H123 AromaticContact CZ-NE2 3.7Å; S119-H123 WeakPolarHBondContact O-CB 3.46Å; S119-H123 PolarHBondContact O-N 3.47Å; L120-H123 WeakPolarHBondContact O-CB 3.19Å; L120-H123 PolarHBondContact O-N 3.47Å; L120-H123 VanDerWaalsContact O-N 3.16Å; H123-R125 PolarHBondContact O-N 3.15Å; H123-R125 VanDerWaalsContact O-N 3.13Å; H123-L126 VanDerWaalsContact O-CB 3.27Å; H123-L126 WeakPolarHBondContact O-CB 3.43Å; H123-L126 PolarHBondContact O-N 2.87Å; H123-H127 AromaticContact CE1-NE2 3.46Å; H123-H127 PolarHBondContact CE1-NE2 3.27Å; H123-H127 AromaticContact NE2-CD2 3.74Å; H123-H127 AromaticContact NE2-NE2 3.1Å; H123-H127 PolarHBondContact NE2-NE2 3.14Å; H123-H127 VanDerWaalsContact NE2-NE2 3.1Å
124	K	90.1	Very high	86.6	Confident	86 Å²	86	76.2 Å²	76.2	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-58.8	-25	176.9	-76.7	-176.1	175.8	-174.8	0	113	L120 A121 V122 L126 H127	L120-K124 HydrophobicContact CD1-CG 4.17Å; L120-K124 HydrophobicContact CG-CD 4.43Å; L120-K124 HydrophobicContact CG-CG 4.47Å; L120-K124 WeakPolarHBondContact O-CG 3.43Å; L120-K124 PolarHBondContact O-N 3.49Å; A121-K124 PolarHBondContact O-N 3.42Å; V122-K124 VanDerWaalsContact C-N 3.33Å; V122-K124 PolarHBondContact O-N 3.18Å; K124-L126 PolarHBondContact O-N 3.16Å; K124-H127 PolarHBondContact O-N 3.43Å
125	R	89.4	Confident	86.2	Confident	74 Å²	74	75 Å²	75	28%	0.279	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-33.7	173.4	-60.8	179.5	-169.9	-161.2	-5.2	112.4	V122 H123 H127 R128 N129 H130 A143	V122-R125 WeakPolarHBondContact O-CB 3.47Å; V122-R125 WeakPolarHBondContact O-CG 3.21Å; V122-R125 PolarHBondContact O-N 3.14Å; V122-R125 VanDerWaalsContact O-N 3.15Å; H123-R125 PolarHBondContact O-N 3.15Å; H123-R125 VanDerWaalsContact O-N 3.13Å; R125-H127 VanDerWaalsContact C-N 3.32Å; R125-H127 PolarHBondContact O-N 3.13Å; R125-R128 PolarHBondContact O-N 3.42Å; R125-N129 PolarHBondContact O-N 3.44Å; R125-H130 WeakPolarHBondContact CB-O 3.47Å; R125-H130 PolarHBondContact O-N 2.94Å; R125-A143 HydrophobicContact CB-CB 4.49Å; R125-A143 PolarHBondContact NH1-O 2.85Å
126	L	84.5	Confident	86	Confident	84 Å²	84	80.1 Å²	80.1	44%	0.44	40%	0.396	S	S	.	.	H	α-helix	trans	-67	-33.2	178.4	-57.2	176	0	0	0	112.1	H123 K124 R128 N129 M131 A143	H123-L126 VanDerWaalsContact O-CB 3.27Å; H123-L126 WeakPolarHBondContact O-CB 3.43Å; H123-L126 PolarHBondContact O-N 2.87Å; K124-L126 PolarHBondContact O-N 3.16Å; L126-R128 VanDerWaalsContact C-N 3.32Å; L126-N129 PolarHBondContact O-N 3.24Å; L126-M131 HydrophobicContact CD2-CE 3.55Å; L126-M131 HydrophobicContact CD2-SD 4.17Å; L126-A143 HydrophobicContact CD2-CB 3.93Å
127	H	86.1	Confident	85.2	Confident	72 Å²	72	82.1 Å²	82.1	33%	0.333	40%	0.403	S	S	.	.	H	α-helix	trans	-70.3	-29.9	176.7	-71.2	-59.5	0	0	0	113.1	C107 H123 K124 R125	C107-H127 PolarHBondContact SG-CD2 2.87Å; C107-H127 PolarHBondContact SG-NE2 3.46Å; H123-H127 AromaticContact CE1-NE2 3.46Å; H123-H127 PolarHBondContact CE1-NE2 3.27Å; H123-H127 AromaticContact NE2-CD2 3.74Å; H123-H127 AromaticContact NE2-NE2 3.1Å; H123-H127 PolarHBondContact NE2-NE2 3.14Å; H123-H127 VanDerWaalsContact NE2-NE2 3.1Å; K124-H127 PolarHBondContact O-N 3.43Å; R125-H127 VanDerWaalsContact C-N 3.32Å; R125-H127 PolarHBondContact O-N 3.13Å
128	R	85.8	Confident	84.3	Confident	210 Å²	210	78.8 Å²	78.8	79%	0.792	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	4.4	179.2	-63.1	-177.5	177.8	176.4	-2.7	113	R125 L126 H130	R125-R128 PolarHBondContact O-N 3.42Å; L126-R128 VanDerWaalsContact C-N 3.32Å; R128-H130 HydrophobicContact CB-CB 4.14Å; R128-H130 PolarHBondContact O-N 3.37Å
129	N	78.2	Confident	83.7	Confident	137 Å²	137	79.2 Å²	79.2	73%	0.733	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	27	-167.6	-63	-44.9	0	0	0	113.3	R125 L126 M131	R125-N129 PolarHBondContact O-N 3.44Å; L126-N129 PolarHBondContact O-N 3.24Å; N129-M131 PolarHBondContact O-N 2.91Å; N129-M131 VanDerWaalsContact O-N 3.16Å
130	H	86.3	Confident	83.1	Confident	107 Å²	107	78.4 Å²	78.4	50%	0.495	39%	0.391	S	S	.	.			trans	-85.2	95.2	-175.6	179.6	-93.6	0	0	0	109.6	R125 R128 P132	R125-H130 WeakPolarHBondContact CB-O 3.47Å; R125-H130 PolarHBondContact O-N 2.94Å; R128-H130 HydrophobicContact CB-CB 4.14Å; R128-H130 PolarHBondContact O-N 3.37Å; H130-P132 WeakPolarHBondContact O-CD 3.26Å
131	M	84.6	Confident	82.8	Confident	59 Å²	59	81.9 Å²	81.9	29%	0.291	41%	0.41	S	S	.	.			trans	-113	82	-174.6	-61.9	-61.7	-155.1	0	0	110	L126 N129 Y133 N141 F142 A143	L126-M131 HydrophobicContact CD2-CE 3.55Å; L126-M131 HydrophobicContact CD2-SD 4.17Å; N129-M131 PolarHBondContact O-N 2.91Å; N129-M131 VanDerWaalsContact O-N 3.16Å; M131-Y133 PolarHBondContact O-N 2.78Å; M131-Y133 VanDerWaalsContact O-N 3.11Å; M131-N141 HydrophobicContact CB-CB 3.54Å; M131-N141 HydrophobicContact CG-CB 4.22Å; M131-F142 CarbonylContact C-O 3.59Å; M131-F142 WeakPolarHBondContact CA-O 3.34Å; M131-F142 VanDerWaalsContact SD-C 3.55Å; M131-A143 VanDerWaalsContact SD-CA 3.5Å; M131-A143 HydrophobicContact SD-CB 3.53Å; M131-A143 VanDerWaalsContact SD-CB 3.53Å; M131-A143 PolarHBondContact SD-N 3.34Å
132	P	86.6	Confident	82.6	Confident	51 Å²	51	81.4 Å²	81.4	33%	0.331	40%	0.399	S	S	.	.			trans	-71	-9.6	-168.5	28.6	-35.4	0	0	0	114.1	H130	H130-P132 WeakPolarHBondContact O-CD 3.26Å
133	Y	89.1	Confident	82.5	Confident	78 Å²	78	80.8 Å²	80.8	31%	0.306	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	108	-179.2	-55.2	-76.1	0	0	0	108.8	M131 N141 F142 K145	M131-Y133 PolarHBondContact O-N 2.78Å; M131-Y133 VanDerWaalsContact O-N 3.11Å; Y133-N141 CarbonylContact O-C 3.57Å; Y133-F142 PolarHBondContact N-O 2.9Å; Y133-F142 PolarHBondContact O-N 3.21Å; Y133-K145 HydrophobicContact CD1-CB 3.96Å; Y133-K145 HydrophobicContact CD1-CG 4.3Å; Y133-K145 VanDerWaalsContact CD2-N 3.29Å; Y133-K145 HydrophobicContact CE1-CB 3.68Å; Y133-K145 HydrophobicContact CE1-CD 4.43Å; Y133-K145 HydrophobicContact CE1-CG 4.17Å; Y133-K145 HydrophobicContact CE2-CB 4.26Å; Y133-K145 VanDerWaalsContact CE2-N 3.3Å; Y133-K145 HydrophobicContact CG-CB 4.36Å
134	Y	83.4	Confident	82.4	Confident	137 Å²	137	82.8 Å²	82.8	54%	0.537	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	150.1	-178.9	58.8	-85.8	0	0	0	110.6	Q136 N141 L148	Y134-Q136 HydrophobicContact CD2-CG 4.3Å; Y134-Q136 HydrophobicContact CE2-CG 3.87Å; Y134-N141 WeakPolarHBondContact CB-OD1 3.41Å; Y134-L148 WeakPolarHBondContact O-CD2 3.29Å
135	C	75.9	Confident	82.4	Confident	6 Å²	6	85.8 Å²	85.8	4%	0.041	42%	0.418	C	S	.	.			trans	-76.3	132.3	168.3	-171.7	0	0	0	0	109	L137 C138 A140 L148 H156	C135-L137 VanDerWaalsContact C-N 3.26Å; C135-L137 PolarHBondContact SG-N 3.5Å; C135-C138 CarbonylContact C-O 3.6Å; C135-C138 WeakPolarHBondContact CB-O 3.42Å; C135-A140 HydrophobicContact CB-CB 4.42Å; C135-A140 PolarHBondContact N-O 3.05Å; C135-L148 HydrophobicContact CB-CD1 4.06Å; C135-H156 PolarHBondContact SG-CD2 2.91Å; C135-H156 PolarHBondContact SG-NE2 2.82Å
136	Q	75.9	Confident	82.3	Confident	165 Å²	165	85.2 Å²	85.2	77%	0.771	43%	0.426	S	S	*	.	S	Bend	trans	-79.5	-13.8	173.9	-70.1	179	-27	0	0	112.5	Y134	Y134-Q136 HydrophobicContact CD2-CG 4.3Å; Y134-Q136 HydrophobicContact CE2-CG 3.87Å
137	L	65.9	Low	82.4	Confident	84 Å²	84	85.3 Å²	85.3	44%	0.44	42%	0.424	S	S	.	.	S	Bend	trans	-102.6	-9.3	-176	-56.6	173.3	0	0	0	112.9	C135 L152 H156 V159 L161	C135-L137 VanDerWaalsContact C-N 3.26Å; C135-L137 PolarHBondContact SG-N 3.5Å; L137-L152 HydrophobicContact CD1-CD2 4.41Å; L137-H156 WeakPolarHBondContact CB-CE1 3.17Å; L137-H156 WeakPolarHBondContact CB-ND1 3.22Å; L137-H156 HydrophobicContact CD1-CB 3.75Å; L137-V159 HydrophobicContact CD1-CG2 4.28Å; L137-L161 HydrophobicContact CD1-CD1 4.25Å
138	C	68.8	Low	82.4	Confident	39 Å²	39	83 Å²	83	26%	0.264	41%	0.414	S	S	.	.	S	Bend	trans	-158.9	168.9	173.6	73.5	0	0	0	0	111.4	C135 A140 H151 H156	C135-C138 CarbonylContact C-O 3.6Å; C135-C138 WeakPolarHBondContact CB-O 3.42Å; C138-A140 PolarHBondContact O-N 3.34Å; C138-A140 VanDerWaalsContact SG-CB 3.51Å; C138-H151 VanDerWaalsContact SG-CE1 3.58Å; C138-H151 PolarHBondContact SG-NE2 3.46Å; C138-H156 PolarHBondContact SG-NE2 3.32Å
139	S	77	Confident	82.3	Confident	120 Å²	120	79 Å²	79	84%	0.839	40%	0.402	S	S	*	.	S	Bend	trans	-73.1	14.4	-177.6	-43.5	0	0	0	0	115.4	N141	S139-N141 PolarHBondContact O-ND2 3.27Å; S139-N141 VanDerWaalsContact O-ND2 3.1Å
140	A	75.5	Confident	82.4	Confident	27 Å²	27	77.7 Å²	77.7	22%	0.223	39%	0.394	C	S	.	.			trans	-79.6	133.5	-177.7	0	0	0	0	0	112.1	C135 C138 F142	C135-A140 HydrophobicContact CB-CB 4.42Å; C135-A140 PolarHBondContact N-O 3.05Å; C138-A140 PolarHBondContact O-N 3.34Å; C138-A140 VanDerWaalsContact SG-CB 3.51Å; A140-F142 HydrophobicContact CB-CE2 3.76Å; A140-F142 HydrophobicContact CB-CZ 3.74Å
141	N	85	Confident	82.1	Confident	91 Å²	91	73.7 Å²	73.7	49%	0.487	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	145	179.8	-57.8	-81.3	0	0	0	111.2	M131 Y133 Y134 S139	M131-N141 HydrophobicContact CB-CB 3.54Å; M131-N141 HydrophobicContact CG-CB 4.22Å; Y133-N141 CarbonylContact O-C 3.57Å; Y134-N141 WeakPolarHBondContact CB-OD1 3.41Å; S139-N141 PolarHBondContact O-ND2 3.27Å; S139-N141 VanDerWaalsContact O-ND2 3.1Å
142	F	86.3	Confident	81.6	Confident	38 Å²	38	73.8 Å²	73.8	17%	0.167	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.1	-172.5	-55.6	-85.1	0	0	0	112.9	M131 Y133 A140 Q144 H147 L148 H151	M131-F142 CarbonylContact C-O 3.59Å; M131-F142 WeakPolarHBondContact CA-O 3.34Å; M131-F142 VanDerWaalsContact SD-C 3.55Å; Y133-F142 PolarHBondContact N-O 2.9Å; Y133-F142 PolarHBondContact O-N 3.21Å; A140-F142 HydrophobicContact CB-CE2 3.76Å; A140-F142 HydrophobicContact CB-CZ 3.74Å; F142-Q144 VanDerWaalsContact C-N 3.3Å; F142-Q144 PolarHBondContact O-N 3.42Å; F142-H147 HydrophobicContact CB-CB 4.15Å; F142-H147 HydrophobicContact CD1-CB 3.81Å; F142-H147 HydrophobicContact CG-CB 4.25Å; F142-L148 HydrophobicContact CB-CB 4.27Å; F142-L148 HydrophobicContact CD2-CB 3.77Å; F142-L148 HydrophobicContact CD2-CD1 3.75Å; F142-L148 HydrophobicContact CD2-CG 4.37Å; F142-L148 HydrophobicContact CE2-CD1 3.87Å; F142-L148 HydrophobicContact CG-CB 4.17Å; F142-H151 HydrophobicContact CE1-CB 3.79Å; F142-H151 HydrophobicContact CE2-CB 3.72Å; F142-H151 AromaticContact CE2-CD2 3.75Å; F142-H151 AromaticContact CE2-CG 3.58Å; F142-H151 HydrophobicContact CZ-CB 3.25Å; F142-H151 AromaticContact CZ-CD2 3.81Å; F142-H151 AromaticContact CZ-CG 3.18Å; F142-H151 AromaticContact CZ-ND1 3.44Å; F142-H151 WeakPolarHBondContact CZ-ND1 3.43Å
143	A	88	Confident	80.9	Confident	7 Å²	7	72.8 Å²	72.8	6%	0.058	37%	0.369	C	S	.	.	S	Bend	trans	-73.7	-23.5	177.6	0	0	0	0	0	112.9	R125 L126 M131	R125-A143 HydrophobicContact CB-CB 4.49Å; R125-A143 PolarHBondContact NH1-O 2.85Å; L126-A143 HydrophobicContact CD2-CB 3.93Å; M131-A143 VanDerWaalsContact SD-CA 3.5Å; M131-A143 HydrophobicContact SD-CB 3.53Å; M131-A143 VanDerWaalsContact SD-CB 3.53Å; M131-A143 PolarHBondContact SD-N 3.34Å
144	Q	87.7	Confident	79.9	Confident	66 Å²	66	72.7 Å²	72.7	31%	0.308	38%	0.38	S	S	.	.	S	Bend	trans	-134	140.4	-172.6	-63.7	-175.1	-66.9	0	0	111.4	V122 F142 S146 H147 L148	V122-Q144 HydrophobicContact CG1-CG 3.41Å; V122-Q144 VanDerWaalsContact CG1-CG 3.41Å; V122-Q144 HydrophobicContact CG2-CG 4.47Å; F142-Q144 VanDerWaalsContact C-N 3.3Å; F142-Q144 PolarHBondContact O-N 3.42Å; Q144-S146 VanDerWaalsContact C-N 3.26Å; Q144-S146 PolarHBondContact O-N 3.04Å; Q144-H147 PolarHBondContact O-N 3.23Å; Q144-H147 PolarHBondContact OE1-CE1 3.16Å; Q144-H147 PolarHBondContact OE1-NE2 3.43Å; Q144-L148 PolarHBondContact O-N 3.02Å
145	K	89.6	Confident	79.2	Confident	149 Å²	149	70 Å²	70	65%	0.648	37%	0.372	S	S	*	.	H	α-helix	trans	-58	-37.3	177	-170.3	175.3	-179.4	175.8	0	112.7	Y133 H147 L148 K149	Y133-K145 HydrophobicContact CD1-CB 3.96Å; Y133-K145 HydrophobicContact CD1-CG 4.3Å; Y133-K145 VanDerWaalsContact CD2-N 3.29Å; Y133-K145 HydrophobicContact CE1-CB 3.68Å; Y133-K145 HydrophobicContact CE1-CD 4.43Å; Y133-K145 HydrophobicContact CE1-CG 4.17Å; Y133-K145 HydrophobicContact CE2-CB 4.26Å; Y133-K145 VanDerWaalsContact CE2-N 3.3Å; Y133-K145 HydrophobicContact CG-CB 4.36Å; K145-H147 VanDerWaalsContact C-N 3.28Å; K145-H147 PolarHBondContact O-N 3.14Å; K145-L148 PolarHBondContact O-N 3.24Å; K145-K149 PolarHBondContact O-N 2.82Å
146	S	88.3	Confident	78.9	Confident	63 Å²	63	70.7 Å²	70.7	44%	0.441	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-34.3	176.9	51.1	0	0	0	0	112.7	Q144 L150	Q144-S146 VanDerWaalsContact C-N 3.26Å; Q144-S146 PolarHBondContact O-N 3.04Å; S146-L150 WeakPolarHBondContact O-CG 3.49Å; S146-L150 PolarHBondContact O-N 3.1Å
147	H	86.9	Confident	78.1	Confident	85 Å²	85	63.7 Å²	63.7	39%	0.394	35%	0.345	S	S	.	.	H	α-helix	trans	-75.7	-38.4	177.3	-62.8	169.8	0	0	0	111.7	F142 Q144 K145 K149 L150 H151	F142-H147 HydrophobicContact CB-CB 4.15Å; F142-H147 HydrophobicContact CD1-CB 3.81Å; F142-H147 HydrophobicContact CG-CB 4.25Å; Q144-H147 PolarHBondContact O-N 3.23Å; Q144-H147 PolarHBondContact OE1-CE1 3.16Å; Q144-H147 PolarHBondContact OE1-NE2 3.43Å; K145-H147 VanDerWaalsContact C-N 3.28Å; K145-H147 PolarHBondContact O-N 3.14Å; H147-K149 VanDerWaalsContact C-N 3.3Å; H147-K149 PolarHBondContact O-N 3.39Å; H147-L150 PolarHBondContact O-N 3.37Å; H147-H151 WeakPolarHBondContact O-CB 3.42Å; H147-H151 PolarHBondContact O-N 3.5Å
148	L	85.9	Confident	77.4	Confident	25 Å²	25	66.1 Å²	66.1	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-59.7	-43.8	169.8	172.5	61.4	0	0	0	110.8	Y134 C135 F142 Q144 K145 H151 L152	Y134-L148 WeakPolarHBondContact O-CD2 3.29Å; C135-L148 HydrophobicContact CB-CD1 4.06Å; F142-L148 HydrophobicContact CB-CB 4.27Å; F142-L148 HydrophobicContact CD2-CB 3.77Å; F142-L148 HydrophobicContact CD2-CD1 3.75Å; F142-L148 HydrophobicContact CD2-CG 4.37Å; F142-L148 HydrophobicContact CE2-CD1 3.87Å; F142-L148 HydrophobicContact CG-CB 4.17Å; Q144-L148 PolarHBondContact O-N 3.02Å; K145-L148 PolarHBondContact O-N 3.24Å; L148-H151 WeakPolarHBondContact O-CB 3.42Å; L148-H151 PolarHBondContact O-N 3.4Å; L148-L152 HydrophobicContact CD1-CD1 4.17Å; L148-L152 HydrophobicContact CD1-CG 4.07Å; L148-L152 HydrophobicContact CG-CD1 4.09Å; L148-L152 HydrophobicContact CG-CG 4.43Å; L148-L152 WeakPolarHBondContact O-CG 3.34Å; L148-L152 PolarHBondContact O-N 3.34Å
149	K	83.7	Confident	76.5	Confident	125 Å²	125	66.7 Å²	66.7	54%	0.543	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-52.9	175.5	178.3	164.1	-177	167	0	111.4	K145 H147 H151 L152 D153	K145-K149 PolarHBondContact O-N 2.82Å; H147-K149 VanDerWaalsContact C-N 3.3Å; H147-K149 PolarHBondContact O-N 3.39Å; K149-H151 PolarHBondContact O-N 2.96Å; K149-L152 PolarHBondContact O-N 2.86Å; K149-L152 VanDerWaalsContact O-N 3.12Å; K149-D153 VanDerWaalsContact CG-OD2 3.25Å; K149-D153 WeakPolarHBondContact CG-OD2 3.47Å; K149-D153 VanDerWaalsContact O-CB 3.24Å; K149-D153 WeakPolarHBondContact O-CB 3.35Å; K149-D153 PolarHBondContact O-N 3.24Å
150	L	80.7	Confident	75.1	Confident	109 Å²	109	69.1 Å²	69.1	57%	0.571	35%	0.35	S	S	*	.	H	α-helix	trans	-57	-36	176.1	-74.2	170.7	0	0	0	112.9	S146 H147 S154	S146-L150 WeakPolarHBondContact O-CG 3.49Å; S146-L150 PolarHBondContact O-N 3.1Å; H147-L150 PolarHBondContact O-N 3.37Å; L150-S154 VanDerWaalsContact O-CB 3.29Å; L150-S154 WeakPolarHBondContact O-CB 3.27Å; L150-S154 PolarHBondContact O-N 3.22Å; L150-S154 PolarHBondContact O-OG 3.45Å
151	H	79.6	Confident	73.8	Confident	23 Å²	23	72.6 Å²	72.6	11%	0.106	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-50.9	173.7	170.1	82.2	0	0	0	111.9	C138 F142 H147 L148 K149 D153 S154 H155 H156	C138-H151 VanDerWaalsContact SG-CE1 3.58Å; C138-H151 PolarHBondContact SG-NE2 3.46Å; F142-H151 HydrophobicContact CE1-CB 3.79Å; F142-H151 HydrophobicContact CE2-CB 3.72Å; F142-H151 AromaticContact CE2-CD2 3.75Å; F142-H151 AromaticContact CE2-CG 3.58Å; F142-H151 HydrophobicContact CZ-CB 3.25Å; F142-H151 AromaticContact CZ-CD2 3.81Å; F142-H151 AromaticContact CZ-CG 3.18Å; F142-H151 AromaticContact CZ-ND1 3.44Å; F142-H151 WeakPolarHBondContact CZ-ND1 3.43Å; H147-H151 WeakPolarHBondContact O-CB 3.42Å; H147-H151 PolarHBondContact O-N 3.5Å; L148-H151 WeakPolarHBondContact O-CB 3.42Å; L148-H151 PolarHBondContact O-N 3.4Å; K149-H151 PolarHBondContact O-N 2.96Å; H151-D153 PolarHBondContact O-N 2.99Å; H151-S154 PolarHBondContact O-N 3.45Å; H151-S154 PolarHBondContact O-OG 3.2Å; H151-H155 VanDerWaalsContact CE1-CB 3.45Å; H151-H155 WeakPolarHBondContact CE1-CB 3.39Å; H151-H155 AromaticContact CE1-CG 3.38Å; H151-H155 AromaticContact CE1-ND1 3.52Å; H151-H155 AromaticContact ND1-CG 3.94Å; H151-H155 AromaticContact NE2-ND1 3.89Å; H151-H155 WeakPolarHBondContact O-CA 3.11Å; H151-H155 WeakPolarHBondContact O-CB 3.42Å; H151-H155 PolarHBondContact O-N 3.42Å; H151-H156 AromaticContact CD2-CD2 3.67Å; H151-H156 AromaticContact CD2-NE2 3.88Å; H151-H156 AromaticContact CE1-NE2 3.77Å; H151-H156 AromaticContact NE2-CD2 3.22Å; H151-H156 PolarHBondContact NE2-CD2 3.25Å; H151-H156 AromaticContact NE2-NE2 2.98Å; H151-H156 PolarHBondContact NE2-NE2 3.21Å
152	L	74.8	Confident	72.1	Confident	61 Å²	61	75.8 Å²	75.8	32%	0.319	38%	0.381	S	S	.	.	H	α-helix	trans	-57	-43.4	175.2	-67.5	169.2	0	0	0	110.7	L137 L148 K149 S154 H156 A157	L137-L152 HydrophobicContact CD1-CD2 4.41Å; L148-L152 HydrophobicContact CD1-CD1 4.17Å; L148-L152 HydrophobicContact CD1-CG 4.07Å; L148-L152 HydrophobicContact CG-CD1 4.09Å; L148-L152 HydrophobicContact CG-CG 4.43Å; L148-L152 WeakPolarHBondContact O-CG 3.34Å; L148-L152 PolarHBondContact O-N 3.34Å; K149-L152 PolarHBondContact O-N 2.86Å; K149-L152 VanDerWaalsContact O-N 3.12Å; L152-S154 VanDerWaalsContact C-N 3.26Å; L152-S154 PolarHBondContact O-N 3.35Å; L152-H156 HydrophobicContact CD2-CB 4.46Å; L152-H156 CarbonylContact O-C 3.35Å; L152-H156 WeakPolarHBondContact O-CA 3.32Å; L152-H156 PolarHBondContact O-N 3.18Å; L152-H156 VanDerWaalsContact O-N 3.12Å; L152-A157 PolarHBondContact O-N 3.43Å; L152-A157 VanDerWaalsContact O-N 3.17Å
153	D	70.1	Confident	70.7	Confident	31 Å²	31	82.7 Å²	82.7	17%	0.166	41%	0.414	C	S	.	.	H	α-helix	trans	-69.3	-17.8	-177.7	-65	-6.1	0	0	0	114.1	K149 H151 A157 F179	K149-D153 VanDerWaalsContact CG-OD2 3.25Å; K149-D153 WeakPolarHBondContact CG-OD2 3.47Å; K149-D153 VanDerWaalsContact O-CB 3.24Å; K149-D153 WeakPolarHBondContact O-CB 3.35Å; K149-D153 PolarHBondContact O-N 3.24Å; H151-D153 PolarHBondContact O-N 2.99Å; D153-A157 WeakPolarHBondContact O-CB 3.3Å; D153-F179 HydrophobicContact CB-CD2 3.62Å; D153-F179 HydrophobicContact CB-CE2 3.22Å; D153-F179 HydrophobicContact CB-CZ 3.81Å; D153-F179 WeakPolarHBondContact OD1-CE2 3.47Å; D153-F179 WeakPolarHBondContact OD1-CZ 3.42Å; D153-F179 WeakPolarHBondContact OD2-CZ 3.31Å
154	S	69.1	Low	69.3	Low	76 Å²	76	86.2 Å²	86.2	53%	0.531	44%	0.435	S	S	.	.	H	α-helix	trans	-118.5	-41.8	-177.3	59.3	0	0	0	0	113.8	L150 H151 L152 Y158	L150-S154 VanDerWaalsContact O-CB 3.29Å; L150-S154 WeakPolarHBondContact O-CB 3.27Å; L150-S154 PolarHBondContact O-N 3.22Å; L150-S154 PolarHBondContact O-OG 3.45Å; H151-S154 PolarHBondContact O-N 3.45Å; H151-S154 PolarHBondContact O-OG 3.2Å; L152-S154 VanDerWaalsContact C-N 3.26Å; L152-S154 PolarHBondContact O-N 3.35Å; S154-Y158 WeakPolarHBondContact O-CE1 3.5Å
155	H	68.3	Low	68	Low	81 Å²	81	88.6 Å²	88.6	38%	0.375	46%	0.456	S	S	.	.	H	α-helix	trans	-93.2	-27.4	-176.5	-172.3	-83.9	0	0	0	112.9	H151 Y158	H151-H155 VanDerWaalsContact CE1-CB 3.45Å; H151-H155 WeakPolarHBondContact CE1-CB 3.39Å; H151-H155 AromaticContact CE1-CG 3.38Å; H151-H155 AromaticContact CE1-ND1 3.52Å; H151-H155 AromaticContact ND1-CG 3.94Å; H151-H155 AromaticContact NE2-ND1 3.89Å; H151-H155 WeakPolarHBondContact O-CA 3.11Å; H151-H155 WeakPolarHBondContact O-CB 3.42Å; H151-H155 PolarHBondContact O-N 3.42Å; H155-Y158 WeakPolarHBondContact O-CE1 3.48Å; H155-Y158 WeakPolarHBondContact O-CE2 3.02Å; H155-Y158 PolarHBondContact O-OH 3.28Å
156	H	69	Low	66.9	Low	20 Å²	20	85.4 Å²	85.4	9%	0.093	44%	0.442	C	S	.	.	S	Bend	trans	-110.5	6.4	176.2	-63.5	-72.4	0	0	0	113.2	C135 L137 C138 H151 L152 Y158 V159	C135-H156 PolarHBondContact SG-CD2 2.91Å; C135-H156 PolarHBondContact SG-NE2 2.82Å; L137-H156 WeakPolarHBondContact CB-CE1 3.17Å; L137-H156 WeakPolarHBondContact CB-ND1 3.22Å; L137-H156 HydrophobicContact CD1-CB 3.75Å; C138-H156 PolarHBondContact SG-NE2 3.32Å; H151-H156 AromaticContact CD2-CD2 3.67Å; H151-H156 AromaticContact CD2-NE2 3.88Å; H151-H156 AromaticContact CE1-NE2 3.77Å; H151-H156 AromaticContact NE2-CD2 3.22Å; H151-H156 PolarHBondContact NE2-CD2 3.25Å; H151-H156 AromaticContact NE2-NE2 2.98Å; H151-H156 PolarHBondContact NE2-NE2 3.21Å; L152-H156 HydrophobicContact CD2-CB 4.46Å; L152-H156 CarbonylContact O-C 3.35Å; L152-H156 WeakPolarHBondContact O-CA 3.32Å; L152-H156 PolarHBondContact O-N 3.18Å; L152-H156 VanDerWaalsContact O-N 3.12Å; H156-Y158 PolarHBondContact O-N 3.17Å; H156-V159 HydrophobicContact CB-CG2 3.81Å; H156-V159 WeakPolarHBondContact ND1-CG2 3.34Å; H156-V159 PolarHBondContact O-N 2.95Å
157	A	59.7	Low	66.2	Low	17 Å²	17	86.6 Å²	86.6	14%	0.14	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-11.9	174.2	0	0	0	0	0	114.2	L152 D153	L152-A157 PolarHBondContact O-N 3.43Å; L152-A157 VanDerWaalsContact O-N 3.17Å; D153-A157 WeakPolarHBondContact O-CB 3.3Å
158	Y	51.9	Low	65.6	Low	135 Å²	135	85.8 Å²	85.8	53%	0.529	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	11.1	179.7	48.4	-99.3	0	0	0	113.9	S154 H155 H156 E160	S154-Y158 WeakPolarHBondContact O-CE1 3.5Å; H155-Y158 WeakPolarHBondContact O-CE1 3.48Å; H155-Y158 WeakPolarHBondContact O-CE2 3.02Å; H155-Y158 PolarHBondContact O-OH 3.28Å; H156-Y158 PolarHBondContact O-N 3.17Å; Y158-E160 PolarHBondContact O-N 3.27Å
159	V	49.7	Very low	65.2	Low	51 Å²	51	87.9 Å²	87.9	31%	0.309	46%	0.457	S	S	.	.	S	Bend	trans	-69.4	125.2	165.9	-169.6	0	0	0	0	106.8	L137 H156 L161	L137-V159 HydrophobicContact CD1-CG2 4.28Å; H156-V159 HydrophobicContact CB-CG2 3.81Å; H156-V159 WeakPolarHBondContact ND1-CG2 3.34Å; H156-V159 PolarHBondContact O-N 2.95Å; V159-L161 HydrophobicContact CB-CD1 4.36Å; V159-L161 HydrophobicContact CB-CG 4.21Å; V159-L161 HydrophobicContact CG1-CD1 4.33Å; V159-L161 HydrophobicContact CG1-CD2 4.47Å; V159-L161 HydrophobicContact CG1-CG 3.82Å; V159-L161 PolarHBondContact O-N 2.99Å
160	E	47.6	Very low	64.8	Low	172 Å²	172	82 Å²	82	80%	0.804	43%	0.432	S	S	*	.			trans	-65.3	67.4	166.9	-66.3	178.9	163.7	0	0	108.8	Y158 D162	Y158-E160 PolarHBondContact O-N 3.27Å; E160-D162 PolarHBondContact O-N 3.31Å
161	L	48.2	Very low	64.8	Low	99 Å²	99	86.4 Å²	86.4	52%	0.518	45%	0.446	S	S	.	.			trans	-83.9	96.5	162.9	-73.2	166.4	0	0	0	105.3	L137 V159 E163 T164	L137-L161 HydrophobicContact CD1-CD1 4.25Å; V159-L161 HydrophobicContact CB-CD1 4.36Å; V159-L161 HydrophobicContact CB-CG 4.21Å; V159-L161 HydrophobicContact CG1-CD1 4.33Å; V159-L161 HydrophobicContact CG1-CD2 4.47Å; V159-L161 HydrophobicContact CG1-CG 3.82Å; V159-L161 PolarHBondContact O-N 2.99Å; L161-E163 PolarHBondContact O-N 3.2Å; L161-T164 PolarHBondContact O-N 3.32Å
162	D	49.3	Very low	64.6	Low	159 Å²	159	90 Å²	90	85%	0.85	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-1.2	-165.6	-96.7	-27.8	0	0	0	118	E160	E160-D162 PolarHBondContact O-N 3.31Å
163	E	56.5	Low	64.8	Low	182 Å²	182	89.9 Å²	89.9	85%	0.85	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.8	5.1	-172.3	-59.7	-158.3	163.2	0	0	115.9	L161 P165	L161-E163 PolarHBondContact O-N 3.2Å; E163-P165 VanDerWaalsContact O-CD 3.28Å; E163-P165 WeakPolarHBondContact O-CD 3.19Å
164	T	58.1	Low	65.1	Low	81 Å²	81	94.6 Å²	94.6	50%	0.497	50%	0.499	S	S	.	.			trans	-90.3	113.4	175.6	45.9	0	0	0	0	112.1	L161 K166	L161-T164 PolarHBondContact O-N 3.32Å; T164-K166 PolarHBondContact O-N 2.86Å; T164-K166 VanDerWaalsContact O-N 3.16Å
165	P	60.8	Low	65.4	Low	116 Å²	116	95.4 Å²	95.4	75%	0.753	49%	0.49	S	S	*	.			trans	-64.2	121.3	176.7	23.2	-30.1	0	0	0	109.3	E163 P167	E163-P165 VanDerWaalsContact O-CD 3.28Å; E163-P165 WeakPolarHBondContact O-CD 3.19Å; P165-P167 WeakPolarHBondContact O-CD 3.45Å
166	K	66.1	Low	65.5	Low	83 Å²	83	92.2 Å²	92.2	36%	0.361	48%	0.479	S	S	.	.			trans	-82.6	103.7	176.4	-66.4	170.8	-176.9	173.3	0	108.5	T164 F168 L178	T164-K166 PolarHBondContact O-N 2.86Å; T164-K166 VanDerWaalsContact O-N 3.16Å; K166-F168 VanDerWaalsContact C-N 3.28Å; K166-F168 PolarHBondContact O-N 3.11Å; K166-L178 HydrophobicContact CG-CD2 4.14Å
167	P	74.1	Confident	65.3	Low	88 Å²	88	92.4 Å²	92.4	57%	0.571	48%	0.48	S	S	*	.	S	Bend	trans	-72.3	-20.1	-171.3	28.2	-33.7	0	0	0	113.5	P165	P165-P167 WeakPolarHBondContact O-CD 3.45Å
168	F	74.1	Confident	65.3	Low	68 Å²	68	93.9 Å²	93.9	30%	0.298	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	94.6	-176.4	-56.6	-72.1	0	0	0	110.4	K166 G176 F177 L178 F179 I180 L183	K166-F168 VanDerWaalsContact C-N 3.28Å; K166-F168 PolarHBondContact O-N 3.11Å; F168-G176 CarbonylContact O-C 3.58Å; F168-F177 HydrophobicContact CB-CB 4.17Å; F168-F177 WeakPolarHBondContact CB-O 2.84Å; F168-F177 PolarHBondContact N-O 3.05Å; F168-F177 VanDerWaalsContact N-O 3.15Å; F168-F177 WeakPolarHBondContact O-CA 3.4Å; F168-F177 WeakPolarHBondContact O-CB 3.3Å; F168-F177 WeakPolarHBondContact O-CD2 3.5Å; F168-F177 PolarHBondContact O-N 2.98Å; F168-L178 WeakPolarHBondContact CD2-O 3.49Å; F168-L178 WeakPolarHBondContact CE2-O 3.11Å; F168-F179 VanDerWaalsContact CD2-C 3.44Å; F168-I180 HydrophobicContact CD1-CB 4.15Å; F168-I180 HydrophobicContact CD1-CG1 4.41Å; F168-I180 HydrophobicContact CE1-CB 3.93Å; F168-I180 HydrophobicContact CE1-CD1 4.42Å; F168-I180 HydrophobicContact CE1-CG1 4.36Å; F168-I180 HydrophobicContact CE2-CB 4.33Å; F168-I180 HydrophobicContact CG-CB 4.45Å; F168-I180 HydrophobicContact CZ-CB 4.03Å; F168-L183 HydrophobicContact CB-CB 4.13Å; F168-L183 HydrophobicContact CB-CD2 3.88Å
169	V	76.9	Confident	65.8	Low	69 Å²	69	90.6 Å²	90.6	42%	0.418	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.6	-180	-176	0	0	0	0	110.5	K171 D174	V169-K171 PolarHBondContact O-N 3.31Å; V169-D174 WeakPolarHBondContact CG1-O 3.38Å
170	C	76.9	Confident	66.8	Low	1 Å²	1	92.4 Å²	92.4	1%	0.007	48%	0.481	C	S	.	.			trans	-72.7	115.3	170.8	-178.1	0	0	0	0	109.7	T172 C173 D174 R175 F177 L183 H186 H190	C170-T172 PolarHBondContact O-N 3.48Å; C170-T172 PolarHBondContact SG-N 3.25Å; C170-C173 PolarHBondContact O-N 3.24Å; C170-D174 WeakPolarHBondContact O-CA 3.45Å; C170-D174 PolarHBondContact O-N 3.23Å; C170-R175 HydrophobicContact CB-CB 4.42Å; C170-R175 PolarHBondContact N-O 3.33Å; C170-F177 HydrophobicContact CB-CE2 4.03Å; C170-L183 HydrophobicContact CB-CD1 3.81Å; C170-H186 WeakPolarHBondContact CB-NE2 3.21Å; C170-H186 PolarHBondContact SG-NE2 3.42Å; C170-H190 PolarHBondContact SG-CD2 2.9Å; C170-H190 PolarHBondContact SG-NE2 3.44Å; C170-H190 VanDerWaalsContact SG-NE2 3.43Å
171	K	79.5	Confident	67.6	Low	202 Å²	202	90 Å²	90	88%	0.878	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.5	178.8	-60.9	-174.2	176.6	-173.4	0	114.4	V169	V169-K171 PolarHBondContact O-N 3.31Å
172	T	76.3	Confident	68.3	Low	98 Å²	98	86.6 Å²	86.6	60%	0.601	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-25.5	-177.4	-48.9	0	0	0	0	113	C170 H190	C170-T172 PolarHBondContact O-N 3.48Å; C170-T172 PolarHBondContact SG-N 3.25Å; T172-H190 HydrophobicContact CG2-CB 4.18Å; T172-H190 WeakPolarHBondContact CG2-ND1 3.27Å
173	C	78.6	Confident	69.3	Low	58 Å²	58	80.2 Å²	80.2	39%	0.392	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.7	12.8	178.6	68.2	0	0	0	0	113.7	C170 R175 H186 H190	C170-C173 PolarHBondContact O-N 3.24Å; C173-R175 PolarHBondContact O-N 2.84Å; C173-R175 WeakPolarHBondContact SG-CB 3.49Å; C173-H186 PolarHBondContact SG-CE1 3.48Å; C173-H186 PolarHBondContact SG-NE2 2.86Å; C173-H190 PolarHBondContact SG-CE1 3.36Å; C173-H190 PolarHBondContact SG-NE2 2.81Å
174	D	76.5	Confident	69.7	Low	131 Å²	131	76.8 Å²	76.8	70%	0.701	41%	0.407	S	S	*	.			trans	54.4	16.6	-178.1	-56.6	-46.9	0	0	0	115.3	V169 C170 G176	V169-D174 WeakPolarHBondContact CG1-O 3.38Å; C170-D174 WeakPolarHBondContact O-CA 3.45Å; C170-D174 PolarHBondContact O-N 3.23Å; D174-G176 PolarHBondContact O-N 2.86Å
175	R	74.5	Confident	69.9	Low	93 Å²	93	78.8 Å²	78.8	35%	0.351	41%	0.41	S	S	.	.			trans	-72.4	117	178.1	-166.4	167.6	-166.4	144	12.3	110.3	C170 C173 F177 F337	C170-R175 HydrophobicContact CB-CB 4.42Å; C170-R175 PolarHBondContact N-O 3.33Å; C173-R175 PolarHBondContact O-N 2.84Å; C173-R175 WeakPolarHBondContact SG-CB 3.49Å; R175-F177 HydrophobicContact CB-CE2 3.97Å; R175-F177 HydrophobicContact CB-CZ 4.12Å; R175-F177 HydrophobicContact CG-CE2 3.97Å; R175-F177 HydrophobicContact CG-CZ 3.73Å; R175-F177 VanDerWaalsContact O-CD2 3.25Å; R175-F177 WeakPolarHBondContact O-CD2 3.5Å; R175-F177 WeakPolarHBondContact O-CE2 3.44Å; R175-F337 VanDerWaalsContact CZ-CE1 3.42Å
176	G	71	Confident	70.3	Confident	14 Å²	14	74.4 Å²	74.4	14%	0.144	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	143.7	173.6	0	0	0	0	0	112.8	F168 D174	F168-G176 CarbonylContact O-C 3.58Å; D174-G176 PolarHBondContact O-N 2.86Å
177	F	65.1	Low	70.3	Confident	23 Å²	23	73.4 Å²	73.4	10%	0.101	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.4	174.1	-60.3	-88.3	0	0	0	109.4	F168 C170 R175 F179 L183 H186	F168-F177 HydrophobicContact CB-CB 4.17Å; F168-F177 WeakPolarHBondContact CB-O 2.84Å; F168-F177 PolarHBondContact N-O 3.05Å; F168-F177 VanDerWaalsContact N-O 3.15Å; F168-F177 WeakPolarHBondContact O-CA 3.4Å; F168-F177 WeakPolarHBondContact O-CB 3.3Å; F168-F177 WeakPolarHBondContact O-CD2 3.5Å; F168-F177 PolarHBondContact O-N 2.98Å; C170-F177 HydrophobicContact CB-CE2 4.03Å; R175-F177 HydrophobicContact CB-CE2 3.97Å; R175-F177 HydrophobicContact CB-CZ 4.12Å; R175-F177 HydrophobicContact CG-CE2 3.97Å; R175-F177 HydrophobicContact CG-CZ 3.73Å; R175-F177 VanDerWaalsContact O-CD2 3.25Å; R175-F177 WeakPolarHBondContact O-CD2 3.5Å; R175-F177 WeakPolarHBondContact O-CE2 3.44Å; F177-F179 VanDerWaalsContact C-N 3.32Å; F177-L183 HydrophobicContact CB-CB 4.17Å; F177-L183 HydrophobicContact CD2-CB 3.86Å; F177-L183 HydrophobicContact CD2-CD1 3.67Å; F177-L183 HydrophobicContact CD2-CG 4.36Å; F177-L183 HydrophobicContact CE2-CD1 3.88Å; F177-L183 HydrophobicContact CG-CB 4.05Å; F177-H186 HydrophobicContact CE1-CB 3.61Å; F177-H186 AromaticContact CE1-CG 3.87Å; F177-H186 HydrophobicContact CE2-CB 3.95Å; F177-H186 AromaticContact CE2-CD2 3.18Å; F177-H186 WeakPolarHBondContact CE2-CD2 3.22Å; F177-H186 AromaticContact CE2-CG 3.57Å; F177-H186 AromaticContact CE2-NE2 3.62Å; F177-H186 HydrophobicContact CZ-CB 3.3Å; F177-H186 AromaticContact CZ-CD2 3.2Å; F177-H186 WeakPolarHBondContact CZ-CD2 3.41Å; F177-H186 AromaticContact CZ-CE1 3.8Å; F177-H186 AromaticContact CZ-CG 3.04Å; F177-H186 AromaticContact CZ-ND1 3.47Å; F177-H186 WeakPolarHBondContact CZ-ND1 3.2Å; F177-H186 AromaticContact CZ-NE2 3.64Å
178	L	59.3	Low	69.8	Low	49 Å²	49	72.9 Å²	72.9	26%	0.257	37%	0.37	S	S	.	.	S	Bend	trans	-74.3	-25.8	174.3	-65.2	176.5	0	0	0	112.3	K166 F168	K166-L178 HydrophobicContact CG-CD2 4.14Å; F168-L178 WeakPolarHBondContact CD2-O 3.49Å; F168-L178 WeakPolarHBondContact CE2-O 3.11Å
179	F	62.9	Low	69.3	Low	66 Å²	66	75 Å²	75	29%	0.289	38%	0.381	S	S	.	.	S	Bend	trans	-132.1	144.3	-175.9	-59	-79.5	0	0	0	112.3	D153 F168 F177 I181 S182 L183	D153-F179 HydrophobicContact CB-CD2 3.62Å; D153-F179 HydrophobicContact CB-CE2 3.22Å; D153-F179 HydrophobicContact CB-CZ 3.81Å; D153-F179 WeakPolarHBondContact OD1-CE2 3.47Å; D153-F179 WeakPolarHBondContact OD1-CZ 3.42Å; D153-F179 WeakPolarHBondContact OD2-CZ 3.31Å; F168-F179 VanDerWaalsContact CD2-C 3.44Å; F177-F179 VanDerWaalsContact C-N 3.32Å; F179-I181 VanDerWaalsContact C-N 3.29Å; F179-I181 PolarHBondContact O-N 2.89Å; F179-S182 WeakPolarHBondContact O-CB 3.5Å; F179-S182 PolarHBondContact O-N 2.75Å; F179-L183 PolarHBondContact O-N 3.24Å; F179-L183 VanDerWaalsContact O-N 3.15Å
180	I	70.6	Confident	68.6	Low	88 Å²	88	74.7 Å²	74.7	45%	0.451	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-32.5	178.8	-166.2	169.4	0	0	0	113.1	F168 S182 L183 Q184	F168-I180 HydrophobicContact CD1-CB 4.15Å; F168-I180 HydrophobicContact CD1-CG1 4.41Å; F168-I180 HydrophobicContact CE1-CB 3.93Å; F168-I180 HydrophobicContact CE1-CD1 4.42Å; F168-I180 HydrophobicContact CE1-CG1 4.36Å; F168-I180 HydrophobicContact CE2-CB 4.33Å; F168-I180 HydrophobicContact CG-CB 4.45Å; F168-I180 HydrophobicContact CZ-CB 4.03Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 3.16Å; I180-L183 PolarHBondContact O-N 3.29Å; I180-Q184 HydrophobicContact CG1-CG 4.42Å; I180-Q184 WeakPolarHBondContact O-CB 3.39Å; I180-Q184 VanDerWaalsContact O-CG 3.26Å; I180-Q184 WeakPolarHBondContact O-CG 3.45Å; I180-Q184 PolarHBondContact O-N 3.06Å
181	I	63.9	Low	67.5	Low	121 Å²	121	77.5 Å²	77.5	62%	0.621	39%	0.393	S	S	*	.	H	α-helix	trans	-64.6	-39.8	178.3	-62.1	171.8	0	0	0	110	F179 Q184 Q185	F179-I181 VanDerWaalsContact C-N 3.29Å; F179-I181 PolarHBondContact O-N 2.89Å; I181-Q184 WeakPolarHBondContact O-CB 3.22Å; I181-Q184 PolarHBondContact O-N 3.37Å; I181-Q185 WeakPolarHBondContact O-CB 3.11Å; I181-Q185 PolarHBondContact O-N 3.17Å
182	S	64.2	Low	66.2	Low	28 Å²	28	77.6 Å²	77.6	20%	0.196	39%	0.394	C	S	.	.	H	α-helix	trans	-68	-42.7	176.8	-47.4	0	0	0	0	111.3	F179 I180 Q184 Q185 H186	F179-S182 WeakPolarHBondContact O-CB 3.5Å; F179-S182 PolarHBondContact O-N 2.75Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 3.16Å; S182-Q184 VanDerWaalsContact C-N 3.35Å; S182-Q184 PolarHBondContact O-N 3.5Å; S182-Q185 PolarHBondContact O-N 2.76Å; S182-H186 VanDerWaalsContact O-CB 3.22Å; S182-H186 WeakPolarHBondContact O-CB 3.32Å; S182-H186 PolarHBondContact O-N 3.29Å
183	L	69.9	Low	64.3	Low	25 Å²	25	80.7 Å²	80.7	13%	0.131	41%	0.406	C	S	.	.	H	α-helix	trans	-59.7	-45	171.2	174.8	63	0	0	0	110.9	F168 C170 F177 F179 I180 Q185 H186 L187	F168-L183 HydrophobicContact CB-CB 4.13Å; F168-L183 HydrophobicContact CB-CD2 3.88Å; C170-L183 HydrophobicContact CB-CD1 3.81Å; F177-L183 HydrophobicContact CB-CB 4.17Å; F177-L183 HydrophobicContact CD2-CB 3.86Å; F177-L183 HydrophobicContact CD2-CD1 3.67Å; F177-L183 HydrophobicContact CD2-CG 4.36Å; F177-L183 HydrophobicContact CE2-CD1 3.88Å; F177-L183 HydrophobicContact CG-CB 4.05Å; F179-L183 PolarHBondContact O-N 3.24Å; F179-L183 VanDerWaalsContact O-N 3.15Å; I180-L183 PolarHBondContact O-N 3.29Å; L183-Q185 PolarHBondContact O-N 3.44Å; L183-H186 CarbonylContact O-C 3.54Å; L183-H186 PolarHBondContact O-N 3.14Å; L183-L187 HydrophobicContact CD1-CD1 4.1Å; L183-L187 HydrophobicContact CD1-CD2 4.22Å; L183-L187 HydrophobicContact CD1-CG 3.86Å; L183-L187 HydrophobicContact CD2-CD1 4.49Å; L183-L187 HydrophobicContact CG-CD1 3.91Å; L183-L187 HydrophobicContact CG-CG 4.15Å; L183-L187 WeakPolarHBondContact O-CB 3.47Å; L183-L187 WeakPolarHBondContact O-CG 3.25Å; L183-L187 PolarHBondContact O-N 2.78Å
184	Q	65.5	Low	62.7	Low	111 Å²	111	80.8 Å²	80.8	52%	0.519	41%	0.407	S	S	.	.	H	α-helix	trans	-59.9	-45.9	178.1	-76.9	173.9	-8.2	0	0	111.9	I180 I181 S182 H186 L187 L188	I180-Q184 HydrophobicContact CG1-CG 4.42Å; I180-Q184 WeakPolarHBondContact O-CB 3.39Å; I180-Q184 VanDerWaalsContact O-CG 3.26Å; I180-Q184 WeakPolarHBondContact O-CG 3.45Å; I180-Q184 PolarHBondContact O-N 3.06Å; I181-Q184 WeakPolarHBondContact O-CB 3.22Å; I181-Q184 PolarHBondContact O-N 3.37Å; S182-Q184 VanDerWaalsContact C-N 3.35Å; S182-Q184 PolarHBondContact O-N 3.5Å; Q184-H186 VanDerWaalsContact C-N 3.32Å; Q184-L187 PolarHBondContact O-N 2.99Å; Q184-L188 WeakPolarHBondContact O-CG 3.41Å; Q184-L188 PolarHBondContact O-N 3.06Å
185	Q	62.2	Low	61.2	Low	123 Å²	123	80.6 Å²	80.6	58%	0.575	41%	0.413	S	S	*	.	H	α-helix	trans	-65.9	-37.4	177.4	-172.1	174.7	6.4	0	0	111.8	I181 S182 L183 L188	I181-Q185 WeakPolarHBondContact O-CB 3.11Å; I181-Q185 PolarHBondContact O-N 3.17Å; S182-Q185 PolarHBondContact O-N 2.76Å; L183-Q185 PolarHBondContact O-N 3.44Å; Q185-L188 WeakPolarHBondContact O-CB 3.38Å; Q185-L188 PolarHBondContact O-N 2.89Å
186	H	68.6	Low	60.2	Low	23 Å²	23	86 Å²	86	11%	0.106	44%	0.439	C	S	.	.	H	α-helix	trans	-69.2	-38.7	175.3	164.2	78.5	0	0	0	113.1	C170 C173 F177 S182 L183 Q184 L188 Q189 H190	C170-H186 WeakPolarHBondContact CB-NE2 3.21Å; C170-H186 PolarHBondContact SG-NE2 3.42Å; C173-H186 PolarHBondContact SG-CE1 3.48Å; C173-H186 PolarHBondContact SG-NE2 2.86Å; F177-H186 HydrophobicContact CE1-CB 3.61Å; F177-H186 AromaticContact CE1-CG 3.87Å; F177-H186 HydrophobicContact CE2-CB 3.95Å; F177-H186 AromaticContact CE2-CD2 3.18Å; F177-H186 WeakPolarHBondContact CE2-CD2 3.22Å; F177-H186 AromaticContact CE2-CG 3.57Å; F177-H186 AromaticContact CE2-NE2 3.62Å; F177-H186 HydrophobicContact CZ-CB 3.3Å; F177-H186 AromaticContact CZ-CD2 3.2Å; F177-H186 WeakPolarHBondContact CZ-CD2 3.41Å; F177-H186 AromaticContact CZ-CE1 3.8Å; F177-H186 AromaticContact CZ-CG 3.04Å; F177-H186 AromaticContact CZ-ND1 3.47Å; F177-H186 WeakPolarHBondContact CZ-ND1 3.2Å; F177-H186 AromaticContact CZ-NE2 3.64Å; S182-H186 VanDerWaalsContact O-CB 3.22Å; S182-H186 WeakPolarHBondContact O-CB 3.32Å; S182-H186 PolarHBondContact O-N 3.29Å; L183-H186 CarbonylContact O-C 3.54Å; L183-H186 PolarHBondContact O-N 3.14Å; Q184-H186 VanDerWaalsContact C-N 3.32Å; H186-L188 PolarHBondContact O-N 3.04Å; H186-Q189 WeakPolarHBondContact O-CA 3.42Å; H186-Q189 WeakPolarHBondContact O-CB 3.3Å; H186-Q189 PolarHBondContact O-N 3.06Å; H186-H190 AromaticContact CD2-CD2 3.8Å; H186-H190 AromaticContact CD2-NE2 3.89Å; H186-H190 AromaticContact CE1-CD2 3.58Å; H186-H190 AromaticContact CE1-NE2 2.97Å; H186-H190 PolarHBondContact CE1-NE2 3.08Å; H186-H190 AromaticContact ND1-NE2 3.97Å; H186-H190 AromaticContact NE2-CD2 3.27Å; H186-H190 PolarHBondContact NE2-CD2 3.24Å; H186-H190 VanDerWaalsContact NE2-CD2 3.27Å; H186-H190 AromaticContact NE2-NE2 2.91Å; H186-H190 PolarHBondContact NE2-NE2 2.98Å
187	L	65.3	Low	59.5	Low	63 Å²	63	94.3 Å²	94.3	33%	0.33	47%	0.471	S	S	.	.	H	α-helix	trans	-60.4	-27.5	176.7	-74.4	171.5	0	0	0	111.5	L183 Q184 Q189 H190 C191	L183-L187 HydrophobicContact CD1-CD1 4.1Å; L183-L187 HydrophobicContact CD1-CD2 4.22Å; L183-L187 HydrophobicContact CD1-CG 3.86Å; L183-L187 HydrophobicContact CD2-CD1 4.49Å; L183-L187 HydrophobicContact CG-CD1 3.91Å; L183-L187 HydrophobicContact CG-CG 4.15Å; L183-L187 WeakPolarHBondContact O-CB 3.47Å; L183-L187 WeakPolarHBondContact O-CG 3.25Å; L183-L187 PolarHBondContact O-N 2.78Å; Q184-L187 PolarHBondContact O-N 2.99Å; L187-Q189 PolarHBondContact O-N 3.26Å; L187-H190 PolarHBondContact O-N 2.86Å; L187-H190 VanDerWaalsContact O-N 3.09Å; L187-C191 PolarHBondContact O-N 3.33Å; L187-C191 PolarHBondContact O-SG 3.38Å; L187-C191 VanDerWaalsContact O-SG 3.34Å
188	L	63.2	Low	59.6	Low	76 Å²	76	95.9 Å²	95.9	40%	0.398	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-27.3	171.1	-58.6	171.4	0	0	0	112.7	Q184 Q185 H186 A209	Q184-L188 WeakPolarHBondContact O-CG 3.41Å; Q184-L188 PolarHBondContact O-N 3.06Å; Q185-L188 WeakPolarHBondContact O-CB 3.38Å; Q185-L188 PolarHBondContact O-N 2.89Å; H186-L188 PolarHBondContact O-N 3.04Å; L188-A209 HydrophobicContact CD1-CB 3.87Å
189	Q	63.7	Low	60.4	Low	114 Å²	114	96.4 Å²	96.4	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-75.5	-30.1	175.2	-55.6	-67	-43.1	0	0	112.2	H186 L187	H186-Q189 WeakPolarHBondContact O-CA 3.42Å; H186-Q189 WeakPolarHBondContact O-CB 3.3Å; H186-Q189 PolarHBondContact O-N 3.06Å; L187-Q189 PolarHBondContact O-N 3.26Å
190	H	62.5	Low	61.3	Low	62 Å²	62	96.4 Å²	96.4	29%	0.287	49%	0.49	S	S	.	.	H	α-helix	trans	-79.3	-28.5	175.1	-74.1	-60.3	0	0	0	113.5	C170 T172 C173 H186 L187 K192	C170-H190 PolarHBondContact SG-CD2 2.9Å; C170-H190 PolarHBondContact SG-NE2 3.44Å; C170-H190 VanDerWaalsContact SG-NE2 3.43Å; T172-H190 HydrophobicContact CG2-CB 4.18Å; T172-H190 WeakPolarHBondContact CG2-ND1 3.27Å; C173-H190 PolarHBondContact SG-CE1 3.36Å; C173-H190 PolarHBondContact SG-NE2 2.81Å; H186-H190 AromaticContact CD2-CD2 3.8Å; H186-H190 AromaticContact CD2-NE2 3.89Å; H186-H190 AromaticContact CE1-CD2 3.58Å; H186-H190 AromaticContact CE1-NE2 2.97Å; H186-H190 PolarHBondContact CE1-NE2 3.08Å; H186-H190 AromaticContact ND1-NE2 3.97Å; H186-H190 AromaticContact NE2-CD2 3.27Å; H186-H190 PolarHBondContact NE2-CD2 3.24Å; H186-H190 VanDerWaalsContact NE2-CD2 3.27Å; H186-H190 AromaticContact NE2-NE2 2.91Å; H186-H190 PolarHBondContact NE2-NE2 2.98Å; L187-H190 PolarHBondContact O-N 2.86Å; L187-H190 VanDerWaalsContact O-N 3.09Å; H190-K192 PolarHBondContact O-N 2.89Å
191	C	53.9	Low	61.8	Low	59 Å²	59	92.2 Å²	92.2	40%	0.399	47%	0.468	S	S	.	.			trans	-76.7	70.1	178.8	-67.1	0	0	0	0	111.8	L187 L193	L187-C191 PolarHBondContact O-N 3.33Å; L187-C191 PolarHBondContact O-SG 3.38Å; L187-C191 VanDerWaalsContact O-SG 3.34Å; C191-L193 PolarHBondContact O-N 3.48Å
192	K	52.2	Low	62.7	Low	205 Å²	205	95.7 Å²	95.7	89%	0.891	48%	0.479	S	S	*	.	S	Bend	trans	-67.1	-5.7	150.7	-76.2	-171	178.3	179.9	0	112	H190	H190-K192 PolarHBondContact O-N 2.89Å
193	L	37.9	Very low	63.6	Low	163 Å²	163	99.1 Å²	99.1	85%	0.853	50%	0.499	S	S	*	.	S	Bend	trans	-140.8	72.7	-175.9	-74.1	158.2	0	0	0	112	C191	C191-L193 PolarHBondContact O-N 3.48Å
194	S	43.7	Very low	64	Low	60 Å²	60	100.5 Å²	100.5	42%	0.42	51%	0.509	S	S	.	.			trans	-158.8	112.7	145.3	97.8	0	0	0	0	110.9	K196	S194-K196 PolarHBondContact O-N 3.37Å
195	P	45.9	Very low	64.7	Low	127 Å²	127	102.1 Å²	102.1	83%	0.825	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.8	-178.3	-14.6	27.3	0	0	0	115.2
196	K	52	Low	65.3	Low	207 Å²	207	102 Å²	102	90%	0.9	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.1	-160.4	-92.3	-176.6	175.1	178.4	0	116.6	S194	S194-K196 PolarHBondContact O-N 3.37Å
197	K	58.2	Low	65.7	Low	188 Å²	188	105.7 Å²	105.7	82%	0.817	53%	0.533	S	S	*	.	S	Bend	trans	-141.6	9.7	176	-147.7	-179.1	179.2	-178.7	0	115.4
198	L	66.6	Low	66.1	Low	56 Å²	56	104.2 Å²	104.2	29%	0.293	52%	0.524	S	S	.	.			trans	-90.1	146.6	170.2	-62.5	172.3	0	0	0	109.3	P200 N207 F208 A209	L198-P200 VanDerWaalsContact O-CD 3.25Å; L198-P200 WeakPolarHBondContact O-CD 3.34Å; L198-N207 HydrophobicContact CB-CB 3.86Å; L198-N207 HydrophobicContact CD1-CB 3.8Å; L198-N207 HydrophobicContact CG-CB 4.37Å; L198-F208 WeakPolarHBondContact CA-O 3.45Å; L198-F208 WeakPolarHBondContact CD2-O 3.36Å; L198-A209 HydrophobicContact CD2-CB 4.5Å
199	L	75.7	Confident	66.5	Low	59 Å²	59	102.2 Å²	102.2	31%	0.309	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	105.5	-179.2	-62.6	166.7	0	0	0	108	F208 Q211 L214	L199-F208 PolarHBondContact N-O 2.99Å; L199-F208 PolarHBondContact O-N 2.71Å; L199-Q211 HydrophobicContact CD1-CB 3.75Å; L199-Q211 VanDerWaalsContact CD1-N 3.27Å; L199-L214 HydrophobicContact CB-CB 4.36Å; L199-L214 HydrophobicContact CB-CD2 3.74Å
200	P	80.9	Confident	67	Low	66 Å²	66	100.9 Å²	100.9	43%	0.429	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.8	-178.2	29.8	-34.2	0	0	0	110.3	L198 K202 K206	L198-P200 VanDerWaalsContact O-CD 3.25Å; L198-P200 WeakPolarHBondContact O-CD 3.34Å; P200-K202 PolarHBondContact O-N 2.88Å; P200-K206 CarbonylContact C-O 3.59Å; P200-K206 WeakPolarHBondContact CA-O 3.09Å
201	C	81.3	Confident	67.9	Low	1 Å²	1	102.4 Å²	102.4	1%	0.007	52%	0.519	C	S	.	.			trans	-63.4	126.3	165.6	-178.9	0	0	0	0	109.8	V203 K205 K206 F208 L214 H217 H221	C201-V203 PolarHBondContact O-N 3.17Å; C201-V203 PolarHBondContact SG-N 3.33Å; C201-V203 VanDerWaalsContact SG-N 3.45Å; C201-K205 WeakPolarHBondContact O-CA 3.37Å; C201-K205 PolarHBondContact O-N 2.77Å; C201-K206 PolarHBondContact N-O 3.23Å; C201-F208 HydrophobicContact CB-CE2 4.16Å; C201-L214 HydrophobicContact CB-CD1 3.89Å; C201-H217 PolarHBondContact SG-NE2 3.5Å; C201-H221 PolarHBondContact SG-CD2 3.11Å; C201-H221 PolarHBondContact SG-NE2 2.67Å
202	K	83.1	Confident	69.2	Low	193 Å²	193	103.3 Å²	103.3	84%	0.839	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.8	179.5	-66.1	-176.1	179	-179.2	0	113	P200	P200-K202 PolarHBondContact O-N 2.88Å
203	V	83.1	Confident	70.4	Confident	101 Å²	101	96.1 Å²	96.1	61%	0.612	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-58.1	-175.9	-175.5	0	0	0	0	111.9	C201 H221	C201-V203 PolarHBondContact O-N 3.17Å; C201-V203 PolarHBondContact SG-N 3.33Å; C201-V203 VanDerWaalsContact SG-N 3.45Å; V203-H221 HydrophobicContact CB-CB 4.4Å; V203-H221 HydrophobicContact CG1-CB 4.36Å; V203-H221 WeakPolarHBondContact CG1-ND1 3.32Å; V203-H221 HydrophobicContact CG2-CB 4.06Å
204	C	79.7	Confident	72.6	Confident	53 Å²	53	89.4 Å²	89.4	36%	0.358	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	3.3	-173.5	70.1	0	0	0	0	114.9	K206 H217	C204-K206 PolarHBondContact O-N 2.75Å; C204-H217 VanDerWaalsContact SG-CE1 3.58Å; C204-H217 PolarHBondContact SG-NE2 3.32Å
205	K	79.2	Confident	74.4	Confident	145 Å²	145	91.8 Å²	91.8	63%	0.63	47%	0.465	S	S	*	.			trans	59.9	9.9	178.9	-51.3	-61.3	-176.5	-177	0	115.9	C201	C201-K205 WeakPolarHBondContact O-CA 3.37Å; C201-K205 PolarHBondContact O-N 2.77Å
206	K	74.7	Confident	76.1	Confident	122 Å²	122	90.6 Å²	90.6	53%	0.53	44%	0.444	S	S	.	.			trans	-60.6	138.5	168.4	-74.2	-170.3	177.5	-171.5	0	110.4	P200 C201 C204 F208	P200-K206 CarbonylContact C-O 3.59Å; P200-K206 WeakPolarHBondContact CA-O 3.09Å; C201-K206 PolarHBondContact N-O 3.23Å; C204-K206 PolarHBondContact O-N 2.75Å; K206-F208 HydrophobicContact CB-CE2 3.84Å; K206-F208 HydrophobicContact CB-CZ 3.99Å; K206-F208 WeakPolarHBondContact O-CE2 3.48Å
207	N	76.8	Confident	77.6	Confident	99 Å²	99	81.8 Å²	81.8	53%	0.529	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	139.4	-176.1	-72.5	-45.9	0	0	0	110.9	L198	L198-N207 HydrophobicContact CB-CB 3.86Å; L198-N207 HydrophobicContact CD1-CB 3.8Å; L198-N207 HydrophobicContact CG-CB 4.37Å
208	F	74.3	Confident	78.7	Confident	33 Å²	33	74.8 Å²	74.8	15%	0.145	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.7	-180	-64.7	-82.6	0	0	0	111.1	L198 L199 C201 K206 E213 L214 H217	L198-F208 WeakPolarHBondContact CA-O 3.45Å; L198-F208 WeakPolarHBondContact CD2-O 3.36Å; L199-F208 PolarHBondContact N-O 2.99Å; L199-F208 PolarHBondContact O-N 2.71Å; C201-F208 HydrophobicContact CB-CE2 4.16Å; K206-F208 HydrophobicContact CB-CE2 3.84Å; K206-F208 HydrophobicContact CB-CZ 3.99Å; K206-F208 WeakPolarHBondContact O-CE2 3.48Å; F208-E213 HydrophobicContact CB-CB 4.13Å; F208-E213 HydrophobicContact CD1-CB 3.75Å; F208-E213 HydrophobicContact CG-CB 4.28Å; F208-L214 HydrophobicContact CB-CB 4.03Å; F208-L214 HydrophobicContact CD2-CB 3.98Å; F208-L214 HydrophobicContact CD2-CD1 3.72Å; F208-L214 HydrophobicContact CD2-CG 4.44Å; F208-L214 HydrophobicContact CE2-CD1 4.1Å; F208-L214 HydrophobicContact CG-CB 4.08Å; F208-H217 HydrophobicContact CD1-CB 4.39Å; F208-H217 HydrophobicContact CE1-CB 3.61Å; F208-H217 AromaticContact CE1-CG 3.85Å; F208-H217 HydrophobicContact CE2-CB 3.82Å; F208-H217 AromaticContact CE2-CD2 3.36Å; F208-H217 WeakPolarHBondContact CE2-CD2 3.22Å; F208-H217 AromaticContact CE2-CG 3.47Å; F208-H217 VanDerWaalsContact CE2-CG 3.47Å; F208-H217 AromaticContact CE2-NE2 3.87Å; F208-H217 HydrophobicContact CZ-CB 3.32Å; F208-H217 AromaticContact CZ-CD2 3.45Å; F208-H217 VanDerWaalsContact CZ-CD2 3.45Å; F208-H217 WeakPolarHBondContact CZ-CD2 3.26Å; F208-H217 AromaticContact CZ-CE1 3.77Å; F208-H217 AromaticContact CZ-CG 3.04Å; F208-H217 AromaticContact CZ-ND1 3.3Å; F208-H217 VanDerWaalsContact CZ-ND1 3.3Å; F208-H217 WeakPolarHBondContact CZ-ND1 3.23Å; F208-H217 AromaticContact CZ-NE2 3.88Å
209	A	72	Confident	79.3	Confident	33 Å²	33	74 Å²	74	27%	0.273	38%	0.377	S	S	.	.	S	Bend	trans	-74.7	-33.2	179.1	0	0	0	0	0	112	L188 L198 E213	L188-A209 HydrophobicContact CD1-CB 3.87Å; L198-A209 HydrophobicContact CD2-CB 4.5Å; A209-E213 PolarHBondContact N-OE2 3.12Å
210	H	74.2	Confident	79.3	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.398	38%	0.384	S	S	.	.	S	Bend	trans	-129.1	148.6	-176.3	-54.4	97.3	0	0	0	112.3	S212 E213 L214	H210-S212 PolarHBondContact O-N 3.08Å; H210-E213 HydrophobicContact CB-CG 4.2Å; H210-E213 IonicContact CE1-OE1 3.98Å; H210-E213 IonicContact CG-OE1 3.9Å; H210-E213 PolarHBondContact N-OE2 2.94Å; H210-E213 IonicContact ND1-OE1 2.99Å; H210-E213 PolarHBondContact ND1-OE1 3.32Å; H210-E213 IonicContact ND1-OE2 3.81Å; H210-E213 WeakPolarHBondContact O-CB 3.46Å; H210-E213 PolarHBondContact O-N 3.4Å; H210-L214 PolarHBondContact O-N 3.28Å; H210-L214 VanDerWaalsContact O-N 3.14Å
211	Q	80.1	Confident	79.2	Confident	94 Å²	94	75.2 Å²	75.2	44%	0.439	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-36.6	178	178.3	62.5	28.1	0	0	112	L199 E213 L214 E215	L199-Q211 HydrophobicContact CD1-CB 3.75Å; L199-Q211 VanDerWaalsContact CD1-N 3.27Å; Q211-E213 VanDerWaalsContact C-N 3.28Å; Q211-E213 PolarHBondContact O-N 3.45Å; Q211-L214 PolarHBondContact O-N 3.41Å; Q211-E215 HydrophobicContact CG-CG 4.45Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.23Å; Q211-E215 PolarHBondContact NE2-OE1 3.35Å; Q211-E215 WeakPolarHBondContact O-CB 3.41Å; Q211-E215 WeakPolarHBondContact O-CG 3.23Å; Q211-E215 PolarHBondContact O-N 3.45Å
212	S	81.3	Confident	78.7	Confident	78 Å²	78	79.1 Å²	79.1	55%	0.545	40%	0.4	S	S	.	.	H	α-helix	trans	-62.6	-32.9	176	54.7	0	0	0	0	113.1	H210 R216	H210-S212 PolarHBondContact O-N 3.08Å; S212-R216 VanDerWaalsContact O-CB 3.26Å; S212-R216 WeakPolarHBondContact O-CB 3.47Å; S212-R216 PolarHBondContact O-N 3.13Å; S212-R216 VanDerWaalsContact O-N 3.08Å
213	E	78.3	Confident	77.8	Confident	55 Å²	55	78.9 Å²	78.9	26%	0.257	40%	0.4	S	S	.	.	H	α-helix	trans	-74.4	-41.3	175.6	-64.4	165.5	-175.5	0	0	111	F208 A209 H210 Q211 R216 H217	F208-E213 HydrophobicContact CB-CB 4.13Å; F208-E213 HydrophobicContact CD1-CB 3.75Å; F208-E213 HydrophobicContact CG-CB 4.28Å; A209-E213 PolarHBondContact N-OE2 3.12Å; H210-E213 HydrophobicContact CB-CG 4.2Å; H210-E213 IonicContact CE1-OE1 3.98Å; H210-E213 IonicContact CG-OE1 3.9Å; H210-E213 PolarHBondContact N-OE2 2.94Å; H210-E213 IonicContact ND1-OE1 2.99Å; H210-E213 PolarHBondContact ND1-OE1 3.32Å; H210-E213 IonicContact ND1-OE2 3.81Å; H210-E213 WeakPolarHBondContact O-CB 3.46Å; H210-E213 PolarHBondContact O-N 3.4Å; Q211-E213 VanDerWaalsContact C-N 3.28Å; Q211-E213 PolarHBondContact O-N 3.45Å; E213-R216 PolarHBondContact O-N 3.2Å; E213-H217 WeakPolarHBondContact O-CB 3.38Å; E213-H217 PolarHBondContact O-N 2.92Å
214	L	82.9	Confident	76.6	Confident	22 Å²	22	78.6 Å²	78.6	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-62.7	-44	174.5	172.5	60.1	0	0	0	111.5	L199 C201 F208 H210 Q211 H217 S218	L199-L214 HydrophobicContact CB-CB 4.36Å; L199-L214 HydrophobicContact CB-CD2 3.74Å; C201-L214 HydrophobicContact CB-CD1 3.89Å; F208-L214 HydrophobicContact CB-CB 4.03Å; F208-L214 HydrophobicContact CD2-CB 3.98Å; F208-L214 HydrophobicContact CD2-CD1 3.72Å; F208-L214 HydrophobicContact CD2-CG 4.44Å; F208-L214 HydrophobicContact CE2-CD1 4.1Å; F208-L214 HydrophobicContact CG-CB 4.08Å; H210-L214 PolarHBondContact O-N 3.28Å; H210-L214 VanDerWaalsContact O-N 3.14Å; Q211-L214 PolarHBondContact O-N 3.41Å; L214-H217 PolarHBondContact O-N 2.83Å; L214-S218 WeakPolarHBondContact O-CB 3.39Å; L214-S218 PolarHBondContact O-N 3.17Å; L214-S218 PolarHBondContact O-OG 3.08Å
215	E	82.5	Confident	75.9	Confident	109 Å²	109	77.5 Å²	77.5	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-49	176.5	-76.6	169.4	-173.7	0	0	111	Q211 H217 S218 I219	Q211-E215 HydrophobicContact CG-CG 4.45Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.23Å; Q211-E215 PolarHBondContact NE2-OE1 3.35Å; Q211-E215 WeakPolarHBondContact O-CB 3.41Å; Q211-E215 WeakPolarHBondContact O-CG 3.23Å; Q211-E215 PolarHBondContact O-N 3.45Å; E215-H217 VanDerWaalsContact C-N 3.29Å; E215-H217 PolarHBondContact O-N 2.79Å; E215-S218 PolarHBondContact O-N 3.1Å; E215-S218 VanDerWaalsContact O-N 3.1Å; E215-I219 PolarHBondContact O-N 3.25Å
216	R	81.6	Confident	75.8	Confident	102 Å²	102	74.4 Å²	74.4	39%	0.385	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-41.4	175.7	-178.5	176.2	68.1	-158.8	-0.3	111.9	S212 E213 I219	S212-R216 VanDerWaalsContact O-CB 3.26Å; S212-R216 WeakPolarHBondContact O-CB 3.47Å; S212-R216 PolarHBondContact O-N 3.13Å; S212-R216 VanDerWaalsContact O-N 3.08Å; E213-R216 PolarHBondContact O-N 3.2Å; R216-I219 WeakPolarHBondContact O-CB 3.05Å
217	H	82.6	Confident	76	Confident	22 Å²	22	73.1 Å²	73.1	10%	0.102	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-41	175.1	169.2	79.6	0	0	0	111.6	C201 C204 F208 E213 L214 E215 I219 I220 H221	C201-H217 PolarHBondContact SG-NE2 3.5Å; C204-H217 VanDerWaalsContact SG-CE1 3.58Å; C204-H217 PolarHBondContact SG-NE2 3.32Å; F208-H217 HydrophobicContact CD1-CB 4.39Å; F208-H217 HydrophobicContact CE1-CB 3.61Å; F208-H217 AromaticContact CE1-CG 3.85Å; F208-H217 HydrophobicContact CE2-CB 3.82Å; F208-H217 AromaticContact CE2-CD2 3.36Å; F208-H217 WeakPolarHBondContact CE2-CD2 3.22Å; F208-H217 AromaticContact CE2-CG 3.47Å; F208-H217 VanDerWaalsContact CE2-CG 3.47Å; F208-H217 AromaticContact CE2-NE2 3.87Å; F208-H217 HydrophobicContact CZ-CB 3.32Å; F208-H217 AromaticContact CZ-CD2 3.45Å; F208-H217 VanDerWaalsContact CZ-CD2 3.45Å; F208-H217 WeakPolarHBondContact CZ-CD2 3.26Å; F208-H217 AromaticContact CZ-CE1 3.77Å; F208-H217 AromaticContact CZ-CG 3.04Å; F208-H217 AromaticContact CZ-ND1 3.3Å; F208-H217 VanDerWaalsContact CZ-ND1 3.3Å; F208-H217 WeakPolarHBondContact CZ-ND1 3.23Å; F208-H217 AromaticContact CZ-NE2 3.88Å; E213-H217 WeakPolarHBondContact O-CB 3.38Å; E213-H217 PolarHBondContact O-N 2.92Å; L214-H217 PolarHBondContact O-N 2.83Å; E215-H217 VanDerWaalsContact C-N 3.29Å; E215-H217 PolarHBondContact O-N 2.79Å; H217-I219 PolarHBondContact O-N 2.95Å; H217-I219 VanDerWaalsContact O-N 3.08Å; H217-I220 WeakPolarHBondContact CE1-CD1 3.33Å; H217-I220 WeakPolarHBondContact ND1-CD1 3.46Å; H217-I220 WeakPolarHBondContact O-CG1 3.22Å; H217-I220 WeakPolarHBondContact O-CG2 3.45Å; H217-I220 PolarHBondContact O-N 2.7Å; H217-H221 AromaticContact CD2-NE2 3.7Å; H217-H221 AromaticContact CE1-NE2 3.71Å; H217-H221 AromaticContact NE2-CD2 3.9Å; H217-H221 AromaticContact NE2-CE1 3.9Å; H217-H221 AromaticContact NE2-NE2 2.98Å; H217-H221 PolarHBondContact NE2-NE2 2.79Å
218	S	81.3	Confident	76.2	Confident	42 Å²	42	76.8 Å²	76.8	29%	0.294	39%	0.388	S	S	.	.	H	α-helix	trans	-61.4	-24.2	-175.3	-62.2	0	0	0	0	113	L214 E215 I220 H221	L214-S218 WeakPolarHBondContact O-CB 3.39Å; L214-S218 PolarHBondContact O-N 3.17Å; L214-S218 PolarHBondContact O-OG 3.08Å; E215-S218 PolarHBondContact O-N 3.1Å; E215-S218 VanDerWaalsContact O-N 3.1Å; S218-I220 PolarHBondContact O-N 3.37Å; S218-H221 PolarHBondContact O-N 2.95Å; S218-H221 VanDerWaalsContact O-N 3.09Å
219	I	79.8	Confident	76.3	Confident	40 Å²	40	75.5 Å²	75.5	21%	0.205	38%	0.382	C	S	.	.	H	α-helix	trans	-54.6	-36.7	172.4	-59.2	173.8	0	0	0	111.4	E215 R216 H217 H221 T222 K223 C224 T237	E215-I219 PolarHBondContact O-N 3.25Å; R216-I219 WeakPolarHBondContact O-CB 3.05Å; H217-I219 PolarHBondContact O-N 2.95Å; H217-I219 VanDerWaalsContact O-N 3.08Å; I219-H221 PolarHBondContact O-N 2.83Å; I219-T222 PolarHBondContact O-N 3.21Å; I219-T222 VanDerWaalsContact O-N 3.11Å; I219-T222 PolarHBondContact O-OG1 2.84Å; I219-K223 PolarHBondContact O-N 2.97Å; I219-C224 WeakPolarHBondContact CG2-O 3.48Å; I219-T237 HydrophobicContact CG2-CG2 4.06Å
220	I	76.6	Confident	76.8	Confident	88 Å²	88	79 Å²	79	45%	0.451	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-30.9	-179.1	81.6	-175.9	0	0	0	112.2	H217 S218 T237	H217-I220 WeakPolarHBondContact CE1-CD1 3.33Å; H217-I220 WeakPolarHBondContact ND1-CD1 3.46Å; H217-I220 WeakPolarHBondContact O-CG1 3.22Å; H217-I220 WeakPolarHBondContact O-CG2 3.45Å; H217-I220 PolarHBondContact O-N 2.7Å; S218-I220 PolarHBondContact O-N 3.37Å; I220-T237 HydrophobicContact CG2-CG2 4.18Å
221	H	78.8	Confident	76.7	Confident	61 Å²	61	80.9 Å²	80.9	28%	0.282	41%	0.412	S	S	.	.	H	α-helix	trans	-78.3	-28.1	-179.6	-60.9	-54.2	0	0	0	112.1	C201 V203 H217 S218 I219 K223	C201-H221 PolarHBondContact SG-CD2 3.11Å; C201-H221 PolarHBondContact SG-NE2 2.67Å; V203-H221 HydrophobicContact CB-CB 4.4Å; V203-H221 HydrophobicContact CG1-CB 4.36Å; V203-H221 WeakPolarHBondContact CG1-ND1 3.32Å; V203-H221 HydrophobicContact CG2-CB 4.06Å; H217-H221 AromaticContact CD2-NE2 3.7Å; H217-H221 AromaticContact CE1-NE2 3.71Å; H217-H221 AromaticContact NE2-CD2 3.9Å; H217-H221 AromaticContact NE2-CE1 3.9Å; H217-H221 AromaticContact NE2-NE2 2.98Å; H217-H221 PolarHBondContact NE2-NE2 2.79Å; S218-H221 PolarHBondContact O-N 2.95Å; S218-H221 VanDerWaalsContact O-N 3.09Å; I219-H221 PolarHBondContact O-N 2.83Å; H221-K223 PolarHBondContact O-N 3.24Å
222	T	70.4	Confident	76.5	Confident	83 Å²	83	78.3 Å²	78.3	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-75.8	-13.7	178.8	65.6	0	0	0	0	113.1	I219 C224	I219-T222 PolarHBondContact O-N 3.21Å; I219-T222 VanDerWaalsContact O-N 3.11Å; I219-T222 PolarHBondContact O-OG1 2.84Å; T222-C224 PolarHBondContact O-N 2.74Å; T222-C224 PolarHBondContact O-SG 3.11Å; T222-C224 PolarHBondContact OG1-N 3.44Å
223	K	62.9	Low	76.4	Confident	189 Å²	189	79.4 Å²	79.4	82%	0.822	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	7.7	-168	-62.7	-176.8	179.3	179.6	0	114.3	I219 H221	I219-K223 PolarHBondContact O-N 2.97Å; H221-K223 PolarHBondContact O-N 3.24Å
224	C	58.2	Low	76.2	Confident	94 Å²	94	84.3 Å²	84.3	64%	0.635	43%	0.428	S	S	*	.			trans	-103.5	90	179.8	-71.5	0	0	0	0	108.7	I219 T222	I219-C224 WeakPolarHBondContact CG2-O 3.48Å; T222-C224 PolarHBondContact O-N 2.74Å; T222-C224 PolarHBondContact O-SG 3.11Å; T222-C224 PolarHBondContact OG1-N 3.44Å
225	S	66.3	Low	75.8	Confident	30 Å²	30	86.4 Å²	86.4	21%	0.21	44%	0.442	C	S	.	.			trans	-80.9	125.4	174.6	-84.6	0	0	0	0	110	Y227 T235 F236	S225-Y227 PolarHBondContact O-N 3.5Å; S225-T235 VanDerWaalsContact CB-CB 3.44Å; S225-T235 WeakPolarHBondContact CB-OG1 3.19Å; S225-F236 VanDerWaalsContact CB-O 3.3Å; S225-F236 WeakPolarHBondContact CB-O 3.49Å
226	P	76	Confident	75.4	Confident	81 Å²	81	82.9 Å²	82.9	53%	0.526	43%	0.425	S	S	.	.	S	Bend	trans	-70.5	-15.9	-174.5	24.8	-31.8	0	0	0	113.8
227	Y	79.8	Confident	75.2	Confident	95 Å²	95	79.9 Å²	79.9	37%	0.373	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	104.4	-175.3	-55.4	-71.1	0	0	0	110.5	S225 T235 F236 S239	S225-Y227 PolarHBondContact O-N 3.5Å; Y227-T235 CarbonylContact O-C 3.59Å; Y227-T235 WeakPolarHBondContact O-CA 3.38Å; Y227-F236 WeakPolarHBondContact CB-O 3.41Å; Y227-F236 WeakPolarHBondContact CD2-O 3.35Å; Y227-F236 PolarHBondContact N-O 3.36Å; Y227-F236 PolarHBondContact O-N 3.34Å; Y227-S239 VanDerWaalsContact CE2-N 3.34Å
228	R	80	Confident	75	Confident	176 Å²	176	83.5 Å²	83.5	66%	0.664	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.6	178.6	-176.7	174.5	-178.1	174.1	2.5	110.8	T235	R228-T235 HydrophobicContact CB-CG2 4.23Å; R228-T235 HydrophobicContact CG-CG2 4.15Å
229	C	77.1	Confident	75.1	Confident	5 Å²	5	84.1 Å²	84.1	3%	0.034	44%	0.435	C	S	.	.			trans	-71	136.9	170.4	-173.8	0	0	0	0	110.8	F231 R234 F236 L242 H245	C229-F231 PolarHBondContact SG-N 3.09Å; C229-F231 VanDerWaalsContact SG-N 3.4Å; C229-R234 PolarHBondContact N-O 3.21Å; C229-F236 HydrophobicContact CB-CE2 4.36Å; C229-L242 HydrophobicContact CB-CD1 3.89Å; C229-H245 PolarHBondContact SG-CD2 3.29Å; C229-H245 PolarHBondContact SG-NE2 3.21Å
230	S	81.2	Confident	75	Confident	107 Å²	107	85.3 Å²	85.3	75%	0.748	44%	0.442	S	S	*	.	S	Bend	trans	-75.8	-25.3	175.3	48.3	0	0	0	0	112.9
231	F	72.7	Confident	75.1	Confident	125 Å²	125	82.4 Å²	82.4	55%	0.548	43%	0.427	S	S	.	.	S	Bend	trans	-94.9	-16.5	-176.2	-58	-77.6	0	0	0	113.7	C229 H249 T250	C229-F231 PolarHBondContact SG-N 3.09Å; C229-F231 VanDerWaalsContact SG-N 3.4Å; F231-H249 HydrophobicContact CB-CB 4.07Å; F231-H249 VanDerWaalsContact CB-CG 3.47Å; F231-H249 WeakPolarHBondContact CB-ND1 3.32Å; F231-H249 HydrophobicContact CD1-CB 4.43Å; F231-H249 HydrophobicContact CD2-CB 3.7Å; F231-H249 AromaticContact CD2-CD2 3.94Å; F231-H249 AromaticContact CD2-CG 3.82Å; F231-H249 HydrophobicContact CE2-CB 4.23Å; F231-H249 HydrophobicContact CG-CB 3.82Å; F231-H249 AromaticContact CG-CG 3.77Å; F231-T250 HydrophobicContact CE2-CG2 3.94Å; F231-T250 HydrophobicContact CZ-CG2 3.93Å
232	C	76.9	Confident	75.2	Confident	40 Å²	40	81.2 Å²	81.2	27%	0.27	42%	0.423	S	S	.	.	S	Bend	trans	-152.8	170.3	178.4	73.8	0	0	0	0	112.4	R234 H245	C232-R234 PolarHBondContact O-N 2.97Å; C232-R234 VanDerWaalsContact O-N 3.08Å; C232-H245 PolarHBondContact SG-NE2 3.18Å
233	S	78	Confident	75.6	Confident	102 Å²	102	84.3 Å²	84.3	71%	0.713	43%	0.429	S	S	*	.	S	Bend	trans	-73.2	4.4	-178	-55.3	0	0	0	0	115.1
234	R	73.6	Confident	76	Confident	158 Å²	158	77.6 Å²	77.6	60%	0.596	40%	0.402	S	S	*	.			trans	-73.3	142.8	-179	-67.2	-173.8	178.1	-173.7	1.6	111.7	C229 C232 F236	C229-R234 PolarHBondContact N-O 3.21Å; C232-R234 PolarHBondContact O-N 2.97Å; C232-R234 VanDerWaalsContact O-N 3.08Å; R234-F236 HydrophobicContact CB-CE2 3.91Å; R234-F236 HydrophobicContact CB-CZ 3.96Å
235	T	74.6	Confident	77	Confident	66 Å²	66	73.8 Å²	73.8	41%	0.405	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	152.2	178.2	64.9	0	0	0	0	110.6	S225 Y227 R228	S225-T235 VanDerWaalsContact CB-CB 3.44Å; S225-T235 WeakPolarHBondContact CB-OG1 3.19Å; Y227-T235 CarbonylContact O-C 3.59Å; Y227-T235 WeakPolarHBondContact O-CA 3.38Å; R228-T235 HydrophobicContact CB-CG2 4.23Å; R228-T235 HydrophobicContact CG-CG2 4.15Å
236	F	75.5	Confident	77.3	Confident	35 Å²	35	73.6 Å²	73.6	15%	0.154	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.7	-170.7	-59.3	-88.6	0	0	0	111.4	S225 Y227 C229 R234 R238 L241 L242 H245	S225-F236 VanDerWaalsContact CB-O 3.3Å; S225-F236 WeakPolarHBondContact CB-O 3.49Å; Y227-F236 WeakPolarHBondContact CB-O 3.41Å; Y227-F236 WeakPolarHBondContact CD2-O 3.35Å; Y227-F236 PolarHBondContact N-O 3.36Å; Y227-F236 PolarHBondContact O-N 3.34Å; C229-F236 HydrophobicContact CB-CE2 4.36Å; R234-F236 HydrophobicContact CB-CE2 3.91Å; R234-F236 HydrophobicContact CB-CZ 3.96Å; F236-R238 VanDerWaalsContact C-N 3.29Å; F236-R238 PolarHBondContact O-N 2.86Å; F236-L241 HydrophobicContact CB-CB 4.18Å; F236-L241 HydrophobicContact CD1-CB 3.75Å; F236-L241 HydrophobicContact CG-CB 4.27Å; F236-L242 HydrophobicContact CB-CB 4.16Å; F236-L242 HydrophobicContact CD2-CB 3.79Å; F236-L242 HydrophobicContact CD2-CD1 3.76Å; F236-L242 HydrophobicContact CD2-CG 4.36Å; F236-L242 HydrophobicContact CE2-CD1 3.92Å; F236-L242 HydrophobicContact CG-CB 4.07Å; F236-H245 HydrophobicContact CE1-CB 3.69Å; F236-H245 HydrophobicContact CE2-CB 3.83Å; F236-H245 AromaticContact CE2-CD2 3.39Å; F236-H245 WeakPolarHBondContact CE2-CD2 3.19Å; F236-H245 AromaticContact CE2-CG 3.62Å; F236-H245 HydrophobicContact CZ-CB 3.26Å; F236-H245 AromaticContact CZ-CD2 3.39Å; F236-H245 WeakPolarHBondContact CZ-CD2 3.5Å; F236-H245 AromaticContact CZ-CG 3.11Å; F236-H245 AromaticContact CZ-ND1 3.72Å
237	T	76.8	Confident	77.2	Confident	39 Å²	39	72.7 Å²	72.7	24%	0.239	37%	0.366	C	S	.	.	S	Bend	trans	-77.9	-15.6	177.3	55.8	0	0	0	0	112.9	I219 I220	I219-T237 HydrophobicContact CG2-CG2 4.06Å; I220-T237 HydrophobicContact CG2-CG2 4.18Å
238	R	77.9	Confident	76.7	Confident	97 Å²	97	71.5 Å²	71.5	37%	0.366	37%	0.365	S	S	.	.	S	Bend	trans	-138	144.4	-178.8	-55.4	174.2	63.3	149.2	1.3	111.2	F236 N240 L241 L242	F236-R238 VanDerWaalsContact C-N 3.29Å; F236-R238 PolarHBondContact O-N 2.86Å; R238-N240 VanDerWaalsContact C-N 3.35Å; R238-N240 WeakPolarHBondContact CB-OD1 3.44Å; R238-N240 PolarHBondContact NE-OD1 3.21Å; R238-N240 PolarHBondContact O-N 3.06Å; R238-L241 HydrophobicContact CB-CD1 4.08Å; R238-L241 HydrophobicContact CB-CG 4.07Å; R238-L241 HydrophobicContact CG-CD1 4.28Å; R238-L241 PolarHBondContact O-N 3.19Å; R238-L242 PolarHBondContact O-N 3.21Å
239	S	83	Confident	76.2	Confident	55 Å²	55	66.9 Å²	66.9	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-34.7	-179.5	61.4	0	0	0	0	113.4	Y227 L241 L242 K243	Y227-S239 VanDerWaalsContact CE2-N 3.34Å; S239-L241 VanDerWaalsContact C-N 3.32Å; S239-L241 PolarHBondContact O-N 3.16Å; S239-L242 PolarHBondContact O-N 3.29Å; S239-K243 WeakPolarHBondContact O-CG 3.34Å; S239-K243 PolarHBondContact O-N 3.09Å
240	N	77.8	Confident	75.7	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.353	38%	0.375	S	S	.	.	H	α-helix	trans	-66.4	-33.8	176.5	67.2	-44.9	0	0	0	112.3	R238 K243 N244	R238-N240 VanDerWaalsContact C-N 3.35Å; R238-N240 WeakPolarHBondContact CB-OD1 3.44Å; R238-N240 PolarHBondContact NE-OD1 3.21Å; R238-N240 PolarHBondContact O-N 3.06Å; N240-K243 PolarHBondContact O-N 3.45Å; N240-N244 VanDerWaalsContact O-CG 3.31Å; N240-N244 PolarHBondContact O-N 2.9Å; N240-N244 PolarHBondContact O-OD1 2.76Å
241	L	79.8	Confident	74.7	Confident	27 Å²	27	68.1 Å²	68.1	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-67.6	-41.5	173.9	-62.2	177.3	0	0	0	111.3	F236 R238 S239 N244 H245 Y269	F236-L241 HydrophobicContact CB-CB 4.18Å; F236-L241 HydrophobicContact CD1-CB 3.75Å; F236-L241 HydrophobicContact CG-CB 4.27Å; R238-L241 HydrophobicContact CB-CD1 4.08Å; R238-L241 HydrophobicContact CB-CG 4.07Å; R238-L241 HydrophobicContact CG-CD1 4.28Å; R238-L241 PolarHBondContact O-N 3.19Å; S239-L241 VanDerWaalsContact C-N 3.32Å; S239-L241 PolarHBondContact O-N 3.16Å; L241-N244 PolarHBondContact O-N 2.92Å; L241-H245 VanDerWaalsContact O-CB 3.31Å; L241-H245 WeakPolarHBondContact O-CB 3.41Å; L241-H245 PolarHBondContact O-N 3.23Å; L241-Y269 WeakPolarHBondContact CD2-OH 3.46Å
242	L	79.7	Confident	73.8	Confident	35 Å²	35	68.5 Å²	68.5	18%	0.183	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-44.5	171.9	171.1	61.8	0	0	0	111.4	C229 F236 R238 S239 H245 A246	C229-L242 HydrophobicContact CB-CD1 3.89Å; F236-L242 HydrophobicContact CB-CB 4.16Å; F236-L242 HydrophobicContact CD2-CB 3.79Å; F236-L242 HydrophobicContact CD2-CD1 3.76Å; F236-L242 HydrophobicContact CD2-CG 4.36Å; F236-L242 HydrophobicContact CE2-CD1 3.92Å; F236-L242 HydrophobicContact CG-CB 4.07Å; R238-L242 PolarHBondContact O-N 3.21Å; S239-L242 PolarHBondContact O-N 3.29Å; L242-H245 CarbonylContact O-C 3.55Å; L242-H245 PolarHBondContact O-N 3.09Å; L242-A246 WeakPolarHBondContact O-CB 3.43Å; L242-A246 PolarHBondContact O-N 3.39Å
243	K	78.6	Confident	73.1	Confident	148 Å²	148	70.7 Å²	70.7	64%	0.643	38%	0.383	S	S	*	.	H	α-helix	trans	-59.3	-49.2	177.7	-75.6	-177.8	177.8	-170.1	0	111.6	S239 N240 H245 A246 L247	S239-K243 WeakPolarHBondContact O-CG 3.34Å; S239-K243 PolarHBondContact O-N 3.09Å; N240-K243 PolarHBondContact O-N 3.45Å; K243-H245 VanDerWaalsContact C-N 3.31Å; K243-H245 PolarHBondContact O-N 2.95Å; K243-A246 PolarHBondContact O-N 3.37Å; K243-L247 PolarHBondContact O-N 2.85Å
244	N	72.1	Confident	72.5	Confident	48 Å²	48	67.2 Å²	67.2	26%	0.257	36%	0.357	S	S	.	.	H	α-helix	trans	-61.3	-42.6	176.3	-68.8	0.9	0	0	0	110.6	N240 L241 A246 L247 A265	N240-N244 VanDerWaalsContact O-CG 3.31Å; N240-N244 PolarHBondContact O-N 2.9Å; N240-N244 PolarHBondContact O-OD1 2.76Å; L241-N244 PolarHBondContact O-N 2.92Å; N244-A246 VanDerWaalsContact C-N 3.35Å; N244-A246 PolarHBondContact O-N 3.23Å; N244-L247 WeakPolarHBondContact O-CB 3.35Å; N244-L247 PolarHBondContact O-N 3.48Å; N244-A265 HydrophobicContact CB-CB 4.48Å; N244-A265 WeakPolarHBondContact O-CB 3.47Å
245	H	78.8	Confident	72.2	Confident	15 Å²	15	63.1 Å²	63.1	7%	0.069	35%	0.346	C	S	.	.	H	α-helix	trans	-63.2	-39.1	175.1	169.7	69.2	0	0	0	113.3	C229 C232 F236 L241 L242 K243 L247 L248 H249	C229-H245 PolarHBondContact SG-CD2 3.29Å; C229-H245 PolarHBondContact SG-NE2 3.21Å; C232-H245 PolarHBondContact SG-NE2 3.18Å; F236-H245 HydrophobicContact CE1-CB 3.69Å; F236-H245 HydrophobicContact CE2-CB 3.83Å; F236-H245 AromaticContact CE2-CD2 3.39Å; F236-H245 WeakPolarHBondContact CE2-CD2 3.19Å; F236-H245 AromaticContact CE2-CG 3.62Å; F236-H245 HydrophobicContact CZ-CB 3.26Å; F236-H245 AromaticContact CZ-CD2 3.39Å; F236-H245 WeakPolarHBondContact CZ-CD2 3.5Å; F236-H245 AromaticContact CZ-CG 3.11Å; F236-H245 AromaticContact CZ-ND1 3.72Å; L241-H245 VanDerWaalsContact O-CB 3.31Å; L241-H245 WeakPolarHBondContact O-CB 3.41Å; L241-H245 PolarHBondContact O-N 3.23Å; L242-H245 CarbonylContact O-C 3.55Å; L242-H245 PolarHBondContact O-N 3.09Å; K243-H245 VanDerWaalsContact C-N 3.31Å; K243-H245 PolarHBondContact O-N 2.95Å; H245-L247 PolarHBondContact O-N 3.1Å; H245-L248 WeakPolarHBondContact O-CB 3.31Å; H245-L248 PolarHBondContact O-N 3.4Å; H245-H249 AromaticContact CD2-NE2 4Å; H245-H249 AromaticContact CE1-NE2 3.37Å; H245-H249 PolarHBondContact CE1-NE2 3.43Å; H245-H249 AromaticContact NE2-CD2 3.72Å; H245-H249 AromaticContact NE2-NE2 3.06Å; H245-H249 PolarHBondContact NE2-NE2 2.97Å
246	A	72.7	Confident	71.9	Confident	26 Å²	26	63.7 Å²	63.7	22%	0.215	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-32	-179.5	0	0	0	0	0	111.7	L242 K243 N244 L248 H249 T250	L242-A246 WeakPolarHBondContact O-CB 3.43Å; L242-A246 PolarHBondContact O-N 3.39Å; K243-A246 PolarHBondContact O-N 3.37Å; N244-A246 VanDerWaalsContact C-N 3.35Å; N244-A246 PolarHBondContact O-N 3.23Å; A246-L248 PolarHBondContact O-N 3.11Å; A246-H249 WeakPolarHBondContact O-CB 3.41Å; A246-H249 PolarHBondContact O-N 3.36Å; A246-T250 PolarHBondContact O-N 3.39Å; A246-T250 PolarHBondContact O-OG1 3.22Å
247	L	73.5	Confident	71.9	Confident	61 Å²	61	62.1 Å²	62.1	32%	0.319	34%	0.343	S	S	.	.	H	α-helix	trans	-57.8	-30.7	172.5	-64.2	172.5	0	0	0	112	K243 N244 H245 H249 T250 D251 L254 A265	K243-L247 PolarHBondContact O-N 2.85Å; N244-L247 WeakPolarHBondContact O-CB 3.35Å; N244-L247 PolarHBondContact O-N 3.48Å; H245-L247 PolarHBondContact O-N 3.1Å; L247-H249 PolarHBondContact O-N 3.41Å; L247-T250 PolarHBondContact O-N 3.11Å; L247-D251 HydrophobicContact CB-CB 4.34Å; L247-D251 HydrophobicContact CD2-CB 4.38Å; L247-D251 VanDerWaalsContact O-CB 3.3Å; L247-D251 WeakPolarHBondContact O-CB 3.3Å; L247-D251 PolarHBondContact O-N 3.48Å; L247-L254 HydrophobicContact CB-CD2 3.99Å; L247-A265 HydrophobicContact CB-CB 3.87Å; L247-A265 HydrophobicContact CD1-CB 4.34Å
248	L	70.1	Confident	71.7	Confident	70 Å²	70	64.9 Å²	64.9	37%	0.366	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-20.7	175	-58.8	175.2	0	0	0	113.6	H245 A246 L254 A265	H245-L248 WeakPolarHBondContact O-CB 3.31Å; H245-L248 PolarHBondContact O-N 3.4Å; A246-L248 PolarHBondContact O-N 3.11Å; L248-L254 HydrophobicContact CD2-CD1 3.91Å; L248-L254 HydrophobicContact CD2-CD2 4.07Å; L248-A265 HydrophobicContact CD2-CB 3.78Å; L248-A265 HydrophobicContact CG-CB 4.01Å
249	H	70.4	Confident	71.5	Confident	79 Å²	79	66 Å²	66	37%	0.366	37%	0.368	S	S	.	.	H	α-helix	trans	-95.4	-28.4	177.9	-64.7	-76.6	0	0	0	112.8	F231 H245 A246 L247	F231-H249 HydrophobicContact CB-CB 4.07Å; F231-H249 VanDerWaalsContact CB-CG 3.47Å; F231-H249 WeakPolarHBondContact CB-ND1 3.32Å; F231-H249 HydrophobicContact CD1-CB 4.43Å; F231-H249 HydrophobicContact CD2-CB 3.7Å; F231-H249 AromaticContact CD2-CD2 3.94Å; F231-H249 AromaticContact CD2-CG 3.82Å; F231-H249 HydrophobicContact CE2-CB 4.23Å; F231-H249 HydrophobicContact CG-CB 3.82Å; F231-H249 AromaticContact CG-CG 3.77Å; H245-H249 AromaticContact CD2-NE2 4Å; H245-H249 AromaticContact CE1-NE2 3.37Å; H245-H249 PolarHBondContact CE1-NE2 3.43Å; H245-H249 AromaticContact NE2-CD2 3.72Å; H245-H249 AromaticContact NE2-NE2 3.06Å; H245-H249 PolarHBondContact NE2-NE2 2.97Å; A246-H249 WeakPolarHBondContact O-CB 3.41Å; A246-H249 PolarHBondContact O-N 3.36Å; L247-H249 PolarHBondContact O-N 3.41Å
250	T	65.5	Low	71.2	Confident	87 Å²	87	65.7 Å²	65.7	53%	0.534	37%	0.365	S	S	.	.	H	α-helix	trans	-112.7	-20.3	-166.3	57.8	0	0	0	0	114.3	F231 A246 L247	F231-T250 HydrophobicContact CE2-CG2 3.94Å; F231-T250 HydrophobicContact CZ-CG2 3.93Å; A246-T250 PolarHBondContact O-N 3.39Å; A246-T250 PolarHBondContact O-OG1 3.22Å; L247-T250 PolarHBondContact O-N 3.11Å
251	D	60.9	Low	71.1	Confident	51 Å²	51	67.2 Å²	67.2	27%	0.273	38%	0.38	S	S	.	.			trans	-112.9	116.7	-168.4	-162.1	-14.8	0	0	0	111.5	L247 S253 L254	L247-D251 HydrophobicContact CB-CB 4.34Å; L247-D251 HydrophobicContact CD2-CB 4.38Å; L247-D251 VanDerWaalsContact O-CB 3.3Å; L247-D251 WeakPolarHBondContact O-CB 3.3Å; L247-D251 PolarHBondContact O-N 3.48Å; D251-S253 VanDerWaalsContact C-N 3.25Å; D251-S253 PolarHBondContact O-N 2.96Å; D251-S253 WeakPolarHBondContact OD1-CA 3.36Å; D251-S253 VanDerWaalsContact OD1-CB 3.26Å; D251-S253 WeakPolarHBondContact OD1-CB 3.35Å; D251-S253 PolarHBondContact OD1-N 3.43Å; D251-S253 PolarHBondContact OD1-OG 2.87Å; D251-S253 PolarHBondContact OD2-OG 3.43Å; D251-S253 VanDerWaalsContact OD2-OG 3.1Å; D251-L254 HydrophobicContact CB-CD2 4.32Å; D251-L254 HydrophobicContact CB-CG 4.24Å; D251-L254 WeakPolarHBondContact O-CD1 3.36Å; D251-L254 WeakPolarHBondContact O-CG 3.27Å
252	P	54.6	Low	70.9	Confident	133 Å²	133	73.1 Å²	73.1	86%	0.864	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.4	170.3	-15.5	29.5	0	0	0	113.2	L254	P252-L254 PolarHBondContact O-N 3.24Å
253	S	60.5	Low	70.4	Confident	86 Å²	86	74.9 Å²	74.9	60%	0.601	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	17.5	-174.5	74.8	0	0	0	0	114.7	D251	D251-S253 VanDerWaalsContact C-N 3.25Å; D251-S253 PolarHBondContact O-N 2.96Å; D251-S253 WeakPolarHBondContact OD1-CA 3.36Å; D251-S253 VanDerWaalsContact OD1-CB 3.26Å; D251-S253 WeakPolarHBondContact OD1-CB 3.35Å; D251-S253 PolarHBondContact OD1-N 3.43Å; D251-S253 PolarHBondContact OD1-OG 2.87Å; D251-S253 PolarHBondContact OD2-OG 3.43Å; D251-S253 VanDerWaalsContact OD2-OG 3.1Å
254	L	66.7	Low	69.8	Low	30 Å²	30	69.8 Å²	69.8	16%	0.157	39%	0.39	C	S	.	.			trans	-64.7	153.9	-179.9	-63.1	161.5	0	0	0	111.9	L247 L248 D251 P252 T256 V263 A265	L247-L254 HydrophobicContact CB-CD2 3.99Å; L248-L254 HydrophobicContact CD2-CD1 3.91Å; L248-L254 HydrophobicContact CD2-CD2 4.07Å; D251-L254 HydrophobicContact CB-CD2 4.32Å; D251-L254 HydrophobicContact CB-CG 4.24Å; D251-L254 WeakPolarHBondContact O-CD1 3.36Å; D251-L254 WeakPolarHBondContact O-CG 3.27Å; P252-L254 PolarHBondContact O-N 3.24Å; L254-T256 PolarHBondContact O-N 3.11Å; L254-V263 HydrophobicContact CB-CG1 3.21Å; L254-V263 HydrophobicContact CD1-CG1 3.62Å; L254-V263 HydrophobicContact CG-CG1 4.04Å; L254-A265 VanDerWaalsContact CD2-CA 3.44Å; L254-A265 HydrophobicContact CD2-CB 3.66Å
255	L	67.2	Low	69.7	Low	71 Å²	71	68.6 Å²	68.6	37%	0.372	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	114.4	-173.2	-54.6	172.4	0	0	0	109.9	Y264 R267 L270	L255-Y264 PolarHBondContact N-O 3.35Å; L255-Y264 PolarHBondContact O-N 3.34Å; L255-R267 HydrophobicContact CD1-CB 3.84Å; L255-L270 HydrophobicContact CB-CD2 3.57Å; L255-L270 HydrophobicContact CD1-CD2 4.38Å
256	T	67.9	Low	69.1	Low	79 Å²	79	69 Å²	69	49%	0.485	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.9	178.4	-54	0	0	0	0	110.7	L254 C258 R262	L254-T256 PolarHBondContact O-N 3.11Å; T256-C258 PolarHBondContact O-N 3.26Å; T256-R262 CarbonylContact C-O 3.56Å; T256-R262 WeakPolarHBondContact CA-O 3.25Å
257	C	75	Confident	68.8	Low	2 Å²	2	74.7 Å²	74.7	1%	0.014	41%	0.408	C	S	.	.			trans	-69.6	125.1	169	179.8	0	0	0	0	110.4	Y259 S261 R262 Y264 L270 H273	C257-Y259 PolarHBondContact O-N 3.31Å; C257-Y259 PolarHBondContact SG-N 3.32Å; C257-S261 WeakPolarHBondContact O-CA 3.49Å; C257-S261 PolarHBondContact O-N 3.4Å; C257-R262 HydrophobicContact CB-CB 4.41Å; C257-R262 PolarHBondContact N-O 3.48Å; C257-Y264 HydrophobicContact CB-CE2 4.22Å; C257-L270 HydrophobicContact CB-CD1 3.84Å; C257-H273 WeakPolarHBondContact CB-NE2 3.32Å; C257-H273 PolarHBondContact SG-CD2 3.43Å; C257-H273 PolarHBondContact SG-NE2 2.84Å
258	C	73.8	Confident	68.6	Low	96 Å²	96	75.6 Å²	75.6	65%	0.649	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-17.6	176.6	54.3	0	0	0	0	114	T256	T256-C258 PolarHBondContact O-N 3.26Å
259	Y	72	Confident	68.6	Low	122 Å²	122	77.2 Å²	77.2	48%	0.478	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-23.8	-178.4	-61.2	-73.9	0	0	0	114.7	C257 I274 H277	C257-Y259 PolarHBondContact O-N 3.31Å; C257-Y259 PolarHBondContact SG-N 3.32Å; Y259-I274 HydrophobicContact CE2-CG2 3.93Å; Y259-H277 WeakPolarHBondContact CB-ND1 3.1Å; Y259-H277 HydrophobicContact CD2-CB 3.88Å; Y259-H277 AromaticContact CD2-CG 3.91Å; Y259-H277 HydrophobicContact CE2-CB 4.42Å; Y259-H277 HydrophobicContact CG-CB 4.08Å; Y259-H277 AromaticContact CG-CG 3.88Å
260	C	77.7	Confident	68.7	Low	47 Å²	47	74 Å²	74	32%	0.318	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	18.4	-175.7	77.2	0	0	0	0	115	R262 H273 H277	C260-R262 PolarHBondContact O-N 2.92Å; C260-R262 VanDerWaalsContact SG-CD 3.57Å; C260-R262 VanDerWaalsContact SG-CG 3.51Å; C260-H273 PolarHBondContact SG-CE1 2.8Å; C260-H273 PolarHBondContact SG-NE2 3.1Å; C260-H277 PolarHBondContact SG-NE2 2.84Å; C260-H277 VanDerWaalsContact SG-NE2 3.39Å
261	S	75.7	Confident	68.9	Low	98 Å²	98	73.3 Å²	73.3	69%	0.685	40%	0.399	S	S	*	.			trans	55.8	15.8	175.5	-50.5	0	0	0	0	115.6	C257	C257-S261 WeakPolarHBondContact O-CA 3.49Å; C257-S261 PolarHBondContact O-N 3.4Å
262	R	74.8	Confident	69.6	Low	152 Å²	152	74.9 Å²	74.9	57%	0.574	40%	0.404	S	S	*	.			trans	-74.5	136.8	176.4	-77.9	-179.6	-177.2	-169.1	-1.7	110.1	T256 C257 C260 Y264	T256-R262 CarbonylContact C-O 3.56Å; T256-R262 WeakPolarHBondContact CA-O 3.25Å; C257-R262 HydrophobicContact CB-CB 4.41Å; C257-R262 PolarHBondContact N-O 3.48Å; C260-R262 PolarHBondContact O-N 2.92Å; C260-R262 VanDerWaalsContact SG-CD 3.57Å; C260-R262 VanDerWaalsContact SG-CG 3.51Å; R262-Y264 HydrophobicContact CB-CE2 3.59Å; R262-Y264 WeakPolarHBondContact O-CD2 3.11Å; R262-Y264 WeakPolarHBondContact O-CE2 3.4Å
263	V	70.3	Confident	70.6	Confident	72 Å²	72	69.4 Å²	69.4	44%	0.436	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.9	-174	-177.2	0	0	0	0	111.1	L254	L254-V263 HydrophobicContact CB-CG1 3.21Å; L254-V263 HydrophobicContact CD1-CG1 3.62Å; L254-V263 HydrophobicContact CG-CG1 4.04Å
264	Y	66.8	Low	71.1	Confident	40 Å²	40	66.4 Å²	66.4	16%	0.157	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.6	-174.4	-66.4	-93.1	0	0	0	111.9	L255 C257 R262 S266 L270 H273	L255-Y264 PolarHBondContact N-O 3.35Å; L255-Y264 PolarHBondContact O-N 3.34Å; C257-Y264 HydrophobicContact CB-CE2 4.22Å; R262-Y264 HydrophobicContact CB-CE2 3.59Å; R262-Y264 WeakPolarHBondContact O-CD2 3.11Å; R262-Y264 WeakPolarHBondContact O-CE2 3.4Å; Y264-S266 VanDerWaalsContact C-N 3.32Å; Y264-S266 PolarHBondContact O-N 3.33Å; Y264-L270 HydrophobicContact CD2-CB 4.17Å; Y264-L270 HydrophobicContact CD2-CD1 3.66Å; Y264-L270 HydrophobicContact CD2-CG 4.49Å; Y264-L270 HydrophobicContact CE2-CD1 4.03Å; Y264-L270 HydrophobicContact CG-CB 4.01Å; Y264-L270 HydrophobicContact CG-CD1 4.37Å; Y264-H273 HydrophobicContact CE1-CB 3.94Å; Y264-H273 HydrophobicContact CE2-CB 4.21Å; Y264-H273 AromaticContact CE2-CD2 3.32Å; Y264-H273 WeakPolarHBondContact CE2-CD2 3.45Å; Y264-H273 AromaticContact CE2-CG 3.86Å; Y264-H273 AromaticContact CE2-NE2 3.9Å; Y264-H273 AromaticContact CZ-CD2 3.41Å; Y264-H273 VanDerWaalsContact CZ-CD2 3.41Å; Y264-H273 AromaticContact CZ-CG 3.43Å; Y264-H273 VanDerWaalsContact CZ-CG 3.43Å; Y264-H273 WeakPolarHBondContact OH-CB 3.48Å; Y264-H273 PolarHBondContact OH-CD2 2.97Å; Y264-H273 PolarHBondContact OH-CE1 3.09Å; Y264-H273 PolarHBondContact OH-ND1 2.77Å; Y264-H273 PolarHBondContact OH-NE2 3.1Å
265	A	68.3	Low	71.5	Confident	24 Å²	24	70.1 Å²	70.1	20%	0.198	36%	0.361	C	S	.	.	S	Bend	trans	-85.9	2	176.5	0	0	0	0	0	115.3	N244 L247 L248 L254	N244-A265 HydrophobicContact CB-CB 4.48Å; N244-A265 WeakPolarHBondContact O-CB 3.47Å; L247-A265 HydrophobicContact CB-CB 3.87Å; L247-A265 HydrophobicContact CD1-CB 4.34Å; L248-A265 HydrophobicContact CD2-CB 3.78Å; L248-A265 HydrophobicContact CG-CB 4.01Å; L254-A265 VanDerWaalsContact CD2-CA 3.44Å; L254-A265 HydrophobicContact CD2-CB 3.66Å
266	S	66.2	Low	72.1	Confident	24 Å²	24	72.5 Å²	72.5	17%	0.168	37%	0.368	C	S	.	.	S	Bend	trans	-150.2	134.5	179.8	154.2	0	0	0	0	109.8	Y264 S268 Y269 L270	Y264-S266 VanDerWaalsContact C-N 3.32Å; Y264-S266 PolarHBondContact O-N 3.33Å; S266-S268 VanDerWaalsContact C-N 3.27Å; S266-S268 PolarHBondContact O-N 3.08Å; S266-S268 PolarHBondContact OG-N 3.33Å; S266-Y269 PolarHBondContact O-N 3.18Å; S266-Y269 VanDerWaalsContact O-N 3.14Å; S266-L270 PolarHBondContact O-N 3.43Å; S266-L270 VanDerWaalsContact O-N 3.14Å
267	R	68	Low	72.5	Confident	145 Å²	145	70.1 Å²	70.1	55%	0.547	35%	0.352	S	S	.	.	H	α-helix	trans	-55.4	-41.3	176.8	-177.6	178.7	170.3	86.7	1.5	111.9	L255 Y269 L270 L271	L255-R267 HydrophobicContact CD1-CB 3.84Å; R267-Y269 VanDerWaalsContact C-N 3.3Å; R267-Y269 PolarHBondContact O-N 3.48Å; R267-L270 PolarHBondContact O-N 3.24Å; R267-L271 HydrophobicContact CG-CD1 3.95Å; R267-L271 HydrophobicContact CG-CG 4.22Å; R267-L271 WeakPolarHBondContact O-CG 3.49Å; R267-L271 PolarHBondContact O-N 2.77Å
268	S	68.3	Low	72.2	Confident	79 Å²	79	74.5 Å²	74.5	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-61.9	-36.7	180	-51.6	0	0	0	0	112.7	S266 Q272	S266-S268 VanDerWaalsContact C-N 3.27Å; S266-S268 PolarHBondContact O-N 3.08Å; S266-S268 PolarHBondContact OG-N 3.33Å; S268-Q272 WeakPolarHBondContact O-CG 3.32Å; S268-Q272 PolarHBondContact O-N 3.35Å
269	Y	69.6	Low	71.9	Confident	105 Å²	105	75.4 Å²	75.4	41%	0.412	37%	0.366	S	S	.	.	H	α-helix	trans	-75.5	-34.6	177.4	-73.2	-57.4	0	0	0	112.4	L241 S266 R267 H273	L241-Y269 WeakPolarHBondContact CD2-OH 3.46Å; S266-Y269 PolarHBondContact O-N 3.18Å; S266-Y269 VanDerWaalsContact O-N 3.14Å; R267-Y269 VanDerWaalsContact C-N 3.3Å; R267-Y269 PolarHBondContact O-N 3.48Å; Y269-H273 WeakPolarHBondContact O-CB 3.43Å; Y269-H273 PolarHBondContact O-N 3Å; Y269-H273 VanDerWaalsContact O-N 3.08Å
270	L	72.5	Confident	71.5	Confident	11 Å²	11	76.7 Å²	76.7	6%	0.058	38%	0.375	C	S	.	.	H	α-helix	trans	-64.6	-46	173.2	174.8	59.8	0	0	0	111.1	L255 C257 Y264 S266 R267 H273 I274	L255-L270 HydrophobicContact CB-CD2 3.57Å; L255-L270 HydrophobicContact CD1-CD2 4.38Å; C257-L270 HydrophobicContact CB-CD1 3.84Å; Y264-L270 HydrophobicContact CD2-CB 4.17Å; Y264-L270 HydrophobicContact CD2-CD1 3.66Å; Y264-L270 HydrophobicContact CD2-CG 4.49Å; Y264-L270 HydrophobicContact CE2-CD1 4.03Å; Y264-L270 HydrophobicContact CG-CB 4.01Å; Y264-L270 HydrophobicContact CG-CD1 4.37Å; S266-L270 PolarHBondContact O-N 3.43Å; S266-L270 VanDerWaalsContact O-N 3.14Å; R267-L270 PolarHBondContact O-N 3.24Å; L270-H273 CarbonylContact O-C 3.36Å; L270-H273 WeakPolarHBondContact O-CA 3.4Å; L270-H273 WeakPolarHBondContact O-CB 3.4Å; L270-H273 PolarHBondContact O-N 3.41Å; L270-I274 HydrophobicContact CD1-CD1 3.81Å; L270-I274 HydrophobicContact CD1-CG1 3.94Å; L270-I274 HydrophobicContact CD2-CD1 4.32Å; L270-I274 HydrophobicContact CG-CD1 3.75Å; L270-I274 HydrophobicContact CG-CG1 4.31Å; L270-I274 WeakPolarHBondContact O-CG1 3.05Å; L270-I274 PolarHBondContact O-N 3.41Å
271	L	71	Confident	70.5	Confident	72 Å²	72	79 Å²	79	38%	0.377	38%	0.382	S	S	.	.	H	α-helix	trans	-60.7	-48	179	-69.4	174.7	0	0	0	111.5	R267 H273 I274 E275	R267-L271 HydrophobicContact CG-CD1 3.95Å; R267-L271 HydrophobicContact CG-CG 4.22Å; R267-L271 WeakPolarHBondContact O-CG 3.49Å; R267-L271 PolarHBondContact O-N 2.77Å; L271-H273 PolarHBondContact O-N 3.04Å; L271-I274 PolarHBondContact O-N 3.17Å; L271-I274 VanDerWaalsContact O-N 3.12Å; L271-E275 WeakPolarHBondContact O-CG 3.4Å; L271-E275 PolarHBondContact O-N 2.81Å
272	Q	74.2	Confident	69.2	Low	84 Å²	84	79.7 Å²	79.7	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-59.6	-28.2	173.5	-76.4	-177.5	-8.3	0	0	113.6	S268	S268-Q272 WeakPolarHBondContact O-CG 3.32Å; S268-Q272 PolarHBondContact O-N 3.35Å
273	H	76.1	Confident	68	Low	18 Å²	18	77.8 Å²	77.8	8%	0.083	37%	0.374	C	S	.	.	H	α-helix	trans	-78.5	-40.1	175.5	166	61.1	0	0	0	112.4	C257 C260 Y264 Y269 L270 L271 E275 K276 H277	C257-H273 WeakPolarHBondContact CB-NE2 3.32Å; C257-H273 PolarHBondContact SG-CD2 3.43Å; C257-H273 PolarHBondContact SG-NE2 2.84Å; C260-H273 PolarHBondContact SG-CE1 2.8Å; C260-H273 PolarHBondContact SG-NE2 3.1Å; Y264-H273 HydrophobicContact CE1-CB 3.94Å; Y264-H273 HydrophobicContact CE2-CB 4.21Å; Y264-H273 AromaticContact CE2-CD2 3.32Å; Y264-H273 WeakPolarHBondContact CE2-CD2 3.45Å; Y264-H273 AromaticContact CE2-CG 3.86Å; Y264-H273 AromaticContact CE2-NE2 3.9Å; Y264-H273 AromaticContact CZ-CD2 3.41Å; Y264-H273 VanDerWaalsContact CZ-CD2 3.41Å; Y264-H273 AromaticContact CZ-CG 3.43Å; Y264-H273 VanDerWaalsContact CZ-CG 3.43Å; Y264-H273 WeakPolarHBondContact OH-CB 3.48Å; Y264-H273 PolarHBondContact OH-CD2 2.97Å; Y264-H273 PolarHBondContact OH-CE1 3.09Å; Y264-H273 PolarHBondContact OH-ND1 2.77Å; Y264-H273 PolarHBondContact OH-NE2 3.1Å; Y269-H273 WeakPolarHBondContact O-CB 3.43Å; Y269-H273 PolarHBondContact O-N 3Å; Y269-H273 VanDerWaalsContact O-N 3.08Å; L270-H273 CarbonylContact O-C 3.36Å; L270-H273 WeakPolarHBondContact O-CA 3.4Å; L270-H273 WeakPolarHBondContact O-CB 3.4Å; L270-H273 PolarHBondContact O-N 3.41Å; L271-H273 PolarHBondContact O-N 3.04Å; H273-E275 VanDerWaalsContact C-N 3.31Å; H273-K276 WeakPolarHBondContact O-CB 3.48Å; H273-K276 PolarHBondContact O-N 3.4Å; H273-K276 VanDerWaalsContact O-N 3.15Å; H273-H277 AromaticContact CE1-CD2 3.52Å; H273-H277 AromaticContact CE1-NE2 3.04Å; H273-H277 PolarHBondContact CE1-NE2 2.99Å; H273-H277 AromaticContact ND1-NE2 3.98Å; H273-H277 AromaticContact NE2-CD2 3.6Å; H273-H277 AromaticContact NE2-NE2 3.19Å; H273-H277 PolarHBondContact NE2-NE2 3.08Å; H273-H277 VanDerWaalsContact NE2-NE2 3.19Å; H273-H277 PolarHBondContact O-CD2 2.84Å; H273-H277 PolarHBondContact O-N 3.33Å
274	I	71	Confident	66.9	Low	23 Å²	23	77 Å²	77	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-40.9	174.4	-70.5	169.2	0	0	0	110.1	Y259 L270 L271 K276 H277 E278	Y259-I274 HydrophobicContact CE2-CG2 3.93Å; L270-I274 HydrophobicContact CD1-CD1 3.81Å; L270-I274 HydrophobicContact CD1-CG1 3.94Å; L270-I274 HydrophobicContact CD2-CD1 4.32Å; L270-I274 HydrophobicContact CG-CD1 3.75Å; L270-I274 HydrophobicContact CG-CG1 4.31Å; L270-I274 WeakPolarHBondContact O-CG1 3.05Å; L270-I274 PolarHBondContact O-N 3.41Å; L271-I274 PolarHBondContact O-N 3.17Å; L271-I274 VanDerWaalsContact O-N 3.12Å; I274-K276 PolarHBondContact O-N 3.36Å; I274-H277 WeakPolarHBondContact O-CA 3.23Å; I274-H277 VanDerWaalsContact O-CB 3.28Å; I274-H277 WeakPolarHBondContact O-CB 3.44Å; I274-H277 PolarHBondContact O-N 2.79Å; I274-E278 PolarHBondContact O-N 3.15Å
275	E	75.9	Confident	65.6	Low	108 Å²	108	83.4 Å²	83.4	51%	0.505	40%	0.396	S	S	.	.	H	α-helix	trans	-53.5	-39.9	172.5	-75	169.5	-174.7	0	0	111.6	L271 H273 H277 E278 E279	L271-E275 WeakPolarHBondContact O-CG 3.4Å; L271-E275 PolarHBondContact O-N 2.81Å; H273-E275 VanDerWaalsContact C-N 3.31Å; E275-H277 VanDerWaalsContact C-N 3.31Å; E275-H277 PolarHBondContact O-N 2.85Å; E275-E278 WeakPolarHBondContact O-CB 3.15Å; E275-E278 PolarHBondContact O-N 3.01Å; E275-E278 VanDerWaalsContact O-N 3.16Å; E275-E279 WeakPolarHBondContact O-CG 3.21Å; E275-E279 PolarHBondContact O-N 3.19Å
276	K	78.4	Confident	64.3	Low	121 Å²	121	87.6 Å²	87.6	53%	0.526	41%	0.414	S	S	.	.	H	α-helix	trans	-69.5	-24.9	175.2	-67.1	-178.8	179.7	-172.4	0	113.9	H273 I274 K280	H273-K276 WeakPolarHBondContact O-CB 3.48Å; H273-K276 PolarHBondContact O-N 3.4Å; H273-K276 VanDerWaalsContact O-N 3.15Å; I274-K276 PolarHBondContact O-N 3.36Å; K276-K280 WeakPolarHBondContact O-CB 3.47Å; K276-K280 VanDerWaalsContact O-CG 3.29Å; K276-K280 WeakPolarHBondContact O-CG 3.42Å; K276-K280 PolarHBondContact O-N 3.37Å
277	H	76.6	Confident	63.3	Low	30 Å²	30	91.1 Å²	91.1	14%	0.139	44%	0.438	C	S	.	.	H	α-helix	trans	-70.3	-44.8	168.8	-79.8	-75.5	0	0	0	110.2	Y259 C260 H273 I274 E275 K280 M281	Y259-H277 WeakPolarHBondContact CB-ND1 3.1Å; Y259-H277 HydrophobicContact CD2-CB 3.88Å; Y259-H277 AromaticContact CD2-CG 3.91Å; Y259-H277 HydrophobicContact CE2-CB 4.42Å; Y259-H277 HydrophobicContact CG-CB 4.08Å; Y259-H277 AromaticContact CG-CG 3.88Å; C260-H277 PolarHBondContact SG-NE2 2.84Å; C260-H277 VanDerWaalsContact SG-NE2 3.39Å; H273-H277 AromaticContact CE1-CD2 3.52Å; H273-H277 AromaticContact CE1-NE2 3.04Å; H273-H277 PolarHBondContact CE1-NE2 2.99Å; H273-H277 AromaticContact ND1-NE2 3.98Å; H273-H277 AromaticContact NE2-CD2 3.6Å; H273-H277 AromaticContact NE2-NE2 3.19Å; H273-H277 PolarHBondContact NE2-NE2 3.08Å; H273-H277 VanDerWaalsContact NE2-NE2 3.19Å; H273-H277 PolarHBondContact O-CD2 2.84Å; H273-H277 PolarHBondContact O-N 3.33Å; I274-H277 WeakPolarHBondContact O-CA 3.23Å; I274-H277 VanDerWaalsContact O-CB 3.28Å; I274-H277 WeakPolarHBondContact O-CB 3.44Å; I274-H277 PolarHBondContact O-N 2.79Å; E275-H277 VanDerWaalsContact C-N 3.31Å; E275-H277 PolarHBondContact O-N 2.85Å; H277-K280 PolarHBondContact O-N 3.4Å; H277-M281 WeakPolarHBondContact O-CB 3.28Å; H277-M281 WeakPolarHBondContact O-CG 3.39Å; H277-M281 PolarHBondContact O-N 3.46Å
278	E	69.9	Low	62.2	Low	93 Å²	93	88.5 Å²	88.5	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-43.3	177.6	-66.3	-178	173.4	0	0	111.7	I274 E275 K280 M281 Q282	I274-E278 PolarHBondContact O-N 3.15Å; E275-E278 WeakPolarHBondContact O-CB 3.15Å; E275-E278 PolarHBondContact O-N 3.01Å; E275-E278 VanDerWaalsContact O-N 3.16Å; E278-K280 VanDerWaalsContact C-N 3.35Å; E278-K280 PolarHBondContact O-N 3.41Å; E278-M281 CarbonylContact O-C 3.58Å; E278-M281 PolarHBondContact O-N 3.23Å; E278-Q282 WeakPolarHBondContact O-CB 3.3Å; E278-Q282 VanDerWaalsContact O-CG 3.28Å; E278-Q282 WeakPolarHBondContact O-CG 3.19Å; E278-Q282 PolarHBondContact O-N 2.96Å
279	E	67.5	Low	60.7	Low	115 Å²	115	90.2 Å²	90.2	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-57.6	-46.8	173.1	-74.3	176.9	175.2	0	0	111.3	E275 M281 Q282 I283	E275-E279 WeakPolarHBondContact O-CG 3.21Å; E275-E279 PolarHBondContact O-N 3.19Å; E279-M281 VanDerWaalsContact C-N 3.34Å; E279-M281 PolarHBondContact O-N 3.46Å; E279-Q282 PolarHBondContact O-N 3.34Å; E279-I283 WeakPolarHBondContact O-CB 3.32Å; E279-I283 WeakPolarHBondContact O-CD1 3.39Å; E279-I283 WeakPolarHBondContact O-CG1 3.39Å; E279-I283 PolarHBondContact O-N 3.13Å
280	K	63.2	Low	59	Low	149 Å²	149	88.3 Å²	88.3	65%	0.648	46%	0.457	S	S	*	.	H	α-helix	trans	-65.9	-35.1	177.7	-74.5	179.4	179.3	-171.7	0	112.9	K276 H277 E278 S284	K276-K280 WeakPolarHBondContact O-CB 3.47Å; K276-K280 VanDerWaalsContact O-CG 3.29Å; K276-K280 WeakPolarHBondContact O-CG 3.42Å; K276-K280 PolarHBondContact O-N 3.37Å; H277-K280 PolarHBondContact O-N 3.4Å; E278-K280 VanDerWaalsContact C-N 3.35Å; E278-K280 PolarHBondContact O-N 3.41Å; K280-S284 PolarHBondContact O-N 3.34Å; K280-S284 PolarHBondContact O-OG 3.47Å
281	M	56.9	Low	57	Low	96 Å²	96	94.8 Å²	94.8	47%	0.473	50%	0.497	S	S	.	.	H	α-helix	trans	-75.9	-30.9	177.3	-69	-68.2	175.8	0	0	112.3	H277 E278 E279 S284 R285	H277-M281 WeakPolarHBondContact O-CB 3.28Å; H277-M281 WeakPolarHBondContact O-CG 3.39Å; H277-M281 PolarHBondContact O-N 3.46Å; E278-M281 CarbonylContact O-C 3.58Å; E278-M281 PolarHBondContact O-N 3.23Å; E279-M281 VanDerWaalsContact C-N 3.34Å; E279-M281 PolarHBondContact O-N 3.46Å; M281-S284 WeakPolarHBondContact CA-OG 3.37Å; M281-S284 PolarHBondContact O-OG 3.48Å; M281-R285 VanDerWaalsContact O-CG 3.32Å; M281-R285 WeakPolarHBondContact O-CG 3.27Å; M281-R285 PolarHBondContact O-N 2.99Å; M281-R285 VanDerWaalsContact O-N 3.13Å
282	Q	48.5	Very low	55.1	Low	113 Å²	113	97 Å²	97	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-72.7	-42.3	171.5	-74	179.6	15.9	0	0	110.5	E278 E279 S284 R285 I286	E278-Q282 WeakPolarHBondContact O-CB 3.3Å; E278-Q282 VanDerWaalsContact O-CG 3.28Å; E278-Q282 WeakPolarHBondContact O-CG 3.19Å; E278-Q282 PolarHBondContact O-N 2.96Å; E279-Q282 PolarHBondContact O-N 3.34Å; Q282-S284 VanDerWaalsContact C-N 3.3Å; Q282-S284 PolarHBondContact O-N 3.35Å; Q282-R285 PolarHBondContact O-N 3.3Å; Q282-I286 WeakPolarHBondContact O-CB 3.49Å; Q282-I286 WeakPolarHBondContact O-CD1 3.27Å; Q282-I286 WeakPolarHBondContact O-CG1 3.36Å; Q282-I286 PolarHBondContact O-N 3.26Å
283	I	49.7	Very low	53.1	Low	112 Å²	112	97.9 Å²	97.9	57%	0.574	53%	0.529	S	S	*	.	H	α-helix	trans	-60.3	-39.9	174.4	-68.6	162.9	0	0	0	110.9	E279 S287	E279-I283 WeakPolarHBondContact O-CB 3.32Å; E279-I283 WeakPolarHBondContact O-CD1 3.39Å; E279-I283 WeakPolarHBondContact O-CG1 3.39Å; E279-I283 PolarHBondContact O-N 3.13Å; I283-S287 WeakPolarHBondContact O-CB 3.49Å; I283-S287 PolarHBondContact O-N 3.37Å; I283-S287 PolarHBondContact O-OG 2.9Å
284	S	46.4	Very low	50.9	Low	56 Å²	56	105.2 Å²	105.2	39%	0.392	57%	0.567	S	S	.	*	H	α-helix	trans	-72.5	-27.7	177.2	65.8	0	0	0	0	114.1	K280 M281 Q282 S287 S288	K280-S284 PolarHBondContact O-N 3.34Å; K280-S284 PolarHBondContact O-OG 3.47Å; M281-S284 WeakPolarHBondContact CA-OG 3.37Å; M281-S284 PolarHBondContact O-OG 3.48Å; Q282-S284 VanDerWaalsContact C-N 3.3Å; Q282-S284 PolarHBondContact O-N 3.35Å; S284-S287 WeakPolarHBondContact CA-OG 3.38Å; S284-S287 PolarHBondContact O-OG 3.02Å; S284-S288 PolarHBondContact O-OG 3.45Å
285	R	40	Very low	49	Very low	174 Å²	174	107.9 Å²	107.9	66%	0.657	59%	0.588	S	S	*	*	H	α-helix	trans	-76.7	-38.8	171.8	-75.7	178.3	-172.8	174	3	112.4	M281 Q282 S288 L289	M281-R285 VanDerWaalsContact O-CG 3.32Å; M281-R285 WeakPolarHBondContact O-CG 3.27Å; M281-R285 PolarHBondContact O-N 2.99Å; M281-R285 VanDerWaalsContact O-N 3.13Å; Q282-R285 PolarHBondContact O-N 3.3Å; R285-S288 WeakPolarHBondContact CA-OG 3.47Å; R285-S288 PolarHBondContact O-N 3.4Å; R285-S288 PolarHBondContact O-OG 3.12Å; R285-S288 VanDerWaalsContact O-OG 3.04Å; R285-L289 WeakPolarHBondContact O-CB 3.38Å; R285-L289 PolarHBondContact O-N 2.7Å; R285-L289 VanDerWaalsContact O-N 3.09Å
286	I	40.2	Very low	46.8	Very low	112 Å²	112	111.5 Å²	111.5	57%	0.574	61%	0.605	S	S	*	*	H	α-helix	trans	-71.9	-32.3	177.7	-64.4	163.4	0	0	0	111	Q282 S288 L289	Q282-I286 WeakPolarHBondContact O-CB 3.49Å; Q282-I286 WeakPolarHBondContact O-CD1 3.27Å; Q282-I286 WeakPolarHBondContact O-CG1 3.36Å; Q282-I286 PolarHBondContact O-N 3.26Å; I286-S288 VanDerWaalsContact C-N 3.28Å; I286-S288 PolarHBondContact O-N 2.83Å; I286-L289 VanDerWaalsContact O-O 3.05Å
287	S	44.7	Very low	44.8	Very low	97 Å²	97	113.1 Å²	113.1	68%	0.678	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-16.5	175.2	61.8	0	0	0	0	114	I283 S284	I283-S287 WeakPolarHBondContact O-CB 3.49Å; I283-S287 PolarHBondContact O-N 3.37Å; I283-S287 PolarHBondContact O-OG 2.9Å; S284-S287 WeakPolarHBondContact CA-OG 3.38Å; S284-S287 PolarHBondContact O-OG 3.02Å
288	S	46.4	Very low	42.5	Very low	90 Å²	90	114.5 Å²	114.5	63%	0.629	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-17	176.2	46.6	0	0	0	0	113.8	S284 R285 I286	S284-S288 PolarHBondContact O-OG 3.45Å; R285-S288 WeakPolarHBondContact CA-OG 3.47Å; R285-S288 PolarHBondContact O-N 3.4Å; R285-S288 PolarHBondContact O-OG 3.12Å; R285-S288 VanDerWaalsContact O-OG 3.04Å; I286-S288 VanDerWaalsContact C-N 3.28Å; I286-S288 PolarHBondContact O-N 2.83Å
289	L	36.1	Very low	40.6	Very low	116 Å²	116	116.8 Å²	116.8	61%	0.607	67%	0.667	S	S	*	*	S	Bend	trans	-111.3	101.6	176.6	-71.5	157.1	0	0	0	109.1	R285 I286 T291	R285-L289 WeakPolarHBondContact O-CB 3.38Å; R285-L289 PolarHBondContact O-N 2.7Å; R285-L289 VanDerWaalsContact O-N 3.09Å; I286-L289 VanDerWaalsContact O-O 3.05Å; L289-T291 PolarHBondContact O-N 3.08Å
290	G	33.3	Very low	38.8	Very low	64 Å²	64	116.3 Å²	116.3	66%	0.66	68%	0.677	S	S	*	*			trans	-49.5	134.6	172.5	0	0	0	0	0	111.8	T292	G290-T292 PolarHBondContact O-N 3.11Å; G290-T292 VanDerWaalsContact O-N 3.14Å
291	T	31.2	Very low	37.3	Very low	148 Å²	148	115.5 Å²	115.5	91%	0.908	68%	0.678	S	S	*	*	S	Bend	trans	0.5	92.5	169.1	56.7	0	0	0	0	115.8	L289	L289-T291 PolarHBondContact O-N 3.08Å
292	T	31.6	Very low	35.9	Very low	117 Å²	117	118.7 Å²	118.7	72%	0.718	70%	0.696	S	S	*	*			trans	-135.4	137	162.3	35.7	0	0	0	0	109	G290	G290-T292 PolarHBondContact O-N 3.11Å; G290-T292 VanDerWaalsContact O-N 3.14Å
293	S	31.4	Very low	35	Very low	103 Å²	103	120.5 Å²	120.5	72%	0.72	71%	0.71	S	S	*	*			trans	-59.1	132.6	-168.6	53.7	0	0	0	0	112.7	S295	S293-S295 VanDerWaalsContact C-N 3.29Å; S293-S295 PolarHBondContact O-N 2.88Å
294	I	29.5	Very low	34	Very low	173 Å²	173	121.5 Å²	121.5	89%	0.887	72%	0.716	S	S	*	*	S	Bend	trans	-76.5	82.6	178	-56.7	170	0	0	0	109.2
295	S	31.3	Very low	33.1	Very low	79 Å²	79	126.8 Å²	126.8	55%	0.552	73%	0.732	S	S	*	*			trans	-130.9	130.9	151.1	52.9	0	0	0	0	104.8	S293	S293-S295 VanDerWaalsContact C-N 3.29Å; S293-S295 PolarHBondContact O-N 2.88Å
296	E	30.5	Very low	32.4	Very low	184 Å²	184	129.8 Å²	129.8	86%	0.86	74%	0.743	S	S	*	*			trans	89.4	63.3	175.9	-47.9	167.7	-171.9	0	0	117.2
297	V	35	Very low	31.7	Very low	155 Å²	155	130.1 Å²	130.1	94%	0.939	75%	0.751	S	S	*	*			trans	-143.1	91.4	142.4	-169.6	0	0	0	0	108.8
298	G	29.3	Very low	30.9	Very low	59 Å²	59	132.5 Å²	132.5	61%	0.608	76%	0.756	S	S	*	*			trans	-105.5	154.7	168.4	0	0	0	0	0	111.4
299	T	30	Very low	29.9	Very low	140 Å²	140	134.5 Å²	134.5	86%	0.859	76%	0.764	S	S	*	*			trans	103	134.2	150.3	70.6	0	0	0	0	121.1
300	S	30.6	Very low	29.5	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	77%	0.771	S	S	*	*			trans	72.7	125.5	157.3	76.2	0	0	0	0	116.1
301	I	31.4	Very low	29.2	Very low	133 Å²	133	140 Å²	140	68%	0.682	78%	0.779	S	S	*	*				-155.5	118.8	72	-71.5	143.6	0	0	0	109.7
302	L	27.4	Very low	28.9	Very low	163 Å²	163	141.9 Å²	141.9	85%	0.853	78%	0.778	S	S	*	*			trans	-124.2	55.9	165.8	-82.3	176.8	0	0	0	109.5
303	D	28.7	Very low	28.8	Very low	151 Å²	151	145 Å²	145	81%	0.807	79%	0.786	S	S	*	*			trans	-140.5	2.6	179.8	-85.7	-45.5	0	0	0	117
304	N	28.3	Very low	28.4	Very low	132 Å²	132	147.5 Å²	147.5	71%	0.706	79%	0.792	S	S	*	*			trans	-122.3	73.4	-174.7	-72.4	-32.1	0	0	0	113.7
305	F	27.5	Very low	28.4	Very low	168 Å²	168	148.6 Å²	148.6	74%	0.737	79%	0.79	S	S	*	*			trans	-137.2	68.6	156.9	-79.2	-78.1	0	0	0	110.5
306	R	26.2	Very low	28.1	Very low	236 Å²	236	150.7 Å²	150.7	89%	0.891	80%	0.799	S	S	*	*			trans	-120	118.4	158.1	-99.9	-174.5	175	178.7	-0.2	108.9
307	V	25.9	Very low	27.9	Very low	120 Å²	120	148.2 Å²	148.2	73%	0.727	80%	0.801	S	S	*	*			trans	54.2	112.4	146.3	-157.2	0	0	0	0	117.8
308	N	27.7	Very low	27.4	Very low	146 Å²	146	149.8 Å²	149.8	78%	0.781	80%	0.798	S	S	*	*				-174.1	130.1	116.7	-100.1	-27.7	0	0	0	112.6
309	V	24.4	Very low	27.2	Very low	132 Å²	132	150.3 Å²	150.3	80%	0.8	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-92.9	124	162.1	175.7	0	0	0	0	106.2
310	P	29.3	Very low	27	Very low	116 Å²	116	149 Å²	149	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-102.2	128.6	159.7	-5.9	25.9	0	0	0	110.7
311	E	25.4	Very low	26.7	Very low	180 Å²	180	150.3 Å²	150.3	84%	0.841	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-67.3	157.5	166.2	-69.6	174.1	142.9	0	0	111.2
312	E	25.9	Very low	26.5	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.874	81%	0.809	S	S	*	*			trans	76.3	116	171.7	-56.1	-171.7	156.6	0	0	117.1
313	M	28.8	Very low	26.4	Very low	182 Å²	182	151.2 Å²	151.2	90%	0.897	81%	0.808	S	S	*	*				179.9	112.4	108.1	-87.8	-170.9	104.2	0	0	110.2
314	D	24.1	Very low	26.3	Very low	157 Å²	157	151 Å²	151	84%	0.84	81%	0.807	S	S	*	*			trans	-54.9	130.5	158.3	-76.7	-53.9	0	0	0	110.7
315	K	28.6	Very low	26.1	Very low	195 Å²	195	153.2 Å²	153.2	85%	0.848	82%	0.818	S	S	*	*			trans	173.6	109.9	132.5	-95.2	163.2	-174.2	-179.1	0	111.6
316	V	25.1	Very low	26	Very low	123 Å²	123	150 Å²	150	75%	0.745	82%	0.815	S	S	*	*			trans	24.2	111.7	132.4	-171.4	0	0	0	0	116.4
317	C	27.2	Very low	25.9	Very low	133 Å²	133	146.4 Å²	146.4	90%	0.899	81%	0.814	S	S	*	*			trans	-140.8	100.6	137.6	-85.5	0	0	0	0	109.1
318	E	23	Very low	26	Very low	187 Å²	187	146.6 Å²	146.6	87%	0.874	81%	0.811	S	S	*	*			trans	-60.7	144.9	158.1	-65.8	177.7	147.5	0	0	109.7
319	G	24.8	Very low	25.9	Very low	71 Å²	71	147.2 Å²	147.2	73%	0.732	81%	0.809	S	S	*	*			trans	91.5	84.2	162.4	0	0	0	0	0	115.2
320	S	27.3	Very low	26.1	Very low	112 Å²	112	148 Å²	148	78%	0.783	81%	0.807	S	S	*	*			trans	-154	109.3	145	-18.4	0	0	0	0	108.9	P322	S320-P322 WeakPolarHBondContact O-CD 3.32Å
321	T	23.8	Very low	25.9	Very low	133 Å²	133	146.8 Å²	146.8	82%	0.816	80%	0.797	S	S	*	*			trans	-76.5	124.4	169	44.8	0	0	0	0	108.4	K323	T321-K323 PolarHBondContact O-N 3.08Å
322	P	28.1	Very low	26	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	79%	0.787	S	S	*	*			trans	-92.7	84.6	169.9	-7.4	27.7	0	0	0	109	S320 D324	S320-P322 WeakPolarHBondContact O-CD 3.32Å; P322-D324 PolarHBondContact O-N 3.31Å
323	K	23.8	Very low	26.3	Very low	195 Å²	195	137.4 Å²	137.4	85%	0.848	77%	0.77	S	S	*	*			trans	-76.7	81.5	150.5	-82.5	-177.1	177.5	174.3	0	106.7	T321	T321-K323 PolarHBondContact O-N 3.08Å
324	D	26.7	Very low	26.2	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	77%	0.765	S	S	*	*			trans	-131.1	106.1	165.2	-83.7	-49.4	0	0	0	110.5	P322 C326	P322-D324 PolarHBondContact O-N 3.31Å; D324-C326 PolarHBondContact O-N 3.06Å; D324-C326 VanDerWaalsContact O-N 3.11Å
325	L	24.6	Very low	26.4	Very low	177 Å²	177	135 Å²	135	93%	0.927	77%	0.766	S	S	*	*			trans	-46.7	104.7	154	-71.3	139.5	0	0	0	109.1
326	C	25.1	Very low	26.3	Very low	100 Å²	100	128 Å²	128	68%	0.676	75%	0.749	S	S	*	*			trans	-144	102.3	148.9	-123.7	0	0	0	0	110.4	D324 D328	D324-C326 PolarHBondContact O-N 3.06Å; D324-C326 VanDerWaalsContact O-N 3.11Å; C326-D328 PolarHBondContact O-N 3.42Å
327	N	24.7	Very low	26.4	Very low	161 Å²	161	129 Å²	129	86%	0.861	74%	0.744	S	S	*	*			trans	-67.9	66.6	165.1	-160.6	20.8	0	0	0	107.8	Q329	N327-Q329 PolarHBondContact O-N 3Å
328	D	27.8	Very low	26.5	Very low	125 Å²	125	131.3 Å²	131.3	67%	0.668	75%	0.746	S	S	*	*			trans	-74.1	102.9	174.3	-96.3	-25.8	0	0	0	108.3	C326 I330	C326-D328 PolarHBondContact O-N 3.42Å; D328-I330 PolarHBondContact O-N 3.27Å; D328-I330 VanDerWaalsContact O-N 3.11Å
329	Q	25.7	Very low	26.7	Very low	159 Å²	159	131.5 Å²	131.5	74%	0.743	75%	0.746	S	S	*	*			trans	-44.2	112.5	172.1	-58.1	174.6	-5.2	0	0	109.9	N327 V331	N327-Q329 PolarHBondContact O-N 3Å; Q329-V331 HydrophobicContact CB-CG2 3.8Å; Q329-V331 PolarHBondContact O-N 3.24Å
330	I	27.8	Very low	26.9	Very low	148 Å²	148	132.4 Å²	132.4	76%	0.759	75%	0.747	S	S	*	*			trans	-74.8	75.4	158.5	-56.4	176.1	0	0	0	106.2	D328 S332	D328-I330 PolarHBondContact O-N 3.27Å; D328-I330 VanDerWaalsContact O-N 3.11Å; I330-S332 PolarHBondContact O-N 3.18Å
331	V	26.5	Very low	27.1	Very low	90 Å²	90	134.5 Å²	134.5	55%	0.545	75%	0.749	S	S	.	*			trans	-69.2	110.3	157	-175.1	0	0	0	0	104.7	Q329 P333	Q329-V331 HydrophobicContact CB-CG2 3.8Å; Q329-V331 PolarHBondContact O-N 3.24Å; V331-P333 WeakPolarHBondContact O-CD 3.44Å
332	S	26.5	Very low	27.5	Very low	90 Å²	90	135.8 Å²	135.8	63%	0.629	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-57.7	121.6	161	-71	0	0	0	0	106.6	I330 D334	I330-S332 PolarHBondContact O-N 3.18Å; S332-D334 PolarHBondContact O-N 3.39Å; S332-D334 VanDerWaalsContact O-N 3.16Å
333	P	31.4	Very low	27.7	Very low	80 Å²	80	141.3 Å²	141.3	52%	0.519	76%	0.757	S	S	.	*	P	Polyproline II helix	trans	-67.1	116.2	163.8	1.1	14.6	0	0	0	105.6	V331 V335	V331-P333 WeakPolarHBondContact O-CD 3.44Å; P333-V335 PolarHBondContact O-N 3.49Å
334	D	27.6	Very low	28.3	Very low	147 Å²	147	140.6 Å²	140.6	79%	0.786	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-51.6	121.5	155.9	-94.3	-41.2	0	0	0	106.6	S332 G336	S332-D334 PolarHBondContact O-N 3.39Å; S332-D334 VanDerWaalsContact O-N 3.16Å; D334-G336 PolarHBondContact O-N 3.41Å
335	V	27.5	Very low	28.6	Very low	143 Å²	143	142.5 Å²	142.5	87%	0.867	76%	0.76	S	S	*	*			trans	-73.3	80.7	-179.7	-170.2	0	0	0	0	107.2	P333	P333-V335 PolarHBondContact O-N 3.49Å
336	G	27.5	Very low	28.9	Very low	47 Å²	47	141.7 Å²	141.7	49%	0.485	76%	0.757	S	S	.	*			trans	-108.1	104	169.6	0	0	0	0	0	108.8	D334	D334-G336 PolarHBondContact O-N 3.41Å
337	F	27.6	Very low	29.5	Very low	145 Å²	145	145.9 Å²	145.9	64%	0.636	77%	0.769	S	S	*	*			trans	37.3	104.1	143.8	-87.5	-82	0	0	0	118.3	R175	R175-F337 VanDerWaalsContact CZ-CE1 3.42Å
338	L	28.4	Very low	29.9	Very low	181 Å²	181	150 Å²	150	95%	0.948	79%	0.791	S	S	*	*			trans	-159.2	99.5	133.4	-93.2	177.2	0	0	0	108.2
339	H	27.3	Very low	30	Very low	190 Å²	190	151.3 Å²	151.3	88%	0.88	80%	0.797	S	S	*	*			trans	-140	104	160.4	-156.3	-106.2	0	0	0	106.6
340	A	28.6	Very low	30.2	Very low	90 Å²	90	150.8 Å²	150.8	74%	0.744	80%	0.8	S	S	*	*			trans	-165.4	84.1	164.3	0	0	0	0	0	108.1
341	L	31.2	Very low	30.3	Very low	157 Å²	157	151 Å²	151	82%	0.822	80%	0.802	S	S	*	*			trans	-132.7	96.3	152.7	-78.4	177.5	0	0	0	108.1
342	L	33.9	Very low	30.6	Very low	160 Å²	160	154.6 Å²	154.6	84%	0.838	82%	0.817	S	S	*	*			trans	50.9	104	134.1	-58.4	170.2	0	0	0	117.2
343	Y	32.3	Very low	30.8	Very low	236 Å²	236	158.6 Å²	158.6	93%	0.925	83%	0.829	S	S	*	*			trans	-112	66.8	165.1	-141	-79.9	0	0	0	108.8
344	E	35.3	Very low	30.8	Very low	179 Å²	179	163.9 Å²	163.9	84%	0.836	85%	0.85	S	S	*	*			trans	-146.2	98.8	162.9	-75.6	-160.4	167	0	0	108.9
345	Q	33.4	Very low	31	Very low	187 Å²	187	165.1 Å²	165.1	87%	0.874	85%	0.854	S	S	*	*			trans	173.7	87.3	144	-96.3	178.9	11.3	0	0	108.1
346	N	31.6	Very low	31.3	Very low	160 Å²	160	166.8 Å²	166.8	86%	0.856	85%	0.853	S	S	*	*			trans	-179.2	72.4	150.1	-96.7	-20.8	0	0	0	110.9
347	M	37.4	Very low	31.6	Very low	188 Å²	188	176.8 Å²	176.8	93%	0.926	88%	0.884	S	S	*	*			trans	-154.5	106.3	145.6	-76	-55.3	166.8	0	0	105.5
348	N	32.2	Very low	32	Very low	248 Å²	248	179.6 Å²	179.6	100%	1.326	91%	0.907	S	S	*	*			trans	28	0	167.2	-75.2	-17	0	0	0	120.8

Retrieved 348 of 348 residues in 478.4 ms (Link to these results)

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