A0A096MQE7_PAPAN Loading...

Galactose-3-O-sulfotransferase 3

Transfers a sulfate to position 3 of non-reducing beta-galactosyl residues in N-glycans and core2-branched O-glycans. Has high activity towards Gal-beta-1,4-GlcNAc, Gal-beta-1,4(Fuc-alpha-1,3)GlcNAc and lower activity towards Gal-beta-1,3(Fuc-alpha-1,4)GlcNAc.

AlphaFold DB (A0A2K6DTQ1), UniProt , Accession A0A096MQE7, Species PAPAN (Papio anubis, Olive baboon), Gene GAL3ST3, Length 431 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	50.6	Low	51.2	Low	238 Å²	238	134.2 Å²	134.2	100%	1.172	69%	0.686	S	S	*	*				0	122.3	0	-80.6	-175.3	150.7	0	0	108.5
2	P	56.2	Low	51	Low	93 Å²	93	131.9 Å²	131.9	60%	0.604	68%	0.684	S	S	*	*			trans	-80.5	144.7	-171.7	30.9	-30	0	0	0	111.6	I4	P2-I4 PolarHBondContact O-N 3Å
3	P	53.1	Low	51.1	Low	97 Å²	97	136.2 Å²	136.2	63%	0.63	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	9.9	-168.1	28.4	-35.1	0	0	0	115.4
4	I	55.1	Low	51.2	Low	119 Å²	119	138 Å²	138	61%	0.61	70%	0.701	S	S	*	*	H	α-helix	trans	-84.7	-33.2	-177.1	-61.7	171	0	0	0	111.1	P2 Q6 R7 L8	P2-I4 PolarHBondContact O-N 3Å; I4-Q6 VanDerWaalsContact C-N 3.34Å; I4-Q6 PolarHBondContact O-N 2.76Å; I4-R7 PolarHBondContact O-N 2.92Å; I4-L8 PolarHBondContact O-N 3.49Å
5	L	50.1	Low	51.2	Low	123 Å²	123	134 Å²	134	64%	0.644	68%	0.68	S	S	*	*	H	α-helix	trans	-68.1	-32.7	179.3	-118.1	87.6	0	0	0	112.7	Q9	L5-Q9 PolarHBondContact O-N 3.33Å
6	Q	52.3	Low	52.6	Low	142 Å²	142	130.1 Å²	130.1	66%	0.664	67%	0.669	S	S	*	*	H	α-helix	trans	-70.7	-33.3	176.7	-91.6	179.5	-28	0	0	112.9	I4 Q9 Q10	I4-Q6 VanDerWaalsContact C-N 3.34Å; I4-Q6 PolarHBondContact O-N 2.76Å; Q6-Q9 PolarHBondContact O-N 3.1Å; Q6-Q10 PolarHBondContact O-N 3.19Å
7	R	52.4	Low	53.4	Low	201 Å²	201	135.7 Å²	135.7	76%	0.758	68%	0.679	S	S	*	*	H	α-helix	trans	-70	-34.2	177.4	-75.4	-170.7	175.8	-162.2	-0.1	112.6	I4 A11	I4-R7 PolarHBondContact O-N 2.92Å; R7-A11 PolarHBondContact O-N 3.49Å; R7-A11 VanDerWaalsContact O-N 3.17Å
8	L	51.1	Low	54	Low	119 Å²	119	139.2 Å²	139.2	62%	0.623	68%	0.683	S	S	*	*	H	α-helix	trans	-73	-33.5	174.9	-78	162.8	0	0	0	112.7	I4 T12	I4-L8 PolarHBondContact O-N 3.49Å; L8-T12 PolarHBondContact O-N 2.73Å; L8-T12 PolarHBondContact O-OG1 3.28Å
9	Q	47.8	Very low	54.9	Low	133 Å²	133	138.6 Å²	138.6	62%	0.621	68%	0.677	S	S	*	*	H	α-helix	trans	-74.2	-26.4	174.3	-79	-175.6	-48.7	0	0	113.7	L5 Q6 T12	L5-Q9 PolarHBondContact O-N 3.33Å; Q6-Q9 PolarHBondContact O-N 3.1Å; Q9-T12 PolarHBondContact O-OG1 2.02Å
10	Q	47.3	Very low	55.9	Low	145 Å²	145	135.9 Å²	135.9	68%	0.678	66%	0.664	S	S	*	*	H	α-helix	trans	-80.4	-34.6	173.6	-84.1	-178	-25.8	0	0	113.1	Q6 T12 K13	Q6-Q10 PolarHBondContact O-N 3.19Å; Q10-T12 VanDerWaalsContact C-N 3.29Å; Q10-T12 PolarHBondContact O-N 3.17Å; Q10-K13 PolarHBondContact O-N 3.15Å
11	A	47	Very low	56.7	Low	66 Å²	66	134.5 Å²	134.5	55%	0.545	66%	0.66	S	S	.	*	H	α-helix	trans	-65.7	-31.6	177.5	0	0	0	0	0	113	R7 K13	R7-A11 PolarHBondContact O-N 3.49Å; R7-A11 VanDerWaalsContact O-N 3.17Å; A11-K13 VanDerWaalsContact C-N 3.33Å
12	T	49.4	Very low	58	Low	107 Å²	107	129.1 Å²	129.1	66%	0.656	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-14.6	177.7	37.6	0	0	0	0	113.6	L8 Q9 Q10	L8-T12 PolarHBondContact O-N 2.73Å; L8-T12 PolarHBondContact O-OG1 3.28Å; Q9-T12 PolarHBondContact O-OG1 2.02Å; Q10-T12 VanDerWaalsContact C-N 3.29Å; Q10-T12 PolarHBondContact O-N 3.17Å
13	K	51.7	Low	59	Low	187 Å²	187	129.6 Å²	129.6	81%	0.813	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-3.1	-176.3	-136.9	172.9	-174.4	179.1	0	114.8	Q10 A11	Q10-K13 PolarHBondContact O-N 3.15Å; A11-K13 VanDerWaalsContact C-N 3.33Å
14	M	52.3	Low	60.2	Low	162 Å²	162	128.9 Å²	128.9	80%	0.798	63%	0.626	S	S	*	*	S	Bend	trans	-119	5.7	-176.8	-96.2	177.6	40.3	0	0	115
15	M	52	Low	61.3	Low	78 Å²	78	127.8 Å²	127.8	38%	0.384	62%	0.62	S	S	.	*			trans	-97.5	100.8	175	-71.5	-174.4	67.9	0	0	110.1	K19 I20 L23	M15-K19 HydrophobicContact CE-CB 4.19Å; M15-I20 HydrophobicContact CB-CD1 4.4Å; M15-I20 HydrophobicContact CB-CG1 4.04Å; M15-I20 HydrophobicContact CE-CG1 4.29Å; M15-L23 HydrophobicContact CE-CD1 3.89Å
16	S	73.2	Confident	62.5	Low	71 Å²	71	123.3 Å²	123.3	50%	0.497	60%	0.604	S	S	.	*			trans	-49.7	143	168.3	165.3	0	0	0	0	110.4	R18 K19 I20	S16-R18 PolarHBondContact O-N 3.05Å; S16-R18 PolarHBondContact OG-N 3.15Å; S16-K19 WeakPolarHBondContact O-CA 3.49Å; S16-K19 WeakPolarHBondContact O-CB 3.47Å; S16-K19 PolarHBondContact O-N 2.91Å; S16-I20 PolarHBondContact O-N 3.4Å
17	R	66.4	Low	63.4	Low	226 Å²	226	120 Å²	120	85%	0.853	60%	0.595	S	S	*	*	H	α-helix	trans	-47.9	-31	177.9	-71.4	-177.6	177.4	-177.2	-0.9	112.9	I20 L21	R17-I20 PolarHBondContact O-N 3.26Å; R17-L21 WeakPolarHBondContact O-CB 2.92Å; R17-L21 PolarHBondContact O-N 3.33Å
18	R	64.7	Low	64.2	Low	199 Å²	199	113.8 Å²	113.8	75%	0.751	58%	0.583	S	S	*	*	H	α-helix	trans	-63.9	-40.6	173.4	-74.3	-175.2	178.5	-178.3	-3.5	113.4	S16 L21 L22	S16-R18 PolarHBondContact O-N 3.05Å; S16-R18 PolarHBondContact OG-N 3.15Å; R18-L21 PolarHBondContact O-N 2.95Å; R18-L22 WeakPolarHBondContact O-CB 3.41Å; R18-L22 VanDerWaalsContact O-CG 3.27Å; R18-L22 WeakPolarHBondContact O-CG 3.48Å; R18-L22 PolarHBondContact O-N 3.44Å
19	K	69.7	Low	64.7	Low	127 Å²	127	111.3 Å²	111.3	55%	0.552	57%	0.573	S	S	*	*	H	α-helix	trans	-69.6	-37.5	178.5	-66.8	-176.6	178.1	179.5	0	111.6	M15 S16 L23	M15-K19 HydrophobicContact CE-CB 4.19Å; S16-K19 WeakPolarHBondContact O-CA 3.49Å; S16-K19 WeakPolarHBondContact O-CB 3.47Å; S16-K19 PolarHBondContact O-N 2.91Å; K19-L23 WeakPolarHBondContact O-CB 2.97Å; K19-L23 PolarHBondContact O-N 3.05Å
20	I	74.7	Confident	65.6	Low	84 Å²	84	108.6 Å²	108.6	43%	0.431	57%	0.565	S	S	.	*	H	α-helix	trans	-65.3	-45.3	173.8	-59.9	174.8	0	0	0	110.1	M15 S16 R17 L22 L23 V24	M15-I20 HydrophobicContact CB-CD1 4.4Å; M15-I20 HydrophobicContact CB-CG1 4.04Å; M15-I20 HydrophobicContact CE-CG1 4.29Å; S16-I20 PolarHBondContact O-N 3.4Å; R17-I20 PolarHBondContact O-N 3.26Å; I20-L22 PolarHBondContact O-N 3.36Å; I20-L23 PolarHBondContact O-N 3.41Å; I20-V24 HydrophobicContact CG2-CG2 4.42Å; I20-V24 WeakPolarHBondContact O-CG2 3.3Å; I20-V24 PolarHBondContact O-N 3.47Å
21	L	74.4	Confident	66.4	Low	108 Å²	108	104.9 Å²	104.9	57%	0.565	56%	0.555	S	S	*	*	H	α-helix	trans	-60.7	-43.5	177.4	-169.7	73.4	0	0	0	111.9	R17 R18 L23 V24 L25	R17-L21 WeakPolarHBondContact O-CB 2.92Å; R17-L21 PolarHBondContact O-N 3.33Å; R18-L21 PolarHBondContact O-N 2.95Å; L21-L23 VanDerWaalsContact C-N 3.32Å; L21-L23 PolarHBondContact O-N 3.39Å; L21-V24 PolarHBondContact O-N 2.94Å; L21-L25 HydrophobicContact CD1-CD1 4.16Å; L21-L25 HydrophobicContact CD2-CD1 4.42Å; L21-L25 HydrophobicContact CG-CD1 3.78Å; L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 WeakPolarHBondContact O-CD1 3.31Å; L21-L25 PolarHBondContact O-N 3.09Å
22	L	76.4	Confident	66.8	Low	125 Å²	125	106.5 Å²	106.5	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-65.5	-33.7	176.5	-72.4	169.6	0	0	0	112.7	R18 I20 G26	R18-L22 WeakPolarHBondContact O-CB 3.41Å; R18-L22 VanDerWaalsContact O-CG 3.27Å; R18-L22 WeakPolarHBondContact O-CG 3.48Å; R18-L22 PolarHBondContact O-N 3.44Å; I20-L22 PolarHBondContact O-N 3.36Å; L22-G26 WeakPolarHBondContact O-CA 3.47Å; L22-G26 PolarHBondContact O-N 2.89Å
23	L	78	Confident	66.8	Low	102 Å²	102	106.6 Å²	106.6	53%	0.534	55%	0.55	S	S	.	*	H	α-helix	trans	-73.9	-38.9	177.2	-143.8	144.3	0	0	0	111.2	M15 K19 I20 L21 G26 C27	M15-L23 HydrophobicContact CE-CD1 3.89Å; K19-L23 WeakPolarHBondContact O-CB 2.97Å; K19-L23 PolarHBondContact O-N 3.05Å; I20-L23 PolarHBondContact O-N 3.41Å; L21-L23 VanDerWaalsContact C-N 3.32Å; L21-L23 PolarHBondContact O-N 3.39Å; L23-G26 PolarHBondContact O-N 3.45Å; L23-C27 WeakPolarHBondContact O-CB 3.38Å; L23-C27 PolarHBondContact O-N 3.29Å; L23-C27 PolarHBondContact O-SG 3.49Å
24	V	78.1	Confident	67	Low	83 Å²	83	103 Å²	103	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-44	172.6	173.1	0	0	0	0	111.1	I20 L21 C27 S28	I20-V24 HydrophobicContact CG2-CG2 4.42Å; I20-V24 WeakPolarHBondContact O-CG2 3.3Å; I20-V24 PolarHBondContact O-N 3.47Å; L21-V24 PolarHBondContact O-N 2.94Å; V24-C27 PolarHBondContact O-N 3.45Å; V24-S28 VanDerWaalsContact O-CB 3.23Å; V24-S28 WeakPolarHBondContact O-CB 3.41Å; V24-S28 PolarHBondContact O-N 3.2Å; V24-S28 PolarHBondContact O-OG 3Å
25	L	78.2	Confident	66.9	Low	95 Å²	95	101.8 Å²	101.8	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-42.7	173.6	-98.7	118.3	0	0	0	111.3	L21 S28 T29	L21-L25 HydrophobicContact CD1-CD1 4.16Å; L21-L25 HydrophobicContact CD2-CD1 4.42Å; L21-L25 HydrophobicContact CG-CD1 3.78Å; L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 WeakPolarHBondContact O-CD1 3.31Å; L21-L25 PolarHBondContact O-N 3.09Å; L25-S28 PolarHBondContact O-N 3.41Å; L25-T29 WeakPolarHBondContact O-CB 3.3Å; L25-T29 VanDerWaalsContact O-CG2 3.29Å; L25-T29 WeakPolarHBondContact O-CG2 3.45Å; L25-T29 PolarHBondContact O-N 3.08Å; L25-T29 PolarHBondContact O-OG1 3.07Å
26	G	75.3	Confident	66.5	Low	29 Å²	29	103 Å²	103	30%	0.299	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-44.3	176.6	0	0	0	0	0	112.8	L22 L23 S28 T29 V30	L22-G26 WeakPolarHBondContact O-CA 3.47Å; L22-G26 PolarHBondContact O-N 2.89Å; L23-G26 PolarHBondContact O-N 3.45Å; G26-S28 VanDerWaalsContact C-N 3.35Å; G26-T29 WeakPolarHBondContact CA-OG1 3.32Å; G26-T29 PolarHBondContact O-N 3.5Å; G26-T29 PolarHBondContact O-OG1 3.01Å; G26-V30 VanDerWaalsContact O-CB 3.29Å; G26-V30 WeakPolarHBondContact O-CB 3.34Å; G26-V30 WeakPolarHBondContact O-CG2 3.45Å; G26-V30 PolarHBondContact O-N 2.94Å
27	C	71.4	Confident	64.9	Low	72 Å²	72	101.7 Å²	101.7	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-38	173.6	-72.6	0	0	0	0	111.6	L23 V24 S31	L23-C27 WeakPolarHBondContact O-CB 3.38Å; L23-C27 PolarHBondContact O-N 3.29Å; L23-C27 PolarHBondContact O-SG 3.49Å; V24-C27 PolarHBondContact O-N 3.45Å; C27-S31 VanDerWaalsContact O-CB 3.28Å; C27-S31 WeakPolarHBondContact O-CB 3.01Å; C27-S31 PolarHBondContact O-N 3.42Å; C27-S31 PolarHBondContact O-OG 3.06Å
28	S	68.3	Low	63.7	Low	71 Å²	71	94.9 Å²	94.9	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-68.9	-39.2	177.6	-58.5	0	0	0	0	111.9	V24 L25 G26 L32	V24-S28 VanDerWaalsContact O-CB 3.23Å; V24-S28 WeakPolarHBondContact O-CB 3.41Å; V24-S28 PolarHBondContact O-N 3.2Å; V24-S28 PolarHBondContact O-OG 3Å; L25-S28 PolarHBondContact O-N 3.41Å; G26-S28 VanDerWaalsContact C-N 3.35Å; S28-L32 VanDerWaalsContact O-CB 3.23Å; S28-L32 WeakPolarHBondContact O-CB 3.31Å; S28-L32 PolarHBondContact O-N 3.15Å
29	T	63.1	Low	62.7	Low	67 Å²	67	90.3 Å²	90.3	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-72.2	-37.8	175.5	54.3	0	0	0	0	111.5	L25 G26 L32 L33	L25-T29 WeakPolarHBondContact O-CB 3.3Å; L25-T29 VanDerWaalsContact O-CG2 3.29Å; L25-T29 WeakPolarHBondContact O-CG2 3.45Å; L25-T29 PolarHBondContact O-N 3.08Å; L25-T29 PolarHBondContact O-OG1 3.07Å; G26-T29 WeakPolarHBondContact CA-OG1 3.32Å; G26-T29 PolarHBondContact O-N 3.5Å; G26-T29 PolarHBondContact O-OG1 3.01Å; T29-L32 PolarHBondContact O-N 3.42Å; T29-L33 VanDerWaalsContact O-CB 3.24Å; T29-L33 WeakPolarHBondContact O-CB 3.24Å; T29-L33 WeakPolarHBondContact O-CG 3.35Å; T29-L33 PolarHBondContact O-N 3.36Å
30	V	65.5	Low	61.4	Low	76 Å²	76	90.7 Å²	90.7	46%	0.461	52%	0.52	S	S	.	.	H	α-helix	trans	-66.3	-42	172.5	170.2	0	0	0	0	110.9	G26 L32 L33 I34	G26-V30 VanDerWaalsContact O-CB 3.29Å; G26-V30 WeakPolarHBondContact O-CB 3.34Å; G26-V30 WeakPolarHBondContact O-CG2 3.45Å; G26-V30 PolarHBondContact O-N 2.94Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.16Å; V30-L33 CarbonylContact O-C 3.56Å; V30-L33 PolarHBondContact O-N 3.44Å; V30-I34 HydrophobicContact CG1-CD1 3.63Å; V30-I34 HydrophobicContact CG1-CG1 4.26Å; V30-I34 WeakPolarHBondContact O-CB 3.42Å; V30-I34 WeakPolarHBondContact O-CG1 3.46Å; V30-I34 PolarHBondContact O-N 2.92Å
31	S	63.9	Low	59.8	Low	68 Å²	68	88.5 Å²	88.5	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-38.9	171.9	-76.5	0	0	0	0	112.1	C27 H35	C27-S31 VanDerWaalsContact O-CB 3.28Å; C27-S31 WeakPolarHBondContact O-CB 3.01Å; C27-S31 PolarHBondContact O-N 3.42Å; C27-S31 PolarHBondContact O-OG 3.06Å; S31-H35 VanDerWaalsContact O-CB 3.31Å; S31-H35 WeakPolarHBondContact O-CB 3.31Å; S31-H35 PolarHBondContact O-N 3.13Å
32	L	55.3	Low	58.2	Low	100 Å²	100	95 Å²	95	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-67.1	-39.8	175.1	-162.7	78	0	0	0	111.3	S28 T29 V30 H35 Q36	S28-L32 VanDerWaalsContact O-CB 3.23Å; S28-L32 WeakPolarHBondContact O-CB 3.31Å; S28-L32 PolarHBondContact O-N 3.15Å; T29-L32 PolarHBondContact O-N 3.42Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.16Å; L32-H35 PolarHBondContact O-N 2.97Å; L32-Q36 WeakPolarHBondContact O-CB 3.43Å; L32-Q36 WeakPolarHBondContact O-CG 3.46Å; L32-Q36 PolarHBondContact O-N 2.84Å
33	L	50	Low	56.8	Low	108 Å²	108	91 Å²	91	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-74.7	-29.7	177.8	-73	168.5	0	0	0	112.7	T29 V30 G37	T29-L33 VanDerWaalsContact O-CB 3.24Å; T29-L33 WeakPolarHBondContact O-CB 3.24Å; T29-L33 WeakPolarHBondContact O-CG 3.35Å; T29-L33 PolarHBondContact O-N 3.36Å; V30-L33 CarbonylContact O-C 3.56Å; V30-L33 PolarHBondContact O-N 3.44Å; L33-G37 VanDerWaalsContact O-CA 3.29Å; L33-G37 WeakPolarHBondContact O-CA 3.02Å; L33-G37 PolarHBondContact O-N 2.9Å
34	I	55.6	Low	55.1	Low	111 Å²	111	89.8 Å²	89.8	57%	0.569	50%	0.504	S	S	*	.	H	α-helix	trans	-73.4	-42.2	170.3	-69.2	166.6	0	0	0	109.5	V30 G37 A38	V30-I34 HydrophobicContact CG1-CD1 3.63Å; V30-I34 HydrophobicContact CG1-CG1 4.26Å; V30-I34 WeakPolarHBondContact O-CB 3.42Å; V30-I34 WeakPolarHBondContact O-CG1 3.46Å; V30-I34 PolarHBondContact O-N 2.92Å; I34-G37 PolarHBondContact O-N 3.39Å; I34-A38 WeakPolarHBondContact O-CB 3.22Å; I34-A38 PolarHBondContact O-N 2.91Å
35	H	49.9	Very low	53.6	Low	137 Å²	137	95.4 Å²	95.4	63%	0.634	52%	0.522	S	S	*	.	H	α-helix	trans	-61.6	-44.6	172.2	-97.9	-65.5	0	0	0	111.4	S31 L32 Q39	S31-H35 VanDerWaalsContact O-CB 3.31Å; S31-H35 WeakPolarHBondContact O-CB 3.31Å; S31-H35 PolarHBondContact O-N 3.13Å; L32-H35 PolarHBondContact O-N 2.97Å; H35-Q39 WeakPolarHBondContact O-CG 3.03Å; H35-Q39 PolarHBondContact O-N 2.75Å
36	Q	44.4	Very low	52.5	Low	103 Å²	103	94.2 Å²	94.2	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-72.4	-33.4	177.2	-74.5	179.2	-7.3	0	0	113.1	L32 Q39 L40	L32-Q36 WeakPolarHBondContact O-CB 3.43Å; L32-Q36 WeakPolarHBondContact O-CG 3.46Å; L32-Q36 PolarHBondContact O-N 2.84Å; Q36-Q39 CarbonylContact O-C 3.36Å; Q36-Q39 WeakPolarHBondContact O-CA 3.29Å; Q36-Q39 VanDerWaalsContact O-CB 3.24Å; Q36-Q39 WeakPolarHBondContact O-CB 3.49Å; Q36-Q39 PolarHBondContact O-N 2.68Å; Q36-L40 PolarHBondContact O-N 2.87Å
37	G	39.1	Very low	51.6	Low	45 Å²	45	94.6 Å²	94.6	46%	0.464	51%	0.509	S	S	.	.	H	α-helix	trans	-70.2	-35.7	176.3	0	0	0	0	0	112.2	L33 I34 Q39 L40	L33-G37 VanDerWaalsContact O-CA 3.29Å; L33-G37 WeakPolarHBondContact O-CA 3.02Å; L33-G37 PolarHBondContact O-N 2.9Å; I34-G37 PolarHBondContact O-N 3.39Å; G37-Q39 PolarHBondContact O-N 3.49Å; G37-L40 PolarHBondContact O-N 3.27Å
38	A	41.5	Very low	51	Low	82 Å²	82	93 Å²	93	68%	0.678	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.6	164.9	0	0	0	0	0	113	I34	I34-A38 WeakPolarHBondContact O-CB 3.22Å; I34-A38 PolarHBondContact O-N 2.91Å
39	Q	43.3	Very low	50.5	Low	103 Å²	103	95.5 Å²	95.5	48%	0.481	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-9.6	174.1	-60.9	-134.7	-19.9	0	0	114.4	H35 Q36 G37 S41	H35-Q39 WeakPolarHBondContact O-CG 3.03Å; H35-Q39 PolarHBondContact O-N 2.75Å; Q36-Q39 CarbonylContact O-C 3.36Å; Q36-Q39 WeakPolarHBondContact O-CA 3.29Å; Q36-Q39 VanDerWaalsContact O-CB 3.24Å; Q36-Q39 WeakPolarHBondContact O-CB 3.49Å; Q36-Q39 PolarHBondContact O-N 2.68Å; G37-Q39 PolarHBondContact O-N 3.49Å; Q39-S41 PolarHBondContact O-N 3.05Å
40	L	42.3	Very low	50.4	Low	135 Å²	135	95.6 Å²	95.6	71%	0.707	51%	0.508	S	S	*	.			trans	-76.3	60.3	167.1	-81.7	154.2	0	0	0	109.6	Q36 G37 W42	Q36-L40 PolarHBondContact O-N 2.87Å; G37-L40 PolarHBondContact O-N 3.27Å; L40-W42 PolarHBondContact O-N 3.28Å
41	S	41.5	Very low	50.5	Low	39 Å²	39	93.8 Å²	93.8	27%	0.273	50%	0.499	S	S	.	.			trans	-47.5	115.4	163.1	177.4	0	0	0	0	107.5	Q39 Y43 P44	Q39-S41 PolarHBondContact O-N 3.05Å; S41-Y43 PolarHBondContact O-N 3.14Å; S41-P44 VanDerWaalsContact O-CD 3.26Å; S41-P44 WeakPolarHBondContact O-CD 3.32Å
42	W	40.7	Very low	50.5	Low	243 Å²	243	95.3 Å²	95.3	92%	0.92	51%	0.507	S	S	*	.	S	Bend	trans	-63.2	20.2	-179.2	-113.3	53.1	0	0	0	114.2	L40 P44	L40-W42 PolarHBondContact O-N 3.28Å; W42-P44 VanDerWaalsContact C-CD 3.45Å
43	Y	46.9	Very low	50.7	Low	41 Å²	41	95.2 Å²	95.2	16%	0.161	51%	0.512	C	S	.	.			trans	-117.3	17.7	-176.7	-62.5	-84.3	0	0	0	116.7	S41 K45 L46 E232 E233	S41-Y43 PolarHBondContact O-N 3.14Å; Y43-K45 PolarHBondContact O-N 3.21Å; Y43-L46 HydrophobicContact CD1-CD1 4.48Å; Y43-L46 PolarHBondContact O-N 3.18Å; Y43-E232 WeakPolarHBondContact CE2-O 3.5Å; Y43-E232 PolarHBondContact OH-O 3.32Å; Y43-E233 WeakPolarHBondContact OH-CA 3.3Å; Y43-E233 PolarHBondContact OH-O 3.37Å
44	P	42.4	Very low	50.8	Low	77 Å²	77	96.4 Å²	96.4	50%	0.5	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.9	-179.4	-1.5	18.1	0	0	0	112	S41 W42	S41-P44 VanDerWaalsContact O-CD 3.26Å; S41-P44 WeakPolarHBondContact O-CD 3.32Å; W42-P44 VanDerWaalsContact C-CD 3.45Å
45	K	47.4	Very low	50.7	Low	202 Å²	202	103 Å²	103	88%	0.878	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.3	-172.8	-63.2	-174	-179.8	178.6	0	114.9	Y43	Y43-K45 PolarHBondContact O-N 3.21Å
46	L	54.6	Low	50.9	Low	70 Å²	70	104 Å²	104	37%	0.366	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-21.9	-174	-69.3	174.1	0	0	0	114.3	Y43 L254	Y43-L46 HydrophobicContact CD1-CD1 4.48Å; Y43-L46 PolarHBondContact O-N 3.18Å; L46-L254 HydrophobicContact CB-CD1 3.77Å
47	F	56.3	Low	51.7	Low	37 Å²	37	102.6 Å²	102.6	16%	0.162	55%	0.548	C	S	.	.	S	Bend	trans	-97.1	127.2	179.2	-77.8	-88.2	0	0	0	110.9	L49 S236 L237 L254	F47-L49 PolarHBondContact O-N 3.35Å; F47-L49 VanDerWaalsContact O-N 3.08Å; F47-S236 WeakPolarHBondContact CE2-O 3.33Å; F47-S236 WeakPolarHBondContact CZ-O 3.2Å; F47-L237 HydrophobicContact CE1-CD1 4.47Å; F47-L237 HydrophobicContact CZ-CB 4.18Å; F47-L237 HydrophobicContact CZ-CD1 4.14Å; F47-L254 HydrophobicContact CD1-CB 4.49Å; F47-L254 HydrophobicContact CD2-CD1 4.24Å; F47-L254 HydrophobicContact CE1-CB 3.87Å; F47-L254 HydrophobicContact CE1-CD1 4.23Å; F47-L254 HydrophobicContact CE1-CD2 4.44Å; F47-L254 HydrophobicContact CE1-CG 4.41Å; F47-L254 HydrophobicContact CE2-CD1 3.79Å; F47-L254 HydrophobicContact CE2-CD2 4.41Å; F47-L254 HydrophobicContact CZ-CB 4.08Å; F47-L254 HydrophobicContact CZ-CD1 3.8Å; F47-L254 HydrophobicContact CZ-CD2 3.83Å; F47-L254 HydrophobicContact CZ-CG 4.12Å
48	P	59.5	Low	52.9	Low	38 Å²	38	105.5 Å²	105.5	25%	0.247	56%	0.559	C	S	.	*			trans	-57	118	168.9	-20.9	32.5	0	0	0	109.3	S50 R60	P48-S50 PolarHBondContact O-N 2.66Å; P48-S50 VanDerWaalsContact O-N 3.15Å; P48-R60 VanDerWaalsContact CG-NH2 3.26Å
49	L	57.6	Low	54.5	Low	123 Å²	123	107.7 Å²	107.7	64%	0.644	57%	0.566	S	S	*	*			trans	-69.9	-8.3	-167.4	-76.2	164.4	0	0	0	114.7	F47	F47-L49 PolarHBondContact O-N 3.35Å; F47-L49 VanDerWaalsContact O-N 3.08Å
50	S	61.4	Low	56.5	Low	69 Å²	69	108.7 Å²	108.7	48%	0.483	57%	0.565	S	S	.	*	S	Bend	trans	-161	153.3	-175.1	37.3	0	0	0	0	113.8	P48 R253	P48-S50 PolarHBondContact O-N 2.66Å; P48-S50 VanDerWaalsContact O-N 3.15Å; S50-R253 PolarHBondContact O-NH2 2.7Å; S50-R253 VanDerWaalsContact O-NH2 3.1Å
51	C	67	Low	58.9	Low	38 Å²	38	108 Å²	108	26%	0.257	57%	0.568	S	S	.	*	S	Bend	trans	-102.9	145.6	162	-77.1	0	0	0	0	110.8	R253 A312 C316	C51-R253 VanDerWaalsContact SG-CZ 3.52Å; C51-R253 PolarHBondContact SG-NH1 3.48Å; C51-A312 PolarHBondContact N-O 2.93Å; C51-A312 PolarHBondContact SG-O 3.43Å; C51-C316 HydrophobicContact CB-CB 3.31Å; C51-C316 WeakPolarHBondContact CB-SG 3.17Å; C51-C316 WeakPolarHBondContact SG-CB 3.37Å; C51-C316 CovalentContact SG-SG 2.02Å; C51-C316 PolarHBondContact SG-SG 3.2Å
52	P	63.8	Low	61.5	Low	100 Å²	100	108.4 Å²	108.4	65%	0.649	57%	0.566	S	S	*	*	S	Bend	cis	-73.5	168.8	-9.5	23.8	-17.9	0	0	0	111.2	L54	P52-L54 PolarHBondContact O-N 2.85Å
53	P	58.7	Low	64.2	Low	98 Å²	98	99.2 Å²	99.2	64%	0.636	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-51	137.6	164.5	22.9	-31.2	0	0	0	108.3	R55	P53-R55 PolarHBondContact O-N 3.32Å
54	L	53.3	Low	66.6	Low	133 Å²	133	100.6 Å²	100.6	70%	0.696	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-49.5	119.8	170.5	-82.7	157.1	0	0	0	106.6	P52 N56 S57	P52-L54 PolarHBondContact O-N 2.85Å; L54-N56 PolarHBondContact O-N 3.35Å; L54-S57 WeakPolarHBondContact CB-OG 3.49Å; L54-S57 PolarHBondContact O-N 2.95Å
55	R	52.6	Low	69.2	Low	251 Å²	251	98 Å²	98	95%	0.947	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-5.3	-172.6	-151.3	173.7	178.1	-172.9	-2.1	113.6	P53	P53-R55 PolarHBondContact O-N 3.32Å
56	N	55	Low	71.7	Confident	158 Å²	158	88.3 Å²	88.3	85%	0.845	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	9.6	-177.1	-62.7	-9.9	0	0	0	114	L54	L54-N56 PolarHBondContact O-N 3.35Å
57	S	60.1	Low	73.8	Confident	72 Å²	72	85 Å²	85	50%	0.503	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-83.2	133.7	175.5	-66.5	0	0	0	0	111.2	L54	L54-S57 WeakPolarHBondContact CB-OG 3.49Å; L54-S57 PolarHBondContact O-N 2.95Å
58	P	65.6	Low	75.8	Confident	107 Å²	107	83.2 Å²	83.2	70%	0.695	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-59.3	149.3	172.7	24.2	-31.8	0	0	0	110.4	R60	P58-R60 PolarHBondContact O-N 2.88Å
59	P	74.4	Confident	77.7	Confident	128 Å²	128	81.5 Å²	81.5	83%	0.831	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57	125.2	177.6	-10.4	18.8	0	0	0	109.5
60	R	85.9	Confident	79.6	Confident	123 Å²	123	75.7 Å²	75.7	46%	0.464	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-69.6	136.4	172.4	-69.1	-167.8	-59	149.2	9.3	108.8	P48 P58 R253 A256	P48-R60 VanDerWaalsContact CG-NH2 3.26Å; P58-R60 PolarHBondContact O-N 2.88Å; R60-R253 PolarHBondContact NH2-O 2.98Å; R60-A256 HydrophobicContact CB-CB 3.99Å
61	P	91.9	Very high	81.3	Confident	120 Å²	120	72.5 Å²	72.5	78%	0.779	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-61.2	142.9	174.1	26.4	-33.6	0	0	0	110.2	H63	P61-H63 PolarHBondContact O-N 2.85Å
62	K	95.8	Very high	82.8	Confident	49 Å²	49	70.7 Å²	70.7	21%	0.213	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-60.2	134	175.2	-66.2	-172.9	179.8	-172.2	0	109.9	M64 F86 A256 D258 D261	K62-M64 HydrophobicContact CB-CE 4.01Å; K62-M64 HydrophobicContact CB-SD 4.38Å; K62-M64 PolarHBondContact O-N 3.49Å; K62-F86 HydrophobicContact CD-CE2 4.25Å; K62-F86 HydrophobicContact CD-CZ 4.49Å; K62-A256 WeakPolarHBondContact CG-O 3.35Å; K62-D258 WeakPolarHBondContact CE-OD2 3.39Å; K62-D258 IonicContact NZ-OD2 2.66Å; K62-D258 PolarHBondContact NZ-OD2 3.45Å; K62-D261 WeakPolarHBondContact CE-OD2 3.32Å; K62-D261 IonicContact NZ-OD1 3.8Å; K62-D261 IonicContact NZ-OD2 3.65Å; K62-D261 PolarHBondContact NZ-OD2 3.25Å
63	H	97.3	Very high	84.3	Confident	49 Å²	49	67.2 Å²	67.2	23%	0.227	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.7	127	173.1	-163.4	72.4	0	0	0	110	P61 T65 G144 V146 L255 W257	P61-H63 PolarHBondContact O-N 2.85Å; H63-T65 PolarHBondContact CD2-O 2.98Å; H63-T65 PolarHBondContact NE2-O 3.3Å; H63-T65 PolarHBondContact NE2-OG1 3.5Å; H63-G144 PolarHBondContact CE1-O 3.05Å; H63-G144 PolarHBondContact NE2-O 3.45Å; H63-V146 WeakPolarHBondContact NE2-CG2 3.5Å; H63-L255 HydrophobicContact CB-CB 4.1Å; H63-L255 HydrophobicContact CB-CD2 3.93Å; H63-L255 WeakPolarHBondContact CB-O 3.04Å; H63-L255 PolarHBondContact N-O 2.76Å; H63-W257 PolarHBondContact O-NE1 3.36Å
64	M	97.8	Very high	86.2	Confident	71 Å²	71	62.5 Å²	62.5	35%	0.35	33%	0.325	S	S	.	.			trans	-105.9	-12.3	-170.2	-60.3	-62.3	-170.4	0	0	113.9	K62 F86 L92	K62-M64 HydrophobicContact CB-CE 4.01Å; K62-M64 HydrophobicContact CB-SD 4.38Å; K62-M64 PolarHBondContact O-N 3.49Å; M64-F86 HydrophobicContact SD-CE1 3.96Å; M64-F86 HydrophobicContact SD-CZ 3.81Å; M64-L92 HydrophobicContact CB-CD1 4.31Å; M64-L92 HydrophobicContact CB-CD2 4.36Å; M64-L92 VanDerWaalsContact O-CD1 3.27Å; M64-L92 WeakPolarHBondContact O-CD1 3.29Å; M64-L92 HydrophobicContact SD-CD1 4.48Å
65	T	98.1	Very high	88.2	Confident	21 Å²	21	58.1 Å²	58.1	13%	0.129	31%	0.307	C	S	.	.			trans	-118.7	108.5	-173.2	52.1	0	0	0	0	111.8	H63 H124 P142 T145 V146	H63-T65 PolarHBondContact CD2-O 2.98Å; H63-T65 PolarHBondContact NE2-O 3.3Å; H63-T65 PolarHBondContact NE2-OG1 3.5Å; T65-H124 CarbonylContact C-O 3.53Å; T65-H124 WeakPolarHBondContact CA-O 3.19Å; T65-H124 HydrophobicContact CG2-CB 4.23Å; T65-P142 HydrophobicContact CG2-CG 3.58Å; T65-T145 WeakPolarHBondContact O-CA 3.44Å; T65-V146 PolarHBondContact O-N 3.26Å
66	V	98.5	Very high	90.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.1	-171.2	-174.8	0	0	0	0	110.9	L83 H124 V125 L126 V146 V148 L255 W257	V66-L83 HydrophobicContact CG1-CD2 4.11Å; V66-H124 PolarHBondContact N-O 3.24Å; V66-V125 CarbonylContact O-C 3.59Å; V66-V125 VanDerWaalsContact O-CA 3.27Å; V66-V125 WeakPolarHBondContact O-CA 3.48Å; V66-L126 PolarHBondContact O-N 3.24Å; V66-V146 WeakPolarHBondContact CA-O 3.44Å; V66-V148 HydrophobicContact CG1-CG2 3.96Å; V66-L255 HydrophobicContact CG2-CD1 3.9Å; V66-L255 HydrophobicContact CG2-CD2 3.75Å; V66-L255 HydrophobicContact CG2-CG 4.5Å; V66-W257 HydrophobicContact CG2-CZ2 4.15Å
67	A	98.6	Very high	92.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	105	169.7	0	0	0	0	0	109.3	M141 T145 V146 Y147 V148	A67-M141 HydrophobicContact CB-CE 4.16Å; A67-M141 HydrophobicContact CB-CG 4.23Å; A67-T145 HydrophobicContact CB-CG2 3.72Å; A67-V146 PolarHBondContact N-O 3.18Å; A67-Y147 HydrophobicContact CB-CD1 3.44Å; A67-Y147 VanDerWaalsContact CB-CD1 3.44Å; A67-Y147 HydrophobicContact CB-CE1 3.56Å; A67-Y147 HydrophobicContact CB-CG 4.15Å; A67-Y147 CarbonylContact O-C 3.27Å; A67-Y147 VanDerWaalsContact O-CA 3.32Å; A67-Y147 WeakPolarHBondContact O-CA 3.32Å; A67-V148 PolarHBondContact O-N 3.39Å
68	F	98.8	Very high	94.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	108.1	173	173	-126	0	0	0	110.4	K70 V79 L83 L126 A127 V148 I150 M239	F68-K70 HydrophobicContact CD1-CB 4.08Å; F68-K70 HydrophobicContact CE1-CB 3.7Å; F68-K70 HydrophobicContact CE1-CD 4.5Å; F68-K70 HydrophobicContact CE1-CG 3.83Å; F68-K70 HydrophobicContact CZ-CB 4.24Å; F68-K70 HydrophobicContact CZ-CG 4.31Å; F68-K70 PolarHBondContact O-N 3.27Å; F68-K70 VanDerWaalsContact O-N 3.11Å; F68-V79 HydrophobicContact CD1-CB 4.27Å; F68-V79 HydrophobicContact CD1-CG1 3.77Å; F68-V79 HydrophobicContact CD2-CG1 4.1Å; F68-V79 HydrophobicContact CE1-CB 3.62Å; F68-V79 HydrophobicContact CE1-CG1 3.59Å; F68-V79 HydrophobicContact CE2-CB 4.39Å; F68-V79 HydrophobicContact CE2-CG1 3.92Å; F68-V79 HydrophobicContact CG-CG1 4.02Å; F68-V79 HydrophobicContact CZ-CB 3.68Å; F68-V79 HydrophobicContact CZ-CG1 3.66Å; F68-V79 HydrophobicContact CZ-CG2 4.18Å; F68-L83 HydrophobicContact CB-CD1 3.24Å; F68-L83 HydrophobicContact CD1-CD1 3.83Å; F68-L83 HydrophobicContact CG-CD1 3.77Å; F68-L126 PolarHBondContact N-O 3.01Å; F68-A127 HydrophobicContact CB-CB 4.29Å; F68-A127 HydrophobicContact CD1-CB 4.09Å; F68-V148 CarbonylContact C-O 3.53Å; F68-V148 VanDerWaalsContact CA-O 3.26Å; F68-V148 WeakPolarHBondContact CA-O 3.47Å; F68-V148 HydrophobicContact CB-CG2 3.92Å; F68-V148 HydrophobicContact CD2-CG2 3.94Å; F68-V148 HydrophobicContact CG-CG2 4.35Å; F68-I150 HydrophobicContact CE2-CB 4.12Å; F68-I150 HydrophobicContact CE2-CG2 3.68Å; F68-I150 HydrophobicContact CZ-CB 4.41Å; F68-I150 HydrophobicContact CZ-CG2 3.57Å; F68-M239 HydrophobicContact CD2-CE 4.28Å; F68-M239 HydrophobicContact CE2-CE 3.77Å; F68-M239 HydrophobicContact CZ-CE 4.46Å
69	L	98.6	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	105.4	166.4	176.4	65.6	0	0	0	108.1	T71 L130 F132 V148 T149 L209 F235	L69-T71 PolarHBondContact O-N 3.35Å; L69-L130 HydrophobicContact CD1-CD1 3.37Å; L69-L130 HydrophobicContact CD1-CG 3.83Å; L69-F132 HydrophobicContact CD1-CB 4.19Å; L69-F132 HydrophobicContact CD2-CB 3.86Å; L69-F132 HydrophobicContact CD2-CD2 4.26Å; L69-F132 HydrophobicContact CD2-CG 4.19Å; L69-V148 PolarHBondContact N-O 3.31Å; L69-T149 PolarHBondContact O-OG1 2.85Å; L69-L209 HydrophobicContact CD2-CD2 3.61Å; L69-L209 HydrophobicContact CD2-CG 4.42Å; L69-F235 HydrophobicContact CB-CE1 3.66Å; L69-F235 HydrophobicContact CB-CZ 3.86Å; L69-F235 HydrophobicContact CD2-CE1 4.23Å; L69-F235 HydrophobicContact CD2-CE2 4.41Å; L69-F235 HydrophobicContact CD2-CZ 3.6Å; L69-F235 HydrophobicContact CG-CZ 4.39Å
70	K	98.4	Very high	96.9	Very high	2 Å²	2	25 Å²	25	1%	0.009	13%	0.132	C	C	.	.			trans	-83.6	105	178	-173.7	-176.1	172	180	0	110	F68 G76 T77 Q80 H129 E388	F68-K70 HydrophobicContact CD1-CB 4.08Å; F68-K70 HydrophobicContact CE1-CB 3.7Å; F68-K70 HydrophobicContact CE1-CD 4.5Å; F68-K70 HydrophobicContact CE1-CG 3.83Å; F68-K70 HydrophobicContact CZ-CB 4.24Å; F68-K70 HydrophobicContact CZ-CG 4.31Å; F68-K70 PolarHBondContact O-N 3.27Å; F68-K70 VanDerWaalsContact O-N 3.11Å; K70-G76 VanDerWaalsContact CE-C 3.48Å; K70-T77 PolarHBondContact NZ-OG1 2.98Å; K70-Q80 HydrophobicContact CD-CB 4.39Å; K70-H129 WeakPolarHBondContact CE-NE2 3.38Å; K70-H129 PolarHBondContact O-ND1 3.09Å; K70-E388 IonicContact NZ-OE1 3.94Å; K70-E388 PolarHBondContact NZ-OE1 3.41Å; K70-E388 IonicContact NZ-OE2 2.77Å; K70-E388 PolarHBondContact NZ-OE2 3.04Å
71	T	98	Very high	97.6	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.111	C	C	.	.			trans	-80.5	157.5	173.5	56.9	0	0	0	0	111.7	L69 T74 H129 I150 L151 L205 D208	L69-T71 PolarHBondContact O-N 3.35Å; T71-T74 PolarHBondContact O-OG1 2.96Å; T71-T74 WeakPolarHBondContact OG1-CB 3.38Å; T71-T74 WeakPolarHBondContact OG1-CG2 3.25Å; T71-T74 PolarHBondContact OG1-OG1 2.93Å; T71-H129 PolarHBondContact O-CE1 3.47Å; T71-I150 PolarHBondContact OG1-O 2.6Å; T71-L151 HydrophobicContact CG2-CD2 4.5Å; T71-L205 HydrophobicContact CG2-CD2 4.1Å; T71-D208 VanDerWaalsContact CA-OD2 3.3Å; T71-D208 WeakPolarHBondContact CA-OD2 3.44Å; T71-D208 HydrophobicContact CG2-CB 4.05Å
72	H	97.6	Very high	97.9	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	132.9	-175.6	-70.4	88.4	0	0	0	112.8	T74 Y107 H129 L161 F200 T204 D208	H72-T74 VanDerWaalsContact C-N 3.27Å; H72-T74 WeakPolarHBondContact O-CG2 3.48Å; H72-T74 PolarHBondContact O-N 2.9Å; H72-Y107 AromaticContact CE1-CE1 3.83Å; H72-Y107 AromaticContact CE1-CE2 3.76Å; H72-Y107 AromaticContact CE1-CZ 3.54Å; H72-H129 AromaticContact CD2-CE1 3.62Å; H72-H129 AromaticContact CD2-ND1 3.75Å; H72-H129 AromaticContact CD2-NE2 3.99Å; H72-H129 AromaticContact CE1-CG 3.89Å; H72-H129 AromaticContact CE1-ND1 3.59Å; H72-H129 AromaticContact CG-CE1 3.86Å; H72-H129 AromaticContact CG-ND1 3.91Å; H72-H129 AromaticContact ND1-ND1 3.8Å; H72-H129 AromaticContact NE2-CD2 3.99Å; H72-H129 AromaticContact NE2-CE1 3.86Å; H72-H129 AromaticContact NE2-CG 3.63Å; H72-H129 AromaticContact NE2-ND1 3.55Å; H72-L161 HydrophobicContact CB-CD2 4.25Å; H72-F200 HydrophobicContact CB-CE1 4.49Å; H72-F200 AromaticContact CD2-CE1 3.6Å; H72-F200 AromaticContact CE1-CE1 3.9Å; H72-F200 AromaticContact CG-CE1 3.79Å; H72-F200 AromaticContact ND1-CE1 3.97Å; H72-F200 AromaticContact NE2-CE1 3.69Å; H72-F200 AromaticContact NE2-CZ 3.98Å; H72-T204 HydrophobicContact CB-CG2 4.07Å; H72-D208 IonicContact CE1-OD1 3.66Å; H72-D208 IonicContact CG-OD2 3.96Å; H72-D208 PolarHBondContact N-OD2 2.84Å; H72-D208 VanDerWaalsContact ND1-CG 3.31Å; H72-D208 IonicContact ND1-OD1 3.76Å; H72-D208 PolarHBondContact ND1-OD1 2.9Å; H72-D208 IonicContact ND1-OD2 2.73Å; H72-D208 PolarHBondContact ND1-OD2 3.43Å
73	K	96.3	Very high	98	Very high	26 Å²	26	11.3 Å²	11.3	11%	0.113	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	24.8	173	-47	-52.2	-63.5	-179.7	0	115.9	R152 M157 S160 L161 Y164 Y165	K73-R152 WeakPolarHBondContact O-CD 3.19Å; K73-R152 PolarHBondContact O-NH1 3.45Å; K73-M157 HydrophobicContact CB-CG 4.11Å; K73-S160 WeakPolarHBondContact CE-OG 3.48Å; K73-L161 HydrophobicContact CB-CD2 4.38Å; K73-L161 HydrophobicContact CB-CG 4.3Å; K73-L161 HydrophobicContact CD-CD2 4.5Å; K73-L161 HydrophobicContact CG-CD2 3.44Å; K73-L161 VanDerWaalsContact CG-CD2 3.44Å; K73-L161 HydrophobicContact CG-CG 3.72Å; K73-Y164 HydrophobicContact CD-CG 4.43Å; K73-Y165 HydrophobicContact CD-CE2 4.29Å
74	T	97.5	Very high	98.1	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	S	Bend	trans	-107.1	26.6	-179.3	54.9	0	0	0	0	113.9	T71 H72 G76 I150 R152 M157 L205	T71-T74 PolarHBondContact O-OG1 2.96Å; T71-T74 WeakPolarHBondContact OG1-CB 3.38Å; T71-T74 WeakPolarHBondContact OG1-CG2 3.25Å; T71-T74 PolarHBondContact OG1-OG1 2.93Å; H72-T74 VanDerWaalsContact C-N 3.27Å; H72-T74 WeakPolarHBondContact O-CG2 3.48Å; H72-T74 PolarHBondContact O-N 2.9Å; T74-G76 PolarHBondContact O-N 2.99Å; T74-I150 VanDerWaalsContact O-CD1 3.23Å; T74-I150 WeakPolarHBondContact O-CD1 3.38Å; T74-I150 WeakPolarHBondContact O-CG1 3.39Å; T74-I150 WeakPolarHBondContact OG1-CG2 3.45Å; T74-R152 HydrophobicContact CG2-CB 3.79Å; T74-M157 HydrophobicContact CG2-SD 3.98Å; T74-L205 HydrophobicContact CG2-CD2 3.78Å
75	A	96.4	Very high	98.1	Very high	40 Å²	40	7.1 Å²	7.1	33%	0.331	4%	0.042	S	C	.	.	S	Bend	trans	64.5	13.7	-172.6	0	0	0	0	0	115.5	T77 T78 A241 F244	A75-T77 VanDerWaalsContact C-N 3.26Å; A75-T77 PolarHBondContact O-N 3.35Å; A75-T77 VanDerWaalsContact O-N 3.13Å; A75-T78 WeakPolarHBondContact O-CB 3.49Å; A75-T78 PolarHBondContact O-N 3.26Å; A75-A241 HydrophobicContact CB-CB 4.48Å; A75-F244 HydrophobicContact CB-CD2 4.23Å; A75-F244 HydrophobicContact CB-CE2 4.03Å
76	G	97.4	Very high	98.1	Very high	3 Å²	3	6.2 Å²	6.2	3%	0.031	4%	0.036	C	C	.	.	H	α-helix	trans	-59.6	-23.9	-178.1	0	0	0	0	0	116.1	K70 T74 T78 V79 Q80	K70-G76 VanDerWaalsContact CE-C 3.48Å; T74-G76 PolarHBondContact O-N 2.99Å; G76-T78 VanDerWaalsContact C-N 3.26Å; G76-T78 PolarHBondContact O-N 3.07Å; G76-V79 PolarHBondContact O-N 3.25Å; G76-Q80 WeakPolarHBondContact O-CB 3.31Å; G76-Q80 PolarHBondContact O-N 3.34Å
77	T	97.4	Very high	98.1	Very high	10 Å²	10	6.2 Å²	6.2	6%	0.061	4%	0.037	C	C	.	.	H	α-helix	trans	-62.4	-35	174.8	-57.1	0	0	0	0	111.8	K70 A75 N81 L267 N268 E388	K70-T77 PolarHBondContact NZ-OG1 2.98Å; A75-T77 VanDerWaalsContact C-N 3.26Å; A75-T77 PolarHBondContact O-N 3.35Å; A75-T77 VanDerWaalsContact O-N 3.13Å; T77-N81 PolarHBondContact O-N 2.95Å; T77-N81 VanDerWaalsContact O-N 3.09Å; T77-L267 HydrophobicContact CG2-CB 3.8Å; T77-L267 HydrophobicContact CG2-CD1 4.41Å; T77-N268 HydrophobicContact CG2-CB 4.07Å; T77-N268 PolarHBondContact OG1-ND2 3.39Å; T77-E388 HydrophobicContact CG2-CB 4.09Å
78	T	98.3	Very high	98	Very high	7 Å²	7	7.9 Å²	7.9	4%	0.043	4%	0.044	C	C	.	.	H	α-helix	trans	-68.9	-45.8	177.2	-59.1	0	0	0	0	110.6	A75 G76 N81 I82 F244 Y264 L267	A75-T78 WeakPolarHBondContact O-CB 3.49Å; A75-T78 PolarHBondContact O-N 3.26Å; G76-T78 VanDerWaalsContact C-N 3.26Å; G76-T78 PolarHBondContact O-N 3.07Å; T78-N81 PolarHBondContact O-N 3.01Å; T78-I82 WeakPolarHBondContact O-CG1 3.47Å; T78-I82 PolarHBondContact O-N 2.82Å; T78-I82 VanDerWaalsContact O-N 3.12Å; T78-F244 HydrophobicContact CG2-CE1 3.8Å; T78-F244 HydrophobicContact CG2-CZ 3.54Å; T78-Y264 HydrophobicContact CG2-CD2 3.43Å; T78-Y264 VanDerWaalsContact CG2-CD2 3.43Å; T78-Y264 HydrophobicContact CG2-CE2 4.26Å; T78-Y264 HydrophobicContact CG2-CG 3.8Å; T78-L267 PolarHBondContact OG1-N 3.5Å
79	V	98.8	Very high	97.9	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-43.3	176.5	-179.2	0	0	0	0	111.2	F68 G76 N81 I82 L83 I150 M239 F244	F68-V79 HydrophobicContact CD1-CB 4.27Å; F68-V79 HydrophobicContact CD1-CG1 3.77Å; F68-V79 HydrophobicContact CD2-CG1 4.1Å; F68-V79 HydrophobicContact CE1-CB 3.62Å; F68-V79 HydrophobicContact CE1-CG1 3.59Å; F68-V79 HydrophobicContact CE2-CB 4.39Å; F68-V79 HydrophobicContact CE2-CG1 3.92Å; F68-V79 HydrophobicContact CG-CG1 4.02Å; F68-V79 HydrophobicContact CZ-CB 3.68Å; F68-V79 HydrophobicContact CZ-CG1 3.66Å; F68-V79 HydrophobicContact CZ-CG2 4.18Å; G76-V79 PolarHBondContact O-N 3.25Å; V79-N81 VanDerWaalsContact C-N 3.31Å; V79-N81 PolarHBondContact O-N 2.89Å; V79-I82 WeakPolarHBondContact O-CB 3.47Å; V79-I82 PolarHBondContact O-N 3.44Å; V79-L83 HydrophobicContact CG1-CD1 4.13Å; V79-L83 HydrophobicContact CG1-CG 4.41Å; V79-L83 WeakPolarHBondContact O-CG 3.47Å; V79-L83 PolarHBondContact O-N 3.5Å; V79-I150 HydrophobicContact CG2-CD1 4.3Å; V79-M239 HydrophobicContact CB-CE 4.47Å; V79-M239 HydrophobicContact CG1-CE 3.84Å; V79-M239 HydrophobicContact CG2-CE 3.87Å; V79-F244 HydrophobicContact CG2-CE2 3.72Å; V79-F244 HydrophobicContact CG2-CZ 3.86Å
80	Q	98.7	Very high	97.8	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.009	8%	0.08	C	C	.	.	H	α-helix	trans	-56.9	-44.9	175.3	176.1	-171.7	72.4	0	0	111.7	K70 G76 I82 L83 F84 A127 S128 E388	K70-Q80 HydrophobicContact CD-CB 4.39Å; G76-Q80 WeakPolarHBondContact O-CB 3.31Å; G76-Q80 PolarHBondContact O-N 3.34Å; Q80-I82 VanDerWaalsContact C-N 3.34Å; Q80-I82 PolarHBondContact O-N 3.45Å; Q80-L83 PolarHBondContact O-N 2.82Å; Q80-F84 HydrophobicContact CG-CD1 4.12Å; Q80-F84 HydrophobicContact CG-CD2 4.05Å; Q80-F84 HydrophobicContact CG-CE1 3.77Å; Q80-F84 HydrophobicContact CG-CE2 3.71Å; Q80-F84 HydrophobicContact CG-CG 4.26Å; Q80-F84 HydrophobicContact CG-CZ 3.56Å; Q80-F84 WeakPolarHBondContact O-CB 3.3Å; Q80-F84 WeakPolarHBondContact O-CD1 3.35Å; Q80-F84 WeakPolarHBondContact O-CG 3.5Å; Q80-F84 PolarHBondContact O-N 3.41Å; Q80-A127 HydrophobicContact CB-CB 4.32Å; Q80-A127 WeakPolarHBondContact CB-O 3.26Å; Q80-A127 HydrophobicContact CG-CB 4.07Å; Q80-A127 WeakPolarHBondContact CG-O 3.42Å; Q80-A127 PolarHBondContact NE2-O 3.49Å; Q80-S128 PolarHBondContact NE2-OG 3.44Å; Q80-E388 PolarHBondContact NE2-OE1 2.77Å; Q80-E388 PolarHBondContact OE1-OE1 3.44Å
81	N	98.6	Very high	97.7	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-41.2	177.4	-177.8	-80.4	0	0	0	112.1	T77 T78 V79 F84 R85 L267 K383 L384 M386	T77-N81 PolarHBondContact O-N 2.95Å; T77-N81 VanDerWaalsContact O-N 3.09Å; T78-N81 PolarHBondContact O-N 3.01Å; V79-N81 VanDerWaalsContact C-N 3.31Å; V79-N81 PolarHBondContact O-N 2.89Å; N81-F84 PolarHBondContact O-N 3.4Å; N81-R85 WeakPolarHBondContact O-CB 3.49Å; N81-R85 VanDerWaalsContact O-CG 3.31Å; N81-R85 WeakPolarHBondContact O-CG 3.48Å; N81-R85 PolarHBondContact O-N 3.43Å; N81-R85 WeakPolarHBondContact OD1-CD 3.44Å; N81-L267 HydrophobicContact CB-CD1 3.54Å; N81-K383 PolarHBondContact ND2-O 2.9Å; N81-L384 PolarHBondContact OD1-O 3.27Å; N81-M386 PolarHBondContact ND2-O 3.01Å
82	I	98.8	Very high	97.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-55.5	-52.6	172.8	-67.5	168.8	0	0	0	110.2	T78 V79 Q80 F84 R85 F86 L248 W257 D261 Y264	T78-I82 WeakPolarHBondContact O-CG1 3.47Å; T78-I82 PolarHBondContact O-N 2.82Å; T78-I82 VanDerWaalsContact O-N 3.12Å; V79-I82 WeakPolarHBondContact O-CB 3.47Å; V79-I82 PolarHBondContact O-N 3.44Å; Q80-I82 VanDerWaalsContact C-N 3.34Å; Q80-I82 PolarHBondContact O-N 3.45Å; I82-F84 PolarHBondContact O-N 3.43Å; I82-R85 PolarHBondContact O-N 2.85Å; I82-F86 WeakPolarHBondContact O-CB 3.41Å; I82-F86 PolarHBondContact O-N 3.45Å; I82-L248 HydrophobicContact CD1-CD1 3.89Å; I82-L248 HydrophobicContact CD1-CD2 3.68Å; I82-L248 HydrophobicContact CD1-CG 4.47Å; I82-W257 HydrophobicContact CG2-CZ3 4.14Å; I82-D261 WeakPolarHBondContact CG2-O 3.44Å; I82-Y264 HydrophobicContact CD1-CG 4.44Å
83	L	98.8	Very high	97.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.6	-37.9	-178	-63.6	175.7	0	0	0	112.7	V66 F68 V79 Q80 F86 A87 V125 A127 W257	V66-L83 HydrophobicContact CG1-CD2 4.11Å; F68-L83 HydrophobicContact CB-CD1 3.24Å; F68-L83 HydrophobicContact CD1-CD1 3.83Å; F68-L83 HydrophobicContact CG-CD1 3.77Å; V79-L83 HydrophobicContact CG1-CD1 4.13Å; V79-L83 HydrophobicContact CG1-CG 4.41Å; V79-L83 WeakPolarHBondContact O-CG 3.47Å; V79-L83 PolarHBondContact O-N 3.5Å; Q80-L83 PolarHBondContact O-N 2.82Å; L83-F86 PolarHBondContact O-N 3.35Å; L83-A87 VanDerWaalsContact O-CB 3.32Å; L83-A87 WeakPolarHBondContact O-CB 3.28Å; L83-A87 PolarHBondContact O-N 3.48Å; L83-V125 HydrophobicContact CB-CG1 4Å; L83-A127 HydrophobicContact CB-CB 4.14Å; L83-A127 HydrophobicContact CD1-CB 3.7Å; L83-W257 HydrophobicContact CD2-CH2 3.45Å; L83-W257 VanDerWaalsContact CD2-CH2 3.45Å; L83-W257 HydrophobicContact CD2-CZ2 4.49Å; L83-W257 HydrophobicContact CD2-CZ3 3.94Å
84	F	98.6	Very high	97.9	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-43.4	176	-79.3	9	0	0	0	111.9	Q80 N81 I82 A87 E88 V94 L96 A127 Y391 L395	Q80-F84 HydrophobicContact CG-CD1 4.12Å; Q80-F84 HydrophobicContact CG-CD2 4.05Å; Q80-F84 HydrophobicContact CG-CE1 3.77Å; Q80-F84 HydrophobicContact CG-CE2 3.71Å; Q80-F84 HydrophobicContact CG-CG 4.26Å; Q80-F84 HydrophobicContact CG-CZ 3.56Å; Q80-F84 WeakPolarHBondContact O-CB 3.3Å; Q80-F84 WeakPolarHBondContact O-CD1 3.35Å; Q80-F84 WeakPolarHBondContact O-CG 3.5Å; Q80-F84 PolarHBondContact O-N 3.41Å; N81-F84 PolarHBondContact O-N 3.4Å; I82-F84 PolarHBondContact O-N 3.43Å; F84-A87 PolarHBondContact O-N 3.5Å; F84-E88 VanDerWaalsContact O-CB 3.32Å; F84-E88 WeakPolarHBondContact O-CB 3.27Å; F84-E88 PolarHBondContact O-N 2.91Å; F84-V94 HydrophobicContact CD1-CG1 3.78Å; F84-V94 HydrophobicContact CD1-CG2 4.34Å; F84-V94 HydrophobicContact CE1-CG1 3.36Å; F84-V94 HydrophobicContact CZ-CG1 4.12Å; F84-L96 HydrophobicContact CZ-CD2 4.14Å; F84-A127 HydrophobicContact CD1-CB 4.3Å; F84-A127 HydrophobicContact CE1-CB 3.87Å; F84-Y391 HydrophobicContact CB-CD1 4.03Å; F84-Y391 HydrophobicContact CB-CE1 3.78Å; F84-Y391 HydrophobicContact CD2-CD1 4Å; F84-Y391 AromaticContact CD2-CG 3.98Å; F84-Y391 HydrophobicContact CD2-CG 3.98Å; F84-L395 HydrophobicContact CB-CD1 3.77Å; F84-L395 HydrophobicContact CD1-CD1 3.97Å; F84-L395 HydrophobicContact CD2-CD1 3.54Å; F84-L395 HydrophobicContact CE1-CD1 4.45Å; F84-L395 HydrophobicContact CE2-CD1 4.07Å; F84-L395 HydrophobicContact CG-CD1 3.48Å; F84-L395 VanDerWaalsContact CG-CD1 3.48Å; F84-L395 HydrophobicContact CZ-CD1 4.49Å
85	R	98.4	Very high	97.9	Very high	30 Å²	30	22.3 Å²	22.3	11%	0.113	11%	0.112	C	C	.	.	H	α-helix	trans	-65.5	-41.8	176	-73.3	172.3	61.1	-123.4	-3.8	111.8	N81 I82 E88 R89 L263 K383 Y391	N81-R85 WeakPolarHBondContact O-CB 3.49Å; N81-R85 VanDerWaalsContact O-CG 3.31Å; N81-R85 WeakPolarHBondContact O-CG 3.48Å; N81-R85 PolarHBondContact O-N 3.43Å; N81-R85 WeakPolarHBondContact OD1-CD 3.44Å; I82-R85 PolarHBondContact O-N 2.85Å; R85-E88 PolarHBondContact O-N 2.87Å; R85-R89 WeakPolarHBondContact O-CB 3.39Å; R85-R89 PolarHBondContact O-N 3.31Å; R85-L263 PolarHBondContact NH1-O 3.27Å; R85-K383 HydrophobicContact CG-CB 4.34Å; R85-Y391 WeakPolarHBondContact CA-OH 3.37Å; R85-Y391 HydrophobicContact CG-CE1 3.76Å; R85-Y391 VanDerWaalsContact CG-OH 3.26Å; R85-Y391 WeakPolarHBondContact CG-OH 3.33Å
86	F	98.5	Very high	98	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-50.4	174.3	-177	-90.9	0	0	0	111	K62 M64 I82 L83 E88 R89 H90 L92 W257 D261	K62-F86 HydrophobicContact CD-CE2 4.25Å; K62-F86 HydrophobicContact CD-CZ 4.49Å; M64-F86 HydrophobicContact SD-CE1 3.96Å; M64-F86 HydrophobicContact SD-CZ 3.81Å; I82-F86 WeakPolarHBondContact O-CB 3.41Å; I82-F86 PolarHBondContact O-N 3.45Å; L83-F86 PolarHBondContact O-N 3.35Å; F86-E88 VanDerWaalsContact C-N 3.28Å; F86-E88 PolarHBondContact O-N 3.25Å; F86-R89 PolarHBondContact O-N 2.96Å; F86-H90 AromaticContact CD2-CD2 3.65Å; F86-H90 AromaticContact CD2-NE2 3.95Å; F86-H90 AromaticContact CE1-CD2 3.85Å; F86-H90 AromaticContact CE2-CD2 3.38Å; F86-H90 WeakPolarHBondContact CE2-CD2 3.41Å; F86-H90 AromaticContact CE2-NE2 3.45Å; F86-H90 WeakPolarHBondContact CE2-NE2 3.45Å; F86-H90 AromaticContact CZ-CD2 3.49Å; F86-H90 VanDerWaalsContact CZ-CD2 3.49Å; F86-H90 WeakPolarHBondContact CZ-CD2 3.36Å; F86-H90 AromaticContact CZ-NE2 3.84Å; F86-H90 PolarHBondContact O-CD2 3.26Å; F86-H90 VanDerWaalsContact O-CD2 3.31Å; F86-H90 PolarHBondContact O-N 2.83Å; F86-L92 HydrophobicContact CD1-CD1 4.06Å; F86-L92 HydrophobicContact CE1-CD1 3.84Å; F86-W257 HydrophobicContact CB-CH2 3.75Å; F86-W257 HydrophobicContact CB-CZ2 4.27Å; F86-W257 HydrophobicContact CB-CZ3 4.1Å; F86-W257 AromaticContact CD1-CE2 3.98Å; F86-W257 AromaticContact CD1-CH2 3.66Å; F86-W257 HydrophobicContact CD1-CH2 3.66Å; F86-W257 AromaticContact CD1-CZ2 3.31Å; F86-W257 HydrophobicContact CD1-CZ2 3.31Å; F86-W257 AromaticContact CD2-CD2 3.92Å; F86-W257 HydrophobicContact CD2-CD2 3.92Å; F86-W257 AromaticContact CD2-CE2 3.72Å; F86-W257 HydrophobicContact CD2-CE3 4.09Å; F86-W257 AromaticContact CD2-CH2 3.89Å; F86-W257 HydrophobicContact CD2-CH2 3.89Å; F86-W257 AromaticContact CD2-CZ2 3.74Å; F86-W257 HydrophobicContact CD2-CZ2 3.74Å; F86-W257 HydrophobicContact CD2-CZ3 4.08Å; F86-W257 AromaticContact CE1-CE2 3.74Å; F86-W257 HydrophobicContact CE1-CH2 4.23Å; F86-W257 AromaticContact CE1-CZ2 3.41Å; F86-W257 HydrophobicContact CE1-CZ2 3.41Å; F86-W257 VanDerWaalsContact CE1-CZ2 3.41Å; F86-W257 AromaticContact CE1-NE1 3.83Å; F86-W257 AromaticContact CE2-CD1 3.86Å; F86-W257 AromaticContact CE2-CD2 3.8Å; F86-W257 HydrophobicContact CE2-CD2 3.8Å; F86-W257 AromaticContact CE2-CE2 3.45Å; F86-W257 VanDerWaalsContact CE2-CE2 3.45Å; F86-W257 HydrophobicContact CE2-CE3 4.44Å; F86-W257 HydrophobicContact CE2-CG 4.07Å; F86-W257 HydrophobicContact CE2-CH2 4.43Å; F86-W257 AromaticContact CE2-CZ2 3.83Å; F86-W257 HydrophobicContact CE2-CZ2 3.83Å; F86-W257 AromaticContact CE2-NE1 3.5Å; F86-W257 HydrophobicContact CG-CD2 4.46Å; F86-W257 AromaticContact CG-CE2 3.97Å; F86-W257 HydrophobicContact CG-CE3 4.47Å; F86-W257 AromaticContact CG-CH2 3.46Å; F86-W257 HydrophobicContact CG-CH2 3.46Å; F86-W257 VanDerWaalsContact CG-CH2 3.46Å; F86-W257 AromaticContact CG-CZ2 3.48Å; F86-W257 HydrophobicContact CG-CZ2 3.48Å; F86-W257 VanDerWaalsContact CG-CZ2 3.48Å; F86-W257 AromaticContact CG-CZ3 4Å; F86-W257 HydrophobicContact CG-CZ3 4Å; F86-W257 AromaticContact CZ-CD1 3.96Å; F86-W257 HydrophobicContact CZ-CD2 4.28Å; F86-W257 AromaticContact CZ-CE2 3.47Å; F86-W257 VanDerWaalsContact CZ-CE2 3.47Å; F86-W257 AromaticContact CZ-CZ2 3.68Å; F86-W257 HydrophobicContact CZ-CZ2 3.68Å; F86-W257 AromaticContact CZ-NE1 3.25Å; F86-W257 VanDerWaalsContact CZ-NE1 3.25Å; F86-D261 HydrophobicContact CD2-CB 3.93Å; F86-D261 HydrophobicContact CE2-CB 4.31Å
87	A	98.3	Very high	97.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-57.5	-43.1	177.5	0	0	0	0	0	112.1	L83 F84 H90 N91 L92 V94 V125	L83-A87 VanDerWaalsContact O-CB 3.32Å; L83-A87 WeakPolarHBondContact O-CB 3.28Å; L83-A87 PolarHBondContact O-N 3.48Å; F84-A87 PolarHBondContact O-N 3.5Å; A87-H90 CarbonylContact O-C 3.22Å; A87-H90 PolarHBondContact O-N 3.25Å; A87-N91 PolarHBondContact O-N 2.95Å; A87-L92 HydrophobicContact CB-CB 4Å; A87-L92 PolarHBondContact O-N 2.04Å; A87-V94 HydrophobicContact CB-CG2 3.37Å; A87-V125 HydrophobicContact CB-CB 4.28Å; A87-V125 HydrophobicContact CB-CG2 3.99Å
88	E	96.8	Very high	97.8	Very high	35 Å²	35	23.8 Å²	23.8	16%	0.164	11%	0.111	C	C	.	.	H	α-helix	trans	-64.1	-46.6	178.1	-175	170.7	-167.8	0	0	112.6	F84 R85 F86 H90 N91 Y391 Y394 L395 K398	F84-E88 VanDerWaalsContact O-CB 3.32Å; F84-E88 WeakPolarHBondContact O-CB 3.27Å; F84-E88 PolarHBondContact O-N 2.91Å; R85-E88 PolarHBondContact O-N 2.87Å; F86-E88 VanDerWaalsContact C-N 3.28Å; F86-E88 PolarHBondContact O-N 3.25Å; E88-H90 VanDerWaalsContact C-N 3.26Å; E88-H90 PolarHBondContact O-N 2.77Å; E88-N91 PolarHBondContact O-N 2.95Å; E88-Y391 WeakPolarHBondContact OE2-CE2 3.43Å; E88-Y391 PolarHBondContact OE2-OH 3.32Å; E88-Y394 WeakPolarHBondContact OE1-CE1 3.19Å; E88-Y394 PolarHBondContact OE1-OH 2.58Å; E88-L395 HydrophobicContact CB-CD2 4.32Å; E88-K398 VanDerWaalsContact CG-NZ 3.25Å; E88-K398 IonicContact OE1-NZ 3.63Å; E88-K398 PolarHBondContact OE1-NZ 2.77Å
89	R	96.5	Very high	97.4	Very high	130 Å²	130	27.4 Å²	27.4	49%	0.491	14%	0.135	S	C	.	.	H	α-helix	trans	-60.4	-36	178.6	179.9	-176.5	-69.6	168.2	-4.9	112.1	R85 F86 D260 D261	R85-R89 WeakPolarHBondContact O-CB 3.39Å; R85-R89 PolarHBondContact O-N 3.31Å; F86-R89 PolarHBondContact O-N 2.96Å; R89-D260 PolarHBondContact NH1-O 2.85Å; R89-D261 IonicContact CZ-OD1 3.68Å; R89-D261 IonicContact NH1-OD1 2.82Å; R89-D261 PolarHBondContact NH1-OD1 3.5Å
90	H	96.6	Very high	97	Very high	58 Å²	58	31.7 Å²	31.7	27%	0.269	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	12.8	-177.7	-68.9	-75.2	0	0	0	113.6	F86 A87 E88 L92	F86-H90 AromaticContact CD2-CD2 3.65Å; F86-H90 AromaticContact CD2-NE2 3.95Å; F86-H90 AromaticContact CE1-CD2 3.85Å; F86-H90 AromaticContact CE2-CD2 3.38Å; F86-H90 WeakPolarHBondContact CE2-CD2 3.41Å; F86-H90 AromaticContact CE2-NE2 3.45Å; F86-H90 WeakPolarHBondContact CE2-NE2 3.45Å; F86-H90 AromaticContact CZ-CD2 3.49Å; F86-H90 VanDerWaalsContact CZ-CD2 3.49Å; F86-H90 WeakPolarHBondContact CZ-CD2 3.36Å; F86-H90 AromaticContact CZ-NE2 3.84Å; F86-H90 PolarHBondContact O-CD2 3.26Å; F86-H90 VanDerWaalsContact O-CD2 3.31Å; F86-H90 PolarHBondContact O-N 2.83Å; A87-H90 CarbonylContact O-C 3.22Å; A87-H90 PolarHBondContact O-N 3.25Å; E88-H90 VanDerWaalsContact C-N 3.26Å; E88-H90 PolarHBondContact O-N 2.77Å; H90-L92 HydrophobicContact CB-CD1 4.13Å; H90-L92 HydrophobicContact CB-CD2 4.45Å; H90-L92 HydrophobicContact CB-CG 3.87Å; H90-L92 PolarHBondContact O-N 3.23Å; H90-L92 VanDerWaalsContact O-N 3.15Å
91	N	96.4	Very high	96.6	Very high	106 Å²	106	31.9 Å²	31.9	57%	0.567	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	32.7	179.8	-164.7	34.4	0	0	0	113.8	A87 E88 R402	A87-N91 PolarHBondContact O-N 2.95Å; E88-N91 PolarHBondContact O-N 2.95Å; N91-R402 PolarHBondContact O-NH1 3.44Å; N91-R402 WeakPolarHBondContact OD1-CD 3.49Å; N91-R402 PolarHBondContact OD1-NH1 3.05Å
92	L	97.6	Very high	96.1	Very high	18 Å²	18	34.7 Å²	34.7	9%	0.094	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-78.8	162.2	178.8	-56.9	179.4	0	0	0	111.2	M64 F86 A87 H90 H124 V125 R402	M64-L92 HydrophobicContact CB-CD1 4.31Å; M64-L92 HydrophobicContact CB-CD2 4.36Å; M64-L92 VanDerWaalsContact O-CD1 3.27Å; M64-L92 WeakPolarHBondContact O-CD1 3.29Å; M64-L92 HydrophobicContact SD-CD1 4.48Å; F86-L92 HydrophobicContact CD1-CD1 4.06Å; F86-L92 HydrophobicContact CE1-CD1 3.84Å; A87-L92 HydrophobicContact CB-CB 4Å; A87-L92 PolarHBondContact O-N 2.04Å; H90-L92 HydrophobicContact CB-CD1 4.13Å; H90-L92 HydrophobicContact CB-CD2 4.45Å; H90-L92 HydrophobicContact CB-CG 3.87Å; H90-L92 PolarHBondContact O-N 3.23Å; H90-L92 VanDerWaalsContact O-N 3.15Å; L92-H124 HydrophobicContact CB-CB 4Å; L92-H124 HydrophobicContact CD1-CB 4.46Å; L92-H124 HydrophobicContact CD2-CB 4.32Å; L92-H124 HydrophobicContact CG-CB 4.49Å; L92-V125 HydrophobicContact CD1-CG2 4.27Å; L92-R402 PolarHBondContact O-NH1 3.38Å; L92-R402 PolarHBondContact O-NH2 3.1Å
93	T	98.2	Very high	95.6	Very high	22 Å²	22	36 Å²	36	14%	0.135	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-92.8	123	172.3	-56.2	0	0	0	0	109.3	T120 H124 V125 R402	T93-T120 WeakPolarHBondContact CG2-O 3.38Å; T93-H124 PolarHBondContact N-ND1 3.17Å; T93-H124 PolarHBondContact O-N 2.99Å; T93-V125 PolarHBondContact O-N 3.03Å; T93-V125 VanDerWaalsContact O-N 3.1Å; T93-R402 PolarHBondContact OG1-NH2 3.34Å
94	V	98.4	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-92.8	127.9	171.1	-177.8	0	0	0	0	109.1	F84 A87 L96 T120 V125 L395 Q399	F84-V94 HydrophobicContact CD1-CG1 3.78Å; F84-V94 HydrophobicContact CD1-CG2 4.34Å; F84-V94 HydrophobicContact CE1-CG1 3.36Å; F84-V94 HydrophobicContact CZ-CG1 4.12Å; A87-V94 HydrophobicContact CB-CG2 3.37Å; V94-L96 HydrophobicContact CB-CG 4.47Å; V94-L96 HydrophobicContact CG1-CD2 3.99Å; V94-L96 HydrophobicContact CG1-CG 4.21Å; V94-L96 PolarHBondContact O-N 3.39Å; V94-T120 VanDerWaalsContact O-CB 3.3Å; V94-T120 WeakPolarHBondContact O-CB 3.34Å; V94-V125 CarbonylContact C-O 3.58Å; V94-V125 VanDerWaalsContact CA-O 3.29Å; V94-V125 WeakPolarHBondContact CA-O 3.32Å; V94-V125 HydrophobicContact CG2-CB 4.27Å; V94-L395 HydrophobicContact CB-CD1 4.37Å; V94-L395 HydrophobicContact CG1-CD1 4.49Å; V94-L395 HydrophobicContact CG2-CD1 4.02Å; V94-Q399 PolarHBondContact O-NE2 3.08Å; V94-Q399 PolarHBondContact O-OE1 3.12Å
95	A	98.1	Very high	95.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-62	120.1	168.7	0	0	0	0	0	108.9	F105 V116 P123 V125 L126	A95-F105 HydrophobicContact CB-CZ 4.16Å; A95-F105 WeakPolarHBondContact O-CZ 3.34Å; A95-V116 HydrophobicContact CB-CG1 4.12Å; A95-P123 HydrophobicContact CB-CB 3.62Å; A95-P123 HydrophobicContact CB-CG 3.97Å; A95-V125 PolarHBondContact N-O 3.46Å; A95-L126 HydrophobicContact CB-CB 4.16Å; A95-L126 HydrophobicContact CB-CD1 4.23Å; A95-L126 HydrophobicContact CB-CG 4.3Å
96	L	97.9	Very high	95.1	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.189	C	C	.	.			trans	-123.7	145.5	178.3	-64.3	166.3	0	0	0	110	F84 V94 F105 H117 T120 L395 L396	F84-L96 HydrophobicContact CZ-CD2 4.14Å; V94-L96 HydrophobicContact CB-CG 4.47Å; V94-L96 HydrophobicContact CG1-CD2 3.99Å; V94-L96 HydrophobicContact CG1-CG 4.21Å; V94-L96 PolarHBondContact O-N 3.39Å; L96-F105 VanDerWaalsContact C-CE1 3.45Å; L96-H117 WeakPolarHBondContact O-CB 3.44Å; L96-H117 PolarHBondContact O-N 3.41Å; L96-T120 HydrophobicContact CB-CG2 4.04Å; L96-T120 HydrophobicContact CD1-CG2 4.25Å; L96-T120 HydrophobicContact CG-CG2 4.41Å; L96-T120 PolarHBondContact N-OG1 3.17Å; L96-T120 PolarHBondContact O-OG1 2.77Å; L96-L395 HydrophobicContact CD1-CB 3.75Å; L96-L396 HydrophobicContact CB-CD1 4.48Å; L96-L396 VanDerWaalsContact CD1-CA 3.47Å; L96-L396 HydrophobicContact CD1-CB 3.69Å; L96-L396 HydrophobicContact CD1-CD1 4.39Å
97	P	96.3	Very high	95	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.071	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-61.2	148.6	-178.3	-23.7	33.4	0	0	0	112.7	C101 E102 F105 F115	P97-C101 HydrophobicContact CB-CB 4.22Å; P97-E102 WeakPolarHBondContact CB-O 3.44Å; P97-F105 HydrophobicContact CB-CD1 3.85Å; P97-F105 HydrophobicContact CB-CE1 4.11Å; P97-F105 HydrophobicContact CB-CG 4.38Å; P97-F105 HydrophobicContact CG-CD1 3.72Å; P97-F105 HydrophobicContact CG-CD2 4.25Å; P97-F105 HydrophobicContact CG-CE1 3.77Å; P97-F105 HydrophobicContact CG-CE2 4.33Å; P97-F105 HydrophobicContact CG-CG 3.97Å; P97-F105 HydrophobicContact CG-CZ 4.08Å; P97-F105 VanDerWaalsContact N-CE1 3.32Å; P97-F115 CarbonylContact C-O 3.46Å; P97-F115 WeakPolarHBondContact CA-O 3.39Å
98	H	94.7	Very high	94.8	Very high	70 Å²	70	38.1 Å²	38.1	32%	0.324	20%	0.201	S	C	.	.			trans	-60.1	146.2	164	-168.9	-94.4	0	0	0	109.7	S100 C101 F115	H98-S100 PolarHBondContact ND1-N 2.75Å; H98-S100 PolarHBondContact ND1-OG 3.02Å; H98-S100 PolarHBondContact O-N 3.33Å; H98-S100 VanDerWaalsContact O-N 3.08Å; H98-C101 HydrophobicContact CB-CB 4.46Å; H98-C101 WeakPolarHBondContact O-CA 3.44Å; H98-C101 VanDerWaalsContact O-CB 3.31Å; H98-C101 WeakPolarHBondContact O-CB 3.38Å; H98-C101 PolarHBondContact O-N 2.86Å; H98-F115 PolarHBondContact N-O 3.19Å
99	P	89.5	Confident	94.8	Very high	84 Å²	84	42.7 Å²	42.7	55%	0.545	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-60.5	-25.7	-175.3	-26.7	37.1	0	0	0	114.4	C101	P99-C101 PolarHBondContact O-N 3.31Å
100	S	91.2	Very high	94.9	Very high	90 Å²	90	40.2 Å²	40.2	63%	0.629	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-74.9	-8.4	173.1	64.8	0	0	0	0	114.2	H98	H98-S100 PolarHBondContact ND1-N 2.75Å; H98-S100 PolarHBondContact ND1-OG 3.02Å; H98-S100 PolarHBondContact O-N 3.33Å; H98-S100 VanDerWaalsContact O-N 3.08Å
101	C	91.3	Very high	94.9	Very high	6 Å²	6	37.6 Å²	37.6	4%	0.041	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-107.4	15	-177.9	-76.8	0	0	0	0	113.5	P97 H98 P99 Q104 F105 C106 F115	P97-C101 HydrophobicContact CB-CB 4.22Å; H98-C101 HydrophobicContact CB-CB 4.46Å; H98-C101 WeakPolarHBondContact O-CA 3.44Å; H98-C101 VanDerWaalsContact O-CB 3.31Å; H98-C101 WeakPolarHBondContact O-CB 3.38Å; H98-C101 PolarHBondContact O-N 2.86Å; P99-C101 PolarHBondContact O-N 3.31Å; C101-Q104 PolarHBondContact O-N 3.38Å; C101-F105 PolarHBondContact O-N 3.46Å; C101-C106 WeakPolarHBondContact CA-SG 3.04Å; C101-C106 HydrophobicContact CB-CB 3.82Å; C101-C106 WeakPolarHBondContact CB-SG 3.4Å; C101-C106 PolarHBondContact O-N 2.83Å; C101-C106 VanDerWaalsContact O-N 3.1Å; C101-C106 WeakPolarHBondContact SG-CB 2.99Å; C101-C106 CovalentContact SG-SG 2.03Å; C101-C106 PolarHBondContact SG-SG 3.49Å; C101-F115 HydrophobicContact CB-CB 4.49Å
102	E	87	Confident	95	Very high	62 Å²	62	33.6 Å²	33.6	29%	0.29	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	-145	-178	-55.9	-176.6	-179.7	0	0	111.1	P97 I421	P97-E102 WeakPolarHBondContact CB-O 3.44Å; E102-I421 WeakPolarHBondContact OE1-CA 3.29Å
103	H	88.9	Confident	94.9	Very high	27 Å²	27	32.9 Å²	32.9	13%	0.125	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	9.1	179.7	68.6	-70.1	0	0	0	112.9	E388 V389	H103-E388 IonicContact CD2-OE1 2.85Å; H103-V389 HydrophobicContact CB-CG2 4.43Å
104	Q	93.7	Very high	94.7	Very high	18 Å²	18	38.5 Å²	38.5	8%	0.084	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	30.9	-168	-53	-169.1	-15.6	0	0	113.7	C101 C106 Y107 H129	C101-Q104 PolarHBondContact O-N 3.38Å; Q104-C106 VanDerWaalsContact C-N 3.26Å; Q104-C106 PolarHBondContact O-N 2.78Å; Q104-C106 VanDerWaalsContact O-N 3.09Å; Q104-Y107 VanDerWaalsContact O-CB 3.27Å; Q104-Y107 WeakPolarHBondContact O-CB 3.2Å; Q104-Y107 PolarHBondContact O-N 3.27Å; Q104-H129 CarbonylContact C-O 3.55Å; Q104-H129 VanDerWaalsContact CA-O 3.28Å; Q104-H129 WeakPolarHBondContact CA-O 3.48Å; Q104-H129 HydrophobicContact CB-CB 3.88Å; Q104-H129 HydrophobicContact CG-CB 3.89Å
105	F	96.3	Very high	94.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	45.8	177	-63.1	-67.4	0	0	0	113.9	A95 L96 P97 C101 Y107 F111 F115 V116 L126 H129 L130	A95-F105 HydrophobicContact CB-CZ 4.16Å; A95-F105 WeakPolarHBondContact O-CZ 3.34Å; L96-F105 VanDerWaalsContact C-CE1 3.45Å; P97-F105 HydrophobicContact CB-CD1 3.85Å; P97-F105 HydrophobicContact CB-CE1 4.11Å; P97-F105 HydrophobicContact CB-CG 4.38Å; P97-F105 HydrophobicContact CG-CD1 3.72Å; P97-F105 HydrophobicContact CG-CD2 4.25Å; P97-F105 HydrophobicContact CG-CE1 3.77Å; P97-F105 HydrophobicContact CG-CE2 4.33Å; P97-F105 HydrophobicContact CG-CG 3.97Å; P97-F105 HydrophobicContact CG-CZ 4.08Å; P97-F105 VanDerWaalsContact N-CE1 3.32Å; C101-F105 PolarHBondContact O-N 3.46Å; F105-Y107 PolarHBondContact O-N 2.99Å; F105-F111 HydrophobicContact CB-CD2 3.82Å; F105-F111 HydrophobicContact CB-CE2 3.88Å; F105-F111 AromaticContact CD1-CE2 3.84Å; F105-F111 HydrophobicContact CD1-CE2 3.84Å; F105-F111 HydrophobicContact CD2-CE2 4.12Å; F105-F111 HydrophobicContact CE1-CE2 4.37Å; F105-F111 HydrophobicContact CG-CD2 4.12Å; F105-F111 AromaticContact CG-CE2 3.71Å; F105-F111 HydrophobicContact CG-CE2 3.71Å; F105-F115 HydrophobicContact CB-CB 4.16Å; F105-F115 HydrophobicContact CD1-CB 4.29Å; F105-F115 WeakPolarHBondContact O-CD2 3.29Å; F105-V116 HydrophobicContact CD1-CG2 4.18Å; F105-V116 HydrophobicContact CE1-CB 4.41Å; F105-V116 HydrophobicContact CE1-CG2 3.78Å; F105-L126 HydrophobicContact CE2-CD1 4.47Å; F105-L126 HydrophobicContact CE2-CG 4.36Å; F105-H129 WeakPolarHBondContact CD2-O 3.47Å; F105-L130 HydrophobicContact CB-CB 4.18Å; F105-L130 HydrophobicContact CD2-CB 4.13Å; F105-L130 HydrophobicContact CD2-CD2 4.26Å
106	C	95.8	Very high	94.6	Very high	17 Å²	17	39.7 Å²	39.7	12%	0.115	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	25.5	177.9	-80.3	0	0	0	0	114.5	C101 Q104 R109 F115	C101-C106 WeakPolarHBondContact CA-SG 3.04Å; C101-C106 HydrophobicContact CB-CB 3.82Å; C101-C106 WeakPolarHBondContact CB-SG 3.4Å; C101-C106 PolarHBondContact O-N 2.83Å; C101-C106 VanDerWaalsContact O-N 3.1Å; C101-C106 WeakPolarHBondContact SG-CB 2.99Å; C101-C106 CovalentContact SG-SG 2.03Å; C101-C106 PolarHBondContact SG-SG 3.49Å; Q104-C106 VanDerWaalsContact C-N 3.26Å; Q104-C106 PolarHBondContact O-N 2.78Å; Q104-C106 VanDerWaalsContact O-N 3.09Å; C106-R109 WeakPolarHBondContact O-CB 3.29Å; C106-R109 PolarHBondContact O-N 3Å; C106-R109 VanDerWaalsContact O-N 3.15Å; C106-R109 PolarHBondContact SG-NH2 2.84Å; C106-F115 HydrophobicContact CB-CD1 3.97Å; C106-F115 HydrophobicContact CB-CD2 3.8Å; C106-F115 HydrophobicContact CB-CE1 4.09Å; C106-F115 HydrophobicContact CB-CE2 3.87Å; C106-F115 HydrophobicContact CB-CG 3.85Å; C106-F115 HydrophobicContact CB-CZ 4.03Å
107	Y	95.1	Very high	94.6	Very high	6 Å²	6	40.5 Å²	40.5	2%	0.024	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	136.7	165.7	-170.9	-88.9	0	0	0	109.8	H72 Q104 F105 R131 M199 F200 Y207 D208	H72-Y107 AromaticContact CE1-CE1 3.83Å; H72-Y107 AromaticContact CE1-CE2 3.76Å; H72-Y107 AromaticContact CE1-CZ 3.54Å; Q104-Y107 VanDerWaalsContact O-CB 3.27Å; Q104-Y107 WeakPolarHBondContact O-CB 3.2Å; Q104-Y107 PolarHBondContact O-N 3.27Å; F105-Y107 PolarHBondContact O-N 2.99Å; Y107-R131 HydrophobicContact CD2-CB 4.14Å; Y107-R131 HydrophobicContact CE2-CB 4.26Å; Y107-M199 HydrophobicContact CE1-CG 3.79Å; Y107-M199 HydrophobicContact CE1-SD 4.15Å; Y107-M199 VanDerWaalsContact OH-CG 3.32Å; Y107-M199 WeakPolarHBondContact OH-CG 3.38Å; Y107-F200 HydrophobicContact CD1-CZ 4.41Å; Y107-F200 AromaticContact CE1-CE1 3.88Å; Y107-F200 HydrophobicContact CE1-CE1 3.88Å; Y107-F200 AromaticContact CE1-CZ 3.79Å; Y107-F200 HydrophobicContact CE1-CZ 3.79Å; Y107-Y207 HydrophobicContact CE2-CD1 4.04Å; Y107-Y207 HydrophobicContact CE2-CE1 4.04Å; Y107-Y207 AromaticContact CZ-CD1 3.8Å; Y107-Y207 AromaticContact CZ-CE1 3.85Å; Y107-Y207 VanDerWaalsContact OH-CD1 3.3Å; Y107-Y207 WeakPolarHBondContact OH-CD1 3.35Å; Y107-D208 VanDerWaalsContact CE2-OD1 3.28Å; Y107-D208 WeakPolarHBondContact CE2-OD1 3.47Å; Y107-D208 PolarHBondContact OH-OD1 3.09Å
108	P	95.1	Very high	94.5	Very high	38 Å²	38	43.5 Å²	43.5	25%	0.247	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.7	16.3	16.8	40.3	-39.3	0	0	0	115.3	R131 M199 Y207	P108-R131 VanDerWaalsContact O-CD 3.3Å; P108-R131 WeakPolarHBondContact O-CD 3.36Å; P108-M199 HydrophobicContact CB-CE 3.54Å; P108-M199 HydrophobicContact CB-CG 4.44Å; P108-M199 HydrophobicContact CB-SD 4.16Å; P108-M199 HydrophobicContact CG-CE 3.65Å; P108-Y207 HydrophobicContact CB-CE1 3.76Å; P108-Y207 WeakPolarHBondContact CB-OH 3.33Å; P108-Y207 PolarHBondContact O-OH 3.18Å
109	R	96.2	Very high	94.5	Very high	132 Å²	132	42 Å²	42	50%	0.498	23%	0.23	S	C	.	.	S	Bend	trans	-68.4	147.5	176	-60.7	-170.9	-68.2	178.2	-1.5	110.6	C106 F111 F115 R131	C106-R109 WeakPolarHBondContact O-CB 3.29Å; C106-R109 PolarHBondContact O-N 3Å; C106-R109 VanDerWaalsContact O-N 3.15Å; C106-R109 PolarHBondContact SG-NH2 2.84Å; R109-F111 PolarHBondContact O-N 2.94Å; R109-F115 HydrophobicContact CB-CE2 4.3Å; R109-F115 HydrophobicContact CB-CZ 4.34Å; R109-R131 WeakPolarHBondContact O-CB 3.4Å
110	N	97.7	Very high	94.9	Very high	78 Å²	78	38 Å²	38	42%	0.417	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-50.7	133.1	169.5	-72.6	6.6	0	0	0	109.1	S112 F115 R131	N110-S112 PolarHBondContact O-N 3.3Å; N110-F115 VanDerWaalsContact O-CE2 3.27Å; N110-F115 WeakPolarHBondContact O-CE2 3.42Å; N110-R131 WeakPolarHBondContact OD1-CD 3.29Å; N110-R131 PolarHBondContact OD1-NE 2.76Å; N110-R131 PolarHBondContact OD1-NH1 3.46Å
111	F	98.2	Very high	94.9	Very high	3 Å²	3	39 Å²	39	1%	0.013	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-56.9	139	-176.3	177.3	-98.6	0	0	0	111.3	F105 R109 F115 V116 L126 L130 R131 D133 E136 L137 L140	F105-F111 HydrophobicContact CB-CD2 3.82Å; F105-F111 HydrophobicContact CB-CE2 3.88Å; F105-F111 AromaticContact CD1-CE2 3.84Å; F105-F111 HydrophobicContact CD1-CE2 3.84Å; F105-F111 HydrophobicContact CD2-CE2 4.12Å; F105-F111 HydrophobicContact CE1-CE2 4.37Å; F105-F111 HydrophobicContact CG-CD2 4.12Å; F105-F111 AromaticContact CG-CE2 3.71Å; F105-F111 HydrophobicContact CG-CE2 3.71Å; R109-F111 PolarHBondContact O-N 2.94Å; F111-F115 HydrophobicContact CD2-CD2 4.49Å; F111-V116 HydrophobicContact CE2-CG2 4.12Å; F111-V116 HydrophobicContact CZ-CG2 3.7Å; F111-L126 HydrophobicContact CZ-CD1 4.25Å; F111-L130 HydrophobicContact CB-CB 4.2Å; F111-L130 HydrophobicContact CB-CD1 4.05Å; F111-L130 HydrophobicContact CD2-CB 3.77Å; F111-L130 HydrophobicContact CD2-CD2 3.66Å; F111-L130 HydrophobicContact CD2-CG 4.23Å; F111-L130 HydrophobicContact CE2-CD2 3.93Å; F111-L130 HydrophobicContact CG-CB 4.3Å; F111-L130 HydrophobicContact CG-CD1 4.39Å; F111-L130 HydrophobicContact CG-CD2 4Å; F111-L130 HydrophobicContact CG-CG 4.48Å; F111-R131 WeakPolarHBondContact CB-O 3.46Å; F111-R131 PolarHBondContact N-O 3Å; F111-D133 HydrophobicContact CB-CB 4.32Å; F111-E136 HydrophobicContact CD1-CB 3.9Å; F111-E136 HydrophobicContact CE1-CB 4.35Å; F111-E136 WeakPolarHBondContact O-CG 3.4Å; F111-L137 HydrophobicContact CD1-CD1 3.43Å; F111-L137 VanDerWaalsContact CD1-CD1 3.43Å; F111-L137 HydrophobicContact CE1-CD1 3.44Å; F111-L137 VanDerWaalsContact CE1-CD1 3.44Å; F111-L137 HydrophobicContact CG-CD1 4.09Å; F111-L137 HydrophobicContact CZ-CD1 4.07Å; F111-L140 HydrophobicContact CE1-CD2 3.96Å; F111-L140 HydrophobicContact CZ-CD2 3.64Å
112	S	97.3	Very high	95	Very high	22 Å²	22	43.5 Å²	43.5	15%	0.154	22%	0.224	C	C	.	.			trans	-131.7	145.5	166.7	176.9	0	0	0	0	110.1	N110 H114 F115 E136	N110-S112 PolarHBondContact O-N 3.3Å; S112-H114 PolarHBondContact O-N 2.79Å; S112-H114 PolarHBondContact OG-N 2.88Å; S112-H114 PolarHBondContact OG-ND1 3.49Å; S112-H114 VanDerWaalsContact OG-ND1 3.07Å; S112-F115 VanDerWaalsContact N-CD2 3.29Å; S112-F115 VanDerWaalsContact O-CB 3.27Å; S112-F115 WeakPolarHBondContact O-CB 3.49Å; S112-F115 WeakPolarHBondContact O-CG 3.27Å; S112-F115 PolarHBondContact O-N 2.85Å; S112-E136 WeakPolarHBondContact CA-OE2 3.21Å; S112-E136 WeakPolarHBondContact CB-OE2 3.41Å; S112-E136 PolarHBondContact OG-OE2 3.46Å
113	A	95.5	Very high	95.5	Very high	2 Å²	2	40.6 Å²	40.6	2%	0.017	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-62.1	-14.6	174.9	0	0	0	0	0	113	F115 V116 R121 E136 R139 L140	A113-F115 PolarHBondContact O-N 3.39Å; A113-V116 WeakPolarHBondContact O-CB 3.39Å; A113-V116 PolarHBondContact O-N 3.44Å; A113-R121 PolarHBondContact O-NH1 3.09Å; A113-E136 PolarHBondContact N-OE2 3.46Å; A113-R139 VanDerWaalsContact CB-NH2 3.26Å; A113-L140 HydrophobicContact CB-CB 4.25Å; A113-L140 HydrophobicContact CB-CD1 4.28Å
114	H	95.3	Very high	95.9	Very high	140 Å²	140	42.5 Å²	42.5	65%	0.648	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-68.1	-21.4	170.1	-65.9	94.7	0	0	0	113.1	S112 V116	S112-H114 PolarHBondContact O-N 2.79Å; S112-H114 PolarHBondContact OG-N 2.88Å; S112-H114 PolarHBondContact OG-ND1 3.49Å; S112-H114 VanDerWaalsContact OG-ND1 3.07Å; H114-V116 PolarHBondContact O-N 3.14Å
115	F	97.2	Very high	96.2	Very high	24 Å²	24	41.7 Å²	41.7	11%	0.105	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-77.9	-8	175.7	-53.7	-23.4	0	0	0	112.2	P97 H98 C101 F105 C106 R109 N110 F111 S112 A113	P97-F115 CarbonylContact C-O 3.46Å; P97-F115 WeakPolarHBondContact CA-O 3.39Å; H98-F115 PolarHBondContact N-O 3.19Å; C101-F115 HydrophobicContact CB-CB 4.49Å; F105-F115 HydrophobicContact CB-CB 4.16Å; F105-F115 HydrophobicContact CD1-CB 4.29Å; F105-F115 WeakPolarHBondContact O-CD2 3.29Å; C106-F115 HydrophobicContact CB-CD1 3.97Å; C106-F115 HydrophobicContact CB-CD2 3.8Å; C106-F115 HydrophobicContact CB-CE1 4.09Å; C106-F115 HydrophobicContact CB-CE2 3.87Å; C106-F115 HydrophobicContact CB-CG 3.85Å; C106-F115 HydrophobicContact CB-CZ 4.03Å; R109-F115 HydrophobicContact CB-CE2 4.3Å; R109-F115 HydrophobicContact CB-CZ 4.34Å; N110-F115 VanDerWaalsContact O-CE2 3.27Å; N110-F115 WeakPolarHBondContact O-CE2 3.42Å; F111-F115 HydrophobicContact CD2-CD2 4.49Å; S112-F115 VanDerWaalsContact N-CD2 3.29Å; S112-F115 VanDerWaalsContact O-CB 3.27Å; S112-F115 WeakPolarHBondContact O-CB 3.49Å; S112-F115 WeakPolarHBondContact O-CG 3.27Å; S112-F115 PolarHBondContact O-N 2.85Å; A113-F115 PolarHBondContact O-N 3.39Å
116	V	97.4	Very high	96.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-88.3	131.7	177.5	-174.4	0	0	0	0	110.3	A95 F105 F111 A113 H114 T120 R121 L140	A95-V116 HydrophobicContact CB-CG1 4.12Å; F105-V116 HydrophobicContact CD1-CG2 4.18Å; F105-V116 HydrophobicContact CE1-CB 4.41Å; F105-V116 HydrophobicContact CE1-CG2 3.78Å; F111-V116 HydrophobicContact CE2-CG2 4.12Å; F111-V116 HydrophobicContact CZ-CG2 3.7Å; A113-V116 WeakPolarHBondContact O-CB 3.39Å; A113-V116 PolarHBondContact O-N 3.44Å; H114-V116 PolarHBondContact O-N 3.14Å; V116-T120 VanDerWaalsContact CG1-OG1 3.27Å; V116-T120 WeakPolarHBondContact CG1-OG1 3.17Å; V116-R121 HydrophobicContact CB-CG 4.25Å; V116-R121 HydrophobicContact CG1-CG 3.72Å; V116-L140 HydrophobicContact CG2-CD1 4.4Å; V116-L140 HydrophobicContact CG2-CD2 3.65Å
117	H	97.1	Very high	96.4	Very high	19 Å²	19	40.9 Å²	40.9	9%	0.088	21%	0.21	C	C	.	.			trans	-59.6	131.2	178.5	-174.1	-64.2	0	0	0	110.1	L96 A119 T120 L396	L96-H117 WeakPolarHBondContact O-CB 3.44Å; L96-H117 PolarHBondContact O-N 3.41Å; H117-A119 VanDerWaalsContact C-N 3.33Å; H117-A119 VanDerWaalsContact CE1-CB 3.5Å; H117-A119 WeakPolarHBondContact CE1-CB 3.23Å; H117-A119 WeakPolarHBondContact ND1-CB 3.41Å; H117-A119 PolarHBondContact ND1-N 3.08Å; H117-A119 PolarHBondContact O-N 2.86Å; H117-T120 HydrophobicContact CB-CG2 4.24Å; H117-T120 WeakPolarHBondContact O-CA 3.15Å; H117-T120 PolarHBondContact O-N 2.65Å; H117-T120 PolarHBondContact O-OG1 3.11Å; H117-L396 HydrophobicContact CB-CD1 4.13Å
118	P	94.9	Very high	96.4	Very high	74 Å²	74	40.6 Å²	40.6	48%	0.481	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-52.8	-43.3	-176.2	-30.3	35.3	0	0	0	114.8	T120 R121	P118-T120 PolarHBondContact O-N 3.43Å; P118-R121 PolarHBondContact O-N 3.47Å; P118-R121 VanDerWaalsContact O-N 3.16Å
119	A	94.6	Very high	96.5	Very high	38 Å²	38	39.4 Å²	39.4	31%	0.314	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-64.5	0.2	175.4	0	0	0	0	0	115.5	H117 K400	H117-A119 VanDerWaalsContact C-N 3.33Å; H117-A119 VanDerWaalsContact CE1-CB 3.5Å; H117-A119 WeakPolarHBondContact CE1-CB 3.23Å; H117-A119 WeakPolarHBondContact ND1-CB 3.41Å; H117-A119 PolarHBondContact ND1-N 3.08Å; H117-A119 PolarHBondContact O-N 2.86Å; A119-K400 HydrophobicContact CB-CG 3.72Å
120	T	96.3	Very high	96.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-118.3	17.4	178.5	70.1	0	0	0	0	112.7	T93 V94 L96 V116 H117 P118 L396	T93-T120 WeakPolarHBondContact CG2-O 3.38Å; V94-T120 VanDerWaalsContact O-CB 3.3Å; V94-T120 WeakPolarHBondContact O-CB 3.34Å; L96-T120 HydrophobicContact CB-CG2 4.04Å; L96-T120 HydrophobicContact CD1-CG2 4.25Å; L96-T120 HydrophobicContact CG-CG2 4.41Å; L96-T120 PolarHBondContact N-OG1 3.17Å; L96-T120 PolarHBondContact O-OG1 2.77Å; V116-T120 VanDerWaalsContact CG1-OG1 3.27Å; V116-T120 WeakPolarHBondContact CG1-OG1 3.17Å; H117-T120 HydrophobicContact CB-CG2 4.24Å; H117-T120 WeakPolarHBondContact O-CA 3.15Å; H117-T120 PolarHBondContact O-N 2.65Å; H117-T120 PolarHBondContact O-OG1 3.11Å; P118-T120 PolarHBondContact O-N 3.43Å; T120-L396 HydrophobicContact CG2-CD1 3.79Å
121	R	92.6	Very high	96.6	Very high	111 Å²	111	31.5 Å²	31.5	42%	0.419	16%	0.164	S	C	.	.			trans	-116.3	141	175.7	-60.6	-174.7	-63.4	-171.5	3.7	110.8	A113 V116 P118 L140	A113-R121 PolarHBondContact O-NH1 3.09Å; V116-R121 HydrophobicContact CB-CG 4.25Å; V116-R121 HydrophobicContact CG1-CG 3.72Å; P118-R121 PolarHBondContact O-N 3.47Å; P118-R121 VanDerWaalsContact O-N 3.16Å; R121-L140 HydrophobicContact CG-CD1 4.25Å
122	P	92.6	Very high	96.6	Very high	101 Å²	101	32.1 Å²	32.1	66%	0.656	17%	0.167	S	C	*	.	S	Bend	cis	-72.3	141.8	-10.2	30.8	-33.9	0	0	0	111.6
123	P	97.4	Very high	96.6	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	17%	0.171	C	C	.	.			trans	-87	156.3	177.3	35.5	-34.7	0	0	0	112.4	A95 L140 M141 P142	A95-P123 HydrophobicContact CB-CB 3.62Å; A95-P123 HydrophobicContact CB-CG 3.97Å; P123-L140 HydrophobicContact CG-CD1 3.81Å; P123-L140 HydrophobicContact CG-CD2 4.23Å; P123-L140 HydrophobicContact CG-CG 3.76Å; P123-M141 HydrophobicContact CB-SD 4.43Å; P123-M141 HydrophobicContact CG-SD 3.76Å; P123-P142 WeakPolarHBondContact O-CD 3.32Å
124	H	98.5	Very high	96.6	Very high	67 Å²	67	37.9 Å²	37.9	31%	0.31	19%	0.188	S	C	.	.	S	Bend	trans	-104.7	-31.2	166.4	-58.6	76.4	0	0	0	110.7	T65 V66 L92 T93 M141	T65-H124 CarbonylContact C-O 3.53Å; T65-H124 WeakPolarHBondContact CA-O 3.19Å; T65-H124 HydrophobicContact CG2-CB 4.23Å; V66-H124 PolarHBondContact N-O 3.24Å; L92-H124 HydrophobicContact CB-CB 4Å; L92-H124 HydrophobicContact CD1-CB 4.46Å; L92-H124 HydrophobicContact CD2-CB 4.32Å; L92-H124 HydrophobicContact CG-CB 4.49Å; T93-H124 PolarHBondContact N-ND1 3.17Å; T93-H124 PolarHBondContact O-N 2.99Å; H124-M141 WeakPolarHBondContact O-CE 3.24Å
125	V	98.8	Very high	96.6	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133	-178.1	175.3	0	0	0	0	110.3	V66 L83 A87 L92 T93 V94 A95 A127	V66-V125 CarbonylContact O-C 3.59Å; V66-V125 VanDerWaalsContact O-CA 3.27Å; V66-V125 WeakPolarHBondContact O-CA 3.48Å; L83-V125 HydrophobicContact CB-CG1 4Å; A87-V125 HydrophobicContact CB-CB 4.28Å; A87-V125 HydrophobicContact CB-CG2 3.99Å; L92-V125 HydrophobicContact CD1-CG2 4.27Å; T93-V125 PolarHBondContact O-N 3.03Å; T93-V125 VanDerWaalsContact O-N 3.1Å; V94-V125 CarbonylContact C-O 3.58Å; V94-V125 VanDerWaalsContact CA-O 3.29Å; V94-V125 WeakPolarHBondContact CA-O 3.32Å; V94-V125 HydrophobicContact CG2-CB 4.27Å; A95-V125 PolarHBondContact N-O 3.46Å; V125-A127 HydrophobicContact CG1-CB 4.45Å
126	L	98.5	Very high	96.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.5	167.6	-179.7	151.5	0	0	0	107.9	V66 F68 A95 F105 F111 L130 L137 L140 M141	V66-L126 PolarHBondContact O-N 3.24Å; F68-L126 PolarHBondContact N-O 3.01Å; A95-L126 HydrophobicContact CB-CB 4.16Å; A95-L126 HydrophobicContact CB-CD1 4.23Å; A95-L126 HydrophobicContact CB-CG 4.3Å; F105-L126 HydrophobicContact CE2-CD1 4.47Å; F105-L126 HydrophobicContact CE2-CG 4.36Å; F111-L126 HydrophobicContact CZ-CD1 4.25Å; L126-L130 HydrophobicContact CD1-CD2 3.96Å; L126-L130 HydrophobicContact CD2-CD2 3.65Å; L126-L130 HydrophobicContact CG-CD2 4.36Å; L126-L137 HydrophobicContact CD1-CD1 3.98Å; L126-L140 HydrophobicContact CD1-CD2 4.1Å; L126-M141 HydrophobicContact CB-CE 4.41Å; L126-M141 HydrophobicContact CB-SD 3.95Å
127	A	98	Very high	96.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.			trans	-153	21.9	-175.1	0	0	0	0	0	114.8	F68 Q80 L83 F84 V125	F68-A127 HydrophobicContact CB-CB 4.29Å; F68-A127 HydrophobicContact CD1-CB 4.09Å; Q80-A127 HydrophobicContact CB-CB 4.32Å; Q80-A127 WeakPolarHBondContact CB-O 3.26Å; Q80-A127 HydrophobicContact CG-CB 4.07Å; Q80-A127 WeakPolarHBondContact CG-O 3.42Å; Q80-A127 PolarHBondContact NE2-O 3.49Å; L83-A127 HydrophobicContact CB-CB 4.14Å; L83-A127 HydrophobicContact CD1-CB 3.7Å; F84-A127 HydrophobicContact CD1-CB 4.3Å; F84-A127 HydrophobicContact CE1-CB 3.87Å; V125-A127 HydrophobicContact CG1-CB 4.45Å
128	S	95.6	Very high	96.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-108.5	164.3	178.1	-51.1	0	0	0	0	111.6	Q80 L130	Q80-S128 PolarHBondContact NE2-OG 3.44Å; S128-L130 PolarHBondContact O-N 2.9Å
129	H	96.6	Very high	96.5	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.06	21%	0.206	C	C	.	.			trans	-58.1	136	175.5	-70.2	-64.6	0	0	0	111	K70 T71 H72 Q104 F105	K70-H129 WeakPolarHBondContact CE-NE2 3.38Å; K70-H129 PolarHBondContact O-ND1 3.09Å; T71-H129 PolarHBondContact O-CE1 3.47Å; H72-H129 AromaticContact CD2-CE1 3.62Å; H72-H129 AromaticContact CD2-ND1 3.75Å; H72-H129 AromaticContact CD2-NE2 3.99Å; H72-H129 AromaticContact CE1-CG 3.89Å; H72-H129 AromaticContact CE1-ND1 3.59Å; H72-H129 AromaticContact CG-CE1 3.86Å; H72-H129 AromaticContact CG-ND1 3.91Å; H72-H129 AromaticContact ND1-ND1 3.8Å; H72-H129 AromaticContact NE2-CD2 3.99Å; H72-H129 AromaticContact NE2-CE1 3.86Å; H72-H129 AromaticContact NE2-CG 3.63Å; H72-H129 AromaticContact NE2-ND1 3.55Å; Q104-H129 CarbonylContact C-O 3.55Å; Q104-H129 VanDerWaalsContact CA-O 3.28Å; Q104-H129 WeakPolarHBondContact CA-O 3.48Å; Q104-H129 HydrophobicContact CB-CB 3.88Å; Q104-H129 HydrophobicContact CG-CB 3.89Å; F105-H129 WeakPolarHBondContact CD2-O 3.47Å
130	L	97.3	Very high	96.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.195	C	C	.	.			trans	-155.7	161.3	171.4	60.5	82.4	0	0	0	108.8	L69 F105 F111 L126 S128 F132 L137	L69-L130 HydrophobicContact CD1-CD1 3.37Å; L69-L130 HydrophobicContact CD1-CG 3.83Å; F105-L130 HydrophobicContact CB-CB 4.18Å; F105-L130 HydrophobicContact CD2-CB 4.13Å; F105-L130 HydrophobicContact CD2-CD2 4.26Å; F111-L130 HydrophobicContact CB-CB 4.2Å; F111-L130 HydrophobicContact CB-CD1 4.05Å; F111-L130 HydrophobicContact CD2-CB 3.77Å; F111-L130 HydrophobicContact CD2-CD2 3.66Å; F111-L130 HydrophobicContact CD2-CG 4.23Å; F111-L130 HydrophobicContact CE2-CD2 3.93Å; F111-L130 HydrophobicContact CG-CB 4.3Å; F111-L130 HydrophobicContact CG-CD1 4.39Å; F111-L130 HydrophobicContact CG-CD2 4Å; F111-L130 HydrophobicContact CG-CG 4.48Å; L126-L130 HydrophobicContact CD1-CD2 3.96Å; L126-L130 HydrophobicContact CD2-CD2 3.65Å; L126-L130 HydrophobicContact CG-CD2 4.36Å; S128-L130 PolarHBondContact O-N 2.9Å; L130-F132 VanDerWaalsContact CD1-CA 3.49Å; L130-F132 HydrophobicContact CD1-CB 4.28Å; L130-L137 HydrophobicContact CD1-CD1 4.49Å; L130-L137 HydrophobicContact CD2-CD1 3.77Å
131	R	98.1	Very high	96.6	Very high	44 Å²	44	41 Å²	41	17%	0.166	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-88.4	117.5	165.5	-179	171	-172.5	-165.5	0.4	108.1	Y107 P108 R109 N110 F111 D133 Y207 G211	Y107-R131 HydrophobicContact CD2-CB 4.14Å; Y107-R131 HydrophobicContact CE2-CB 4.26Å; P108-R131 VanDerWaalsContact O-CD 3.3Å; P108-R131 WeakPolarHBondContact O-CD 3.36Å; R109-R131 WeakPolarHBondContact O-CB 3.4Å; N110-R131 WeakPolarHBondContact OD1-CD 3.29Å; N110-R131 PolarHBondContact OD1-NE 2.76Å; N110-R131 PolarHBondContact OD1-NH1 3.46Å; F111-R131 WeakPolarHBondContact CB-O 3.46Å; F111-R131 PolarHBondContact N-O 3Å; R131-D133 PolarHBondContact O-N 3.24Å; R131-Y207 HydrophobicContact CG-CE1 4.33Å; R131-Y207 VanDerWaalsContact CZ-CE2 3.46Å; R131-Y207 PolarHBondContact NH1-OH 3.29Å; R131-G211 PolarHBondContact NH2-O 3.03Å
132	F	98.4	Very high	96.8	Very high	17 Å²	17	37.7 Å²	37.7	8%	0.075	19%	0.189	C	C	.	.			trans	-59.1	130.6	-169.5	-179.4	-109.2	0	0	0	112.3	L69 L130 R134 L137 D208 L209 G210 V234 F235	L69-F132 HydrophobicContact CD1-CB 4.19Å; L69-F132 HydrophobicContact CD2-CB 3.86Å; L69-F132 HydrophobicContact CD2-CD2 4.26Å; L69-F132 HydrophobicContact CD2-CG 4.19Å; L130-F132 VanDerWaalsContact CD1-CA 3.49Å; L130-F132 HydrophobicContact CD1-CB 4.28Å; F132-R134 HydrophobicContact CE1-CB 3.89Å; F132-R134 HydrophobicContact CZ-CB 3.72Å; F132-R134 HydrophobicContact CZ-CG 4.29Å; F132-L137 HydrophobicContact CD2-CD2 3.97Å; F132-L137 HydrophobicContact CE2-CD2 3.77Å; F132-D208 VanDerWaalsContact CB-O 3.3Å; F132-D208 WeakPolarHBondContact CB-O 3.37Å; F132-D208 PolarHBondContact N-O 3.25Å; F132-L209 WeakPolarHBondContact CD1-O 3.35Å; F132-G210 VanDerWaalsContact O-CA 3.26Å; F132-G210 WeakPolarHBondContact O-CA 3.18Å; F132-V234 HydrophobicContact CE1-CG2 4.47Å; F132-V234 HydrophobicContact CE2-CG1 4.2Å; F132-V234 HydrophobicContact CZ-CB 4.3Å; F132-V234 HydrophobicContact CZ-CG1 3.75Å; F132-V234 HydrophobicContact CZ-CG2 4.06Å; F132-F235 HydrophobicContact CD2-CZ 4.03Å; F132-F235 HydrophobicContact CE1-CE2 4.42Å; F132-F235 HydrophobicContact CE2-CE2 4.36Å; F132-F235 AromaticContact CE2-CZ 3.92Å; F132-F235 HydrophobicContact CE2-CZ 3.92Å; F132-F235 HydrophobicContact CG-CZ 4.5Å; F132-F235 HydrophobicContact CZ-CE2 4.28Å; F132-F235 HydrophobicContact CZ-CZ 4.29Å
133	D	98	Very high	96.9	Very high	43 Å²	43	39.2 Å²	39.2	23%	0.23	20%	0.199	C	C	.	.			trans	-135.4	111.5	169.3	-174.6	-62.3	0	0	0	106.9	F111 R131 A135 E136 L137	F111-D133 HydrophobicContact CB-CB 4.32Å; R131-D133 PolarHBondContact O-N 3.24Å; D133-A135 PolarHBondContact O-N 3.15Å; D133-A135 PolarHBondContact OD1-N 2.79Å; D133-E136 HydrophobicContact CB-CB 4.25Å; D133-E136 PolarHBondContact OD1-N 3.12Å; D133-L137 WeakPolarHBondContact O-CB 3.47Å; D133-L137 PolarHBondContact O-N 3.27Å; D133-L137 VanDerWaalsContact O-N 3.09Å
134	R	95.3	Very high	96.7	Very high	101 Å²	101	42.1 Å²	42.1	38%	0.381	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-46.9	-173.1	179.1	179.2	175.5	168.9	-0.8	111.7	F132 L137 E138 E233 V234	F132-R134 HydrophobicContact CE1-CB 3.89Å; F132-R134 HydrophobicContact CZ-CB 3.72Å; F132-R134 HydrophobicContact CZ-CG 4.29Å; R134-L137 PolarHBondContact O-N 3.41Å; R134-E138 HydrophobicContact CG-CG 4.28Å; R134-E138 IonicContact CZ-OE1 3.73Å; R134-E138 IonicContact NE-OE1 2.74Å; R134-E138 PolarHBondContact NE-OE1 3.32Å; R134-E138 IonicContact NE-OE2 3Å; R134-E138 IonicContact NH2-OE1 2.69Å; R134-E138 PolarHBondContact NH2-OE1 3.03Å; R134-E138 WeakPolarHBondContact O-CB 3.12Å; R134-E138 WeakPolarHBondContact O-CG 3.27Å; R134-E138 PolarHBondContact O-N 3.24Å; R134-E233 IonicContact NH1-OE2 2.85Å; R134-E233 PolarHBondContact NH1-OE2 3.29Å; R134-V234 HydrophobicContact CG-CG2 4.04Å
135	A	96.6	Very high	96.7	Very high	67 Å²	67	39.6 Å²	39.6	55%	0.554	22%	0.218	S	C	*	.	H	α-helix	trans	-65.7	-43.5	-174	0	0	0	0	0	111.1	D133 R139	D133-A135 PolarHBondContact O-N 3.15Å; D133-A135 PolarHBondContact OD1-N 2.79Å; A135-R139 VanDerWaalsContact O-CB 3.28Å; A135-R139 WeakPolarHBondContact O-CB 3.38Å; A135-R139 PolarHBondContact O-N 3.2Å
136	E	97.6	Very high	96.7	Very high	35 Å²	35	39.8 Å²	39.8	16%	0.164	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-34.3	177.6	-75.4	-73.9	94.7	0	0	112.5	F111 S112 A113 D133 R139 L140	F111-E136 HydrophobicContact CD1-CB 3.9Å; F111-E136 HydrophobicContact CE1-CB 4.35Å; F111-E136 WeakPolarHBondContact O-CG 3.4Å; S112-E136 WeakPolarHBondContact CA-OE2 3.21Å; S112-E136 WeakPolarHBondContact CB-OE2 3.41Å; S112-E136 PolarHBondContact OG-OE2 3.46Å; A113-E136 PolarHBondContact N-OE2 3.46Å; D133-E136 HydrophobicContact CB-CB 4.25Å; D133-E136 PolarHBondContact OD1-N 3.12Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 IonicContact OE1-CZ 3.88Å; E136-R139 VanDerWaalsContact OE1-CZ 3.29Å; E136-R139 IonicContact OE1-NE 3.62Å; E136-R139 PolarHBondContact OE1-NE 3.34Å; E136-R139 IonicContact OE1-NH2 3.89Å; E136-R139 PolarHBondContact OE1-NH2 2.95Å; E136-R139 IonicContact OE2-NH2 3.46Å; E136-R139 PolarHBondContact OE2-NH2 3.46Å; E136-L140 WeakPolarHBondContact O-CB 3.33Å; E136-L140 PolarHBondContact O-N 3.41Å; E136-L140 VanDerWaalsContact O-N 3.1Å
137	L	95.1	Very high	96.7	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-71.8	-42.9	176.6	-125.2	68.4	0	0	0	112.6	F111 L126 L130 F132 D133 R134 R139 L140 M141 Y147	F111-L137 HydrophobicContact CD1-CD1 3.43Å; F111-L137 VanDerWaalsContact CD1-CD1 3.43Å; F111-L137 HydrophobicContact CE1-CD1 3.44Å; F111-L137 VanDerWaalsContact CE1-CD1 3.44Å; F111-L137 HydrophobicContact CG-CD1 4.09Å; F111-L137 HydrophobicContact CZ-CD1 4.07Å; L126-L137 HydrophobicContact CD1-CD1 3.98Å; L130-L137 HydrophobicContact CD1-CD1 4.49Å; L130-L137 HydrophobicContact CD2-CD1 3.77Å; F132-L137 HydrophobicContact CD2-CD2 3.97Å; F132-L137 HydrophobicContact CE2-CD2 3.77Å; D133-L137 WeakPolarHBondContact O-CB 3.47Å; D133-L137 PolarHBondContact O-N 3.27Å; D133-L137 VanDerWaalsContact O-N 3.09Å; R134-L137 PolarHBondContact O-N 3.41Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 PolarHBondContact O-N 2.95Å; L137-L140 PolarHBondContact O-N 2.92Å; L137-M141 WeakPolarHBondContact O-CB 3.36Å; L137-M141 WeakPolarHBondContact O-CG 3.5Å; L137-M141 PolarHBondContact O-N 3.38Å; L137-Y147 HydrophobicContact CB-CE1 4.21Å; L137-Y147 HydrophobicContact CD2-CD1 4.12Å; L137-Y147 HydrophobicContact CD2-CE1 3.85Å; L137-Y147 HydrophobicContact CG-CE1 4.21Å; L137-Y147 PolarHBondContact O-OH 3.27Å
138	E	94.6	Very high	96.7	Very high	94 Å²	94	41 Å²	41	44%	0.439	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-34.6	175.5	-75.2	177.6	173.5	0	0	111.6	R134	R134-E138 HydrophobicContact CG-CG 4.28Å; R134-E138 IonicContact CZ-OE1 3.73Å; R134-E138 IonicContact NE-OE1 2.74Å; R134-E138 PolarHBondContact NE-OE1 3.32Å; R134-E138 IonicContact NE-OE2 3Å; R134-E138 IonicContact NH2-OE1 2.69Å; R134-E138 PolarHBondContact NH2-OE1 3.03Å; R134-E138 WeakPolarHBondContact O-CB 3.12Å; R134-E138 WeakPolarHBondContact O-CG 3.27Å; R134-E138 PolarHBondContact O-N 3.24Å
139	R	95.4	Very high	96.8	Very high	143 Å²	143	41 Å²	41	54%	0.54	22%	0.224	S	C	.	.	H	α-helix	trans	-71.4	-33.5	175.3	-170.8	178.7	66.8	81.8	-7.3	113.2	A113 A135 E136 L137	A113-R139 VanDerWaalsContact CB-NH2 3.26Å; A135-R139 VanDerWaalsContact O-CB 3.28Å; A135-R139 WeakPolarHBondContact O-CB 3.38Å; A135-R139 PolarHBondContact O-N 3.2Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 IonicContact OE1-CZ 3.88Å; E136-R139 VanDerWaalsContact OE1-CZ 3.29Å; E136-R139 IonicContact OE1-NE 3.62Å; E136-R139 PolarHBondContact OE1-NE 3.34Å; E136-R139 IonicContact OE1-NH2 3.89Å; E136-R139 PolarHBondContact OE1-NH2 2.95Å; E136-R139 IonicContact OE2-NH2 3.46Å; E136-R139 PolarHBondContact OE2-NH2 3.46Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 PolarHBondContact O-N 2.95Å
140	L	97.1	Very high	96.9	Very high	16 Å²	16	40.4 Å²	40.4	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-79.5	-43.1	-178.6	173.9	65.1	0	0	0	112.6	F111 A113 V116 R121 P123 L126 E136 L137	F111-L140 HydrophobicContact CE1-CD2 3.96Å; F111-L140 HydrophobicContact CZ-CD2 3.64Å; A113-L140 HydrophobicContact CB-CB 4.25Å; A113-L140 HydrophobicContact CB-CD1 4.28Å; V116-L140 HydrophobicContact CG2-CD1 4.4Å; V116-L140 HydrophobicContact CG2-CD2 3.65Å; R121-L140 HydrophobicContact CG-CD1 4.25Å; P123-L140 HydrophobicContact CG-CD1 3.81Å; P123-L140 HydrophobicContact CG-CD2 4.23Å; P123-L140 HydrophobicContact CG-CG 3.76Å; L126-L140 HydrophobicContact CD1-CD2 4.1Å; E136-L140 WeakPolarHBondContact O-CB 3.33Å; E136-L140 PolarHBondContact O-N 3.41Å; E136-L140 VanDerWaalsContact O-N 3.1Å; L137-L140 PolarHBondContact O-N 2.92Å
141	M	97.6	Very high	97	Very high	7 Å²	7	40.4 Å²	40.4	3%	0.034	22%	0.222	C	C	.	.	S	Bend	trans	-86.7	145.3	-172.1	-62.6	-61.4	-64.5	0	0	111.1	A67 P123 H124 L126 L137 T145	A67-M141 HydrophobicContact CB-CE 4.16Å; A67-M141 HydrophobicContact CB-CG 4.23Å; P123-M141 HydrophobicContact CB-SD 4.43Å; P123-M141 HydrophobicContact CG-SD 3.76Å; H124-M141 WeakPolarHBondContact O-CE 3.24Å; L126-M141 HydrophobicContact CB-CE 4.41Å; L126-M141 HydrophobicContact CB-SD 3.95Å; L137-M141 WeakPolarHBondContact O-CB 3.36Å; L137-M141 WeakPolarHBondContact O-CG 3.5Å; L137-M141 PolarHBondContact O-N 3.38Å; M141-T145 HydrophobicContact CB-CG2 4.04Å; M141-T145 HydrophobicContact CE-CG2 3.75Å; M141-T145 HydrophobicContact CG-CG2 4.3Å
142	P	96.4	Very high	97	Very high	40 Å²	40	41.3 Å²	41.3	26%	0.26	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-65.4	154	178.6	26.4	-34.9	0	0	0	112.1	T65 P123 T145	T65-P142 HydrophobicContact CG2-CG 3.58Å; P123-P142 WeakPolarHBondContact O-CD 3.32Å; P142-T145 WeakPolarHBondContact O-CB 3.1Å; P142-T145 PolarHBondContact O-N 3.37Å; P142-T145 PolarHBondContact O-OG1 2.76Å
143	P	94.7	Very high	97	Very high	134 Å²	134	42.3 Å²	42.3	87%	0.87	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	144.4	173.2	-26.4	34.7	0	0	0	112.5	T145	P143-T145 VanDerWaalsContact C-N 3.29Å; P143-T145 PolarHBondContact O-N 2.89Å
144	G	92.9	Very high	97	Very high	61 Å²	61	40.2 Å²	40.2	63%	0.629	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	7	-176.9	0	0	0	0	0	114.6	H63 V146	H63-G144 PolarHBondContact CE1-O 3.05Å; H63-G144 PolarHBondContact NE2-O 3.45Å; G144-V146 PolarHBondContact O-N 3.26Å
145	T	97.7	Very high	97.2	Very high	14 Å²	14	35.5 Å²	35.5	9%	0.086	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-58.2	133	172.2	-68.2	0	0	0	0	111.3	T65 A67 M141 P142 P143 Y147	T65-T145 WeakPolarHBondContact O-CA 3.44Å; A67-T145 HydrophobicContact CB-CG2 3.72Å; M141-T145 HydrophobicContact CB-CG2 4.04Å; M141-T145 HydrophobicContact CE-CG2 3.75Å; M141-T145 HydrophobicContact CG-CG2 4.3Å; P142-T145 WeakPolarHBondContact O-CB 3.1Å; P142-T145 PolarHBondContact O-N 3.37Å; P142-T145 PolarHBondContact O-OG1 2.76Å; P143-T145 VanDerWaalsContact C-N 3.29Å; P143-T145 PolarHBondContact O-N 2.89Å; T145-Y147 HydrophobicContact CG2-CD2 4.27Å; T145-Y147 HydrophobicContact CG2-CE1 4.44Å; T145-Y147 HydrophobicContact CG2-CE2 3.89Å; T145-Y147 WeakPolarHBondContact O-CD2 3.31Å; T145-Y147 WeakPolarHBondContact O-CE2 3.26Å
146	V	98.2	Very high	97.2	Very high	6 Å²	6	33.3 Å²	33.3	4%	0.036	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.8	173.7	170.5	0	0	0	0	108.8	H63 T65 V66 A67 G144 V148 L254 L255	H63-V146 WeakPolarHBondContact NE2-CG2 3.5Å; T65-V146 PolarHBondContact O-N 3.26Å; V66-V146 WeakPolarHBondContact CA-O 3.44Å; A67-V146 PolarHBondContact N-O 3.18Å; G144-V146 PolarHBondContact O-N 3.26Å; V146-V148 HydrophobicContact CG1-CG1 3.99Å; V146-L254 HydrophobicContact CG1-CD2 3.62Å; V146-L254 HydrophobicContact CG1-CG 4.02Å; V146-L255 HydrophobicContact CB-CD2 3.91Å; V146-L255 HydrophobicContact CG1-CD2 3.76Å; V146-L255 HydrophobicContact CG2-CD2 4.25Å
147	Y	98.5	Very high	97.2	Very high	25 Å²	25	31.7 Å²	31.7	10%	0.098	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.7	178.8	-64.7	-99	0	0	0	110.4	A67 L137 T145 V234 F235 S236 L237	A67-Y147 HydrophobicContact CB-CD1 3.44Å; A67-Y147 VanDerWaalsContact CB-CD1 3.44Å; A67-Y147 HydrophobicContact CB-CE1 3.56Å; A67-Y147 HydrophobicContact CB-CG 4.15Å; A67-Y147 CarbonylContact O-C 3.27Å; A67-Y147 VanDerWaalsContact O-CA 3.32Å; A67-Y147 WeakPolarHBondContact O-CA 3.32Å; L137-Y147 HydrophobicContact CB-CE1 4.21Å; L137-Y147 HydrophobicContact CD2-CD1 4.12Å; L137-Y147 HydrophobicContact CD2-CE1 3.85Å; L137-Y147 HydrophobicContact CG-CE1 4.21Å; L137-Y147 PolarHBondContact O-OH 3.27Å; T145-Y147 HydrophobicContact CG2-CD2 4.27Å; T145-Y147 HydrophobicContact CG2-CE1 4.44Å; T145-Y147 HydrophobicContact CG2-CE2 3.89Å; T145-Y147 WeakPolarHBondContact O-CD2 3.31Å; T145-Y147 WeakPolarHBondContact O-CE2 3.26Å; Y147-V234 WeakPolarHBondContact CB-O 3.35Å; Y147-V234 HydrophobicContact CD1-CG1 4.14Å; Y147-V234 HydrophobicContact CG-CG1 4Å; Y147-F235 CarbonylContact O-C 3.06Å; Y147-F235 WeakPolarHBondContact O-CA 3.4Å; Y147-S236 WeakPolarHBondContact O-CB 3.39Å; Y147-S236 PolarHBondContact O-N 2.96Å; Y147-L237 PolarHBondContact O-N 2.87Å
148	V	98.7	Very high	97.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	153	178.4	-59.7	0	0	0	0	110.5	V66 A67 F68 L69 V146 F235 L237 L251 L254	V66-V148 HydrophobicContact CG1-CG2 3.96Å; A67-V148 PolarHBondContact O-N 3.39Å; F68-V148 CarbonylContact C-O 3.53Å; F68-V148 VanDerWaalsContact CA-O 3.26Å; F68-V148 WeakPolarHBondContact CA-O 3.47Å; F68-V148 HydrophobicContact CB-CG2 3.92Å; F68-V148 HydrophobicContact CD2-CG2 3.94Å; F68-V148 HydrophobicContact CG-CG2 4.35Å; L69-V148 PolarHBondContact N-O 3.31Å; V146-V148 HydrophobicContact CG1-CG1 3.99Å; V148-F235 VanDerWaalsContact C-CD1 3.5Å; V148-L237 VanDerWaalsContact CA-O 3.3Å; V148-L237 WeakPolarHBondContact CA-O 3.44Å; V148-L237 HydrophobicContact CB-CB 4.45Å; V148-L237 HydrophobicContact CG1-CB 3.87Å; V148-L251 HydrophobicContact CB-CD1 4.4Å; V148-L251 HydrophobicContact CG1-CD1 3.88Å; V148-L251 HydrophobicContact CG2-CD1 4.2Å; V148-L254 HydrophobicContact CG1-CD2 4.05Å
149	T	98.8	Very high	97.4	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	174.9	173.9	-172.4	0	0	0	0	109.1	L69 F235 L237 V238 M239	L69-T149 PolarHBondContact O-OG1 2.85Å; T149-F235 HydrophobicContact CG2-CB 4.33Å; T149-F235 HydrophobicContact CG2-CD1 3.72Å; T149-F235 HydrophobicContact CG2-CD2 4.33Å; T149-F235 HydrophobicContact CG2-CE1 4.09Å; T149-F235 HydrophobicContact CG2-CG 3.85Å; T149-L237 PolarHBondContact N-O 2.59Å; T149-V238 HydrophobicContact CG2-CB 4.28Å; T149-V238 HydrophobicContact CG2-CG1 4.06Å; T149-V238 HydrophobicContact CG2-CG2 3.84Å; T149-M239 WeakPolarHBondContact O-CB 3.07Å; T149-M239 PolarHBondContact O-N 2.68Å
150	I	98.8	Very high	97.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138.3	177.4	-173.1	160.7	0	0	0	109.5	F68 T71 T74 V79 M239 A241 F244	F68-I150 HydrophobicContact CE2-CB 4.12Å; F68-I150 HydrophobicContact CE2-CG2 3.68Å; F68-I150 HydrophobicContact CZ-CB 4.41Å; F68-I150 HydrophobicContact CZ-CG2 3.57Å; T71-I150 PolarHBondContact OG1-O 2.6Å; T74-I150 VanDerWaalsContact O-CD1 3.23Å; T74-I150 WeakPolarHBondContact O-CD1 3.38Å; T74-I150 WeakPolarHBondContact O-CG1 3.39Å; T74-I150 WeakPolarHBondContact OG1-CG2 3.45Å; V79-I150 HydrophobicContact CG2-CD1 4.3Å; I150-M239 CarbonylContact C-O 3.57Å; I150-M239 WeakPolarHBondContact CA-O 3.31Å; I150-M239 HydrophobicContact CB-CB 3.92Å; I150-M239 HydrophobicContact CB-CE 3.89Å; I150-M239 HydrophobicContact CD1-CB 4.03Å; I150-M239 HydrophobicContact CD1-CE 4.25Å; I150-M239 HydrophobicContact CG1-CB 3.78Å; I150-M239 HydrophobicContact CG1-CE 4.5Å; I150-A241 HydrophobicContact CD1-CB 4.26Å; I150-A241 HydrophobicContact CG1-CB 4.4Å; I150-F244 HydrophobicContact CD1-CD2 4.07Å; I150-F244 HydrophobicContact CD1-CE2 4.02Å
151	L	98.8	Very high	97.4	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	168.1	172.8	-53.6	-179	0	0	0	109.6	T71 L205 L209 V238 M239 I240 A241 Y298 F301	T71-L151 HydrophobicContact CG2-CD2 4.5Å; L151-L205 HydrophobicContact CB-CD1 4.4Å; L151-L205 HydrophobicContact CD2-CB 4.48Å; L151-L205 HydrophobicContact CD2-CD1 4.15Å; L151-L205 HydrophobicContact CD2-CD2 3.85Å; L151-L205 HydrophobicContact CD2-CG 4.37Å; L151-L209 HydrophobicContact CD2-CD1 4.3Å; L151-V238 HydrophobicContact CD1-CG1 3.66Å; L151-V238 HydrophobicContact CG-CG1 3.62Å; L151-M239 PolarHBondContact N-O 3.04Å; L151-I240 HydrophobicContact CB-CD1 4.41Å; L151-A241 WeakPolarHBondContact O-CB 3.33Å; L151-A241 PolarHBondContact O-N 3.11Å; L151-Y298 HydrophobicContact CB-CD2 4.38Å; L151-F301 HydrophobicContact CD1-CB 3.77Å; L151-F301 HydrophobicContact CD1-CD2 3.77Å; L151-F301 HydrophobicContact CD1-CG 4.05Å
152	R	98.4	Very high	97.3	Very high	62 Å²	62	20.7 Å²	20.7	23%	0.234	13%	0.13	C	C	.	.			trans	-143.9	153.1	177.7	-174.6	175.6	-177.5	-170.8	-4	108.8	K73 T74 P154 M157 A241 E242 Y298	K73-R152 WeakPolarHBondContact O-CD 3.19Å; K73-R152 PolarHBondContact O-NH1 3.45Å; T74-R152 HydrophobicContact CG2-CB 3.79Å; R152-P154 WeakPolarHBondContact O-CD 3.35Å; R152-M157 HydrophobicContact CB-CB 4.25Å; R152-M157 HydrophobicContact CG-CB 4.29Å; R152-A241 HydrophobicContact CB-CB 3.93Å; R152-A241 HydrophobicContact CG-CB 3.97Å; R152-E242 WeakPolarHBondContact CG-OE1 3.48Å; R152-Y298 VanDerWaalsContact O-CD2 3.3Å; R152-Y298 WeakPolarHBondContact O-CD2 3.47Å
153	E	98.3	Very high	97.2	Very high	38 Å²	38	20 Å²	20	18%	0.178	13%	0.127	C	C	.	.			trans	-53.3	124.1	176.9	-161.9	-67.3	132.7	0	0	109.4	A155 A156 M157 E242 R288 Y298	E153-A155 PolarHBondContact O-N 2.69Å; E153-A155 PolarHBondContact OE1-N 2.77Å; E153-A155 VanDerWaalsContact OE2-CA 3.31Å; E153-A155 WeakPolarHBondContact OE2-CA 3.37Å; E153-A155 WeakPolarHBondContact OE2-CB 3.47Å; E153-A155 PolarHBondContact OE2-N 2.95Å; E153-A156 HydrophobicContact CB-CB 4.44Å; E153-A156 PolarHBondContact O-N 3.44Å; E153-A156 PolarHBondContact OE2-N 3.4Å; E153-M157 WeakPolarHBondContact O-CB 3.39Å; E153-M157 PolarHBondContact O-N 3.33Å; E153-E242 WeakPolarHBondContact CB-OE1 3.38Å; E153-E242 PolarHBondContact N-OE1 2.79Å; E153-R288 WeakPolarHBondContact OE1-CD 3.35Å; E153-R288 IonicContact OE1-CZ 2.7Å; E153-R288 IonicContact OE1-NH1 3.57Å; E153-R288 PolarHBondContact OE1-NH1 3.25Å; E153-Y298 HydrophobicContact CB-CE1 4.1Å; E153-Y298 HydrophobicContact CB-CE2 4.13Å; E153-Y298 HydrophobicContact CG-CE1 3.95Å
154	P	98.1	Very high	97.1	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60	-35.2	-169.1	-31.6	37.4	0	0	0	115.5	R152 F158 D294 Y298	R152-P154 WeakPolarHBondContact O-CD 3.35Å; P154-F158 WeakPolarHBondContact O-CB 3.35Å; P154-F158 PolarHBondContact O-N 2.96Å; P154-D294 HydrophobicContact CB-CB 4.11Å; P154-D294 HydrophobicContact CG-CB 3.98Å; P154-D294 WeakPolarHBondContact CG-O 3.44Å; P154-Y298 HydrophobicContact CG-CG 4.44Å
155	A	98.1	Very high	97.1	Very high	2 Å²	2	13 Å²	13	2%	0.017	6%	0.064	C	C	.	.	H	α-helix	trans	-68.1	-44.7	176.6	0	0	0	0	0	111.6	E153 M157 F158 E159 I279 A284 A287 R288	E153-A155 PolarHBondContact O-N 2.69Å; E153-A155 PolarHBondContact OE1-N 2.77Å; E153-A155 VanDerWaalsContact OE2-CA 3.31Å; E153-A155 WeakPolarHBondContact OE2-CA 3.37Å; E153-A155 WeakPolarHBondContact OE2-CB 3.47Å; E153-A155 PolarHBondContact OE2-N 2.95Å; A155-M157 VanDerWaalsContact C-N 3.32Å; A155-M157 PolarHBondContact O-N 2.91Å; A155-F158 PolarHBondContact O-N 3.34Å; A155-E159 WeakPolarHBondContact O-CB 3.47Å; A155-E159 PolarHBondContact O-N 3.17Å; A155-I279 WeakPolarHBondContact O-CD1 3.47Å; A155-A284 HydrophobicContact CB-CB 3.85Å; A155-A287 HydrophobicContact CB-CB 3.73Å; A155-R288 HydrophobicContact CB-CG 4.48Å
156	A	96.9	Very high	96.7	Very high	21 Å²	21	13.6 Å²	13.6	17%	0.174	7%	0.067	C	C	.	.	H	α-helix	trans	-65.1	-36.3	176.2	0	0	0	0	0	112.7	E153 S160 I279	E153-A156 HydrophobicContact CB-CB 4.44Å; E153-A156 PolarHBondContact O-N 3.44Å; E153-A156 PolarHBondContact OE2-N 3.4Å; A156-S160 PolarHBondContact O-N 2.85Å; A156-I279 HydrophobicContact CB-CD1 4.31Å
157	M	97.4	Very high	96.3	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-68.9	-45.8	173.9	-174.9	-172.2	71.7	0	0	111.4	K73 T74 R152 E153 A155 S160 L161 L205 D294	K73-M157 HydrophobicContact CB-CG 4.11Å; T74-M157 HydrophobicContact CG2-SD 3.98Å; R152-M157 HydrophobicContact CB-CB 4.25Å; R152-M157 HydrophobicContact CG-CB 4.29Å; E153-M157 WeakPolarHBondContact O-CB 3.39Å; E153-M157 PolarHBondContact O-N 3.33Å; A155-M157 VanDerWaalsContact C-N 3.32Å; A155-M157 PolarHBondContact O-N 2.91Å; M157-S160 CarbonylContact O-C 3.56Å; M157-S160 WeakPolarHBondContact O-CA 3.41Å; M157-S160 VanDerWaalsContact O-CB 3.3Å; M157-S160 WeakPolarHBondContact O-CB 3.45Å; M157-S160 PolarHBondContact O-N 3Å; M157-L161 HydrophobicContact CE-CD1 4.04Å; M157-L161 HydrophobicContact CG-CD1 4.07Å; M157-L161 PolarHBondContact O-N 3.17Å; M157-L205 HydrophobicContact CE-CD1 3.84Å; M157-L205 HydrophobicContact CE-CD2 4.29Å; M157-L205 HydrophobicContact CE-CG 3.56Å; M157-L205 HydrophobicContact SD-CD1 3.78Å; M157-L205 HydrophobicContact SD-CD2 3.54Å; M157-L205 VanDerWaalsContact SD-CD2 3.54Å; M157-L205 HydrophobicContact SD-CG 3.48Å; M157-L205 WeakPolarHBondContact SD-CG 3.33Å; M157-D294 VanDerWaalsContact CE-OD2 3.28Å; M157-D294 WeakPolarHBondContact CE-OD2 3.47Å
158	F	98.1	Very high	95.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-40.7	-178.7	-170	-107	0	0	0	112.4	P154 A155 S160 L161 F162 F172 L180 F183 L184 A201 A287 W290 N291	P154-F158 WeakPolarHBondContact O-CB 3.35Å; P154-F158 PolarHBondContact O-N 2.96Å; A155-F158 PolarHBondContact O-N 3.34Å; F158-S160 PolarHBondContact O-N 2.76Å; F158-L161 PolarHBondContact O-N 3.1Å; F158-L161 VanDerWaalsContact O-N 3.16Å; F158-F162 VanDerWaalsContact O-CB 3.28Å; F158-F162 WeakPolarHBondContact O-CB 3.23Å; F158-F162 PolarHBondContact O-N 3.47Å; F158-F172 HydrophobicContact CE2-CE1 4.2Å; F158-F172 HydrophobicContact CE2-CZ 4.18Å; F158-F172 AromaticContact CZ-CE1 3.96Å; F158-F172 HydrophobicContact CZ-CE1 3.96Å; F158-F172 HydrophobicContact CZ-CZ 4.35Å; F158-L180 HydrophobicContact CD1-CD1 3.86Å; F158-L180 HydrophobicContact CE1-CD1 3.74Å; F158-F183 AromaticContact CE1-CD1 3.84Å; F158-F183 HydrophobicContact CE1-CD1 3.84Å; F158-F183 AromaticContact CE1-CE1 3.8Å; F158-F183 HydrophobicContact CE1-CE1 3.8Å; F158-F183 AromaticContact CZ-CD1 3.85Å; F158-F183 HydrophobicContact CZ-CD1 3.85Å; F158-F183 AromaticContact CZ-CE1 3.36Å; F158-F183 HydrophobicContact CZ-CE1 3.36Å; F158-F183 AromaticContact CZ-CZ 3.99Å; F158-F183 HydrophobicContact CZ-CZ 3.99Å; F158-L184 HydrophobicContact CD1-CD1 4.47Å; F158-L184 HydrophobicContact CD1-CD2 4.11Å; F158-L184 HydrophobicContact CE1-CD2 3.68Å; F158-L184 HydrophobicContact CE1-CG 4.18Å; F158-A201 VanDerWaalsContact CE2-O 3.31Å; F158-A201 WeakPolarHBondContact CE2-O 3.26Å; F158-A287 HydrophobicContact CD1-CB 4.35Å; F158-W290 AromaticContact CZ-CD1 3.96Å; F158-N291 VanDerWaalsContact CD2-ND2 3.32Å; F158-N291 WeakPolarHBondContact CD2-ND2 3.23Å; F158-N291 WeakPolarHBondContact CG-ND2 3.38Å
159	E	97.4	Very high	95.7	Very high	17 Å²	17	19.4 Å²	19.4	8%	0.079	9%	0.092	C	C	.	.	H	α-helix	trans	-55.6	-42	169.9	178.4	-79.6	152.8	0	0	111.1	A155 S163 L180 R270 L276 I279	A155-E159 WeakPolarHBondContact O-CB 3.47Å; A155-E159 PolarHBondContact O-N 3.17Å; E159-S163 WeakPolarHBondContact O-CB 3.47Å; E159-S163 PolarHBondContact O-N 3.45Å; E159-L180 HydrophobicContact CB-CD2 3.81Å; E159-L180 HydrophobicContact CG-CD2 3.92Å; E159-R270 IonicContact OE1-CZ 3.29Å; E159-R270 IonicContact OE1-NH1 2.95Å; E159-R270 PolarHBondContact OE1-NH1 2.94Å; E159-R270 IonicContact OE1-NH2 2.98Å; E159-R270 IonicContact OE2-CZ 2.9Å; E159-R270 IonicContact OE2-NH1 3.61Å; E159-R270 PolarHBondContact OE2-NH1 3.5Å; E159-R270 IonicContact OE2-NH2 3.54Å; E159-R270 PolarHBondContact OE2-NH2 3.31Å; E159-L276 HydrophobicContact CG-CB 4.43Å; E159-L276 HydrophobicContact CG-CD1 3.93Å; E159-L276 HydrophobicContact CG-CG 4.06Å; E159-L276 PolarHBondContact OE1-N 2.99Å; E159-I279 HydrophobicContact CB-CD1 3.77Å; E159-I279 HydrophobicContact CG-CD1 4.22Å
160	S	95.8	Very high	95.5	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-69.5	-36.6	177.8	-166	0	0	0	0	113.4	K73 A156 M157 F158 Y164 R270	K73-S160 WeakPolarHBondContact CE-OG 3.48Å; A156-S160 PolarHBondContact O-N 2.85Å; M157-S160 CarbonylContact O-C 3.56Å; M157-S160 WeakPolarHBondContact O-CA 3.41Å; M157-S160 VanDerWaalsContact O-CB 3.3Å; M157-S160 WeakPolarHBondContact O-CB 3.45Å; M157-S160 PolarHBondContact O-N 3Å; F158-S160 PolarHBondContact O-N 2.76Å; S160-Y164 WeakPolarHBondContact O-CB 3.4Å; S160-Y164 PolarHBondContact O-N 3.03Å; S160-Y164 VanDerWaalsContact O-N 3.08Å; S160-R270 PolarHBondContact OG-NE 2.97Å; S160-R270 PolarHBondContact OG-NH2 3.47Å
161	L	96.4	Very high	95.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.7	-49.6	175.6	-75.4	163.5	0	0	0	110.2	H72 K73 M157 F158 S163 Y164 Y165 F200 T204	H72-L161 HydrophobicContact CB-CD2 4.25Å; K73-L161 HydrophobicContact CB-CD2 4.38Å; K73-L161 HydrophobicContact CB-CG 4.3Å; K73-L161 HydrophobicContact CD-CD2 4.5Å; K73-L161 HydrophobicContact CG-CD2 3.44Å; K73-L161 VanDerWaalsContact CG-CD2 3.44Å; K73-L161 HydrophobicContact CG-CG 3.72Å; M157-L161 HydrophobicContact CE-CD1 4.04Å; M157-L161 HydrophobicContact CG-CD1 4.07Å; M157-L161 PolarHBondContact O-N 3.17Å; F158-L161 PolarHBondContact O-N 3.1Å; F158-L161 VanDerWaalsContact O-N 3.16Å; L161-S163 PolarHBondContact O-N 2.79Å; L161-Y164 PolarHBondContact O-N 3.43Å; L161-Y165 HydrophobicContact CD2-CD2 3.86Å; L161-Y165 HydrophobicContact CD2-CE2 3.73Å; L161-Y165 WeakPolarHBondContact O-CB 3.37Å; L161-Y165 PolarHBondContact O-N 2.89Å; L161-F200 HydrophobicContact CD2-CB 4.33Å; L161-F200 HydrophobicContact CD2-CD1 4.07Å; L161-T204 HydrophobicContact CD1-CG2 4.13Å; L161-T204 WeakPolarHBondContact CD1-OG1 3.48Å; L161-T204 HydrophobicContact CD2-CG2 4.32Å
162	F	96	Very high	95.4	Very high	9 Å²	9	20.6 Å²	20.6	4%	0.039	10%	0.1	C	C	.	.	H	α-helix	trans	-55.9	-50	180	-175.7	-88.1	0	0	0	111.8	F158 N166 F172 V175 A178 L180 F183	F158-F162 VanDerWaalsContact O-CB 3.28Å; F158-F162 WeakPolarHBondContact O-CB 3.23Å; F158-F162 PolarHBondContact O-N 3.47Å; F162-N166 WeakPolarHBondContact O-CA 3.34Å; F162-N166 VanDerWaalsContact O-CB 3.27Å; F162-N166 WeakPolarHBondContact O-CB 3.28Å; F162-N166 PolarHBondContact O-N 3.19Å; F162-F172 HydrophobicContact CB-CZ 4.41Å; F162-F172 HydrophobicContact CD2-CB 4.34Å; F162-F172 AromaticContact CD2-CD1 3.42Å; F162-F172 HydrophobicContact CD2-CD1 3.42Å; F162-F172 VanDerWaalsContact CD2-CD1 3.42Å; F162-F172 AromaticContact CD2-CE1 3.73Å; F162-F172 HydrophobicContact CD2-CE1 3.73Å; F162-F172 AromaticContact CD2-CG 3.88Å; F162-F172 HydrophobicContact CD2-CG 3.88Å; F162-F172 HydrophobicContact CD2-CZ 4.41Å; F162-F172 HydrophobicContact CE2-CB 4.23Å; F162-F172 AromaticContact CE2-CD1 3.8Å; F162-F172 HydrophobicContact CE2-CD1 3.8Å; F162-F172 HydrophobicContact CE2-CE1 4.48Å; F162-F172 HydrophobicContact CE2-CG 4.21Å; F162-F172 HydrophobicContact CG-CD1 4.39Å; F162-V175 HydrophobicContact CE2-CG2 4.03Å; F162-V175 HydrophobicContact CZ-CB 4.22Å; F162-V175 HydrophobicContact CZ-CG1 4.16Å; F162-V175 HydrophobicContact CZ-CG2 4.24Å; F162-A178 WeakPolarHBondContact CE1-O 3.18Å; F162-L180 HydrophobicContact CB-CD1 3.94Å; F162-L180 HydrophobicContact CD1-CB 4.06Å; F162-L180 HydrophobicContact CD1-CD1 4.19Å; F162-L180 HydrophobicContact CD2-CD1 3.93Å; F162-L180 HydrophobicContact CE1-CB 4.16Å; F162-L180 HydrophobicContact CG-CB 4.47Å; F162-L180 HydrophobicContact CG-CD1 3.74Å; F162-F183 HydrophobicContact CD2-CB 4.36Å; F162-F183 HydrophobicContact CD2-CG 4.3Å; F162-F183 HydrophobicContact CE2-CB 3.63Å; F162-F183 HydrophobicContact CE2-CD2 4.07Å; F162-F183 AromaticContact CE2-CG 3.88Å; F162-F183 HydrophobicContact CE2-CG 3.88Å; F162-F183 HydrophobicContact CZ-CB 4.3Å
163	S	93.1	Very high	95.2	Very high	27 Å²	27	25.7 Å²	25.7	19%	0.189	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-48.6	178.7	177.4	0	0	0	0	111.9	E159 L161 V362	E159-S163 WeakPolarHBondContact O-CB 3.47Å; E159-S163 PolarHBondContact O-N 3.45Å; L161-S163 PolarHBondContact O-N 2.79Å; S163-V362 VanDerWaalsContact OG-CG2 3.26Å; S163-V362 WeakPolarHBondContact OG-CG2 3.29Å
164	Y	91.8	Very high	95.1	Very high	25 Å²	25	27.3 Å²	27.3	10%	0.098	12%	0.124	C	C	.	.	H	α-helix	trans	-69.8	-41.2	-173.4	-171.8	-87.7	0	0	0	113	K73 S160 L161 W356 P358 I364	K73-Y164 HydrophobicContact CD-CG 4.43Å; S160-Y164 WeakPolarHBondContact O-CB 3.4Å; S160-Y164 PolarHBondContact O-N 3.03Å; S160-Y164 VanDerWaalsContact O-N 3.08Å; L161-Y164 PolarHBondContact O-N 3.43Å; Y164-W356 AromaticContact CE1-CZ3 3.97Å; Y164-W356 HydrophobicContact CE1-CZ3 3.97Å; Y164-W356 HydrophobicContact CE2-CZ3 4.48Å; Y164-W356 AromaticContact CZ-CZ3 3.66Å; Y164-W356 VanDerWaalsContact OH-CZ3 3.25Å; Y164-W356 WeakPolarHBondContact OH-CZ3 3.38Å; Y164-P358 HydrophobicContact CD1-CB 4.37Å; Y164-P358 HydrophobicContact CD2-CB 4.05Å; Y164-P358 HydrophobicContact CD2-CG 3.66Å; Y164-P358 HydrophobicContact CE1-CB 4.29Å; Y164-P358 HydrophobicContact CE2-CB 3.99Å; Y164-P358 HydrophobicContact CE2-CG 3.69Å; Y164-P358 HydrophobicContact CG-CB 4.26Å; Y164-P358 HydrophobicContact CG-CG 4.28Å; Y164-I364 HydrophobicContact CD2-CD1 4.2Å; Y164-I364 HydrophobicContact CE2-CD1 3.95Å; Y164-I364 HydrophobicContact CE2-CG1 4.33Å
165	Y	93.2	Very high	95	Very high	23 Å²	23	27.6 Å²	27.6	9%	0.09	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	10.6	-178.2	-66.6	-74.6	0	0	0	113.3	K73 L161 Q167 Y168 C169 F200	K73-Y165 HydrophobicContact CD-CE2 4.29Å; L161-Y165 HydrophobicContact CD2-CD2 3.86Å; L161-Y165 HydrophobicContact CD2-CE2 3.73Å; L161-Y165 WeakPolarHBondContact O-CB 3.37Å; L161-Y165 PolarHBondContact O-N 2.89Å; Y165-Q167 PolarHBondContact O-N 2.81Å; Y165-Q167 VanDerWaalsContact O-N 3.09Å; Y165-Y168 HydrophobicContact CD1-CD2 4.38Å; Y165-Y168 PolarHBondContact O-N 2.69Å; Y165-C169 PolarHBondContact O-N 2.84Å; Y165-F200 AromaticContact CD1-CD2 3.92Å; Y165-F200 HydrophobicContact CD1-CD2 3.92Å; Y165-F200 AromaticContact CD1-CE2 3.97Å; Y165-F200 HydrophobicContact CD1-CE2 3.97Å; Y165-F200 HydrophobicContact CD2-CB 4.24Å; Y165-F200 HydrophobicContact CD2-CD1 4.38Å; Y165-F200 HydrophobicContact CD2-CD2 4.15Å; Y165-F200 HydrophobicContact CD2-CG 4.01Å; Y165-F200 HydrophobicContact CE1-CD2 4.04Å; Y165-F200 AromaticContact CE1-CE2 3.67Å; Y165-F200 HydrophobicContact CE1-CE2 3.67Å; Y165-F200 HydrophobicContact CE1-CZ 4.02Å; Y165-F200 HydrophobicContact CE2-CD1 4.05Å; Y165-F200 HydrophobicContact CE2-CD2 4.28Å; Y165-F200 HydrophobicContact CE2-CE1 4.19Å; Y165-F200 HydrophobicContact CE2-CE2 4.4Å; Y165-F200 HydrophobicContact CE2-CG 4.11Å; Y165-F200 HydrophobicContact CE2-CZ 4.37Å; Y165-F200 AromaticContact CG-CD2 3.97Å; Y165-F200 HydrophobicContact CG-CD2 3.97Å; Y165-F200 HydrophobicContact CG-CE2 4.45Å; Y165-F200 HydrophobicContact CG-CG 4.26Å; Y165-F200 AromaticContact CZ-CE2 3.91Å; Y165-F200 AromaticContact CZ-CZ 3.83Å
166	N	90.6	Very high	94.8	Very high	25 Å²	25	30.8 Å²	30.8	13%	0.134	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-37.9	-174.1	-174.7	-104.7	0	0	0	113.4	F162 F172 R173	F162-N166 WeakPolarHBondContact O-CA 3.34Å; F162-N166 VanDerWaalsContact O-CB 3.27Å; F162-N166 WeakPolarHBondContact O-CB 3.28Å; F162-N166 PolarHBondContact O-N 3.19Å; N166-F172 PolarHBondContact ND2-O 3.49Å; N166-R173 WeakPolarHBondContact O-CG 3.19Å
167	Q	88.8	Confident	94.6	Very high	94 Å²	94	37.4 Å²	37.4	44%	0.439	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.1	-178.9	-62.5	-167	-15	0	0	114.3	Y165 R173	Y165-Q167 PolarHBondContact O-N 2.81Å; Y165-Q167 VanDerWaalsContact O-N 3.09Å; Q167-R173 WeakPolarHBondContact O-CD 3.34Å
168	Y	89.6	Confident	94.4	Very high	60 Å²	60	39 Å²	39	24%	0.235	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-47.4	-172.5	-57.5	-70	0	0	0	111.6	Y165 P170 F197 W356 P358	Y165-Y168 HydrophobicContact CD1-CD2 4.38Å; Y165-Y168 PolarHBondContact O-N 2.69Å; Y168-P170 VanDerWaalsContact O-CD 3.3Å; Y168-P170 WeakPolarHBondContact O-CD 3.31Å; Y168-F197 WeakPolarHBondContact O-CD2 3.5Å; Y168-W356 AromaticContact CE2-CH2 3.84Å; Y168-W356 HydrophobicContact CE2-CH2 3.84Å; Y168-W356 HydrophobicContact CE2-CZ2 4.49Å; Y168-W356 AromaticContact CZ-CH2 3.9Å; Y168-W356 WeakPolarHBondContact OH-CH2 3.4Å; Y168-W356 VanDerWaalsContact OH-CZ2 3.28Å; Y168-W356 WeakPolarHBondContact OH-CZ2 3.27Å; Y168-P358 HydrophobicContact CE2-CB 4.42Å; Y168-P358 WeakPolarHBondContact CE2-O 3.37Å; Y168-P358 PolarHBondContact OH-O 3.04Å; Y168-P358 VanDerWaalsContact OH-O 3.05Å
169	C	94.7	Very high	94.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.			trans	-75	115.9	179.7	-176.6	0	0	0	0	110.2	Y165 A171 F172 R173 F197	Y165-C169 PolarHBondContact O-N 2.84Å; C169-A171 PolarHBondContact O-N 2.8Å; C169-F172 HydrophobicContact CB-CB 4.26Å; C169-F172 HydrophobicContact CB-CD2 3.45Å; C169-F172 VanDerWaalsContact CB-CD2 3.45Å; C169-F172 HydrophobicContact CB-CE2 3.97Å; C169-F172 HydrophobicContact CB-CG 3.94Å; C169-F172 PolarHBondContact O-N 2.77Å; C169-R173 WeakPolarHBondContact O-CG 3.24Å; C169-R173 PolarHBondContact O-N 2.87Å; C169-F197 HydrophobicContact CB-CB 4.18Å; C169-F197 PolarHBondContact SG-O 3.01Å
170	P	96.3	Very high	94.1	Very high	24 Å²	24	41 Å²	41	16%	0.156	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-33.3	-179.7	-25	36.1	0	0	0	113.3	Y168 F172 R173 R174 E195 H196	Y168-P170 VanDerWaalsContact O-CD 3.3Å; Y168-P170 WeakPolarHBondContact O-CD 3.31Å; P170-F172 VanDerWaalsContact C-N 3.32Å; P170-F172 PolarHBondContact O-N 3.29Å; P170-R173 PolarHBondContact O-N 3.41Å; P170-R174 WeakPolarHBondContact O-CG 3.29Å; P170-R174 PolarHBondContact O-N 3.32Å; P170-R174 VanDerWaalsContact O-N 3.14Å; P170-R174 PolarHBondContact O-NE 3.2Å; P170-E195 VanDerWaalsContact CB-CD 3.47Å; P170-E195 HydrophobicContact CB-CG 4.35Å; P170-E195 VanDerWaalsContact CB-OE1 3.29Å; P170-E195 WeakPolarHBondContact CB-OE1 3.39Å; P170-E195 HydrophobicContact CG-CG 4.13Å; P170-H196 WeakPolarHBondContact CD-O 2.96Å
171	A	96.9	Very high	94.2	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-43.4	175.2	0	0	0	0	0	111.5	C169 V175 F183 Y190 Y191 A201	C169-A171 PolarHBondContact O-N 2.8Å; A171-V175 WeakPolarHBondContact O-CG2 3.47Å; A171-F183 HydrophobicContact CB-CE2 4.39Å; A171-Y190 VanDerWaalsContact CA-O 3.3Å; A171-Y190 WeakPolarHBondContact CA-O 3.12Å; A171-Y190 WeakPolarHBondContact CB-O 3.3Å; A171-Y191 HydrophobicContact CB-CD2 4.41Å; A171-A201 HydrophobicContact CB-CB 3.91Å
172	F	96.6	Very high	94.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-75.1	-36.1	177.8	-56.7	-26.1	0	0	0	113.1	F158 F162 N166 C169 P170 R174 V175 F183 F200 A201	F158-F172 HydrophobicContact CE2-CE1 4.2Å; F158-F172 HydrophobicContact CE2-CZ 4.18Å; F158-F172 AromaticContact CZ-CE1 3.96Å; F158-F172 HydrophobicContact CZ-CE1 3.96Å; F158-F172 HydrophobicContact CZ-CZ 4.35Å; F162-F172 HydrophobicContact CB-CZ 4.41Å; F162-F172 HydrophobicContact CD2-CB 4.34Å; F162-F172 AromaticContact CD2-CD1 3.42Å; F162-F172 HydrophobicContact CD2-CD1 3.42Å; F162-F172 VanDerWaalsContact CD2-CD1 3.42Å; F162-F172 AromaticContact CD2-CE1 3.73Å; F162-F172 HydrophobicContact CD2-CE1 3.73Å; F162-F172 AromaticContact CD2-CG 3.88Å; F162-F172 HydrophobicContact CD2-CG 3.88Å; F162-F172 HydrophobicContact CD2-CZ 4.41Å; F162-F172 HydrophobicContact CE2-CB 4.23Å; F162-F172 AromaticContact CE2-CD1 3.8Å; F162-F172 HydrophobicContact CE2-CD1 3.8Å; F162-F172 HydrophobicContact CE2-CE1 4.48Å; F162-F172 HydrophobicContact CE2-CG 4.21Å; F162-F172 HydrophobicContact CG-CD1 4.39Å; N166-F172 PolarHBondContact ND2-O 3.49Å; C169-F172 HydrophobicContact CB-CB 4.26Å; C169-F172 HydrophobicContact CB-CD2 3.45Å; C169-F172 VanDerWaalsContact CB-CD2 3.45Å; C169-F172 HydrophobicContact CB-CE2 3.97Å; C169-F172 HydrophobicContact CB-CG 3.94Å; C169-F172 PolarHBondContact O-N 2.77Å; P170-F172 VanDerWaalsContact C-N 3.32Å; P170-F172 PolarHBondContact O-N 3.29Å; F172-R174 VanDerWaalsContact C-N 3.27Å; F172-R174 PolarHBondContact O-N 2.77Å; F172-V175 WeakPolarHBondContact O-CB 3.31Å; F172-V175 WeakPolarHBondContact O-CG2 3.46Å; F172-V175 PolarHBondContact O-N 3.31Å; F172-F183 HydrophobicContact CD1-CD2 4.28Å; F172-F183 HydrophobicContact CD1-CE2 4.04Å; F172-F183 HydrophobicContact CE1-CE2 4.18Å; F172-F183 HydrophobicContact CE1-CZ 4.26Å; F172-F200 HydrophobicContact CE2-CB 4.47Å; F172-F200 VanDerWaalsContact CZ-O 3.31Å; F172-F200 WeakPolarHBondContact CZ-O 3.46Å; F172-A201 HydrophobicContact CD1-CB 4.22Å; F172-A201 HydrophobicContact CE1-CB 3.46Å; F172-A201 VanDerWaalsContact CE1-CB 3.46Å; F172-A201 HydrophobicContact CZ-CB 3.69Å
173	R	95.4	Very high	94.3	Very high	169 Å²	169	47.7 Å²	47.7	64%	0.638	24%	0.239	S	C	*	.	H	α-helix	trans	-62.3	-33	178.5	-73.6	-178.8	63.1	-173	-6.8	113.4	N166 Q167 C169 P170 V175	N166-R173 WeakPolarHBondContact O-CG 3.19Å; Q167-R173 WeakPolarHBondContact O-CD 3.34Å; C169-R173 WeakPolarHBondContact O-CG 3.24Å; C169-R173 PolarHBondContact O-N 2.87Å; P170-R173 PolarHBondContact O-N 3.41Å; R173-V175 PolarHBondContact O-N 2.69Å
174	R	95.9	Very high	94.6	Very high	72 Å²	72	47 Å²	47	27%	0.272	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10	-178.8	-75.4	-176.7	-89.1	113.9	2.1	113	P170 F172 Y190 E195	P170-R174 WeakPolarHBondContact O-CG 3.29Å; P170-R174 PolarHBondContact O-N 3.32Å; P170-R174 VanDerWaalsContact O-N 3.14Å; P170-R174 PolarHBondContact O-NE 3.2Å; F172-R174 VanDerWaalsContact C-N 3.27Å; F172-R174 PolarHBondContact O-N 2.77Å; R174-Y190 HydrophobicContact CB-CD1 4.08Å; R174-Y190 VanDerWaalsContact NH1-C 3.26Å; R174-Y190 PolarHBondContact NH1-O 3.43Å; R174-Y190 PolarHBondContact NH2-O 3.49Å; R174-Y190 WeakPolarHBondContact O-CE1 3.3Å; R174-E195 IonicContact CZ-OE2 3.66Å; R174-E195 IonicContact NH2-OE1 2.64Å; R174-E195 IonicContact NH2-OE2 3.64Å; R174-E195 PolarHBondContact NH2-OE2 3.48Å
175	V	96.8	Very high	94.8	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.042	26%	0.263	C	S	.	.	S	Bend	trans	-79.5	125.6	-177.7	-172.5	0	0	0	0	110.2	F162 A171 F172 R173 N177 A178 S179 A182 F183 Y190	F162-V175 HydrophobicContact CE2-CG2 4.03Å; F162-V175 HydrophobicContact CZ-CB 4.22Å; F162-V175 HydrophobicContact CZ-CG1 4.16Å; F162-V175 HydrophobicContact CZ-CG2 4.24Å; A171-V175 WeakPolarHBondContact O-CG2 3.47Å; F172-V175 WeakPolarHBondContact O-CB 3.31Å; F172-V175 WeakPolarHBondContact O-CG2 3.46Å; F172-V175 PolarHBondContact O-N 3.31Å; R173-V175 PolarHBondContact O-N 2.69Å; V175-N177 PolarHBondContact O-N 2.87Å; V175-A178 PolarHBondContact O-N 2.92Å; V175-S179 WeakPolarHBondContact CG1-O 2.88Å; V175-A182 HydrophobicContact CG1-CB 3.92Å; V175-F183 HydrophobicContact CG1-CB 4.12Å; V175-F183 HydrophobicContact CG2-CB 3.9Å; V175-F183 HydrophobicContact CG2-CD2 3.6Å; V175-F183 HydrophobicContact CG2-CG 4.23Å; V175-Y190 HydrophobicContact CG2-CD1 3.96Å; V175-Y190 HydrophobicContact CG2-CD2 4.17Å; V175-Y190 HydrophobicContact CG2-CE1 4.31Å; V175-Y190 HydrophobicContact CG2-CE2 4.48Å; V175-Y190 HydrophobicContact CG2-CG 3.89Å
176	P	93.6	Very high	95	Very high	68 Å²	68	56.4 Å²	56.4	44%	0.442	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-59.7	138.1	178.5	25.5	-34	0	0	0	110.7	A178 S179 A182 Y190	P176-A178 PolarHBondContact O-N 3.43Å; P176-S179 PolarHBondContact O-N 3.2Å; P176-S179 VanDerWaalsContact O-N 3.14Å; P176-A182 HydrophobicContact CG-CB 4.34Å; P176-Y190 WeakPolarHBondContact CD-OH 3.32Å
177	N	92	Very high	95.3	Very high	161 Å²	161	55.7 Å²	55.7	86%	0.861	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	56.4	14.6	178.4	-58.2	-32.4	0	0	0	115.5	V175 S179	V175-N177 PolarHBondContact O-N 2.87Å; N177-S179 PolarHBondContact O-N 3.45Å
178	A	92.6	Very high	95.6	Very high	34 Å²	34	57.7 Å²	57.7	28%	0.281	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	50.4	41.7	-170.3	0	0	0	0	0	112.2	F162 V175 P176	F162-A178 WeakPolarHBondContact CE1-O 3.18Å; V175-A178 PolarHBondContact O-N 2.92Å; P176-A178 PolarHBondContact O-N 3.43Å
179	S	95.1	Very high	96	Very high	40 Å²	40	57.9 Å²	57.9	28%	0.28	30%	0.295	S	S	.	.			trans	-85.4	114.9	178.6	173.4	0	0	0	0	111.5	V175 P176 N177 E181 A182 F183	V175-S179 WeakPolarHBondContact CG1-O 2.88Å; P176-S179 PolarHBondContact O-N 3.2Å; P176-S179 VanDerWaalsContact O-N 3.14Å; N177-S179 PolarHBondContact O-N 3.45Å; S179-E181 PolarHBondContact O-N 3.44Å; S179-E181 PolarHBondContact OG-N 3.03Å; S179-A182 PolarHBondContact O-N 3.42Å; S179-A182 VanDerWaalsContact O-N 3.17Å; S179-A182 PolarHBondContact OG-N 2.85Å; S179-F183 PolarHBondContact O-N 2.67Å; S179-F183 VanDerWaalsContact O-N 3.12Å
180	L	95.8	Very high	96.1	Very high	20 Å²	20	59.4 Å²	59.4	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-58.5	-36.6	174.2	176.7	61	0	0	0	111.9	F158 E159 F162 F183 L184 L276 L283	F158-L180 HydrophobicContact CD1-CD1 3.86Å; F158-L180 HydrophobicContact CE1-CD1 3.74Å; E159-L180 HydrophobicContact CB-CD2 3.81Å; E159-L180 HydrophobicContact CG-CD2 3.92Å; F162-L180 HydrophobicContact CB-CD1 3.94Å; F162-L180 HydrophobicContact CD1-CB 4.06Å; F162-L180 HydrophobicContact CD1-CD1 4.19Å; F162-L180 HydrophobicContact CD2-CD1 3.93Å; F162-L180 HydrophobicContact CE1-CB 4.16Å; F162-L180 HydrophobicContact CG-CB 4.47Å; F162-L180 HydrophobicContact CG-CD1 3.74Å; L180-F183 PolarHBondContact O-N 2.97Å; L180-L184 HydrophobicContact CD1-CD1 3.81Å; L180-L184 HydrophobicContact CD1-CG 4.07Å; L180-L184 HydrophobicContact CG-CD1 3.92Å; L180-L184 WeakPolarHBondContact O-CB 3.38Å; L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.42Å; L180-L276 HydrophobicContact CD2-CD1 4.23Å; L180-L283 HydrophobicContact CD2-CD2 4.02Å; L180-L283 HydrophobicContact CG-CD2 4.28Å
181	E	96.8	Very high	96.2	Very high	136 Å²	136	59.3 Å²	59.3	64%	0.636	30%	0.298	S	S	*	.	H	α-helix	trans	-64.2	-43.7	176.2	-177	179.6	-178.4	0	0	111.8	S179 F183 L184 R185 L283	S179-E181 PolarHBondContact O-N 3.44Å; S179-E181 PolarHBondContact OG-N 3.03Å; E181-F183 VanDerWaalsContact C-N 3.3Å; E181-F183 PolarHBondContact O-N 2.74Å; E181-L184 PolarHBondContact O-N 3.46Å; E181-R185 WeakPolarHBondContact O-CB 3.18Å; E181-R185 PolarHBondContact O-N 3.18Å; E181-L283 HydrophobicContact CB-CD1 4.1Å; E181-L283 HydrophobicContact CG-CD1 4.41Å
182	A	97.4	Very high	96.2	Very high	15 Å²	15	65.6 Å²	65.6	12%	0.124	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-41.4	176.6	0	0	0	0	0	111.5	V175 P176 S179 Y190	V175-A182 HydrophobicContact CG1-CB 3.92Å; P176-A182 HydrophobicContact CG-CB 4.34Å; S179-A182 PolarHBondContact O-N 3.42Å; S179-A182 VanDerWaalsContact O-N 3.17Å; S179-A182 PolarHBondContact OG-N 2.85Å; A182-Y190 WeakPolarHBondContact O-CE2 3.11Å
183	F	98.1	Very high	96	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-53.6	174.1	-178.9	-84.8	0	0	0	111.4	F158 F162 A171 F172 V175 S179 L180 E181 R185 T186 P187 Y190 W290	F158-F183 AromaticContact CE1-CD1 3.84Å; F158-F183 HydrophobicContact CE1-CD1 3.84Å; F158-F183 AromaticContact CE1-CE1 3.8Å; F158-F183 HydrophobicContact CE1-CE1 3.8Å; F158-F183 AromaticContact CZ-CD1 3.85Å; F158-F183 HydrophobicContact CZ-CD1 3.85Å; F158-F183 AromaticContact CZ-CE1 3.36Å; F158-F183 HydrophobicContact CZ-CE1 3.36Å; F158-F183 AromaticContact CZ-CZ 3.99Å; F158-F183 HydrophobicContact CZ-CZ 3.99Å; F162-F183 HydrophobicContact CD2-CB 4.36Å; F162-F183 HydrophobicContact CD2-CG 4.3Å; F162-F183 HydrophobicContact CE2-CB 3.63Å; F162-F183 HydrophobicContact CE2-CD2 4.07Å; F162-F183 AromaticContact CE2-CG 3.88Å; F162-F183 HydrophobicContact CE2-CG 3.88Å; F162-F183 HydrophobicContact CZ-CB 4.3Å; A171-F183 HydrophobicContact CB-CE2 4.39Å; F172-F183 HydrophobicContact CD1-CD2 4.28Å; F172-F183 HydrophobicContact CD1-CE2 4.04Å; F172-F183 HydrophobicContact CE1-CE2 4.18Å; F172-F183 HydrophobicContact CE1-CZ 4.26Å; V175-F183 HydrophobicContact CG1-CB 4.12Å; V175-F183 HydrophobicContact CG2-CB 3.9Å; V175-F183 HydrophobicContact CG2-CD2 3.6Å; V175-F183 HydrophobicContact CG2-CG 4.23Å; S179-F183 PolarHBondContact O-N 2.67Å; S179-F183 VanDerWaalsContact O-N 3.12Å; L180-F183 PolarHBondContact O-N 2.97Å; E181-F183 VanDerWaalsContact C-N 3.3Å; E181-F183 PolarHBondContact O-N 2.74Å; F183-R185 PolarHBondContact O-N 3.42Å; F183-T186 CarbonylContact O-C 3.58Å; F183-T186 VanDerWaalsContact O-C 3.27Å; F183-T186 PolarHBondContact O-N 3.34Å; F183-P187 HydrophobicContact CD1-CB 4.29Å; F183-P187 HydrophobicContact CE1-CB 3.78Å; F183-P187 HydrophobicContact CZ-CB 4.1Å; F183-P187 WeakPolarHBondContact O-CA 3.45Å; F183-P187 WeakPolarHBondContact O-CD 3.36Å; F183-Y190 HydrophobicContact CD2-CD2 4.01Å; F183-Y190 HydrophobicContact CD2-CG 4.23Å; F183-W290 AromaticContact CE1-CD1 3.95Å; F183-W290 AromaticContact CE1-NE1 3.66Å; F183-W290 HydrophobicContact CZ-CZ2 4.47Å; F183-W290 AromaticContact CZ-NE1 3.9Å
184	L	97.8	Very high	95.7	Very high	13 Å²	13	64.6 Å²	64.6	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-71.5	-16.4	-172.8	-73.7	175	0	0	0	114.2	F158 L180 E181 L283 A286 A287 W290	F158-L184 HydrophobicContact CD1-CD1 4.47Å; F158-L184 HydrophobicContact CD1-CD2 4.11Å; F158-L184 HydrophobicContact CE1-CD2 3.68Å; F158-L184 HydrophobicContact CE1-CG 4.18Å; L180-L184 HydrophobicContact CD1-CD1 3.81Å; L180-L184 HydrophobicContact CD1-CG 4.07Å; L180-L184 HydrophobicContact CG-CD1 3.92Å; L180-L184 WeakPolarHBondContact O-CB 3.38Å; L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.42Å; E181-L184 PolarHBondContact O-N 3.46Å; L184-L283 HydrophobicContact CB-CD1 4.15Å; L184-L283 HydrophobicContact CD1-CD1 3.53Å; L184-L283 HydrophobicContact CD1-CG 3.95Å; L184-L283 HydrophobicContact CG-CD1 4.43Å; L184-A286 HydrophobicContact CB-CB 4.04Å; L184-A287 HydrophobicContact CD1-CB 3.73Å; L184-A287 HydrophobicContact CD2-CB 4.22Å; L184-W290 HydrophobicContact CD2-CB 4.13Å; L184-W290 HydrophobicContact CD2-CG 4.42Å
185	R	97.1	Very high	95.6	Very high	190 Å²	190	63.9 Å²	63.9	72%	0.717	36%	0.357	S	S	*	.	H	α-helix	trans	-72.4	-34.9	173.4	-173.2	178.4	60.1	143.2	1.1	112.7	E181 F183	E181-R185 WeakPolarHBondContact O-CB 3.18Å; E181-R185 PolarHBondContact O-N 3.18Å; F183-R185 PolarHBondContact O-N 3.42Å
186	T	96.8	Very high	95.3	Very high	56 Å²	56	67.5 Å²	67.5	34%	0.344	37%	0.373	S	S	.	.	S	Bend	trans	-147.7	64.4	-177.9	50.6	0	0	0	0	110.3	F183 E188 A189 Y190	F183-T186 CarbonylContact O-C 3.58Å; F183-T186 VanDerWaalsContact O-C 3.27Å; F183-T186 PolarHBondContact O-N 3.34Å; T186-E188 PolarHBondContact O-N 3.26Å; T186-A189 WeakPolarHBondContact O-CB 3.47Å; T186-A189 PolarHBondContact O-N 2.99Å; T186-A189 VanDerWaalsContact O-N 3.12Å; T186-Y190 VanDerWaalsContact O-CD2 3.26Å; T186-Y190 WeakPolarHBondContact O-CD2 3.49Å
187	P	96.9	Very high	95.3	Very high	10 Å²	10	65 Å²	65	7%	0.065	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-62	-32.2	-172.2	23.7	-32.7	0	0	0	112.4	F183 A189 Y190 Y191 W290	F183-P187 HydrophobicContact CD1-CB 4.29Å; F183-P187 HydrophobicContact CE1-CB 3.78Å; F183-P187 HydrophobicContact CZ-CB 4.1Å; F183-P187 WeakPolarHBondContact O-CA 3.45Å; F183-P187 WeakPolarHBondContact O-CD 3.36Å; P187-A189 PolarHBondContact O-N 3.25Å; P187-Y190 CarbonylContact O-C 3.54Å; P187-Y190 PolarHBondContact O-N 3.28Å; P187-Y191 WeakPolarHBondContact O-CB 3.43Å; P187-Y191 PolarHBondContact O-N 2.79Å; P187-W290 HydrophobicContact CB-CD2 3.54Å; P187-W290 HydrophobicContact CB-CE3 3.5Å; P187-W290 HydrophobicContact CB-CG 4.22Å; P187-W290 HydrophobicContact CB-CH2 3.89Å; P187-W290 HydrophobicContact CB-CZ2 3.92Å; P187-W290 HydrophobicContact CB-CZ3 3.67Å; P187-W290 HydrophobicContact CG-CD2 3.7Å; P187-W290 HydrophobicContact CG-CE3 3.24Å; P187-W290 HydrophobicContact CG-CG 4.32Å; P187-W290 HydrophobicContact CG-CH2 4.33Å; P187-W290 HydrophobicContact CG-CZ3 3.6Å
188	E	95.8	Very high	95.5	Very high	136 Å²	136	57.6 Å²	57.6	64%	0.636	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-65	-23.5	178.7	-57.1	81	-177.8	0	0	112.9	T186 Y190 W290	T186-E188 PolarHBondContact O-N 3.26Å; E188-Y190 PolarHBondContact O-N 3.03Å; E188-W290 HydrophobicContact CG-CZ3 4.34Å
189	A	97.3	Very high	95.6	Very high	64 Å²	64	56.7 Å²	56.7	53%	0.529	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-68.9	-22.4	172.9	0	0	0	0	0	112.1	T186 P187	T186-A189 WeakPolarHBondContact O-CB 3.47Å; T186-A189 PolarHBondContact O-N 2.99Å; T186-A189 VanDerWaalsContact O-N 3.12Å; P187-A189 PolarHBondContact O-N 3.25Å
190	Y	97.6	Very high	95.7	Very high	31 Å²	31	54.9 Å²	54.9	12%	0.122	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-26.9	-175.1	-51.5	-69	0	0	0	112.8	A171 R174 V175 P176 A182 F183 T186 P187 E188	A171-Y190 VanDerWaalsContact CA-O 3.3Å; A171-Y190 WeakPolarHBondContact CA-O 3.12Å; A171-Y190 WeakPolarHBondContact CB-O 3.3Å; R174-Y190 HydrophobicContact CB-CD1 4.08Å; R174-Y190 VanDerWaalsContact NH1-C 3.26Å; R174-Y190 PolarHBondContact NH1-O 3.43Å; R174-Y190 PolarHBondContact NH2-O 3.49Å; R174-Y190 WeakPolarHBondContact O-CE1 3.3Å; V175-Y190 HydrophobicContact CG2-CD1 3.96Å; V175-Y190 HydrophobicContact CG2-CD2 4.17Å; V175-Y190 HydrophobicContact CG2-CE1 4.31Å; V175-Y190 HydrophobicContact CG2-CE2 4.48Å; V175-Y190 HydrophobicContact CG2-CG 3.89Å; P176-Y190 WeakPolarHBondContact CD-OH 3.32Å; A182-Y190 WeakPolarHBondContact O-CE2 3.11Å; F183-Y190 HydrophobicContact CD2-CD2 4.01Å; F183-Y190 HydrophobicContact CD2-CG 4.23Å; T186-Y190 VanDerWaalsContact O-CD2 3.26Å; T186-Y190 WeakPolarHBondContact O-CD2 3.49Å; P187-Y190 CarbonylContact O-C 3.54Å; P187-Y190 PolarHBondContact O-N 3.28Å; E188-Y190 PolarHBondContact O-N 3.03Å
191	Y	97.8	Very high	95.8	Very high	23 Å²	23	53.9 Å²	53.9	9%	0.09	29%	0.288	C	S	.	.			trans	-85.4	139.4	-177.7	-173.5	-106	0	0	0	111.8	A171 P187 A193 A198 A201 H202 E214 W290	A171-Y191 HydrophobicContact CB-CD2 4.41Å; P187-Y191 WeakPolarHBondContact O-CB 3.43Å; P187-Y191 PolarHBondContact O-N 2.79Å; Y191-A193 HydrophobicContact CE1-CB 4.38Å; Y191-A198 HydrophobicContact CE2-CB 3.9Å; Y191-A198 WeakPolarHBondContact CE2-O 3.21Å; Y191-A201 HydrophobicContact CD2-CB 3.86Å; Y191-A201 HydrophobicContact CE2-CB 3.99Å; Y191-H202 HydrophobicContact CD2-CB 4.17Å; Y191-H202 HydrophobicContact CE1-CB 4.17Å; Y191-H202 HydrophobicContact CE2-CB 3.63Å; Y191-E214 VanDerWaalsContact CE1-OE2 3.31Å; Y191-E214 WeakPolarHBondContact CE1-OE2 3.49Å; Y191-E214 PolarHBondContact OH-OE1 2.89Å; Y191-E214 PolarHBondContact OH-OE2 3.13Å; Y191-W290 AromaticContact CD1-CH2 3.8Å; Y191-W290 HydrophobicContact CD1-CH2 3.8Å; Y191-W290 AromaticContact CD1-CZ2 3.91Å; Y191-W290 HydrophobicContact CD1-CZ2 3.91Å; Y191-W290 HydrophobicContact CD2-CZ2 4.03Å; Y191-W290 AromaticContact CG-CH2 3.81Å; Y191-W290 HydrophobicContact CG-CH2 3.81Å; Y191-W290 AromaticContact CG-CZ2 3.56Å; Y191-W290 HydrophobicContact CG-CZ2 3.56Å
192	R	96.2	Very high	95.8	Very high	133 Å²	133	48.5 Å²	48.5	50%	0.502	26%	0.263	S	S	.	.			trans	-138.9	118.4	171.8	-64.4	-174.5	-173.5	118.9	1.9	109.1	E195	R192-E195 HydrophobicContact CB-CB 4.3Å; R192-E195 WeakPolarHBondContact O-CB 3.42Å; R192-E195 PolarHBondContact O-N 2.72Å
193	A	94.2	Very high	95.9	Very high	67 Å²	67	47.9 Å²	47.9	55%	0.554	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	140.7	178.1	0	0	0	0	0	111.1	Y191 E195 E214	Y191-A193 HydrophobicContact CE1-CB 4.38Å; A193-E195 PolarHBondContact O-N 2.79Å; A193-E195 VanDerWaalsContact O-N 3.16Å; A193-E214 HydrophobicContact CB-CG 4.31Å; A193-E214 WeakPolarHBondContact CB-OE2 3.5Å
194	G	89.1	Confident	95.9	Very high	80 Å²	80	47.9 Å²	47.9	83%	0.825	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	-1.3	178	0	0	0	0	0	115.8
195	E	93.7	Very high	95.9	Very high	58 Å²	58	47.3 Å²	47.3	27%	0.271	26%	0.255	S	S	.	.	S	Bend	trans	-67.6	154.3	171.7	-161.5	176.5	-159.1	0	0	110.6	P170 R174 R192 A193 F197 A198	P170-E195 VanDerWaalsContact CB-CD 3.47Å; P170-E195 HydrophobicContact CB-CG 4.35Å; P170-E195 VanDerWaalsContact CB-OE1 3.29Å; P170-E195 WeakPolarHBondContact CB-OE1 3.39Å; P170-E195 HydrophobicContact CG-CG 4.13Å; R174-E195 IonicContact CZ-OE2 3.66Å; R174-E195 IonicContact NH2-OE1 2.64Å; R174-E195 IonicContact NH2-OE2 3.64Å; R174-E195 PolarHBondContact NH2-OE2 3.48Å; R192-E195 HydrophobicContact CB-CB 4.3Å; R192-E195 WeakPolarHBondContact O-CB 3.42Å; R192-E195 PolarHBondContact O-N 2.72Å; A193-E195 PolarHBondContact O-N 2.79Å; A193-E195 VanDerWaalsContact O-N 3.16Å; E195-F197 PolarHBondContact O-N 2.85Å; E195-A198 HydrophobicContact CB-CB 4.36Å; E195-A198 WeakPolarHBondContact O-CB 3.15Å; E195-A198 PolarHBondContact O-N 3.48Å
196	H	90	Very high	95.9	Very high	82 Å²	82	38.2 Å²	38.2	38%	0.38	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	131	175.8	-171.4	-120	0	0	0	110.8	P170 A198	P170-H196 WeakPolarHBondContact CD-O 2.96Å; H196-A198 PolarHBondContact O-N 2.86Å
197	F	93.6	Very high	96	Very high	16 Å²	16	36.6 Å²	36.6	7%	0.07	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	13.9	-176.4	-59.5	-50.2	0	0	0	116.5	Y168 C169 E195 M199 F200 I421	Y168-F197 WeakPolarHBondContact O-CD2 3.5Å; C169-F197 HydrophobicContact CB-CB 4.18Å; C169-F197 PolarHBondContact SG-O 3.01Å; E195-F197 PolarHBondContact O-N 2.85Å; F197-M199 VanDerWaalsContact C-SD 3.59Å; F197-M199 VanDerWaalsContact CA-SD 3.51Å; F197-M199 PolarHBondContact O-N 2.97Å; F197-F200 HydrophobicContact CB-CD2 3.97Å; F197-F200 HydrophobicContact CB-CE2 4.42Å; F197-F200 HydrophobicContact CD1-CD2 4.01Å; F197-F200 AromaticContact CD1-CE2 3.58Å; F197-F200 HydrophobicContact CD1-CE2 3.58Å; F197-F200 HydrophobicContact CE1-CE2 4.14Å; F197-F200 HydrophobicContact CG-CD2 4.31Å; F197-F200 HydrophobicContact CG-CE2 4.3Å; F197-F200 PolarHBondContact O-N 2.98Å; F197-I421 HydrophobicContact CD1-CD1 4.35Å; F197-I421 HydrophobicContact CE1-CB 3.95Å; F197-I421 HydrophobicContact CE1-CD1 3.43Å; F197-I421 VanDerWaalsContact CE1-CD1 3.43Å; F197-I421 HydrophobicContact CE1-CG1 3.58Å; F197-I421 HydrophobicContact CZ-CB 3.88Å; F197-I421 HydrophobicContact CZ-CD1 4.19Å; F197-I421 HydrophobicContact CZ-CG1 3.8Å
198	A	95	Very high	96.1	Very high	5 Å²	5	36.1 Å²	36.1	4%	0.041	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60.1	-31.4	178.5	0	0	0	0	0	112.9	Y191 E195 H196 F200 A201	Y191-A198 HydrophobicContact CE2-CB 3.9Å; Y191-A198 WeakPolarHBondContact CE2-O 3.21Å; E195-A198 HydrophobicContact CB-CB 4.36Å; E195-A198 WeakPolarHBondContact O-CB 3.15Å; E195-A198 PolarHBondContact O-N 3.48Å; H196-A198 PolarHBondContact O-N 2.86Å; A198-F200 PolarHBondContact O-N 2.65Å; A198-A201 WeakPolarHBondContact O-CA 3.48Å; A198-A201 WeakPolarHBondContact O-CB 3.36Å; A198-A201 PolarHBondContact O-N 3.24Å
199	M	95.8	Very high	96.2	Very high	16 Å²	16	29.8 Å²	29.8	8%	0.079	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-60.5	-21.1	178.8	71	-65.3	-54.8	0	0	114.3	Y107 P108 F197 A201 T204 Y207	Y107-M199 HydrophobicContact CE1-CG 3.79Å; Y107-M199 HydrophobicContact CE1-SD 4.15Å; Y107-M199 VanDerWaalsContact OH-CG 3.32Å; Y107-M199 WeakPolarHBondContact OH-CG 3.38Å; P108-M199 HydrophobicContact CB-CE 3.54Å; P108-M199 HydrophobicContact CB-CG 4.44Å; P108-M199 HydrophobicContact CB-SD 4.16Å; P108-M199 HydrophobicContact CG-CE 3.65Å; F197-M199 VanDerWaalsContact C-SD 3.59Å; F197-M199 VanDerWaalsContact CA-SD 3.51Å; F197-M199 PolarHBondContact O-N 2.97Å; M199-A201 VanDerWaalsContact C-N 3.3Å; M199-T204 WeakPolarHBondContact O-CA 3.21Å; M199-T204 WeakPolarHBondContact O-CB 3.23Å; M199-T204 PolarHBondContact O-OG1 2.97Å; M199-Y207 HydrophobicContact CB-CD1 3.59Å; M199-Y207 HydrophobicContact CB-CD2 3.85Å; M199-Y207 HydrophobicContact CB-CE1 3.78Å; M199-Y207 HydrophobicContact CB-CE2 4.01Å; M199-Y207 HydrophobicContact CB-CG 3.61Å; M199-Y207 HydrophobicContact CG-CD1 3.79Å; M199-Y207 HydrophobicContact CG-CE1 3.78Å; M199-Y207 HydrophobicContact CG-CG 4.33Å
200	F	96.9	Very high	96.2	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-79.1	-14.4	173.3	-62.9	-45.3	0	0	0	113.5	H72 Y107 L161 Y165 F172 F197 A198 T204	H72-F200 HydrophobicContact CB-CE1 4.49Å; H72-F200 AromaticContact CD2-CE1 3.6Å; H72-F200 AromaticContact CE1-CE1 3.9Å; H72-F200 AromaticContact CG-CE1 3.79Å; H72-F200 AromaticContact ND1-CE1 3.97Å; H72-F200 AromaticContact NE2-CE1 3.69Å; H72-F200 AromaticContact NE2-CZ 3.98Å; Y107-F200 HydrophobicContact CD1-CZ 4.41Å; Y107-F200 AromaticContact CE1-CE1 3.88Å; Y107-F200 HydrophobicContact CE1-CE1 3.88Å; Y107-F200 AromaticContact CE1-CZ 3.79Å; Y107-F200 HydrophobicContact CE1-CZ 3.79Å; L161-F200 HydrophobicContact CD2-CB 4.33Å; L161-F200 HydrophobicContact CD2-CD1 4.07Å; Y165-F200 AromaticContact CD1-CD2 3.92Å; Y165-F200 HydrophobicContact CD1-CD2 3.92Å; Y165-F200 AromaticContact CD1-CE2 3.97Å; Y165-F200 HydrophobicContact CD1-CE2 3.97Å; Y165-F200 HydrophobicContact CD2-CB 4.24Å; Y165-F200 HydrophobicContact CD2-CD1 4.38Å; Y165-F200 HydrophobicContact CD2-CD2 4.15Å; Y165-F200 HydrophobicContact CD2-CG 4.01Å; Y165-F200 HydrophobicContact CE1-CD2 4.04Å; Y165-F200 AromaticContact CE1-CE2 3.67Å; Y165-F200 HydrophobicContact CE1-CE2 3.67Å; Y165-F200 HydrophobicContact CE1-CZ 4.02Å; Y165-F200 HydrophobicContact CE2-CD1 4.05Å; Y165-F200 HydrophobicContact CE2-CD2 4.28Å; Y165-F200 HydrophobicContact CE2-CE1 4.19Å; Y165-F200 HydrophobicContact CE2-CE2 4.4Å; Y165-F200 HydrophobicContact CE2-CG 4.11Å; Y165-F200 HydrophobicContact CE2-CZ 4.37Å; Y165-F200 AromaticContact CG-CD2 3.97Å; Y165-F200 HydrophobicContact CG-CD2 3.97Å; Y165-F200 HydrophobicContact CG-CE2 4.45Å; Y165-F200 HydrophobicContact CG-CG 4.26Å; Y165-F200 AromaticContact CZ-CE2 3.91Å; Y165-F200 AromaticContact CZ-CZ 3.83Å; F172-F200 HydrophobicContact CE2-CB 4.47Å; F172-F200 VanDerWaalsContact CZ-O 3.31Å; F172-F200 WeakPolarHBondContact CZ-O 3.46Å; F197-F200 HydrophobicContact CB-CD2 3.97Å; F197-F200 HydrophobicContact CB-CE2 4.42Å; F197-F200 HydrophobicContact CD1-CD2 4.01Å; F197-F200 AromaticContact CD1-CE2 3.58Å; F197-F200 HydrophobicContact CD1-CE2 3.58Å; F197-F200 HydrophobicContact CE1-CE2 4.14Å; F197-F200 HydrophobicContact CG-CD2 4.31Å; F197-F200 HydrophobicContact CG-CE2 4.3Å; F197-F200 PolarHBondContact O-N 2.98Å; A198-F200 PolarHBondContact O-N 2.65Å; F200-T204 WeakPolarHBondContact CA-OG1 3.49Å; F200-T204 HydrophobicContact CD1-CG2 4.09Å; F200-T204 PolarHBondContact O-OG1 3.1Å
201	A	97.8	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-9.9	-174.1	0	0	0	0	0	114.1	F158 A171 F172 Y191 A198 M199 W290	F158-A201 VanDerWaalsContact CE2-O 3.31Å; F158-A201 WeakPolarHBondContact CE2-O 3.26Å; A171-A201 HydrophobicContact CB-CB 3.91Å; F172-A201 HydrophobicContact CD1-CB 4.22Å; F172-A201 HydrophobicContact CE1-CB 3.46Å; F172-A201 VanDerWaalsContact CE1-CB 3.46Å; F172-A201 HydrophobicContact CZ-CB 3.69Å; Y191-A201 HydrophobicContact CD2-CB 3.86Å; Y191-A201 HydrophobicContact CE2-CB 3.99Å; A198-A201 WeakPolarHBondContact O-CA 3.48Å; A198-A201 WeakPolarHBondContact O-CB 3.36Å; A198-A201 PolarHBondContact O-N 3.24Å; M199-A201 VanDerWaalsContact C-N 3.3Å; A201-W290 PolarHBondContact O-NE1 2.88Å
202	H	97.8	Very high	96.1	Very high	23 Å²	23	28.9 Å²	28.9	11%	0.106	17%	0.173	C	C	.	.	S	Bend	trans	-155.1	121.5	-180	-172.8	-137.2	0	0	0	111.2	Y191 T204 N213 W290	Y191-H202 HydrophobicContact CD2-CB 4.17Å; Y191-H202 HydrophobicContact CE1-CB 4.17Å; Y191-H202 HydrophobicContact CE2-CB 3.63Å; H202-T204 PolarHBondContact O-N 2.85Å; H202-N213 PolarHBondContact CE1-O 2.79Å; H202-N213 VanDerWaalsContact CE1-O 3.32Å; H202-N213 PolarHBondContact ND1-O 2.94Å; H202-N213 VanDerWaalsContact ND1-O 3.13Å; H202-N213 WeakPolarHBondContact O-CB 3.27Å; H202-N213 PolarHBondContact O-ND2 3.38Å; H202-W290 HydrophobicContact CB-CZ2 3.85Å; H202-W290 AromaticContact CD2-CD2 3.82Å; H202-W290 AromaticContact CD2-CE2 3.45Å; H202-W290 VanDerWaalsContact CD2-CE2 3.45Å; H202-W290 AromaticContact CD2-CZ2 3.6Å; H202-W290 AromaticContact CD2-NE1 3.74Å; H202-W290 PolarHBondContact CD2-O 3.02Å; H202-W290 AromaticContact CG-CE2 3.96Å; H202-W290 AromaticContact CG-CZ2 3.73Å; H202-W290 PolarHBondContact NE2-O 2.95Å; H202-W290 VanDerWaalsContact NE2-O 3.08Å
203	N	98	Very high	96.1	Very high	2 Å²	2	23 Å²	23	1%	0.011	15%	0.152	C	C	.	.			trans	48.4	52.9	177.2	-61.8	-53.5	0	0	0	114.3	L205 A206 Y207 N213 N291 A292 L293 D294	N203-L205 PolarHBondContact O-N 2.91Å; N203-A206 HydrophobicContact CB-CB 4.14Å; N203-A206 PolarHBondContact O-N 3.38Å; N203-Y207 PolarHBondContact O-N 3.13Å; N203-N213 HydrophobicContact CB-CB 3.9Å; N203-N213 PolarHBondContact ND2-O 2.9Å; N203-N213 WeakPolarHBondContact O-CB 3.21Å; N203-N291 PolarHBondContact N-OD1 3.49Å; N203-N291 WeakPolarHBondContact OD1-CA 3.35Å; N203-N291 PolarHBondContact OD1-O 3.39Å; N203-A292 PolarHBondContact OD1-N 3.23Å; N203-L293 HydrophobicContact CB-CB 4.09Å; N203-L293 HydrophobicContact CB-CD1 4.15Å; N203-L293 PolarHBondContact OD1-N 3.46Å; N203-D294 VanDerWaalsContact C-OD1 3.23Å; N203-D294 WeakPolarHBondContact CA-OD1 3.34Å; N203-D294 WeakPolarHBondContact CA-OD2 3.32Å; N203-D294 PolarHBondContact OD1-N 3.27Å
204	T	98.1	Very high	96.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.9	-35.7	-175.6	-53.9	0	0	0	0	113.1	H72 L161 M199 F200 H202 Y207 D208 D294	H72-T204 HydrophobicContact CB-CG2 4.07Å; L161-T204 HydrophobicContact CD1-CG2 4.13Å; L161-T204 WeakPolarHBondContact CD1-OG1 3.48Å; L161-T204 HydrophobicContact CD2-CG2 4.32Å; M199-T204 WeakPolarHBondContact O-CA 3.21Å; M199-T204 WeakPolarHBondContact O-CB 3.23Å; M199-T204 PolarHBondContact O-OG1 2.97Å; F200-T204 WeakPolarHBondContact CA-OG1 3.49Å; F200-T204 HydrophobicContact CD1-CG2 4.09Å; F200-T204 PolarHBondContact O-OG1 3.1Å; H202-T204 PolarHBondContact O-N 2.85Å; T204-Y207 PolarHBondContact O-N 3.38Å; T204-D208 WeakPolarHBondContact O-CB 3.33Å; T204-D208 PolarHBondContact O-N 2.9Å; T204-D294 PolarHBondContact N-OD2 3.18Å
205	L	97.9	Very high	96.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.8	-45.5	177	-65.7	170.7	0	0	0	110.8	T71 T74 L151 M157 N203 Y207 D208 L209 D294	T71-L205 HydrophobicContact CG2-CD2 4.1Å; T74-L205 HydrophobicContact CG2-CD2 3.78Å; L151-L205 HydrophobicContact CB-CD1 4.4Å; L151-L205 HydrophobicContact CD2-CB 4.48Å; L151-L205 HydrophobicContact CD2-CD1 4.15Å; L151-L205 HydrophobicContact CD2-CD2 3.85Å; L151-L205 HydrophobicContact CD2-CG 4.37Å; M157-L205 HydrophobicContact CE-CD1 3.84Å; M157-L205 HydrophobicContact CE-CD2 4.29Å; M157-L205 HydrophobicContact CE-CG 3.56Å; M157-L205 HydrophobicContact SD-CD1 3.78Å; M157-L205 HydrophobicContact SD-CD2 3.54Å; M157-L205 VanDerWaalsContact SD-CD2 3.54Å; M157-L205 HydrophobicContact SD-CG 3.48Å; M157-L205 WeakPolarHBondContact SD-CG 3.33Å; N203-L205 PolarHBondContact O-N 2.91Å; L205-Y207 PolarHBondContact O-N 3.3Å; L205-D208 PolarHBondContact O-N 3.25Å; L205-L209 WeakPolarHBondContact O-CB 3.38Å; L205-L209 WeakPolarHBondContact O-CD1 3.2Å; L205-L209 VanDerWaalsContact O-CG 3.23Å; L205-L209 WeakPolarHBondContact O-CG 3.48Å; L205-L209 PolarHBondContact O-N 3.33Å; L205-D294 HydrophobicContact CB-CB 4.33Å; L205-D294 WeakPolarHBondContact CB-OD1 3.45Å; L205-D294 HydrophobicContact CD1-CB 4.21Å; L205-D294 PolarHBondContact N-OD1 2.93Å; L205-D294 VanDerWaalsContact N-OD1 3.13Å; L205-D294 PolarHBondContact N-OD2 2.9Å
206	A	98.1	Very high	95.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.2	-42.3	175.2	0	0	0	0	0	111	N203 L209 G210 G211 L227 L293 D294 L297	N203-A206 HydrophobicContact CB-CB 4.14Å; N203-A206 PolarHBondContact O-N 3.38Å; A206-L209 PolarHBondContact O-N 2.86Å; A206-G210 PolarHBondContact O-N 2.86Å; A206-G211 VanDerWaalsContact O-CA 3.26Å; A206-G211 WeakPolarHBondContact O-CA 3.46Å; A206-G211 PolarHBondContact O-N 3.07Å; A206-L227 HydrophobicContact CB-CD2 3.99Å; A206-L293 HydrophobicContact CB-CB 3.88Å; A206-L293 HydrophobicContact CB-CD1 4.03Å; A206-D294 PolarHBondContact N-OD1 3.42Å; A206-L297 HydrophobicContact CB-CD1 3.98Å
207	Y	98.3	Very high	94.9	Very high	22 Å²	22	20.6 Å²	20.6	9%	0.086	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-49.6	176	-164.3	-94.2	0	0	0	112.9	Y107 P108 R131 M199 N203 T204 L205 L209 G210 N213	Y107-Y207 HydrophobicContact CE2-CD1 4.04Å; Y107-Y207 HydrophobicContact CE2-CE1 4.04Å; Y107-Y207 AromaticContact CZ-CD1 3.8Å; Y107-Y207 AromaticContact CZ-CE1 3.85Å; Y107-Y207 VanDerWaalsContact OH-CD1 3.3Å; Y107-Y207 WeakPolarHBondContact OH-CD1 3.35Å; P108-Y207 HydrophobicContact CB-CE1 3.76Å; P108-Y207 WeakPolarHBondContact CB-OH 3.33Å; P108-Y207 PolarHBondContact O-OH 3.18Å; R131-Y207 HydrophobicContact CG-CE1 4.33Å; R131-Y207 VanDerWaalsContact CZ-CE2 3.46Å; R131-Y207 PolarHBondContact NH1-OH 3.29Å; M199-Y207 HydrophobicContact CB-CD1 3.59Å; M199-Y207 HydrophobicContact CB-CD2 3.85Å; M199-Y207 HydrophobicContact CB-CE1 3.78Å; M199-Y207 HydrophobicContact CB-CE2 4.01Å; M199-Y207 HydrophobicContact CB-CG 3.61Å; M199-Y207 HydrophobicContact CG-CD1 3.79Å; M199-Y207 HydrophobicContact CG-CE1 3.78Å; M199-Y207 HydrophobicContact CG-CG 4.33Å; N203-Y207 PolarHBondContact O-N 3.13Å; T204-Y207 PolarHBondContact O-N 3.38Å; L205-Y207 PolarHBondContact O-N 3.3Å; Y207-L209 PolarHBondContact O-N 3.28Å; Y207-G210 PolarHBondContact O-N 3.3Å; Y207-N213 HydrophobicContact CD2-CB 3.97Å; Y207-N213 VanDerWaalsContact CD2-OD1 3.23Å; Y207-N213 WeakPolarHBondContact CD2-OD1 3.38Å; Y207-N213 HydrophobicContact CG-CB 4.45Å
208	D	98.4	Very high	94.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.9	-35.7	179.3	-75.2	-11.7	0	0	0	111.5	T71 H72 Y107 F132 T204 L205 G210	T71-D208 VanDerWaalsContact CA-OD2 3.3Å; T71-D208 WeakPolarHBondContact CA-OD2 3.44Å; T71-D208 HydrophobicContact CG2-CB 4.05Å; H72-D208 IonicContact CE1-OD1 3.66Å; H72-D208 IonicContact CG-OD2 3.96Å; H72-D208 PolarHBondContact N-OD2 2.84Å; H72-D208 VanDerWaalsContact ND1-CG 3.31Å; H72-D208 IonicContact ND1-OD1 3.76Å; H72-D208 PolarHBondContact ND1-OD1 2.9Å; H72-D208 IonicContact ND1-OD2 2.73Å; H72-D208 PolarHBondContact ND1-OD2 3.43Å; Y107-D208 VanDerWaalsContact CE2-OD1 3.28Å; Y107-D208 WeakPolarHBondContact CE2-OD1 3.47Å; Y107-D208 PolarHBondContact OH-OD1 3.09Å; F132-D208 VanDerWaalsContact CB-O 3.3Å; F132-D208 WeakPolarHBondContact CB-O 3.37Å; F132-D208 PolarHBondContact N-O 3.25Å; T204-D208 WeakPolarHBondContact O-CB 3.33Å; T204-D208 PolarHBondContact O-N 2.9Å; L205-D208 PolarHBondContact O-N 3.25Å; D208-G210 PolarHBondContact O-N 3.41Å
209	L	98.5	Very high	93.4	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	8.7	175.6	-67.7	163.3	0	0	0	113.7	L69 F132 L151 L205 A206 Y207 G211 V231 F235 L297	L69-L209 HydrophobicContact CD2-CD2 3.61Å; L69-L209 HydrophobicContact CD2-CG 4.42Å; F132-L209 WeakPolarHBondContact CD1-O 3.35Å; L151-L209 HydrophobicContact CD2-CD1 4.3Å; L205-L209 WeakPolarHBondContact O-CB 3.38Å; L205-L209 WeakPolarHBondContact O-CD1 3.2Å; L205-L209 VanDerWaalsContact O-CG 3.23Å; L205-L209 WeakPolarHBondContact O-CG 3.48Å; L205-L209 PolarHBondContact O-N 3.33Å; A206-L209 PolarHBondContact O-N 2.86Å; Y207-L209 PolarHBondContact O-N 3.28Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-V231 HydrophobicContact CB-CG2 4.4Å; L209-V231 HydrophobicContact CD1-CG2 4.12Å; L209-V231 HydrophobicContact CD2-CG1 4.44Å; L209-V231 HydrophobicContact CD2-CG2 3.88Å; L209-V231 HydrophobicContact CG-CG2 4.36Å; L209-F235 HydrophobicContact CD2-CE2 4.17Å; L209-L297 HydrophobicContact CD1-CD1 3.91Å; L209-L297 HydrophobicContact CD1-CD2 4.46Å
210	G	97.8	Very high	92.7	Very high	29 Å²	29	37.1 Å²	37.1	30%	0.299	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	3.6	175.6	0	0	0	0	0	113.9	F132 A206 Y207 D208	F132-G210 VanDerWaalsContact O-CA 3.26Å; F132-G210 WeakPolarHBondContact O-CA 3.18Å; A206-G210 PolarHBondContact O-N 2.86Å; Y207-G210 PolarHBondContact O-N 3.3Å; D208-G210 PolarHBondContact O-N 3.41Å
211	G	97	Very high	92.2	Very high	5 Å²	5	40.6 Å²	40.6	5%	0.052	21%	0.212	C	C	.	.			trans	-73.9	173.9	175.7	0	0	0	0	0	113.9	R131 A206 L209 Y223	R131-G211 PolarHBondContact NH2-O 3.03Å; A206-G211 VanDerWaalsContact O-CA 3.26Å; A206-G211 WeakPolarHBondContact O-CA 3.46Å; A206-G211 PolarHBondContact O-N 3.07Å; L209-G211 VanDerWaalsContact C-N 3.32Å; G211-Y223 WeakPolarHBondContact CA-OH 3.31Å
212	D	95.8	Very high	92	Very high	64 Å²	64	44.1 Å²	44.1	34%	0.342	24%	0.241	S	C	.	.			trans	-96.3	109.4	168.8	179.6	2.7	0	0	0	107.3	E214 R215 Y223	D212-E214 PolarHBondContact O-N 2.87Å; D212-E214 WeakPolarHBondContact OD1-CB 3.27Å; D212-E214 PolarHBondContact OD1-N 2.94Å; D212-E214 VanDerWaalsContact OD1-N 3.15Å; D212-R215 HydrophobicContact CB-CG 4.28Å; D212-R215 IonicContact OD2-NE 2.72Å; D212-Y223 PolarHBondContact N-OH 3.35Å
213	N	95.4	Very high	91.9	Very high	9 Å²	9	45.1 Å²	45.1	5%	0.048	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.1	-173.5	70.9	-60.3	0	0	0	112.9	H202 N203 Y207	H202-N213 PolarHBondContact CE1-O 2.79Å; H202-N213 VanDerWaalsContact CE1-O 3.32Å; H202-N213 PolarHBondContact ND1-O 2.94Å; H202-N213 VanDerWaalsContact ND1-O 3.13Å; H202-N213 WeakPolarHBondContact O-CB 3.27Å; H202-N213 PolarHBondContact O-ND2 3.38Å; N203-N213 HydrophobicContact CB-CB 3.9Å; N203-N213 PolarHBondContact ND2-O 2.9Å; N203-N213 WeakPolarHBondContact O-CB 3.21Å; Y207-N213 HydrophobicContact CD2-CB 3.97Å; Y207-N213 VanDerWaalsContact CD2-OD1 3.23Å; Y207-N213 WeakPolarHBondContact CD2-OD1 3.38Å; Y207-N213 HydrophobicContact CG-CB 4.45Å
214	E	94.1	Very high	91.8	Very high	72 Å²	72	46.4 Å²	46.4	34%	0.336	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.2	176.9	-55.1	-51.9	130.2	0	0	112.8	Y191 A193 D212	Y191-E214 VanDerWaalsContact CE1-OE2 3.31Å; Y191-E214 WeakPolarHBondContact CE1-OE2 3.49Å; Y191-E214 PolarHBondContact OH-OE1 2.89Å; Y191-E214 PolarHBondContact OH-OE2 3.13Å; A193-E214 HydrophobicContact CB-CG 4.31Å; A193-E214 WeakPolarHBondContact CB-OE2 3.5Å; D212-E214 PolarHBondContact O-N 2.87Å; D212-E214 WeakPolarHBondContact OD1-CB 3.27Å; D212-E214 PolarHBondContact OD1-N 2.94Å; D212-E214 VanDerWaalsContact OD1-N 3.15Å
215	R	91.8	Very high	91.7	Very high	105 Å²	105	49.2 Å²	49.2	40%	0.396	27%	0.274	S	S	.	.			trans	-73.6	147.2	176.8	-71	-169.7	177	-122.2	-2.2	111.6	D212 D220 Y223 L293	D212-R215 HydrophobicContact CB-CG 4.28Å; D212-R215 IonicContact OD2-NE 2.72Å; R215-D220 IonicContact CZ-OD2 2.62Å; R215-D220 IonicContact NH1-OD2 3.81Å; R215-D220 PolarHBondContact NH1-OD2 3.22Å; R215-Y223 HydrophobicContact CB-CD1 3.67Å; R215-Y223 HydrophobicContact CB-CE1 3.83Å; R215-Y223 HydrophobicContact CB-CG 4.3Å; R215-Y223 HydrophobicContact CG-CD1 4.23Å; R215-Y223 HydrophobicContact CG-CE1 4.28Å; R215-Y223 HydrophobicContact CG-CG 4.48Å; R215-L293 HydrophobicContact CB-CD1 4.38Å; R215-L293 WeakPolarHBondContact O-CD1 3.3Å
216	S	83.3	Confident	91.6	Very high	37 Å²	37	50.2 Å²	50.2	26%	0.259	29%	0.285	S	S	.	.			trans	-110.1	125.3	177.9	162	0	0	0	0	109.5	R218 D219 D220	S216-R218 PolarHBondContact O-N 3.17Å; S216-R218 PolarHBondContact OG-N 3.21Å; S216-D219 WeakPolarHBondContact CB-OD2 3.49Å; S216-D219 PolarHBondContact O-N 3.49Å; S216-D219 VanDerWaalsContact O-N 3.15Å; S216-D219 PolarHBondContact OG-OD2 3.25Å; S216-D220 PolarHBondContact O-N 2.85Å
217	P	72.8	Confident	91.5	Very high	24 Å²	24	50.3 Å²	50.3	16%	0.156	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20	174.3	-18.3	28.5	0	0	0	113.6	D219 A221 L224 A292 L293	P217-D219 VanDerWaalsContact C-N 3.34Å; P217-A221 WeakPolarHBondContact O-CA 3.49Å; P217-A221 PolarHBondContact O-N 3.11Å; P217-L224 HydrophobicContact CB-CB 4.43Å; P217-L224 HydrophobicContact CB-CD2 4.22Å; P217-L224 HydrophobicContact CG-CD2 4.48Å; P217-A292 HydrophobicContact CG-CB 3.86Å; P217-L293 HydrophobicContact CG-CD2 3.64Å; P217-L293 HydrophobicContact CG-CG 3.93Å
218	R	77.7	Confident	91.5	Very high	194 Å²	194	50.4 Å²	50.4	73%	0.732	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-36.3	177	-63.6	-176.5	179.3	-165.6	-0.3	111.2	S216	S216-R218 PolarHBondContact O-N 3.17Å; S216-R218 PolarHBondContact OG-N 3.21Å
219	D	79.8	Confident	91.4	Very high	141 Å²	141	56.4 Å²	56.4	75%	0.754	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-25.1	-177.1	-51.4	-50.5	0	0	0	111.2	S216 P217	S216-D219 WeakPolarHBondContact CB-OD2 3.49Å; S216-D219 PolarHBondContact O-N 3.49Å; S216-D219 VanDerWaalsContact O-N 3.15Å; S216-D219 PolarHBondContact OG-OD2 3.25Å; P217-D219 VanDerWaalsContact C-N 3.34Å
220	D	81.8	Confident	91.3	Very high	49 Å²	49	60.7 Å²	60.7	26%	0.262	33%	0.33	S	S	.	.			trans	-144.5	77.4	-178.4	-169.4	-9.4	0	0	0	111.9	R215 S216 A222 Y223	R215-D220 IonicContact CZ-OD2 2.62Å; R215-D220 IonicContact NH1-OD2 3.81Å; R215-D220 PolarHBondContact NH1-OD2 3.22Å; S216-D220 PolarHBondContact O-N 2.85Å; D220-A222 PolarHBondContact O-N 3.09Å; D220-A222 PolarHBondContact OD1-N 2.64Å; D220-Y223 VanDerWaalsContact CG-CB 3.44Å; D220-Y223 WeakPolarHBondContact O-CB 3.33Å; D220-Y223 PolarHBondContact O-N 3.01Å; D220-Y223 PolarHBondContact OD1-N 3.44Å; D220-Y223 WeakPolarHBondContact OD2-CB 3.39Å
221	A	85.9	Confident	91.3	Very high	73 Å²	73	59.5 Å²	59.5	60%	0.603	32%	0.316	S	S	*	.	H	α-helix	trans	-62.9	-28	176.8	0	0	0	0	0	112.8	P217 Y223 A225	P217-A221 WeakPolarHBondContact O-CA 3.49Å; P217-A221 PolarHBondContact O-N 3.11Å; A221-Y223 VanDerWaalsContact C-N 3.28Å; A221-Y223 PolarHBondContact O-N 2.82Å; A221-A225 PolarHBondContact O-N 2.88Å
222	A	93.3	Very high	91.3	Very high	74 Å²	74	62.4 Å²	62.4	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-66.5	-32.5	177.7	0	0	0	0	0	111.6	D220 A225 G226	D220-A222 PolarHBondContact O-N 3.09Å; D220-A222 PolarHBondContact OD1-N 2.64Å; A222-A225 PolarHBondContact O-N 3.21Å; A222-G226 PolarHBondContact O-N 3.39Å
223	Y	95.7	Very high	91.3	Very high	45 Å²	45	62.9 Å²	62.9	18%	0.176	33%	0.329	C	S	.	.	H	α-helix	trans	-61.3	-50.7	176.3	-177.2	-107	0	0	0	113	G211 D212 R215 D220 A221 A225 G226 L227 L293	G211-Y223 WeakPolarHBondContact CA-OH 3.31Å; D212-Y223 PolarHBondContact N-OH 3.35Å; R215-Y223 HydrophobicContact CB-CD1 3.67Å; R215-Y223 HydrophobicContact CB-CE1 3.83Å; R215-Y223 HydrophobicContact CB-CG 4.3Å; R215-Y223 HydrophobicContact CG-CD1 4.23Å; R215-Y223 HydrophobicContact CG-CE1 4.28Å; R215-Y223 HydrophobicContact CG-CG 4.48Å; D220-Y223 VanDerWaalsContact CG-CB 3.44Å; D220-Y223 WeakPolarHBondContact O-CB 3.33Å; D220-Y223 PolarHBondContact O-N 3.01Å; D220-Y223 PolarHBondContact OD1-N 3.44Å; D220-Y223 WeakPolarHBondContact OD2-CB 3.39Å; A221-Y223 VanDerWaalsContact C-N 3.28Å; A221-Y223 PolarHBondContact O-N 2.82Å; Y223-A225 VanDerWaalsContact C-N 3.34Å; Y223-A225 PolarHBondContact O-N 2.89Å; Y223-G226 PolarHBondContact O-N 3.27Å; Y223-L227 PolarHBondContact O-N 2.81Å; Y223-L293 HydrophobicContact CD1-CD2 3.77Å; Y223-L293 HydrophobicContact CE1-CD1 4.1Å; Y223-L293 HydrophobicContact CE1-CD2 3.98Å
224	L	95.9	Very high	91.3	Very high	28 Å²	28	63 Å²	63	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-60.5	-44.2	178	173.3	61.6	0	0	0	111.2	P217 G226 L227 I228 L293 L297	P217-L224 HydrophobicContact CB-CB 4.43Å; P217-L224 HydrophobicContact CB-CD2 4.22Å; P217-L224 HydrophobicContact CG-CD2 4.48Å; L224-G226 VanDerWaalsContact C-N 3.3Å; L224-G226 PolarHBondContact O-N 3.43Å; L224-L227 PolarHBondContact O-N 3.04Å; L224-I228 HydrophobicContact CD1-CD1 4Å; L224-I228 HydrophobicContact CD1-CG1 4.2Å; L224-I228 HydrophobicContact CG-CD1 3.95Å; L224-I228 WeakPolarHBondContact O-CG1 3.4Å; L224-I228 PolarHBondContact O-N 3.41Å; L224-L293 HydrophobicContact CB-CD2 4.27Å; L224-L293 HydrophobicContact CD1-CD2 4.39Å; L224-L297 HydrophobicContact CD1-CD2 4.3Å; L224-L297 HydrophobicContact CD1-CG 4.02Å
225	A	95.6	Very high	91.4	Very high	59 Å²	59	59.7 Å²	59.7	49%	0.488	31%	0.314	S	S	.	.	H	α-helix	trans	-61	-40.2	176.7	0	0	0	0	0	112	A221 A222 Y223 I228 R229	A221-A225 PolarHBondContact O-N 2.88Å; A222-A225 PolarHBondContact O-N 3.21Å; Y223-A225 VanDerWaalsContact C-N 3.34Å; Y223-A225 PolarHBondContact O-N 2.89Å; A225-I228 PolarHBondContact O-N 3.46Å; A225-R229 PolarHBondContact O-N 2.9Å
226	G	96.6	Very high	91.7	Very high	21 Å²	21	55 Å²	55	22%	0.216	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-45	174.7	0	0	0	0	0	112.7	A222 Y223 L224 R229 Q230	A222-G226 PolarHBondContact O-N 3.39Å; Y223-G226 PolarHBondContact O-N 3.27Å; L224-G226 VanDerWaalsContact C-N 3.3Å; L224-G226 PolarHBondContact O-N 3.43Å; G226-R229 PolarHBondContact O-N 3.36Å; G226-Q230 WeakPolarHBondContact O-CG 3.42Å; G226-Q230 PolarHBondContact O-N 2.85Å
227	L	96.4	Very high	92.4	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-42.7	177.6	-173.4	60.3	0	0	0	111.6	A206 Y223 L224 R229 Q230 V231 L297	A206-L227 HydrophobicContact CB-CD2 3.99Å; Y223-L227 PolarHBondContact O-N 2.81Å; L224-L227 PolarHBondContact O-N 3.04Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.02Å; L227-Q230 PolarHBondContact O-N 2.89Å; L227-V231 WeakPolarHBondContact O-CG2 3.27Å; L227-V231 PolarHBondContact O-N 3.17Å; L227-L297 HydrophobicContact CD2-CD1 3.87Å; L227-L297 HydrophobicContact CD2-CD2 4.11Å; L227-L297 HydrophobicContact CD2-CG 4.4Å; L227-L297 HydrophobicContact CG-CD2 4.08Å
228	I	97.6	Very high	93.6	Very high	23 Å²	23	52.3 Å²	52.3	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-55.8	-49.9	173.6	-74.4	167.2	0	0	0	110.5	L224 A225 Q230 V231 E232 L297 H300 F301	L224-I228 HydrophobicContact CD1-CD1 4Å; L224-I228 HydrophobicContact CD1-CG1 4.2Å; L224-I228 HydrophobicContact CG-CD1 3.95Å; L224-I228 WeakPolarHBondContact O-CG1 3.4Å; L224-I228 PolarHBondContact O-N 3.41Å; A225-I228 PolarHBondContact O-N 3.46Å; I228-Q230 VanDerWaalsContact C-N 3.34Å; I228-Q230 PolarHBondContact O-N 3.24Å; I228-V231 PolarHBondContact O-N 3.47Å; I228-E232 HydrophobicContact CG2-CG 4.42Å; I228-E232 WeakPolarHBondContact O-CG 3.43Å; I228-E232 PolarHBondContact O-N 2.92Å; I228-L297 HydrophobicContact CG1-CD2 3.94Å; I228-H300 HydrophobicContact CD1-CB 3.93Å; I228-H300 HydrophobicContact CG1-CB 4.39Å; I228-H300 WeakPolarHBondContact CG2-CD2 3.19Å; I228-H300 VanDerWaalsContact CG2-NE2 3.31Å; I228-H300 WeakPolarHBondContact CG2-NE2 3.39Å; I228-F301 HydrophobicContact CG2-CZ 4.45Å
229	R	97.6	Very high	94.6	Very high	127 Å²	127	43.1 Å²	43.1	48%	0.479	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-44.4	179.1	-177.1	-175.4	61.9	85.9	0.7	111.8	A225 G226 L227 V231 E232 E233	A225-R229 PolarHBondContact O-N 2.9Å; G226-R229 PolarHBondContact O-N 3.36Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.02Å; R229-V231 VanDerWaalsContact C-N 3.32Å; R229-V231 PolarHBondContact O-N 3.25Å; R229-E232 PolarHBondContact O-N 2.95Å; R229-E233 HydrophobicContact CG-CG 4.39Å; R229-E233 WeakPolarHBondContact CG-OE1 3.18Å; R229-E233 IonicContact CZ-OE1 3.48Å; R229-E233 IonicContact NE-OE1 3.84Å; R229-E233 VanDerWaalsContact NH1-CD 3.27Å; R229-E233 IonicContact NH1-OE1 3.25Å; R229-E233 PolarHBondContact NH1-OE1 3.39Å; R229-E233 IonicContact NH1-OE2 3.81Å; R229-E233 PolarHBondContact NH1-OE2 3.39Å; R229-E233 WeakPolarHBondContact O-CB 3.36Å; R229-E233 VanDerWaalsContact O-CG 3.31Å; R229-E233 WeakPolarHBondContact O-CG 3.39Å; R229-E233 PolarHBondContact O-N 3.35Å
230	Q	96.1	Very high	95.5	Very high	93 Å²	93	36.4 Å²	36.4	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-60.4	-42.6	177.8	-72.2	173.7	15.1	0	0	112.1	G226 L227 I228 E233 V234	G226-Q230 WeakPolarHBondContact O-CG 3.42Å; G226-Q230 PolarHBondContact O-N 2.85Å; L227-Q230 PolarHBondContact O-N 2.89Å; I228-Q230 VanDerWaalsContact C-N 3.34Å; I228-Q230 PolarHBondContact O-N 3.24Å; Q230-E233 PolarHBondContact O-N 3.5Å; Q230-V234 WeakPolarHBondContact O-CG2 3.45Å; Q230-V234 PolarHBondContact O-N 3.48Å
231	V	97.4	Very high	96.3	Very high	3 Å²	3	35 Å²	35	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-40.9	178	175.7	0	0	0	0	110.6	L209 L227 I228 R229 E233 V234 F235 V238 F301	L209-V231 HydrophobicContact CB-CG2 4.4Å; L209-V231 HydrophobicContact CD1-CG2 4.12Å; L209-V231 HydrophobicContact CD2-CG1 4.44Å; L209-V231 HydrophobicContact CD2-CG2 3.88Å; L209-V231 HydrophobicContact CG-CG2 4.36Å; L227-V231 WeakPolarHBondContact O-CG2 3.27Å; L227-V231 PolarHBondContact O-N 3.17Å; I228-V231 PolarHBondContact O-N 3.47Å; R229-V231 VanDerWaalsContact C-N 3.32Å; R229-V231 PolarHBondContact O-N 3.25Å; V231-E233 VanDerWaalsContact C-N 3.33Å; V231-E233 PolarHBondContact O-N 2.81Å; V231-V234 PolarHBondContact O-N 3.47Å; V231-F235 HydrophobicContact CB-CD2 4.25Å; V231-F235 HydrophobicContact CG1-CB 4.48Å; V231-F235 HydrophobicContact CG1-CD2 3.65Å; V231-F235 HydrophobicContact CG1-CE2 4.34Å; V231-F235 HydrophobicContact CG1-CG 4.38Å; V231-F235 WeakPolarHBondContact O-CB 3.49Å; V231-F235 WeakPolarHBondContact O-CD2 3.38Å; V231-F235 PolarHBondContact O-N 3Å; V231-V238 HydrophobicContact CG1-CG2 4Å; V231-F301 HydrophobicContact CB-CE1 4.48Å; V231-F301 HydrophobicContact CB-CE2 3.91Å; V231-F301 HydrophobicContact CB-CZ 3.54Å; V231-F301 HydrophobicContact CG1-CD2 4.48Å; V231-F301 HydrophobicContact CG1-CE1 3.86Å; V231-F301 HydrophobicContact CG1-CE2 3.6Å; V231-F301 HydrophobicContact CG1-CZ 3.25Å
232	E	96.2	Very high	96.9	Very high	66 Å²	66	35 Å²	35	31%	0.308	19%	0.192	S	C	.	.	H	α-helix	trans	-61.1	-40.6	174.4	-74.5	-172	138.8	0	0	112.3	Y43 I228 R229 V234 H300 F301	Y43-E232 WeakPolarHBondContact CE2-O 3.5Å; Y43-E232 PolarHBondContact OH-O 3.32Å; I228-E232 HydrophobicContact CG2-CG 4.42Å; I228-E232 WeakPolarHBondContact O-CG 3.43Å; I228-E232 PolarHBondContact O-N 2.92Å; R229-E232 PolarHBondContact O-N 2.95Å; E232-V234 VanDerWaalsContact C-N 3.3Å; E232-V234 PolarHBondContact O-N 2.96Å; E232-H300 VanDerWaalsContact CD-NE2 3.3Å; E232-H300 IonicContact OE1-CD2 2.69Å; E232-H300 IonicContact OE1-CE1 2.66Å; E232-H300 PolarHBondContact OE1-CE1 3.06Å; E232-H300 IonicContact OE1-NE2 2.68Å; E232-H300 PolarHBondContact OE1-NE2 3.26Å; E232-H300 IonicContact OE2-NE2 3.59Å; E232-F301 HydrophobicContact CG-CE1 3.77Å; E232-F301 HydrophobicContact CG-CZ 3.94Å
233	E	95.5	Very high	97.1	Very high	75 Å²	75	35 Å²	35	35%	0.35	18%	0.176	S	C	.	.	H	α-helix	trans	-70.6	-18.6	-179.9	-78.6	175.2	-170.9	0	0	115	Y43 R134 R229 Q230 V231	Y43-E233 WeakPolarHBondContact OH-CA 3.3Å; Y43-E233 PolarHBondContact OH-O 3.37Å; R134-E233 IonicContact NH1-OE2 2.85Å; R134-E233 PolarHBondContact NH1-OE2 3.29Å; R229-E233 HydrophobicContact CG-CG 4.39Å; R229-E233 WeakPolarHBondContact CG-OE1 3.18Å; R229-E233 IonicContact CZ-OE1 3.48Å; R229-E233 IonicContact NE-OE1 3.84Å; R229-E233 VanDerWaalsContact NH1-CD 3.27Å; R229-E233 IonicContact NH1-OE1 3.25Å; R229-E233 PolarHBondContact NH1-OE1 3.39Å; R229-E233 IonicContact NH1-OE2 3.81Å; R229-E233 PolarHBondContact NH1-OE2 3.39Å; R229-E233 WeakPolarHBondContact O-CB 3.36Å; R229-E233 VanDerWaalsContact O-CG 3.31Å; R229-E233 WeakPolarHBondContact O-CG 3.39Å; R229-E233 PolarHBondContact O-N 3.35Å; Q230-E233 PolarHBondContact O-N 3.5Å; V231-E233 VanDerWaalsContact C-N 3.33Å; V231-E233 PolarHBondContact O-N 2.81Å
234	V	95.6	Very high	97.2	Very high	11 Å²	11	34 Å²	34	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-106	-52	-179.6	175.2	0	0	0	0	110.7	F132 R134 Y147 Q230 V231 E232 S236	F132-V234 HydrophobicContact CE1-CG2 4.47Å; F132-V234 HydrophobicContact CE2-CG1 4.2Å; F132-V234 HydrophobicContact CZ-CB 4.3Å; F132-V234 HydrophobicContact CZ-CG1 3.75Å; F132-V234 HydrophobicContact CZ-CG2 4.06Å; R134-V234 HydrophobicContact CG-CG2 4.04Å; Y147-V234 WeakPolarHBondContact CB-O 3.35Å; Y147-V234 HydrophobicContact CD1-CG1 4.14Å; Y147-V234 HydrophobicContact CG-CG1 4Å; Q230-V234 WeakPolarHBondContact O-CG2 3.45Å; Q230-V234 PolarHBondContact O-N 3.48Å; V231-V234 PolarHBondContact O-N 3.47Å; E232-V234 VanDerWaalsContact C-N 3.3Å; E232-V234 PolarHBondContact O-N 2.96Å; V234-S236 PolarHBondContact O-N 3.19Å
235	F	97.7	Very high	97.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	17%	0.171	C	C	.	.			trans	-86.2	109.8	-165.4	-65.9	-83	0	0	0	111.3	L69 F132 Y147 V148 T149 L209 V231 L237 V238	L69-F235 HydrophobicContact CB-CE1 3.66Å; L69-F235 HydrophobicContact CB-CZ 3.86Å; L69-F235 HydrophobicContact CD2-CE1 4.23Å; L69-F235 HydrophobicContact CD2-CE2 4.41Å; L69-F235 HydrophobicContact CD2-CZ 3.6Å; L69-F235 HydrophobicContact CG-CZ 4.39Å; F132-F235 HydrophobicContact CD2-CZ 4.03Å; F132-F235 HydrophobicContact CE1-CE2 4.42Å; F132-F235 HydrophobicContact CE2-CE2 4.36Å; F132-F235 AromaticContact CE2-CZ 3.92Å; F132-F235 HydrophobicContact CE2-CZ 3.92Å; F132-F235 HydrophobicContact CG-CZ 4.5Å; F132-F235 HydrophobicContact CZ-CE2 4.28Å; F132-F235 HydrophobicContact CZ-CZ 4.29Å; Y147-F235 CarbonylContact O-C 3.06Å; Y147-F235 WeakPolarHBondContact O-CA 3.4Å; V148-F235 VanDerWaalsContact C-CD1 3.5Å; T149-F235 HydrophobicContact CG2-CB 4.33Å; T149-F235 HydrophobicContact CG2-CD1 3.72Å; T149-F235 HydrophobicContact CG2-CD2 4.33Å; T149-F235 HydrophobicContact CG2-CE1 4.09Å; T149-F235 HydrophobicContact CG2-CG 3.85Å; L209-F235 HydrophobicContact CD2-CE2 4.17Å; V231-F235 HydrophobicContact CB-CD2 4.25Å; V231-F235 HydrophobicContact CG1-CB 4.48Å; V231-F235 HydrophobicContact CG1-CD2 3.65Å; V231-F235 HydrophobicContact CG1-CE2 4.34Å; V231-F235 HydrophobicContact CG1-CG 4.38Å; V231-F235 WeakPolarHBondContact O-CB 3.49Å; V231-F235 WeakPolarHBondContact O-CD2 3.38Å; V231-F235 PolarHBondContact O-N 3Å; F235-L237 PolarHBondContact O-N 2.79Å; F235-V238 HydrophobicContact CB-CG2 4.06Å
236	S	96.8	Very high	97.5	Very high	7 Å²	7	32.8 Å²	32.8	5%	0.049	16%	0.157	C	C	.	.	S	Bend	trans	-59.9	-30.6	172.6	-65.1	0	0	0	0	111.5	F47 Y147 V234 R308	F47-S236 WeakPolarHBondContact CE2-O 3.33Å; F47-S236 WeakPolarHBondContact CZ-O 3.2Å; Y147-S236 WeakPolarHBondContact O-CB 3.39Å; Y147-S236 PolarHBondContact O-N 2.96Å; V234-S236 PolarHBondContact O-N 3.19Å; S236-R308 VanDerWaalsContact O-CZ 3.31Å; S236-R308 PolarHBondContact O-NH1 3.43Å; S236-R308 PolarHBondContact O-NH2 2.89Å; S236-R308 VanDerWaalsContact O-NH2 3.08Å
237	L	98	Very high	97.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	130.2	171.7	-178.8	62.2	0	0	0	111.2	F47 Y147 V148 T149 F235 M239 L250 L251 L254	F47-L237 HydrophobicContact CE1-CD1 4.47Å; F47-L237 HydrophobicContact CZ-CB 4.18Å; F47-L237 HydrophobicContact CZ-CD1 4.14Å; Y147-L237 PolarHBondContact O-N 2.87Å; V148-L237 VanDerWaalsContact CA-O 3.3Å; V148-L237 WeakPolarHBondContact CA-O 3.44Å; V148-L237 HydrophobicContact CB-CB 4.45Å; V148-L237 HydrophobicContact CG1-CB 3.87Å; T149-L237 PolarHBondContact N-O 2.59Å; F235-L237 PolarHBondContact O-N 2.79Å; L237-M239 HydrophobicContact CD2-CG 3.77Å; L237-M239 HydrophobicContact CD2-SD 4.45Å; L237-M239 HydrophobicContact CG-CG 3.91Å; L237-L250 HydrophobicContact CD1-CB 4.2Å; L237-L250 HydrophobicContact CD1-CD1 4.22Å; L237-L250 HydrophobicContact CD2-CB 4.06Å; L237-L251 HydrophobicContact CD2-CB 3.94Å; L237-L251 HydrophobicContact CD2-CD1 4.29Å; L237-L254 HydrophobicContact CB-CD2 3.85Å
238	V	98.7	Very high	97.7	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.024	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	108.3	164	-176.6	0	0	0	0	107.6	T149 L151 V231 F235 F301	T149-V238 HydrophobicContact CG2-CB 4.28Å; T149-V238 HydrophobicContact CG2-CG1 4.06Å; T149-V238 HydrophobicContact CG2-CG2 3.84Å; L151-V238 HydrophobicContact CD1-CG1 3.66Å; L151-V238 HydrophobicContact CG-CG1 3.62Å; V231-V238 HydrophobicContact CG1-CG2 4Å; F235-V238 HydrophobicContact CB-CG2 4.06Å; V238-F301 HydrophobicContact CB-CB 4.27Å; V238-F301 HydrophobicContact CB-CD1 3.78Å; V238-F301 HydrophobicContact CB-CE1 4.48Å; V238-F301 HydrophobicContact CB-CG 4.13Å; V238-F301 HydrophobicContact CG1-CB 3.76Å; V238-F301 HydrophobicContact CG1-CD1 4.03Å; V238-F301 HydrophobicContact CG1-CG 3.84Å; V238-F301 HydrophobicContact CG2-CD1 3.52Å; V238-F301 HydrophobicContact CG2-CE1 3.73Å; V238-F301 HydrophobicContact CG2-CG 4.13Å; V238-F301 HydrophobicContact CG2-CZ 4.48Å
239	M	98.8	Very high	97.7	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	156.7	177.6	-64	-176	-62.2	0	0	110.8	F68 V79 T149 I150 L151 L237 L251	F68-M239 HydrophobicContact CD2-CE 4.28Å; F68-M239 HydrophobicContact CE2-CE 3.77Å; F68-M239 HydrophobicContact CZ-CE 4.46Å; V79-M239 HydrophobicContact CB-CE 4.47Å; V79-M239 HydrophobicContact CG1-CE 3.84Å; V79-M239 HydrophobicContact CG2-CE 3.87Å; T149-M239 WeakPolarHBondContact O-CB 3.07Å; T149-M239 PolarHBondContact O-N 2.68Å; I150-M239 CarbonylContact C-O 3.57Å; I150-M239 WeakPolarHBondContact CA-O 3.31Å; I150-M239 HydrophobicContact CB-CB 3.92Å; I150-M239 HydrophobicContact CB-CE 3.89Å; I150-M239 HydrophobicContact CD1-CB 4.03Å; I150-M239 HydrophobicContact CD1-CE 4.25Å; I150-M239 HydrophobicContact CG1-CB 3.78Å; I150-M239 HydrophobicContact CG1-CE 4.5Å; L151-M239 PolarHBondContact N-O 3.04Å; L237-M239 HydrophobicContact CD2-CG 3.77Å; L237-M239 HydrophobicContact CD2-SD 4.45Å; L237-M239 HydrophobicContact CG-CG 3.91Å; M239-L251 HydrophobicContact SD-CB 4.35Å; M239-L251 HydrophobicContact SD-CD2 4.15Å
240	I	98.8	Very high	97.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.6	177.8	-57.7	-62.9	0	0	0	108.7	L151 E242 Y243 F244 S247 Y298 N302 F305	L151-I240 HydrophobicContact CB-CD1 4.41Å; I240-E242 HydrophobicContact CG2-CB 4.16Å; I240-E242 WeakPolarHBondContact CG2-OE2 3.41Å; I240-E242 PolarHBondContact O-N 2.75Å; I240-Y243 HydrophobicContact CB-CD2 3.93Å; I240-Y243 HydrophobicContact CG2-CD2 3.51Å; I240-Y243 HydrophobicContact CG2-CE2 3.94Å; I240-Y243 CarbonylContact O-C 3.48Å; I240-Y243 PolarHBondContact O-N 2.97Å; I240-F244 PolarHBondContact O-N 3.33Å; I240-S247 PolarHBondContact N-OG 3.25Å; I240-S247 PolarHBondContact O-OG 3.01Å; I240-Y298 HydrophobicContact CD1-CE2 4.26Å; I240-Y298 HydrophobicContact CG2-CE2 4.03Å; I240-N302 HydrophobicContact CD1-CB 4.3Å; I240-F305 HydrophobicContact CB-CG 4.46Å; I240-F305 HydrophobicContact CG1-CB 3.79Å; I240-F305 HydrophobicContact CG1-CD1 4.16Å; I240-F305 HydrophobicContact CG1-CD2 4.06Å; I240-F305 HydrophobicContact CG1-CG 3.74Å
241	A	98.3	Very high	97.8	Very high	20 Å²	20	20.3 Å²	20.3	17%	0.165	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-62.8	-28.4	-172.7	0	0	0	0	0	113.6	A75 I150 L151 R152 Y243	A75-A241 HydrophobicContact CB-CB 4.48Å; I150-A241 HydrophobicContact CD1-CB 4.26Å; I150-A241 HydrophobicContact CG1-CB 4.4Å; L151-A241 WeakPolarHBondContact O-CB 3.33Å; L151-A241 PolarHBondContact O-N 3.11Å; R152-A241 HydrophobicContact CB-CB 3.93Å; R152-A241 HydrophobicContact CG-CB 3.97Å; A241-Y243 VanDerWaalsContact C-N 3.26Å; A241-Y243 PolarHBondContact O-N 2.88Å
242	E	97.8	Very high	97.7	Very high	73 Å²	73	22.8 Å²	22.8	34%	0.341	11%	0.107	S	C	.	.	G	3₁₀ helix	trans	-65.7	-29.9	174.5	-67.7	69.8	-159.6	0	0	112.1	R152 E153 I240 Y298	R152-E242 WeakPolarHBondContact CG-OE1 3.48Å; E153-E242 WeakPolarHBondContact CB-OE1 3.38Å; E153-E242 PolarHBondContact N-OE1 2.79Å; I240-E242 HydrophobicContact CG2-CB 4.16Å; I240-E242 WeakPolarHBondContact CG2-OE2 3.41Å; I240-E242 PolarHBondContact O-N 2.75Å; E242-Y298 PolarHBondContact OE2-OH 3.22Å
243	Y	98.4	Very high	97.5	Very high	73 Å²	73	20.9 Å²	20.9	29%	0.286	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-115.7	50.7	179.9	-48.2	-64.1	0	0	0	109.5	I240 A241 D245 E246 S247 N302 F305 W306	I240-Y243 HydrophobicContact CB-CD2 3.93Å; I240-Y243 HydrophobicContact CG2-CD2 3.51Å; I240-Y243 HydrophobicContact CG2-CE2 3.94Å; I240-Y243 CarbonylContact O-C 3.48Å; I240-Y243 PolarHBondContact O-N 2.97Å; A241-Y243 VanDerWaalsContact C-N 3.26Å; A241-Y243 PolarHBondContact O-N 2.88Å; Y243-D245 PolarHBondContact O-N 3.36Å; Y243-E246 WeakPolarHBondContact CA-OE2 3.15Å; Y243-E246 PolarHBondContact O-N 3.48Å; Y243-S247 VanDerWaalsContact O-CB 3.27Å; Y243-S247 WeakPolarHBondContact O-CB 3.34Å; Y243-S247 PolarHBondContact O-N 2.85Å; Y243-S247 PolarHBondContact O-OG 3.37Å; Y243-N302 WeakPolarHBondContact CE2-OD1 3.28Å; Y243-F305 HydrophobicContact CD2-CD1 4.19Å; Y243-F305 AromaticContact CD2-CE1 3.88Å; Y243-F305 HydrophobicContact CD2-CE1 3.88Å; Y243-F305 HydrophobicContact CG-CE1 4.03Å; Y243-W306 HydrophobicContact CD1-CH2 4.37Å; Y243-W306 AromaticContact CD1-CZ2 3.71Å; Y243-W306 HydrophobicContact CD1-CZ2 3.71Å; Y243-W306 HydrophobicContact CD2-CZ2 4.05Å; Y243-W306 AromaticContact CD2-NE1 3.93Å; Y243-W306 HydrophobicContact CE1-CH2 4.44Å; Y243-W306 AromaticContact CE1-CZ2 3.53Å; Y243-W306 HydrophobicContact CE1-CZ2 3.53Å; Y243-W306 AromaticContact CE2-CE2 3.93Å; Y243-W306 AromaticContact CE2-CZ2 3.91Å; Y243-W306 HydrophobicContact CE2-CZ2 3.91Å; Y243-W306 AromaticContact CE2-NE1 3.39Å; Y243-W306 AromaticContact CG-CZ2 3.97Å; Y243-W306 HydrophobicContact CG-CZ2 3.97Å; Y243-W306 AromaticContact CZ-CE2 3.98Å; Y243-W306 AromaticContact CZ-CZ2 3.63Å; Y243-W306 AromaticContact CZ-NE1 3.71Å
244	F	98.6	Very high	97.5	Very high	24 Å²	24	17.8 Å²	17.8	11%	0.105	8%	0.083	C	C	.	.	H	α-helix	trans	-62	-42.6	-169.5	-167.4	-98.4	0	0	0	112.6	A75 T78 V79 I150 I240 S247 L248 Y264	A75-F244 HydrophobicContact CB-CD2 4.23Å; A75-F244 HydrophobicContact CB-CE2 4.03Å; T78-F244 HydrophobicContact CG2-CE1 3.8Å; T78-F244 HydrophobicContact CG2-CZ 3.54Å; V79-F244 HydrophobicContact CG2-CE2 3.72Å; V79-F244 HydrophobicContact CG2-CZ 3.86Å; I150-F244 HydrophobicContact CD1-CD2 4.07Å; I150-F244 HydrophobicContact CD1-CE2 4.02Å; I240-F244 PolarHBondContact O-N 3.33Å; F244-S247 WeakPolarHBondContact O-CB 3.49Å; F244-S247 PolarHBondContact O-N 3.04Å; F244-L248 HydrophobicContact CD1-CD1 3.92Å; F244-L248 HydrophobicContact CD1-CG 4.27Å; F244-L248 HydrophobicContact CE1-CD1 3.51Å; F244-L248 HydrophobicContact CE1-CG 4.03Å; F244-L248 HydrophobicContact CZ-CD1 4.27Å; F244-L248 HydrophobicContact CZ-CG 4.47Å; F244-L248 WeakPolarHBondContact O-CG 3.43Å; F244-L248 PolarHBondContact O-N 3.36Å; F244-Y264 HydrophobicContact CD1-CE1 4.02Å; F244-Y264 HydrophobicContact CD1-CE2 4.11Å; F244-Y264 AromaticContact CD1-CZ 3.7Å; F244-Y264 HydrophobicContact CE1-CD1 4.09Å; F244-Y264 HydrophobicContact CE1-CD2 4.05Å; F244-Y264 AromaticContact CE1-CE1 3.87Å; F244-Y264 HydrophobicContact CE1-CE1 3.87Å; F244-Y264 AromaticContact CE1-CE2 3.83Å; F244-Y264 HydrophobicContact CE1-CE2 3.83Å; F244-Y264 HydrophobicContact CE1-CG 4.18Å; F244-Y264 AromaticContact CE1-CZ 3.73Å
245	D	98.5	Very high	97.5	Very high	22 Å²	22	17.3 Å²	17.3	12%	0.118	8%	0.08	C	C	.	.	H	α-helix	trans	-69.5	-42	-178.8	-68.5	-32.3	0	0	0	110.8	Y243 S247 L248 V249 Y264 A321 L324 R325	Y243-D245 PolarHBondContact O-N 3.36Å; D245-S247 VanDerWaalsContact C-N 3.32Å; D245-S247 PolarHBondContact O-N 2.93Å; D245-L248 PolarHBondContact O-N 2.79Å; D245-V249 WeakPolarHBondContact O-CG2 3.45Å; D245-V249 PolarHBondContact O-N 3.28Å; D245-Y264 WeakPolarHBondContact OD1-CE1 3.49Å; D245-Y264 PolarHBondContact OD1-OH 2.94Å; D245-A321 HydrophobicContact CB-CB 4.2Å; D245-L324 HydrophobicContact CB-CD2 4.2Å; D245-R325 WeakPolarHBondContact OD2-CD 3.3Å; D245-R325 WeakPolarHBondContact OD2-CG 3.48Å
246	E	98.4	Very high	97.4	Very high	40 Å²	40	18.1 Å²	18.1	19%	0.187	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-38.4	173.1	-63.4	79.2	-175	0	0	111.6	Y243 L248 V249 L250 F305 V317 A321	Y243-E246 WeakPolarHBondContact CA-OE2 3.15Å; Y243-E246 PolarHBondContact O-N 3.48Å; E246-L248 VanDerWaalsContact C-N 3.34Å; E246-L248 PolarHBondContact O-N 2.86Å; E246-V249 WeakPolarHBondContact O-CB 3.41Å; E246-V249 PolarHBondContact O-N 3.49Å; E246-L250 PolarHBondContact O-N 3.33Å; E246-F305 HydrophobicContact CB-CZ 3.88Å; E246-V317 HydrophobicContact CB-CG1 3.96Å; E246-V317 HydrophobicContact CG-CG1 3.99Å; E246-A321 HydrophobicContact CG-CB 4.32Å
247	S	98.6	Very high	97.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61	-42.6	173.7	-67.6	0	0	0	0	111.9	I240 Y243 F244 D245 L250 L251 F305	I240-S247 PolarHBondContact N-OG 3.25Å; I240-S247 PolarHBondContact O-OG 3.01Å; Y243-S247 VanDerWaalsContact O-CB 3.27Å; Y243-S247 WeakPolarHBondContact O-CB 3.34Å; Y243-S247 PolarHBondContact O-N 2.85Å; Y243-S247 PolarHBondContact O-OG 3.37Å; F244-S247 WeakPolarHBondContact O-CB 3.49Å; F244-S247 PolarHBondContact O-N 3.04Å; D245-S247 VanDerWaalsContact C-N 3.32Å; D245-S247 PolarHBondContact O-N 2.93Å; S247-L250 PolarHBondContact O-N 2.66Å; S247-L251 WeakPolarHBondContact O-CB 3.48Å; S247-L251 PolarHBondContact O-N 2.82Å; S247-F305 WeakPolarHBondContact OG-CE2 3.44Å
248	L	98.6	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.3	-34	175.2	-71.4	-176.7	0	0	0	112.7	I82 F244 D245 E246 L251 R252 Y264 L324	I82-L248 HydrophobicContact CD1-CD1 3.89Å; I82-L248 HydrophobicContact CD1-CD2 3.68Å; I82-L248 HydrophobicContact CD1-CG 4.47Å; F244-L248 HydrophobicContact CD1-CD1 3.92Å; F244-L248 HydrophobicContact CD1-CG 4.27Å; F244-L248 HydrophobicContact CE1-CD1 3.51Å; F244-L248 HydrophobicContact CE1-CG 4.03Å; F244-L248 HydrophobicContact CZ-CD1 4.27Å; F244-L248 HydrophobicContact CZ-CG 4.47Å; F244-L248 WeakPolarHBondContact O-CG 3.43Å; F244-L248 PolarHBondContact O-N 3.36Å; D245-L248 PolarHBondContact O-N 2.79Å; E246-L248 VanDerWaalsContact C-N 3.34Å; E246-L248 PolarHBondContact O-N 2.86Å; L248-L251 HydrophobicContact CD2-CD2 4.07Å; L248-L251 PolarHBondContact O-N 3.41Å; L248-R252 WeakPolarHBondContact O-CB 3.3Å; L248-R252 PolarHBondContact O-N 2.78Å; L248-Y264 HydrophobicContact CD1-CD1 3.37Å; L248-Y264 HydrophobicContact CD1-CE1 3.47Å; L248-Y264 VanDerWaalsContact CD1-CE1 3.47Å; L248-Y264 HydrophobicContact CD1-CG 4.35Å; L248-L324 HydrophobicContact CB-CD2 3.84Å; L248-L324 HydrophobicContact CD1-CD2 4.17Å
249	V	97.4	Very high	97	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-47.5	171.2	168.9	0	0	0	0	110.6	D245 E246 L251 R252 R253 V317 E320 A321	D245-V249 WeakPolarHBondContact O-CG2 3.45Å; D245-V249 PolarHBondContact O-N 3.28Å; E246-V249 WeakPolarHBondContact O-CB 3.41Å; E246-V249 PolarHBondContact O-N 3.49Å; V249-L251 PolarHBondContact O-N 2.85Å; V249-R252 PolarHBondContact O-N 2.85Å; V249-R253 VanDerWaalsContact O-CG 3.31Å; V249-R253 WeakPolarHBondContact O-CG 3.47Å; V249-R253 PolarHBondContact O-N 3.31Å; V249-V317 HydrophobicContact CB-CG1 4.37Å; V249-V317 HydrophobicContact CG1-CB 4.49Å; V249-V317 HydrophobicContact CG1-CG1 4.09Å; V249-V317 HydrophobicContact CG1-CG2 4.43Å; V249-E320 HydrophobicContact CB-CB 4.48Å; V249-E320 HydrophobicContact CG1-CB 3.81Å; V249-E320 HydrophobicContact CG1-CG 4.48Å; V249-E320 HydrophobicContact CG2-CB 3.75Å; V249-A321 HydrophobicContact CG2-CB 4.12Å
250	L	97.2	Very high	96.9	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-41	177	-66.4	-173.1	0	0	0	112.1	L237 E246 S247 R253 L254 F305 R308 V309 A312 V317	L237-L250 HydrophobicContact CD1-CB 4.2Å; L237-L250 HydrophobicContact CD1-CD1 4.22Å; L237-L250 HydrophobicContact CD2-CB 4.06Å; E246-L250 PolarHBondContact O-N 3.33Å; S247-L250 PolarHBondContact O-N 2.66Å; L250-R253 PolarHBondContact O-N 3.45Å; L250-L254 VanDerWaalsContact O-CB 3.28Å; L250-L254 WeakPolarHBondContact O-CB 3.3Å; L250-L254 PolarHBondContact O-N 3.37Å; L250-F305 HydrophobicContact CD1-CD2 4.01Å; L250-F305 HydrophobicContact CD1-CE2 3.68Å; L250-F305 HydrophobicContact CD1-CZ 4.37Å; L250-R308 HydrophobicContact CD1-CB 4.18Å; L250-V309 HydrophobicContact CD1-CG2 4.04Å; L250-A312 HydrophobicContact CD2-CB 4.18Å; L250-V317 HydrophobicContact CD2-CG2 4.34Å
251	L	97.9	Very high	96.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-47.8	175.6	-177.8	66.9	0	0	0	111.4	V148 L237 M239 S247 L248 V249 R253 L254 L255	V148-L251 HydrophobicContact CB-CD1 4.4Å; V148-L251 HydrophobicContact CG1-CD1 3.88Å; V148-L251 HydrophobicContact CG2-CD1 4.2Å; L237-L251 HydrophobicContact CD2-CB 3.94Å; L237-L251 HydrophobicContact CD2-CD1 4.29Å; M239-L251 HydrophobicContact SD-CB 4.35Å; M239-L251 HydrophobicContact SD-CD2 4.15Å; S247-L251 WeakPolarHBondContact O-CB 3.48Å; S247-L251 PolarHBondContact O-N 2.82Å; L248-L251 HydrophobicContact CD2-CD2 4.07Å; L248-L251 PolarHBondContact O-N 3.41Å; V249-L251 PolarHBondContact O-N 2.85Å; L251-R253 VanDerWaalsContact C-N 3.33Å; L251-R253 PolarHBondContact O-N 2.59Å; L251-L254 WeakPolarHBondContact O-CB 3.35Å; L251-L254 PolarHBondContact O-N 2.85Å; L251-L255 HydrophobicContact CD1-CD1 3.62Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 3.9Å; L251-L255 WeakPolarHBondContact O-CB 3.22Å; L251-L255 WeakPolarHBondContact O-CG 3.47Å; L251-L255 PolarHBondContact O-N 3.17Å
252	R	95.8	Very high	96.8	Very high	55 Å²	55	28.2 Å²	28.2	21%	0.208	14%	0.137	C	C	.	.	H	α-helix	trans	-56.7	-47.4	177.8	-174.1	-175.6	84.5	93.8	-9.8	111.3	L248 V249 L255 A256 W257 V262 E320	L248-R252 WeakPolarHBondContact O-CB 3.3Å; L248-R252 PolarHBondContact O-N 2.78Å; V249-R252 PolarHBondContact O-N 2.85Å; R252-L255 PolarHBondContact O-N 3.5Å; R252-A256 WeakPolarHBondContact O-CA 3.25Å; R252-A256 PolarHBondContact O-N 3.36Å; R252-W257 HydrophobicContact CG-CB 4.13Å; R252-W257 WeakPolarHBondContact CG-O 3.29Å; R252-W257 PolarHBondContact NH1-O 3.46Å; R252-W257 PolarHBondContact O-N 3.41Å; R252-V262 HydrophobicContact CB-CG1 4.04Å; R252-V262 HydrophobicContact CB-CG2 4.26Å; R252-V262 HydrophobicContact CG-CG1 4.37Å; R252-V262 HydrophobicContact CG-CG2 4.25Å; R252-E320 IonicContact CZ-OE2 2.85Å; R252-E320 IonicContact NE-OE2 3.45Å; R252-E320 IonicContact NH2-OE2 3.33Å; R252-E320 PolarHBondContact NH2-OE2 3.41Å
253	R	93.2	Very high	96.8	Very high	27 Å²	27	25.2 Å²	25.2	10%	0.102	12%	0.124	C	C	.	.	H	α-helix	trans	-67.3	-40.2	178.5	-68.7	176	70	89.1	2.9	112.2	S50 C51 R60 V249 L250 L251 L255 A256 E320	S50-R253 PolarHBondContact O-NH2 2.7Å; S50-R253 VanDerWaalsContact O-NH2 3.1Å; C51-R253 VanDerWaalsContact SG-CZ 3.52Å; C51-R253 PolarHBondContact SG-NH1 3.48Å; R60-R253 PolarHBondContact NH2-O 2.98Å; V249-R253 VanDerWaalsContact O-CG 3.31Å; V249-R253 WeakPolarHBondContact O-CG 3.47Å; V249-R253 PolarHBondContact O-N 3.31Å; L250-R253 PolarHBondContact O-N 3.45Å; L251-R253 VanDerWaalsContact C-N 3.33Å; L251-R253 PolarHBondContact O-N 2.59Å; R253-L255 VanDerWaalsContact C-N 3.34Å; R253-A256 PolarHBondContact O-N 2.69Å; R253-E320 IonicContact CZ-OE1 2.81Å; R253-E320 IonicContact NH1-OE1 3.82Å; R253-E320 PolarHBondContact NH1-OE1 2.99Å
254	L	94.8	Very high	96.8	Very high	9 Å²	9	22.1 Å²	22.1	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-58.9	-46.4	175.6	174.6	61.2	0	0	0	111.2	L46 F47 V146 V148 L237 L250 L251	L46-L254 HydrophobicContact CB-CD1 3.77Å; F47-L254 HydrophobicContact CD1-CB 4.49Å; F47-L254 HydrophobicContact CD2-CD1 4.24Å; F47-L254 HydrophobicContact CE1-CB 3.87Å; F47-L254 HydrophobicContact CE1-CD1 4.23Å; F47-L254 HydrophobicContact CE1-CD2 4.44Å; F47-L254 HydrophobicContact CE1-CG 4.41Å; F47-L254 HydrophobicContact CE2-CD1 3.79Å; F47-L254 HydrophobicContact CE2-CD2 4.41Å; F47-L254 HydrophobicContact CZ-CB 4.08Å; F47-L254 HydrophobicContact CZ-CD1 3.8Å; F47-L254 HydrophobicContact CZ-CD2 3.83Å; F47-L254 HydrophobicContact CZ-CG 4.12Å; V146-L254 HydrophobicContact CG1-CD2 3.62Å; V146-L254 HydrophobicContact CG1-CG 4.02Å; V148-L254 HydrophobicContact CG1-CD2 4.05Å; L237-L254 HydrophobicContact CB-CD2 3.85Å; L250-L254 VanDerWaalsContact O-CB 3.28Å; L250-L254 WeakPolarHBondContact O-CB 3.3Å; L250-L254 PolarHBondContact O-N 3.37Å; L251-L254 WeakPolarHBondContact O-CB 3.35Å; L251-L254 PolarHBondContact O-N 2.85Å
255	L	96.3	Very high	96.7	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-88.9	-0.2	-174.9	-59	177.3	0	0	0	114	H63 V66 V146 L251 R252 R253 W257	H63-L255 HydrophobicContact CB-CB 4.1Å; H63-L255 HydrophobicContact CB-CD2 3.93Å; H63-L255 WeakPolarHBondContact CB-O 3.04Å; H63-L255 PolarHBondContact N-O 2.76Å; V66-L255 HydrophobicContact CG2-CD1 3.9Å; V66-L255 HydrophobicContact CG2-CD2 3.75Å; V66-L255 HydrophobicContact CG2-CG 4.5Å; V146-L255 HydrophobicContact CB-CD2 3.91Å; V146-L255 HydrophobicContact CG1-CD2 3.76Å; V146-L255 HydrophobicContact CG2-CD2 4.25Å; L251-L255 HydrophobicContact CD1-CD1 3.62Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 3.9Å; L251-L255 WeakPolarHBondContact O-CB 3.22Å; L251-L255 WeakPolarHBondContact O-CG 3.47Å; L251-L255 PolarHBondContact O-N 3.17Å; R252-L255 PolarHBondContact O-N 3.5Å; R253-L255 VanDerWaalsContact C-N 3.34Å; L255-W257 HydrophobicContact CB-CB 4.48Å; L255-W257 VanDerWaalsContact CB-CD1 3.48Å; L255-W257 HydrophobicContact CB-CD2 3.9Å; L255-W257 HydrophobicContact CB-CG 3.71Å; L255-W257 HydrophobicContact CD1-CD2 3.84Å; L255-W257 HydrophobicContact CD1-CE3 4.06Å; L255-W257 HydrophobicContact CD1-CH2 3.91Å; L255-W257 HydrophobicContact CD1-CZ2 3.63Å; L255-W257 HydrophobicContact CD1-CZ3 4.1Å; L255-W257 PolarHBondContact O-N 3.06Å
256	A	94.3	Very high	96.5	Very high	20 Å²	20	24.7 Å²	24.7	17%	0.165	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	36.7	-171.6	0	0	0	0	0	112.8	R60 K62 R252 R253	R60-A256 HydrophobicContact CB-CB 3.99Å; K62-A256 WeakPolarHBondContact CG-O 3.35Å; R252-A256 WeakPolarHBondContact O-CA 3.25Å; R252-A256 PolarHBondContact O-N 3.36Å; R253-A256 PolarHBondContact O-N 2.69Å
257	W	95.4	Very high	96.3	Very high	5 Å²	5	23.5 Å²	23.5	2%	0.019	12%	0.117	C	C	.	.			trans	-84.9	158.2	-180	-74.3	6	0	0	0	112.4	H63 V66 I82 L83 F86 R252 L255 D261 V262	H63-W257 PolarHBondContact O-NE1 3.36Å; V66-W257 HydrophobicContact CG2-CZ2 4.15Å; I82-W257 HydrophobicContact CG2-CZ3 4.14Å; L83-W257 HydrophobicContact CD2-CH2 3.45Å; L83-W257 VanDerWaalsContact CD2-CH2 3.45Å; L83-W257 HydrophobicContact CD2-CZ2 4.49Å; L83-W257 HydrophobicContact CD2-CZ3 3.94Å; F86-W257 HydrophobicContact CB-CH2 3.75Å; F86-W257 HydrophobicContact CB-CZ2 4.27Å; F86-W257 HydrophobicContact CB-CZ3 4.1Å; F86-W257 AromaticContact CD1-CE2 3.98Å; F86-W257 AromaticContact CD1-CH2 3.66Å; F86-W257 HydrophobicContact CD1-CH2 3.66Å; F86-W257 AromaticContact CD1-CZ2 3.31Å; F86-W257 HydrophobicContact CD1-CZ2 3.31Å; F86-W257 AromaticContact CD2-CD2 3.92Å; F86-W257 HydrophobicContact CD2-CD2 3.92Å; F86-W257 AromaticContact CD2-CE2 3.72Å; F86-W257 HydrophobicContact CD2-CE3 4.09Å; F86-W257 AromaticContact CD2-CH2 3.89Å; F86-W257 HydrophobicContact CD2-CH2 3.89Å; F86-W257 AromaticContact CD2-CZ2 3.74Å; F86-W257 HydrophobicContact CD2-CZ2 3.74Å; F86-W257 HydrophobicContact CD2-CZ3 4.08Å; F86-W257 AromaticContact CE1-CE2 3.74Å; F86-W257 HydrophobicContact CE1-CH2 4.23Å; F86-W257 AromaticContact CE1-CZ2 3.41Å; F86-W257 HydrophobicContact CE1-CZ2 3.41Å; F86-W257 VanDerWaalsContact CE1-CZ2 3.41Å; F86-W257 AromaticContact CE1-NE1 3.83Å; F86-W257 AromaticContact CE2-CD1 3.86Å; F86-W257 AromaticContact CE2-CD2 3.8Å; F86-W257 HydrophobicContact CE2-CD2 3.8Å; F86-W257 AromaticContact CE2-CE2 3.45Å; F86-W257 VanDerWaalsContact CE2-CE2 3.45Å; F86-W257 HydrophobicContact CE2-CE3 4.44Å; F86-W257 HydrophobicContact CE2-CG 4.07Å; F86-W257 HydrophobicContact CE2-CH2 4.43Å; F86-W257 AromaticContact CE2-CZ2 3.83Å; F86-W257 HydrophobicContact CE2-CZ2 3.83Å; F86-W257 AromaticContact CE2-NE1 3.5Å; F86-W257 HydrophobicContact CG-CD2 4.46Å; F86-W257 AromaticContact CG-CE2 3.97Å; F86-W257 HydrophobicContact CG-CE3 4.47Å; F86-W257 AromaticContact CG-CH2 3.46Å; F86-W257 HydrophobicContact CG-CH2 3.46Å; F86-W257 VanDerWaalsContact CG-CH2 3.46Å; F86-W257 AromaticContact CG-CZ2 3.48Å; F86-W257 HydrophobicContact CG-CZ2 3.48Å; F86-W257 VanDerWaalsContact CG-CZ2 3.48Å; F86-W257 AromaticContact CG-CZ3 4Å; F86-W257 HydrophobicContact CG-CZ3 4Å; F86-W257 AromaticContact CZ-CD1 3.96Å; F86-W257 HydrophobicContact CZ-CD2 4.28Å; F86-W257 AromaticContact CZ-CE2 3.47Å; F86-W257 VanDerWaalsContact CZ-CE2 3.47Å; F86-W257 AromaticContact CZ-CZ2 3.68Å; F86-W257 HydrophobicContact CZ-CZ2 3.68Å; F86-W257 AromaticContact CZ-NE1 3.25Å; F86-W257 VanDerWaalsContact CZ-NE1 3.25Å; R252-W257 HydrophobicContact CG-CB 4.13Å; R252-W257 WeakPolarHBondContact CG-O 3.29Å; R252-W257 PolarHBondContact NH1-O 3.46Å; R252-W257 PolarHBondContact O-N 3.41Å; L255-W257 HydrophobicContact CB-CB 4.48Å; L255-W257 VanDerWaalsContact CB-CD1 3.48Å; L255-W257 HydrophobicContact CB-CD2 3.9Å; L255-W257 HydrophobicContact CB-CG 3.71Å; L255-W257 HydrophobicContact CD1-CD2 3.84Å; L255-W257 HydrophobicContact CD1-CE3 4.06Å; L255-W257 HydrophobicContact CD1-CH2 3.91Å; L255-W257 HydrophobicContact CD1-CZ2 3.63Å; L255-W257 HydrophobicContact CD1-CZ3 4.1Å; L255-W257 PolarHBondContact O-N 3.06Å; W257-D261 HydrophobicContact CB-CB 3.95Å; W257-D261 HydrophobicContact CD2-CB 4.22Å; W257-D261 HydrophobicContact CE3-CB 3.97Å; W257-D261 HydrophobicContact CG-CB 4.25Å; W257-V262 HydrophobicContact CE3-CG1 3.87Å
258	D	95.2	Very high	96	Very high	87 Å²	87	26 Å²	26	47%	0.465	13%	0.13	S	C	.	.			trans	-80.8	165.5	174.5	-63.2	-34.1	0	0	0	110.8	K62 D260 D261	K62-D258 WeakPolarHBondContact CE-OD2 3.39Å; K62-D258 IonicContact NZ-OD2 2.66Å; K62-D258 PolarHBondContact NZ-OD2 3.45Å; D258-D260 PolarHBondContact O-N 3.28Å; D258-D261 PolarHBondContact N-OD2 3.29Å; D258-D261 WeakPolarHBondContact O-CB 3.35Å; D258-D261 PolarHBondContact O-N 3.35Å
259	L	95.3	Very high	95.7	Very high	47 Å²	47	27.3 Å²	27.3	25%	0.246	14%	0.141	C	C	.	.	H	α-helix	trans	-56.2	-43.3	174.8	-174	62.7	0	0	0	111.3	D261 V262 L263 L324 A327	L259-D261 PolarHBondContact O-N 3.46Å; L259-V262 VanDerWaalsContact O-CG2 3.29Å; L259-V262 WeakPolarHBondContact O-CG2 3.31Å; L259-V262 PolarHBondContact O-N 3.5Å; L259-V262 VanDerWaalsContact O-N 3.14Å; L259-L263 HydrophobicContact CG-CD2 4.47Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 2.93Å; L259-L324 HydrophobicContact CD1-CB 4.07Å; L259-L324 HydrophobicContact CD1-CD1 3.71Å; L259-A327 HydrophobicContact CD2-CB 3.75Å; L259-A327 HydrophobicContact CG-CB 4.36Å
260	D	95.8	Very high	95.4	Very high	98 Å²	98	28.7 Å²	28.7	52%	0.524	15%	0.146	S	C	.	.	H	α-helix	trans	-67	-16	-178.8	-75.6	-6.5	0	0	0	114.5	R89 D258 L263	R89-D260 PolarHBondContact NH1-O 2.85Å; D258-D260 PolarHBondContact O-N 3.28Å; D260-L263 WeakPolarHBondContact OD1-CD1 3.33Å
261	D	97.6	Very high	95	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.027	15%	0.149	C	C	.	.	H	α-helix	trans	-80.2	-23.6	176.2	-65.1	-35.1	0	0	0	111.8	K62 I82 F86 R89 W257 D258 L259	K62-D261 WeakPolarHBondContact CE-OD2 3.32Å; K62-D261 IonicContact NZ-OD1 3.8Å; K62-D261 IonicContact NZ-OD2 3.65Å; K62-D261 PolarHBondContact NZ-OD2 3.25Å; I82-D261 WeakPolarHBondContact CG2-O 3.44Å; F86-D261 HydrophobicContact CD2-CB 3.93Å; F86-D261 HydrophobicContact CE2-CB 4.31Å; R89-D261 IonicContact CZ-OD1 3.68Å; R89-D261 IonicContact NH1-OD1 2.82Å; R89-D261 PolarHBondContact NH1-OD1 3.5Å; W257-D261 HydrophobicContact CB-CB 3.95Å; W257-D261 HydrophobicContact CD2-CB 4.22Å; W257-D261 HydrophobicContact CE3-CB 3.97Å; W257-D261 HydrophobicContact CG-CB 4.25Å; D258-D261 PolarHBondContact N-OD2 3.29Å; D258-D261 WeakPolarHBondContact O-CB 3.35Å; D258-D261 PolarHBondContact O-N 3.35Å; L259-D261 PolarHBondContact O-N 3.46Å
262	V	98	Very high	94.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-110.1	2.5	-177.2	-62.1	0	0	0	0	114.1	R252 W257 L259 L324	R252-V262 HydrophobicContact CB-CG1 4.04Å; R252-V262 HydrophobicContact CB-CG2 4.26Å; R252-V262 HydrophobicContact CG-CG1 4.37Å; R252-V262 HydrophobicContact CG-CG2 4.25Å; W257-V262 HydrophobicContact CE3-CG1 3.87Å; L259-V262 VanDerWaalsContact O-CG2 3.29Å; L259-V262 WeakPolarHBondContact O-CG2 3.31Å; L259-V262 PolarHBondContact O-N 3.5Å; L259-V262 VanDerWaalsContact O-N 3.14Å; V262-L324 HydrophobicContact CG2-CD1 3.91Å
263	L	98.1	Very high	93.8	Very high	11 Å²	11	34.8 Å²	34.8	6%	0.058	20%	0.202	C	C	.	.			trans	-64	138.1	173.5	-64.1	-179.5	0	0	0	111.3	R85 L259 D260 L324 A327 R328 L331	R85-L263 PolarHBondContact NH1-O 3.27Å; L259-L263 HydrophobicContact CG-CD2 4.47Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 2.93Å; D260-L263 WeakPolarHBondContact OD1-CD1 3.33Å; L263-L324 HydrophobicContact CD2-CD1 3.86Å; L263-A327 HydrophobicContact CD2-CB 3.77Å; L263-R328 HydrophobicContact CD2-CB 4.35Å; L263-L331 HydrophobicContact CB-CD2 3.62Å; L263-L331 HydrophobicContact CD1-CB 4.39Å; L263-L331 HydrophobicContact CD1-CD2 3.91Å; L263-L331 HydrophobicContact CG-CD2 4.38Å
264	Y	97.9	Very high	93.2	Very high	7 Å²	7	34 Å²	34	3%	0.027	20%	0.2	C	C	.	.			trans	-142.1	154.2	-169.7	70.2	-88.7	0	0	0	113.7	T78 I82 F244 D245 L248 K266 R328	T78-Y264 HydrophobicContact CG2-CD2 3.43Å; T78-Y264 VanDerWaalsContact CG2-CD2 3.43Å; T78-Y264 HydrophobicContact CG2-CE2 4.26Å; T78-Y264 HydrophobicContact CG2-CG 3.8Å; I82-Y264 HydrophobicContact CD1-CG 4.44Å; F244-Y264 HydrophobicContact CD1-CE1 4.02Å; F244-Y264 HydrophobicContact CD1-CE2 4.11Å; F244-Y264 AromaticContact CD1-CZ 3.7Å; F244-Y264 HydrophobicContact CE1-CD1 4.09Å; F244-Y264 HydrophobicContact CE1-CD2 4.05Å; F244-Y264 AromaticContact CE1-CE1 3.87Å; F244-Y264 HydrophobicContact CE1-CE1 3.87Å; F244-Y264 AromaticContact CE1-CE2 3.83Å; F244-Y264 HydrophobicContact CE1-CE2 3.83Å; F244-Y264 HydrophobicContact CE1-CG 4.18Å; F244-Y264 AromaticContact CE1-CZ 3.73Å; D245-Y264 WeakPolarHBondContact OD1-CE1 3.49Å; D245-Y264 PolarHBondContact OD1-OH 2.94Å; L248-Y264 HydrophobicContact CD1-CD1 3.37Å; L248-Y264 HydrophobicContact CD1-CE1 3.47Å; L248-Y264 VanDerWaalsContact CD1-CE1 3.47Å; L248-Y264 HydrophobicContact CD1-CG 4.35Å; Y264-K266 HydrophobicContact CE2-CG 4.02Å; Y264-R328 WeakPolarHBondContact O-CD 3.41Å; Y264-R328 VanDerWaalsContact O-CG 3.3Å; Y264-R328 WeakPolarHBondContact O-CG 3.15Å
265	A	96.9	Very high	92.7	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	22%	0.22	C	C	.	.			trans	-101.3	147.1	159	0	0	0	0	0	109.1	L267 L332 F336 Y367 L384	A265-L267 PolarHBondContact O-N 2.95Å; A265-L332 HydrophobicContact CB-CD2 3.88Å; A265-F336 HydrophobicContact CB-CE2 4.46Å; A265-Y367 HydrophobicContact CB-CD2 4.01Å; A265-Y367 HydrophobicContact CB-CE2 3.61Å; A265-L384 HydrophobicContact CB-CD1 4.34Å; A265-L384 HydrophobicContact CB-CD2 4.37Å; A265-L384 HydrophobicContact CB-CG 3.85Å
266	K	94.5	Very high	92	Very high	100 Å²	100	43 Å²	43	44%	0.435	24%	0.239	S	C	.	.			trans	-72	117.1	178.1	-70.5	-175.7	178.6	-176.3	0	109	Y264 Y367	Y264-K266 HydrophobicContact CE2-CG 4.02Å; K266-Y367 WeakPolarHBondContact O-CE2 3.42Å
267	L	94.4	Very high	91.2	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	27%	0.269	C	S	.	.			trans	-112.9	153.3	-179.4	-62.3	-179.5	0	0	0	111.8	T77 T78 N81 A265 A269 A385	T77-L267 HydrophobicContact CG2-CB 3.8Å; T77-L267 HydrophobicContact CG2-CD1 4.41Å; T78-L267 PolarHBondContact OG1-N 3.5Å; N81-L267 HydrophobicContact CB-CD1 3.54Å; A265-L267 PolarHBondContact O-N 2.95Å; L267-A269 PolarHBondContact O-N 3.4Å; L267-A385 WeakPolarHBondContact CD2-O 3.39Å
268	N	91.9	Very high	90.8	Very high	52 Å²	52	50.2 Å²	50.2	28%	0.278	30%	0.3	S	S	.	.	S	Bend	trans	56.5	34	-178.6	-160	15.7	0	0	0	112.9	T77	T77-N268 HydrophobicContact CG2-CB 4.07Å; T77-N268 PolarHBondContact OG1-ND2 3.39Å
269	A	91.2	Very high	90.6	Very high	27 Å²	27	48.3 Å²	48.3	22%	0.223	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.5	177.7	0	0	0	0	0	109.7	L267 L342 M365	L267-A269 PolarHBondContact O-N 3.4Å; A269-L342 HydrophobicContact CB-CD1 4.12Å; A269-M365 PolarHBondContact O-N 3.03Å
270	R	91.4	Very high	90.6	Very high	33 Å²	33	49.8 Å²	49.8	13%	0.125	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	146.9	172.6	-75.2	-175.7	-68.3	153.4	0.9	110.8	E159 S160 S274 V362 D363 I364	E159-R270 IonicContact OE1-CZ 3.29Å; E159-R270 IonicContact OE1-NH1 2.95Å; E159-R270 PolarHBondContact OE1-NH1 2.94Å; E159-R270 IonicContact OE1-NH2 2.98Å; E159-R270 IonicContact OE2-CZ 2.9Å; E159-R270 IonicContact OE2-NH1 3.61Å; E159-R270 PolarHBondContact OE2-NH1 3.5Å; E159-R270 IonicContact OE2-NH2 3.54Å; E159-R270 PolarHBondContact OE2-NH2 3.31Å; S160-R270 PolarHBondContact OG-NE 2.97Å; S160-R270 PolarHBondContact OG-NH2 3.47Å; R270-S274 PolarHBondContact NH1-O 3.25Å; R270-V362 HydrophobicContact CG-CG1 4.03Å; R270-D363 CarbonylContact C-O 3.52Å; R270-D363 WeakPolarHBondContact CA-O 3.3Å; R270-I364 HydrophobicContact CG-CD1 3.68Å
271	A	89.8	Confident	90.7	Very high	11 Å²	11	48.2 Å²	48.2	9%	0.091	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-56.6	152.3	166.4	0	0	0	0	0	110.9	S273 S274 D363 M365	A271-S273 PolarHBondContact O-N 3.49Å; A271-S274 PolarHBondContact O-N 2.88Å; A271-D363 HydrophobicContact CB-CB 3.83Å; A271-D363 PolarHBondContact N-O 3.48Å; A271-M365 HydrophobicContact CB-CG 4.07Å; A271-M365 HydrophobicContact CB-SD 3.82Å
272	A	85.3	Confident	90.6	Very high	71 Å²	71	50.8 Å²	50.8	59%	0.587	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-60.5	-33	177.3	0	0	0	0	0	112.4	S274 R275	A272-S274 VanDerWaalsContact C-N 3.26Å; A272-S274 PolarHBondContact O-N 3.18Å; A272-R275 WeakPolarHBondContact O-CG 3.45Å; A272-R275 PolarHBondContact O-N 2.92Å
273	S	83	Confident	90.6	Very high	103 Å²	103	51.9 Å²	51.9	72%	0.72	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-67.1	-22.4	174.3	50	0	0	0	0	113.9	A271	A271-S273 PolarHBondContact O-N 3.49Å
274	S	80.6	Confident	90.5	Very high	10 Å²	10	52.3 Å²	52.3	7%	0.07	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-97.5	12.6	-177.9	-54.4	0	0	0	0	113.7	R270 A271 A272 K361 D363	R270-S274 PolarHBondContact NH1-O 3.25Å; A271-S274 PolarHBondContact O-N 2.88Å; A272-S274 VanDerWaalsContact C-N 3.26Å; A272-S274 PolarHBondContact O-N 3.18Å; S274-K361 PolarHBondContact OG-O 3.47Å; S274-D363 PolarHBondContact OG-N 3.5Å
275	R	84.8	Confident	90.6	Very high	122 Å²	122	59.3 Å²	59.3	46%	0.46	36%	0.361	S	S	.	.	S	Bend	trans	-137.4	153.4	178.1	64.7	179.6	-176.4	91.1	-2.2	110.6	A272 A277	A272-R275 WeakPolarHBondContact O-CG 3.45Å; A272-R275 PolarHBondContact O-N 2.92Å; R275-A277 PolarHBondContact O-N 3.37Å
276	L	81.3	Confident	90.6	Very high	76 Å²	76	60.7 Å²	60.7	40%	0.398	37%	0.373	S	S	.	.			trans	-63.5	133.2	165.3	-63.5	-179.4	0	0	0	109.6	E159 L180 A278 I279 L283	E159-L276 HydrophobicContact CG-CB 4.43Å; E159-L276 HydrophobicContact CG-CD1 3.93Å; E159-L276 HydrophobicContact CG-CG 4.06Å; E159-L276 PolarHBondContact OE1-N 2.99Å; L180-L276 HydrophobicContact CD2-CD1 4.23Å; L276-A278 VanDerWaalsContact C-N 3.31Å; L276-I279 HydrophobicContact CB-CG1 4.38Å; L276-I279 HydrophobicContact CD1-CG1 4.25Å; L276-L283 HydrophobicContact CD1-CD2 4.24Å
277	A	77.8	Confident	90.8	Very high	98 Å²	98	56.1 Å²	56.1	81%	0.81	35%	0.354	S	S	*	.	S	Bend	trans	-61.9	-43.9	177	0	0	0	0	0	110.7	R275	R275-A277 PolarHBondContact O-N 3.37Å
278	A	87	Confident	91	Very high	80 Å²	80	58.2 Å²	58.2	66%	0.661	36%	0.361	S	S	*	.	S	Bend	trans	-143.1	145.7	167.9	0	0	0	0	0	109	L276	L276-A278 VanDerWaalsContact C-N 3.31Å
279	I	90.9	Very high	91.2	Very high	47 Å²	47	59.4 Å²	59.4	24%	0.241	37%	0.37	C	S	.	.			trans	-88.7	120.1	174.3	-59.2	178	0	0	0	107.5	A155 A156 E159 L276 L283 A284	A155-I279 WeakPolarHBondContact O-CD1 3.47Å; A156-I279 HydrophobicContact CB-CD1 4.31Å; E159-I279 HydrophobicContact CB-CD1 3.77Å; E159-I279 HydrophobicContact CG-CD1 4.22Å; L276-I279 HydrophobicContact CB-CG1 4.38Å; L276-I279 HydrophobicContact CD1-CG1 4.25Å; I279-L283 HydrophobicContact CG2-CB 4.12Å; I279-L283 HydrophobicContact CG2-CD2 4.24Å; I279-L283 HydrophobicContact CG2-CG 4.29Å; I279-A284 HydrophobicContact CG2-CB 3.99Å
280	P	95.2	Very high	91.5	Very high	77 Å²	77	59.5 Å²	59.5	50%	0.5	37%	0.365	S	S	.	.			trans	-55.4	142.6	177.1	-26	34.7	0	0	0	111.7	A282 L283 A284	P280-A282 PolarHBondContact O-N 2.99Å; P280-A282 VanDerWaalsContact O-N 3.17Å; P280-L283 HydrophobicContact CB-CB 4.28Å; P280-L283 WeakPolarHBondContact O-CA 3.36Å; P280-L283 WeakPolarHBondContact O-CB 3.35Å; P280-L283 PolarHBondContact O-N 3.11Å; P280-A284 PolarHBondContact O-N 2.95Å
281	A	96.4	Very high	91.8	Very high	65 Å²	65	58 Å²	58	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-36.5	-174.8	0	0	0	0	0	113.3	A284 R285	A281-A284 PolarHBondContact O-N 3.34Å; A281-R285 WeakPolarHBondContact O-CG 3.41Å; A281-R285 PolarHBondContact O-N 3.49Å
282	A	96.7	Very high	92.2	Very high	60 Å²	60	58.7 Å²	58.7	50%	0.496	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-44.2	175	0	0	0	0	0	112.1	P280 R285 A286	P280-A282 PolarHBondContact O-N 2.99Å; P280-A282 VanDerWaalsContact O-N 3.17Å; A282-R285 PolarHBondContact O-N 2.82Å; A282-A286 PolarHBondContact O-N 3.08Å
283	L	96.6	Very high	92.8	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-39.5	177.7	-166.6	64.9	0	0	0	111.4	L180 E181 L184 L276 I279 P280 A286 A287	L180-L283 HydrophobicContact CD2-CD2 4.02Å; L180-L283 HydrophobicContact CG-CD2 4.28Å; E181-L283 HydrophobicContact CB-CD1 4.1Å; E181-L283 HydrophobicContact CG-CD1 4.41Å; L184-L283 HydrophobicContact CB-CD1 4.15Å; L184-L283 HydrophobicContact CD1-CD1 3.53Å; L184-L283 HydrophobicContact CD1-CG 3.95Å; L184-L283 HydrophobicContact CG-CD1 4.43Å; L276-L283 HydrophobicContact CD1-CD2 4.24Å; I279-L283 HydrophobicContact CG2-CB 4.12Å; I279-L283 HydrophobicContact CG2-CD2 4.24Å; I279-L283 HydrophobicContact CG2-CG 4.29Å; P280-L283 HydrophobicContact CB-CB 4.28Å; P280-L283 WeakPolarHBondContact O-CA 3.36Å; P280-L283 WeakPolarHBondContact O-CB 3.35Å; P280-L283 PolarHBondContact O-N 3.11Å; L283-A286 PolarHBondContact O-N 3.35Å; L283-A287 WeakPolarHBondContact O-CB 3.35Å; L283-A287 PolarHBondContact O-N 3.25Å
284	A	97.9	Very high	93.5	Very high	21 Å²	21	50.4 Å²	50.4	17%	0.174	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.7	0	0	0	0	0	112	A155 I279 P280 A281 A286 A287 R288	A155-A284 HydrophobicContact CB-CB 3.85Å; I279-A284 HydrophobicContact CG2-CB 3.99Å; P280-A284 PolarHBondContact O-N 2.95Å; A281-A284 PolarHBondContact O-N 3.34Å; A284-A286 PolarHBondContact O-N 3.49Å; A284-A287 PolarHBondContact O-N 2.95Å; A284-R288 WeakPolarHBondContact O-CG 3.38Å; A284-R288 PolarHBondContact O-N 3.44Å
285	R	98.2	Very high	94.4	Very high	153 Å²	153	50.3 Å²	50.3	58%	0.577	30%	0.303	S	S	*	.	H	α-helix	trans	-62	-41.9	174	-73.6	-171.3	-58.1	-92.6	5.1	112.2	A281 A282 R288 T289	A281-R285 WeakPolarHBondContact O-CG 3.41Å; A281-R285 PolarHBondContact O-N 3.49Å; A282-R285 PolarHBondContact O-N 2.82Å; R285-R288 PolarHBondContact O-N 3.17Å; R285-T289 WeakPolarHBondContact O-CB 3.38Å; R285-T289 PolarHBondContact O-N 3.15Å; R285-T289 PolarHBondContact O-OG1 3.48Å
286	A	98.3	Very high	95	Very high	31 Å²	31	45.4 Å²	45.4	26%	0.256	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-45.3	176.3	0	0	0	0	0	111.4	L184 A282 L283 A284 R288 T289 W290	L184-A286 HydrophobicContact CB-CB 4.04Å; A282-A286 PolarHBondContact O-N 3.08Å; L283-A286 PolarHBondContact O-N 3.35Å; A284-A286 PolarHBondContact O-N 3.49Å; A286-R288 PolarHBondContact O-N 3.46Å; A286-T289 PolarHBondContact O-N 3.49Å; A286-W290 WeakPolarHBondContact O-CB 3.43Å; A286-W290 PolarHBondContact O-N 3.5Å
287	A	98.3	Very high	95.8	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-42.2	176.6	0	0	0	0	0	112.9	A155 F158 L184 L283 A284 N291	A155-A287 HydrophobicContact CB-CB 3.73Å; F158-A287 HydrophobicContact CD1-CB 4.35Å; L184-A287 HydrophobicContact CD1-CB 3.73Å; L184-A287 HydrophobicContact CD2-CB 4.22Å; L283-A287 WeakPolarHBondContact O-CB 3.35Å; L283-A287 PolarHBondContact O-N 3.25Å; A284-A287 PolarHBondContact O-N 2.95Å; A287-N291 WeakPolarHBondContact O-CB 3.35Å; A287-N291 PolarHBondContact O-N 3.23Å; A287-N291 PolarHBondContact O-ND2 2.91Å
288	R	98.1	Very high	96.8	Very high	59 Å²	59	37.9 Å²	37.9	22%	0.223	24%	0.235	C	C	.	.	H	α-helix	trans	-69.9	-34.4	176	-69.9	175.9	66.1	85.1	3.4	112.7	E153 A155 A284 R285 A286 N291 A292 A295 D299	E153-R288 WeakPolarHBondContact OE1-CD 3.35Å; E153-R288 IonicContact OE1-CZ 2.7Å; E153-R288 IonicContact OE1-NH1 3.57Å; E153-R288 PolarHBondContact OE1-NH1 3.25Å; A155-R288 HydrophobicContact CB-CG 4.48Å; A284-R288 WeakPolarHBondContact O-CG 3.38Å; A284-R288 PolarHBondContact O-N 3.44Å; R285-R288 PolarHBondContact O-N 3.17Å; A286-R288 PolarHBondContact O-N 3.46Å; R288-N291 CarbonylContact O-C 3.5Å; R288-A292 WeakPolarHBondContact O-CA 3.37Å; R288-A292 PolarHBondContact O-N 3.31Å; R288-A295 HydrophobicContact CB-CB 4.18Å; R288-D299 IonicContact CZ-OD1 3.9Å; R288-D299 IonicContact NH1-OD1 3.49Å; R288-D299 IonicContact NH2-OD1 3.23Å; R288-D299 PolarHBondContact NH2-OD1 2.88Å; R288-D299 IonicContact NH2-OD2 2.8Å; R288-D299 PolarHBondContact NH2-OD2 3.49Å
289	T	97.2	Very high	97.4	Very high	77 Å²	77	38 Å²	38	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-44.2	176.4	-60.3	0	0	0	0	110.7	R285 A286	R285-T289 WeakPolarHBondContact O-CB 3.38Å; R285-T289 PolarHBondContact O-N 3.15Å; R285-T289 PolarHBondContact O-OG1 3.48Å; A286-T289 PolarHBondContact O-N 3.49Å
290	W	97.8	Very high	97.7	Very high	30 Å²	30	38 Å²	38	11%	0.114	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-44.9	174.1	177.3	-115.6	0	0	0	111.4	F158 F183 L184 P187 E188 Y191 A201 H202 A286 A292	F158-W290 AromaticContact CZ-CD1 3.96Å; F183-W290 AromaticContact CE1-CD1 3.95Å; F183-W290 AromaticContact CE1-NE1 3.66Å; F183-W290 HydrophobicContact CZ-CZ2 4.47Å; F183-W290 AromaticContact CZ-NE1 3.9Å; L184-W290 HydrophobicContact CD2-CB 4.13Å; L184-W290 HydrophobicContact CD2-CG 4.42Å; P187-W290 HydrophobicContact CB-CD2 3.54Å; P187-W290 HydrophobicContact CB-CE3 3.5Å; P187-W290 HydrophobicContact CB-CG 4.22Å; P187-W290 HydrophobicContact CB-CH2 3.89Å; P187-W290 HydrophobicContact CB-CZ2 3.92Å; P187-W290 HydrophobicContact CB-CZ3 3.67Å; P187-W290 HydrophobicContact CG-CD2 3.7Å; P187-W290 HydrophobicContact CG-CE3 3.24Å; P187-W290 HydrophobicContact CG-CG 4.32Å; P187-W290 HydrophobicContact CG-CH2 4.33Å; P187-W290 HydrophobicContact CG-CZ3 3.6Å; E188-W290 HydrophobicContact CG-CZ3 4.34Å; Y191-W290 AromaticContact CD1-CH2 3.8Å; Y191-W290 HydrophobicContact CD1-CH2 3.8Å; Y191-W290 AromaticContact CD1-CZ2 3.91Å; Y191-W290 HydrophobicContact CD1-CZ2 3.91Å; Y191-W290 HydrophobicContact CD2-CZ2 4.03Å; Y191-W290 AromaticContact CG-CH2 3.81Å; Y191-W290 HydrophobicContact CG-CH2 3.81Å; Y191-W290 AromaticContact CG-CZ2 3.56Å; Y191-W290 HydrophobicContact CG-CZ2 3.56Å; A201-W290 PolarHBondContact O-NE1 2.88Å; H202-W290 HydrophobicContact CB-CZ2 3.85Å; H202-W290 AromaticContact CD2-CD2 3.82Å; H202-W290 AromaticContact CD2-CE2 3.45Å; H202-W290 VanDerWaalsContact CD2-CE2 3.45Å; H202-W290 AromaticContact CD2-CZ2 3.6Å; H202-W290 AromaticContact CD2-NE1 3.74Å; H202-W290 PolarHBondContact CD2-O 3.02Å; H202-W290 AromaticContact CG-CE2 3.96Å; H202-W290 AromaticContact CG-CZ2 3.73Å; H202-W290 PolarHBondContact NE2-O 2.95Å; H202-W290 VanDerWaalsContact NE2-O 3.08Å; A286-W290 WeakPolarHBondContact O-CB 3.43Å; A286-W290 PolarHBondContact O-N 3.5Å; W290-A292 PolarHBondContact O-N 3.43Å
291	N	97.8	Very high	97.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	55.8	178.2	-58.1	-77.6	0	0	0	112	F158 N203 A287 R288 L293 D294 A295	F158-N291 VanDerWaalsContact CD2-ND2 3.32Å; F158-N291 WeakPolarHBondContact CD2-ND2 3.23Å; F158-N291 WeakPolarHBondContact CG-ND2 3.38Å; N203-N291 PolarHBondContact N-OD1 3.49Å; N203-N291 WeakPolarHBondContact OD1-CA 3.35Å; N203-N291 PolarHBondContact OD1-O 3.39Å; A287-N291 WeakPolarHBondContact O-CB 3.35Å; A287-N291 PolarHBondContact O-N 3.23Å; A287-N291 PolarHBondContact O-ND2 2.91Å; R288-N291 CarbonylContact O-C 3.5Å; N291-L293 VanDerWaalsContact C-N 3.35Å; N291-L293 PolarHBondContact O-N 3.46Å; N291-D294 HydrophobicContact CB-CB 4.11Å; N291-D294 PolarHBondContact O-N 3.24Å; N291-A295 PolarHBondContact O-N 3.47Å
292	A	97.5	Very high	98	Very high	26 Å²	26	33.2 Å²	33.2	22%	0.215	19%	0.185	C	C	.	.	H	α-helix	trans	-63.5	-34.4	-171.2	0	0	0	0	0	114	N203 P217 R288 W290 A295 G296	N203-A292 PolarHBondContact OD1-N 3.23Å; P217-A292 HydrophobicContact CG-CB 3.86Å; R288-A292 WeakPolarHBondContact O-CA 3.37Å; R288-A292 PolarHBondContact O-N 3.31Å; W290-A292 PolarHBondContact O-N 3.43Å; A292-A295 PolarHBondContact O-N 2.92Å; A292-G296 PolarHBondContact O-N 3.25Å
293	L	97.8	Very high	98.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-46.5	175.2	-71.4	168.6	0	0	0	110.4	N203 A206 R215 P217 Y223 L224 N291 A295 G296 L297	N203-L293 HydrophobicContact CB-CB 4.09Å; N203-L293 HydrophobicContact CB-CD1 4.15Å; N203-L293 PolarHBondContact OD1-N 3.46Å; A206-L293 HydrophobicContact CB-CB 3.88Å; A206-L293 HydrophobicContact CB-CD1 4.03Å; R215-L293 HydrophobicContact CB-CD1 4.38Å; R215-L293 WeakPolarHBondContact O-CD1 3.3Å; P217-L293 HydrophobicContact CG-CD2 3.64Å; P217-L293 HydrophobicContact CG-CG 3.93Å; Y223-L293 HydrophobicContact CD1-CD2 3.77Å; Y223-L293 HydrophobicContact CE1-CD1 4.1Å; Y223-L293 HydrophobicContact CE1-CD2 3.98Å; L224-L293 HydrophobicContact CB-CD2 4.27Å; L224-L293 HydrophobicContact CD1-CD2 4.39Å; N291-L293 VanDerWaalsContact C-N 3.35Å; N291-L293 PolarHBondContact O-N 3.46Å; L293-A295 VanDerWaalsContact C-N 3.29Å; L293-A295 PolarHBondContact O-N 3.02Å; L293-G296 PolarHBondContact O-N 2.8Å; L293-L297 WeakPolarHBondContact O-CB 3.43Å; L293-L297 WeakPolarHBondContact O-CG 3.42Å; L293-L297 PolarHBondContact O-N 2.9Å
294	D	98.4	Very high	98.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-38.3	178.4	-71.5	6	0	0	0	111.2	P154 M157 N203 T204 L205 A206 N291 Y298	P154-D294 HydrophobicContact CB-CB 4.11Å; P154-D294 HydrophobicContact CG-CB 3.98Å; P154-D294 WeakPolarHBondContact CG-O 3.44Å; M157-D294 VanDerWaalsContact CE-OD2 3.28Å; M157-D294 WeakPolarHBondContact CE-OD2 3.47Å; N203-D294 VanDerWaalsContact C-OD1 3.23Å; N203-D294 WeakPolarHBondContact CA-OD1 3.34Å; N203-D294 WeakPolarHBondContact CA-OD2 3.32Å; N203-D294 PolarHBondContact OD1-N 3.27Å; T204-D294 PolarHBondContact N-OD2 3.18Å; L205-D294 HydrophobicContact CB-CB 4.33Å; L205-D294 WeakPolarHBondContact CB-OD1 3.45Å; L205-D294 HydrophobicContact CD1-CB 4.21Å; L205-D294 PolarHBondContact N-OD1 2.93Å; L205-D294 VanDerWaalsContact N-OD1 3.13Å; L205-D294 PolarHBondContact N-OD2 2.9Å; A206-D294 PolarHBondContact N-OD1 3.42Å; N291-D294 HydrophobicContact CB-CB 4.11Å; N291-D294 PolarHBondContact O-N 3.24Å; D294-Y298 VanDerWaalsContact O-CB 3.27Å; D294-Y298 WeakPolarHBondContact O-CB 3.28Å; D294-Y298 PolarHBondContact O-N 2.77Å
295	A	98.4	Very high	98.1	Very high	9 Å²	9	30.7 Å²	30.7	7%	0.074	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-49.4	173.4	0	0	0	0	0	112.2	R288 N291 A292 L293 Y298 D299	R288-A295 HydrophobicContact CB-CB 4.18Å; N291-A295 PolarHBondContact O-N 3.47Å; A292-A295 PolarHBondContact O-N 2.92Å; L293-A295 VanDerWaalsContact C-N 3.29Å; L293-A295 PolarHBondContact O-N 3.02Å; A295-Y298 PolarHBondContact O-N 3.27Å; A295-D299 WeakPolarHBondContact O-CB 3.3Å; A295-D299 PolarHBondContact O-N 3.49Å
296	G	97.7	Very high	98	Very high	19 Å²	19	26.3 Å²	26.3	20%	0.196	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-43.6	177.7	0	0	0	0	0	113.2	A292 L293 H300	A292-G296 PolarHBondContact O-N 3.25Å; L293-G296 PolarHBondContact O-N 2.8Å; G296-H300 PolarHBondContact O-N 2.92Å
297	L	98.3	Very high	97.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.2	-50.3	175.1	-73.5	166.7	0	0	0	111.1	A206 L209 L224 L227 I228 L293 D299 H300 F301	A206-L297 HydrophobicContact CB-CD1 3.98Å; L209-L297 HydrophobicContact CD1-CD1 3.91Å; L209-L297 HydrophobicContact CD1-CD2 4.46Å; L224-L297 HydrophobicContact CD1-CD2 4.3Å; L224-L297 HydrophobicContact CD1-CG 4.02Å; L227-L297 HydrophobicContact CD2-CD1 3.87Å; L227-L297 HydrophobicContact CD2-CD2 4.11Å; L227-L297 HydrophobicContact CD2-CG 4.4Å; L227-L297 HydrophobicContact CG-CD2 4.08Å; I228-L297 HydrophobicContact CG1-CD2 3.94Å; L293-L297 WeakPolarHBondContact O-CB 3.43Å; L293-L297 WeakPolarHBondContact O-CG 3.42Å; L293-L297 PolarHBondContact O-N 2.9Å; L297-D299 PolarHBondContact O-N 3.31Å; L297-H300 PolarHBondContact O-N 3.4Å; L297-F301 HydrophobicContact CD2-CE2 4.09Å; L297-F301 WeakPolarHBondContact O-CD2 3.42Å; L297-F301 PolarHBondContact O-N 3.32Å
298	Y	98.8	Very high	97.7	Very high	15 Å²	15	30.9 Å²	30.9	6%	0.059	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-45	-179.1	179.7	-94	0	0	0	111.9	L151 R152 E153 P154 I240 E242 D294 A295 H300 F301 N302	L151-Y298 HydrophobicContact CB-CD2 4.38Å; R152-Y298 VanDerWaalsContact O-CD2 3.3Å; R152-Y298 WeakPolarHBondContact O-CD2 3.47Å; E153-Y298 HydrophobicContact CB-CE1 4.1Å; E153-Y298 HydrophobicContact CB-CE2 4.13Å; E153-Y298 HydrophobicContact CG-CE1 3.95Å; P154-Y298 HydrophobicContact CG-CG 4.44Å; I240-Y298 HydrophobicContact CD1-CE2 4.26Å; I240-Y298 HydrophobicContact CG2-CE2 4.03Å; E242-Y298 PolarHBondContact OE2-OH 3.22Å; D294-Y298 VanDerWaalsContact O-CB 3.27Å; D294-Y298 WeakPolarHBondContact O-CB 3.28Å; D294-Y298 PolarHBondContact O-N 2.77Å; A295-Y298 PolarHBondContact O-N 3.27Å; Y298-H300 VanDerWaalsContact C-N 3.34Å; Y298-H300 PolarHBondContact O-N 3.37Å; Y298-F301 PolarHBondContact O-N 3.23Å; Y298-N302 HydrophobicContact CD1-CB 4.44Å; Y298-N302 HydrophobicContact CE1-CB 4.15Å; Y298-N302 WeakPolarHBondContact O-CB 3.47Å; Y298-N302 PolarHBondContact O-N 3.47Å
299	D	98.6	Very high	97.6	Very high	82 Å²	82	28.2 Å²	28.2	44%	0.439	15%	0.149	S	C	.	.	H	α-helix	trans	-61.2	-44.5	-178.8	-70	-10.5	0	0	0	111.4	R288 A295 L297 A303	R288-D299 IonicContact CZ-OD1 3.9Å; R288-D299 IonicContact NH1-OD1 3.49Å; R288-D299 IonicContact NH2-OD1 3.23Å; R288-D299 PolarHBondContact NH2-OD1 2.88Å; R288-D299 IonicContact NH2-OD2 2.8Å; R288-D299 PolarHBondContact NH2-OD2 3.49Å; A295-D299 WeakPolarHBondContact O-CB 3.3Å; A295-D299 PolarHBondContact O-N 3.49Å; L297-D299 PolarHBondContact O-N 3.31Å; D299-A303 WeakPolarHBondContact O-CB 3.42Å; D299-A303 PolarHBondContact O-N 3.13Å; D299-A303 VanDerWaalsContact O-N 3.14Å
300	H	98.4	Very high	97.4	Very high	49 Å²	49	26.9 Å²	26.9	23%	0.227	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-52.1	175.8	-177.9	81.5	0	0	0	111.8	I228 E232 G296 L297 Y298 A303 T304	I228-H300 HydrophobicContact CD1-CB 3.93Å; I228-H300 HydrophobicContact CG1-CB 4.39Å; I228-H300 WeakPolarHBondContact CG2-CD2 3.19Å; I228-H300 VanDerWaalsContact CG2-NE2 3.31Å; I228-H300 WeakPolarHBondContact CG2-NE2 3.39Å; E232-H300 VanDerWaalsContact CD-NE2 3.3Å; E232-H300 IonicContact OE1-CD2 2.69Å; E232-H300 IonicContact OE1-CE1 2.66Å; E232-H300 PolarHBondContact OE1-CE1 3.06Å; E232-H300 IonicContact OE1-NE2 2.68Å; E232-H300 PolarHBondContact OE1-NE2 3.26Å; E232-H300 IonicContact OE2-NE2 3.59Å; G296-H300 PolarHBondContact O-N 2.92Å; L297-H300 PolarHBondContact O-N 3.4Å; Y298-H300 VanDerWaalsContact C-N 3.34Å; Y298-H300 PolarHBondContact O-N 3.37Å; H300-A303 WeakPolarHBondContact O-CB 3.27Å; H300-A303 PolarHBondContact O-N 2.89Å; H300-T304 WeakPolarHBondContact NE2-CG2 3.42Å; H300-T304 WeakPolarHBondContact O-CG2 3.47Å; H300-T304 PolarHBondContact O-N 3.46Å
301	F	98.6	Very high	97	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-75.2	-27.4	-173.8	-75	-65.6	0	0	0	113.9	L151 I228 V231 E232 V238 L297 Y298 T304 F305	L151-F301 HydrophobicContact CD1-CB 3.77Å; L151-F301 HydrophobicContact CD1-CD2 3.77Å; L151-F301 HydrophobicContact CD1-CG 4.05Å; I228-F301 HydrophobicContact CG2-CZ 4.45Å; V231-F301 HydrophobicContact CB-CE1 4.48Å; V231-F301 HydrophobicContact CB-CE2 3.91Å; V231-F301 HydrophobicContact CB-CZ 3.54Å; V231-F301 HydrophobicContact CG1-CD2 4.48Å; V231-F301 HydrophobicContact CG1-CE1 3.86Å; V231-F301 HydrophobicContact CG1-CE2 3.6Å; V231-F301 HydrophobicContact CG1-CZ 3.25Å; E232-F301 HydrophobicContact CG-CE1 3.77Å; E232-F301 HydrophobicContact CG-CZ 3.94Å; V238-F301 HydrophobicContact CB-CB 4.27Å; V238-F301 HydrophobicContact CB-CD1 3.78Å; V238-F301 HydrophobicContact CB-CE1 4.48Å; V238-F301 HydrophobicContact CB-CG 4.13Å; V238-F301 HydrophobicContact CG1-CB 3.76Å; V238-F301 HydrophobicContact CG1-CD1 4.03Å; V238-F301 HydrophobicContact CG1-CG 3.84Å; V238-F301 HydrophobicContact CG2-CD1 3.52Å; V238-F301 HydrophobicContact CG2-CE1 3.73Å; V238-F301 HydrophobicContact CG2-CG 4.13Å; V238-F301 HydrophobicContact CG2-CZ 4.48Å; L297-F301 HydrophobicContact CD2-CE2 4.09Å; L297-F301 WeakPolarHBondContact O-CD2 3.42Å; L297-F301 PolarHBondContact O-N 3.32Å; Y298-F301 PolarHBondContact O-N 3.23Å; F301-T304 WeakPolarHBondContact CA-OG1 3.28Å; F301-T304 PolarHBondContact O-N 3.35Å; F301-T304 PolarHBondContact O-OG1 3.37Å; F301-F305 WeakPolarHBondContact O-CB 3.28Å; F301-F305 PolarHBondContact O-N 3.29Å
302	N	98.7	Very high	96.5	Very high	36 Å²	36	32 Å²	32	19%	0.193	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-41.9	167.5	179.5	53.7	0	0	0	110.7	I240 Y243 Y298 F305 W306	I240-N302 HydrophobicContact CD1-CB 4.3Å; Y243-N302 WeakPolarHBondContact CE2-OD1 3.28Å; Y298-N302 HydrophobicContact CD1-CB 4.44Å; Y298-N302 HydrophobicContact CE1-CB 4.15Å; Y298-N302 WeakPolarHBondContact O-CB 3.47Å; Y298-N302 PolarHBondContact O-N 3.47Å; N302-F305 WeakPolarHBondContact O-CB 3.43Å; N302-F305 PolarHBondContact O-N 3.23Å; N302-W306 VanDerWaalsContact O-CD1 3.23Å; N302-W306 PolarHBondContact O-N 2.96Å; N302-W306 VanDerWaalsContact O-N 3.09Å; N302-W306 PolarHBondContact OD1-NE1 3.09Å
303	A	98.3	Very high	96.2	Very high	38 Å²	38	32 Å²	32	31%	0.314	17%	0.17	S	C	.	.	H	α-helix	trans	-66.3	-42	175.4	0	0	0	0	0	112.2	D299 H300 F305 W306 R307	D299-A303 WeakPolarHBondContact O-CB 3.42Å; D299-A303 PolarHBondContact O-N 3.13Å; D299-A303 VanDerWaalsContact O-N 3.14Å; H300-A303 WeakPolarHBondContact O-CB 3.27Å; H300-A303 PolarHBondContact O-N 2.89Å; A303-F305 VanDerWaalsContact C-N 3.35Å; A303-W306 PolarHBondContact O-N 3.31Å; A303-R307 WeakPolarHBondContact O-CG 3.43Å; A303-R307 PolarHBondContact O-N 2.99Å; A303-R307 VanDerWaalsContact O-N 3.07Å; A303-R307 PolarHBondContact O-NH1 2.97Å
304	T	96.4	Very high	96	Very high	13 Å²	13	37.6 Å²	37.6	8%	0.08	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-38.2	175.3	66.8	0	0	0	0	111.7	H300 F301 R307 R308	H300-T304 WeakPolarHBondContact NE2-CG2 3.42Å; H300-T304 WeakPolarHBondContact O-CG2 3.47Å; H300-T304 PolarHBondContact O-N 3.46Å; F301-T304 WeakPolarHBondContact CA-OG1 3.28Å; F301-T304 PolarHBondContact O-N 3.35Å; F301-T304 PolarHBondContact O-OG1 3.37Å; T304-R307 WeakPolarHBondContact O-CB 3.03Å; T304-R307 PolarHBondContact O-N 3.33Å; T304-R308 WeakPolarHBondContact O-CG 3.47Å; T304-R308 PolarHBondContact O-N 3.29Å
305	F	97.9	Very high	95.8	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-51.8	174.6	174.7	-95.6	0	0	0	110.9	I240 Y243 E246 S247 L250 F301 N302 A303 R307 R308 V309	I240-F305 HydrophobicContact CB-CG 4.46Å; I240-F305 HydrophobicContact CG1-CB 3.79Å; I240-F305 HydrophobicContact CG1-CD1 4.16Å; I240-F305 HydrophobicContact CG1-CD2 4.06Å; I240-F305 HydrophobicContact CG1-CG 3.74Å; Y243-F305 HydrophobicContact CD2-CD1 4.19Å; Y243-F305 AromaticContact CD2-CE1 3.88Å; Y243-F305 HydrophobicContact CD2-CE1 3.88Å; Y243-F305 HydrophobicContact CG-CE1 4.03Å; E246-F305 HydrophobicContact CB-CZ 3.88Å; S247-F305 WeakPolarHBondContact OG-CE2 3.44Å; L250-F305 HydrophobicContact CD1-CD2 4.01Å; L250-F305 HydrophobicContact CD1-CE2 3.68Å; L250-F305 HydrophobicContact CD1-CZ 4.37Å; F301-F305 WeakPolarHBondContact O-CB 3.28Å; F301-F305 PolarHBondContact O-N 3.29Å; N302-F305 WeakPolarHBondContact O-CB 3.43Å; N302-F305 PolarHBondContact O-N 3.23Å; A303-F305 VanDerWaalsContact C-N 3.35Å; F305-R307 VanDerWaalsContact C-N 3.31Å; F305-R307 PolarHBondContact O-N 3.1Å; F305-R308 WeakPolarHBondContact O-CA 3.5Å; F305-R308 WeakPolarHBondContact O-CB 3.26Å; F305-R308 PolarHBondContact O-N 3.44Å; F305-V309 HydrophobicContact CD1-CG2 4.13Å; F305-V309 HydrophobicContact CE1-CG2 3.71Å; F305-V309 HydrophobicContact CE2-CG2 4.45Å; F305-V309 HydrophobicContact CZ-CG2 3.89Å; F305-V309 WeakPolarHBondContact O-CG2 3.38Å; F305-V309 PolarHBondContact O-N 2.91Å
306	W	97.8	Very high	95.4	Very high	61 Å²	61	40.9 Å²	40.9	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-29.9	178.9	-77.7	111.1	0	0	0	113.9	Y243 N302 A303 R308 V309 A310	Y243-W306 HydrophobicContact CD1-CH2 4.37Å; Y243-W306 AromaticContact CD1-CZ2 3.71Å; Y243-W306 HydrophobicContact CD1-CZ2 3.71Å; Y243-W306 HydrophobicContact CD2-CZ2 4.05Å; Y243-W306 AromaticContact CD2-NE1 3.93Å; Y243-W306 HydrophobicContact CE1-CH2 4.44Å; Y243-W306 AromaticContact CE1-CZ2 3.53Å; Y243-W306 HydrophobicContact CE1-CZ2 3.53Å; Y243-W306 AromaticContact CE2-CE2 3.93Å; Y243-W306 AromaticContact CE2-CZ2 3.91Å; Y243-W306 HydrophobicContact CE2-CZ2 3.91Å; Y243-W306 AromaticContact CE2-NE1 3.39Å; Y243-W306 AromaticContact CG-CZ2 3.97Å; Y243-W306 HydrophobicContact CG-CZ2 3.97Å; Y243-W306 AromaticContact CZ-CE2 3.98Å; Y243-W306 AromaticContact CZ-CZ2 3.63Å; Y243-W306 AromaticContact CZ-NE1 3.71Å; N302-W306 VanDerWaalsContact O-CD1 3.23Å; N302-W306 PolarHBondContact O-N 2.96Å; N302-W306 VanDerWaalsContact O-N 3.09Å; N302-W306 PolarHBondContact OD1-NE1 3.09Å; A303-W306 PolarHBondContact O-N 3.31Å; W306-R308 VanDerWaalsContact C-N 3.34Å; W306-V309 HydrophobicContact CE3-CB 3.96Å; W306-V309 HydrophobicContact CE3-CG1 4.02Å; W306-V309 HydrophobicContact CE3-CG2 4.13Å; W306-V309 HydrophobicContact CZ3-CB 4.35Å; W306-V309 HydrophobicContact CZ3-CG1 3.95Å; W306-V309 HydrophobicContact CZ3-CG2 4.41Å; W306-A310 WeakPolarHBondContact O-CB 3.25Å; W306-A310 PolarHBondContact O-N 3.41Å
307	R	95.6	Very high	95.3	Very high	96 Å²	96	40 Å²	40	36%	0.362	21%	0.208	S	C	.	.	H	α-helix	trans	-63.4	-39.4	168.4	-72.6	-171.5	-66.9	-88.5	12.5	111.7	A303 T304 F305 A310 R311	A303-R307 WeakPolarHBondContact O-CG 3.43Å; A303-R307 PolarHBondContact O-N 2.99Å; A303-R307 VanDerWaalsContact O-N 3.07Å; A303-R307 PolarHBondContact O-NH1 2.97Å; T304-R307 WeakPolarHBondContact O-CB 3.03Å; T304-R307 PolarHBondContact O-N 3.33Å; F305-R307 VanDerWaalsContact C-N 3.31Å; F305-R307 PolarHBondContact O-N 3.1Å; R307-A310 PolarHBondContact O-N 3.5Å; R307-R311 WeakPolarHBondContact O-CB 3.45Å; R307-R311 VanDerWaalsContact O-CG 3.3Å; R307-R311 WeakPolarHBondContact O-CG 3.45Å; R307-R311 PolarHBondContact O-N 3.02Å
308	R	93.5	Very high	95.1	Very high	35 Å²	35	44.4 Å²	44.4	13%	0.132	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-43.2	176.2	-69.7	159.7	170.8	-114.6	8.5	111.8	S236 L250 T304 F305 W306 A310 R311 A312	S236-R308 VanDerWaalsContact O-CZ 3.31Å; S236-R308 PolarHBondContact O-NH1 3.43Å; S236-R308 PolarHBondContact O-NH2 2.89Å; S236-R308 VanDerWaalsContact O-NH2 3.08Å; L250-R308 HydrophobicContact CD1-CB 4.18Å; T304-R308 WeakPolarHBondContact O-CG 3.47Å; T304-R308 PolarHBondContact O-N 3.29Å; F305-R308 WeakPolarHBondContact O-CA 3.5Å; F305-R308 WeakPolarHBondContact O-CB 3.26Å; F305-R308 PolarHBondContact O-N 3.44Å; W306-R308 VanDerWaalsContact C-N 3.34Å; R308-A310 VanDerWaalsContact C-N 3.31Å; R308-A310 PolarHBondContact O-N 2.91Å; R308-R311 PolarHBondContact O-N 2.98Å; R308-A312 WeakPolarHBondContact O-CB 3.28Å; R308-A312 PolarHBondContact O-N 2.9Å
309	V	95.1	Very high	95	Very high	2 Å²	2	49 Å²	49	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-45.7	172	176.9	0	0	0	0	110.6	L250 F305 W306 A312 G313 R314 V317	L250-V309 HydrophobicContact CD1-CG2 4.04Å; F305-V309 HydrophobicContact CD1-CG2 4.13Å; F305-V309 HydrophobicContact CE1-CG2 3.71Å; F305-V309 HydrophobicContact CE2-CG2 4.45Å; F305-V309 HydrophobicContact CZ-CG2 3.89Å; F305-V309 WeakPolarHBondContact O-CG2 3.38Å; F305-V309 PolarHBondContact O-N 2.91Å; W306-V309 HydrophobicContact CE3-CB 3.96Å; W306-V309 HydrophobicContact CE3-CG1 4.02Å; W306-V309 HydrophobicContact CE3-CG2 4.13Å; W306-V309 HydrophobicContact CZ3-CB 4.35Å; W306-V309 HydrophobicContact CZ3-CG1 3.95Å; W306-V309 HydrophobicContact CZ3-CG2 4.41Å; V309-A312 PolarHBondContact O-N 2.9Å; V309-G313 CarbonylContact O-C 3.53Å; V309-G313 PolarHBondContact O-N 2.9Å; V309-R314 HydrophobicContact CG1-CG 4.14Å; V309-R314 PolarHBondContact O-N 3.23Å; V309-V317 HydrophobicContact CG1-CB 4.1Å; V309-V317 HydrophobicContact CG1-CG1 4.16Å; V309-V317 HydrophobicContact CG1-CG2 4.21Å
310	A	93.8	Very high	94.9	Very high	49 Å²	49	45.6 Å²	45.6	41%	0.405	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-44.4	177.9	0	0	0	0	0	112.5	W306 R307 R308 G313	W306-A310 WeakPolarHBondContact O-CB 3.25Å; W306-A310 PolarHBondContact O-N 3.41Å; R307-A310 PolarHBondContact O-N 3.5Å; R308-A310 VanDerWaalsContact C-N 3.31Å; R308-A310 PolarHBondContact O-N 2.91Å; A310-G313 PolarHBondContact O-N 2.74Å; A310-G313 VanDerWaalsContact O-N 3.16Å
311	R	89.4	Confident	94.8	Very high	131 Å²	131	43.3 Å²	43.3	49%	0.494	22%	0.217	S	C	.	.	H	α-helix	trans	-63.1	-40.7	176	-73.7	173	-178.5	178.3	-1.5	112.7	R307 R308 G313	R307-R311 WeakPolarHBondContact O-CB 3.45Å; R307-R311 VanDerWaalsContact O-CG 3.3Å; R307-R311 WeakPolarHBondContact O-CG 3.45Å; R307-R311 PolarHBondContact O-N 3.02Å; R308-R311 PolarHBondContact O-N 2.98Å; R311-G313 PolarHBondContact O-N 2.79Å
312	A	87.5	Confident	94.8	Very high	8 Å²	8	49.1 Å²	49.1	7%	0.066	24%	0.239	C	C	.	.	H	α-helix	trans	-69.6	-23.3	175.3	0	0	0	0	0	113	C51 L250 R308 V309 V317	C51-A312 PolarHBondContact N-O 2.93Å; C51-A312 PolarHBondContact SG-O 3.43Å; L250-A312 HydrophobicContact CD2-CB 4.18Å; R308-A312 WeakPolarHBondContact O-CB 3.28Å; R308-A312 PolarHBondContact O-N 2.9Å; V309-A312 PolarHBondContact O-N 2.9Å; A312-V317 HydrophobicContact CB-CG2 3.93Å
313	G	91.6	Very high	94.7	Very high	26 Å²	26	51.3 Å²	51.3	27%	0.268	25%	0.248	S	C	.	.			trans	102.6	108.4	-175.9	0	0	0	0	0	111.6	V309 A310 R311 A315 C316 V317	V309-G313 CarbonylContact O-C 3.53Å; V309-G313 PolarHBondContact O-N 2.9Å; A310-G313 PolarHBondContact O-N 2.74Å; A310-G313 VanDerWaalsContact O-N 3.16Å; R311-G313 PolarHBondContact O-N 2.79Å; G313-A315 PolarHBondContact O-N 2.95Å; G313-C316 VanDerWaalsContact O-CB 3.31Å; G313-C316 WeakPolarHBondContact O-CB 3.2Å; G313-C316 PolarHBondContact O-N 2.95Å; G313-V317 PolarHBondContact O-N 3.48Å
314	R	93.8	Very high	94.7	Very high	116 Å²	116	49.5 Å²	49.5	44%	0.438	23%	0.233	S	C	.	.	H	α-helix	trans	-53.6	-54.9	-175.2	-67.7	-178.9	174.7	-91.5	0.1	113.2	V309 C316 V317 E318	V309-R314 HydrophobicContact CG1-CG 4.14Å; V309-R314 PolarHBondContact O-N 3.23Å; R314-C316 PolarHBondContact O-N 2.75Å; R314-V317 PolarHBondContact O-N 3.46Å; R314-V317 VanDerWaalsContact O-N 3.13Å; R314-E318 WeakPolarHBondContact O-CG 3.44Å; R314-E318 PolarHBondContact O-N 3.32Å
315	A	92.9	Very high	94.8	Very high	71 Å²	71	53.6 Å²	53.6	59%	0.587	25%	0.247	S	C	*	.	H	α-helix	trans	-59.8	-30.4	179.9	0	0	0	0	0	113	G313 R319	G313-A315 PolarHBondContact O-N 2.95Å; A315-R319 WeakPolarHBondContact O-CB 3.47Å; A315-R319 PolarHBondContact O-N 3.45Å; A315-R319 VanDerWaalsContact O-N 3.15Å
316	C	90.6	Very high	94.8	Very high	8 Å²	8	57.7 Å²	57.7	5%	0.054	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-49.9	175.2	-178.6	0	0	0	0	111.8	C51 G313 R314 E318 R319 E320	C51-C316 HydrophobicContact CB-CB 3.31Å; C51-C316 WeakPolarHBondContact CB-SG 3.17Å; C51-C316 WeakPolarHBondContact SG-CB 3.37Å; C51-C316 CovalentContact SG-SG 2.02Å; C51-C316 PolarHBondContact SG-SG 3.2Å; G313-C316 VanDerWaalsContact O-CB 3.31Å; G313-C316 WeakPolarHBondContact O-CB 3.2Å; G313-C316 PolarHBondContact O-N 2.95Å; R314-C316 PolarHBondContact O-N 2.75Å; C316-E318 VanDerWaalsContact C-N 3.28Å; C316-E318 PolarHBondContact O-N 3.16Å; C316-R319 PolarHBondContact O-N 2.98Å; C316-R319 VanDerWaalsContact O-N 3.15Å; C316-R319 PolarHBondContact SG-NH2 3.34Å; C316-E320 PolarHBondContact O-N 2.85Å; C316-E320 PolarHBondContact SG-OE1 3.25Å
317	V	94.8	Very high	94.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.8	-42.4	178.8	174.9	0	0	0	0	110.4	E246 V249 L250 V309 A312 G313 R314 R319 E320 A321	E246-V317 HydrophobicContact CB-CG1 3.96Å; E246-V317 HydrophobicContact CG-CG1 3.99Å; V249-V317 HydrophobicContact CB-CG1 4.37Å; V249-V317 HydrophobicContact CG1-CB 4.49Å; V249-V317 HydrophobicContact CG1-CG1 4.09Å; V249-V317 HydrophobicContact CG1-CG2 4.43Å; L250-V317 HydrophobicContact CD2-CG2 4.34Å; V309-V317 HydrophobicContact CG1-CB 4.1Å; V309-V317 HydrophobicContact CG1-CG1 4.16Å; V309-V317 HydrophobicContact CG1-CG2 4.21Å; A312-V317 HydrophobicContact CB-CG2 3.93Å; G313-V317 PolarHBondContact O-N 3.48Å; R314-V317 PolarHBondContact O-N 3.46Å; R314-V317 VanDerWaalsContact O-N 3.13Å; V317-R319 VanDerWaalsContact C-N 3.34Å; V317-R319 PolarHBondContact O-N 3.43Å; V317-E320 PolarHBondContact O-N 3.08Å; V317-A321 VanDerWaalsContact O-CB 3.24Å; V317-A321 WeakPolarHBondContact O-CB 3.26Å; V317-A321 PolarHBondContact O-N 3.33Å
318	E	95.9	Very high	94.9	Very high	93 Å²	93	52.1 Å²	52.1	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-39.8	176.1	-73.6	168.8	-163.1	0	0	112.8	R314 C316 R322	R314-E318 WeakPolarHBondContact O-CG 3.44Å; R314-E318 PolarHBondContact O-N 3.32Å; C316-E318 VanDerWaalsContact C-N 3.28Å; C316-E318 PolarHBondContact O-N 3.16Å; E318-R322 PolarHBondContact O-N 3.07Å
319	R	95.7	Very high	95	Very high	111 Å²	111	55 Å²	55	42%	0.419	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-50.5	175.3	-174.8	-172.4	63.1	-102.3	-6.1	111.3	A315 C316 V317 A321 R322 E323	A315-R319 WeakPolarHBondContact O-CB 3.47Å; A315-R319 PolarHBondContact O-N 3.45Å; A315-R319 VanDerWaalsContact O-N 3.15Å; C316-R319 PolarHBondContact O-N 2.98Å; C316-R319 VanDerWaalsContact O-N 3.15Å; C316-R319 PolarHBondContact SG-NH2 3.34Å; V317-R319 VanDerWaalsContact C-N 3.34Å; V317-R319 PolarHBondContact O-N 3.43Å; R319-A321 VanDerWaalsContact C-N 3.26Å; R319-A321 PolarHBondContact O-N 2.82Å; R319-R322 WeakPolarHBondContact O-CA 3.2Å; R319-R322 VanDerWaalsContact O-CB 3.3Å; R319-R322 WeakPolarHBondContact O-CB 3.28Å; R319-R322 PolarHBondContact O-N 3.16Å; R319-E323 WeakPolarHBondContact CG-OE1 3.11Å; R319-E323 IonicContact NE-OE1 3.96Å; R319-E323 WeakPolarHBondContact O-CG 3.17Å; R319-E323 PolarHBondContact O-N 2.86Å
320	E	95.9	Very high	95.1	Very high	11 Å²	11	62 Å²	62	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-35.8	177.6	-70.5	-169.3	-140.6	0	0	111.9	V249 R252 R253 C316 V317 R322 E323 L324	V249-E320 HydrophobicContact CB-CB 4.48Å; V249-E320 HydrophobicContact CG1-CB 3.81Å; V249-E320 HydrophobicContact CG1-CG 4.48Å; V249-E320 HydrophobicContact CG2-CB 3.75Å; R252-E320 IonicContact CZ-OE2 2.85Å; R252-E320 IonicContact NE-OE2 3.45Å; R252-E320 IonicContact NH2-OE2 3.33Å; R252-E320 PolarHBondContact NH2-OE2 3.41Å; R253-E320 IonicContact CZ-OE1 2.81Å; R253-E320 IonicContact NH1-OE1 3.82Å; R253-E320 PolarHBondContact NH1-OE1 2.99Å; C316-E320 PolarHBondContact O-N 2.85Å; C316-E320 PolarHBondContact SG-OE1 3.25Å; V317-E320 PolarHBondContact O-N 3.08Å; E320-R322 VanDerWaalsContact C-N 3.32Å; E320-R322 PolarHBondContact O-N 3.5Å; E320-E323 PolarHBondContact O-N 3.06Å; E320-L324 WeakPolarHBondContact O-CB 3.26Å; E320-L324 PolarHBondContact O-N 3.19Å
321	A	97.6	Very high	95.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-32.2	175.2	0	0	0	0	0	112	D245 E246 V249 V317 R319 R325	D245-A321 HydrophobicContact CB-CB 4.2Å; E246-A321 HydrophobicContact CG-CB 4.32Å; V249-A321 HydrophobicContact CG2-CB 4.12Å; V317-A321 VanDerWaalsContact O-CB 3.24Å; V317-A321 WeakPolarHBondContact O-CB 3.26Å; V317-A321 PolarHBondContact O-N 3.33Å; R319-A321 VanDerWaalsContact C-N 3.26Å; R319-A321 PolarHBondContact O-N 2.82Å; A321-R325 VanDerWaalsContact O-CG 3.31Å; A321-R325 WeakPolarHBondContact O-CG 3.23Å; A321-R325 PolarHBondContact O-N 3.21Å; A321-R325 PolarHBondContact O-NE 3.06Å
322	R	97.9	Very high	95.5	Very high	127 Å²	127	54.7 Å²	54.7	48%	0.479	25%	0.252	S	S	.	.	H	α-helix	trans	-67.8	-48.4	171.4	-167	-168	-41.6	-81.5	-9.1	111.2	E318 R319 E320 L324 R325 E326	E318-R322 PolarHBondContact O-N 3.07Å; R319-R322 WeakPolarHBondContact O-CA 3.2Å; R319-R322 VanDerWaalsContact O-CB 3.3Å; R319-R322 WeakPolarHBondContact O-CB 3.28Å; R319-R322 PolarHBondContact O-N 3.16Å; E320-R322 VanDerWaalsContact C-N 3.32Å; E320-R322 PolarHBondContact O-N 3.5Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 3.17Å; R322-R325 WeakPolarHBondContact O-CB 3.47Å; R322-R325 PolarHBondContact O-N 2.79Å; R322-R325 VanDerWaalsContact O-N 3.09Å; R322-E326 WeakPolarHBondContact O-CG 3.37Å; R322-E326 PolarHBondContact O-N 3.01Å
323	E	97.3	Very high	95.8	Very high	81 Å²	81	60.2 Å²	60.2	38%	0.379	27%	0.271	S	S	.	.	H	α-helix	trans	-56.9	-42.7	175.8	-68.9	167.2	-165.4	0	0	111.3	R319 E320 E326 A327	R319-E323 WeakPolarHBondContact CG-OE1 3.11Å; R319-E323 IonicContact NE-OE1 3.96Å; R319-E323 WeakPolarHBondContact O-CG 3.17Å; R319-E323 PolarHBondContact O-N 2.86Å; E320-E323 PolarHBondContact O-N 3.06Å; E323-E326 PolarHBondContact O-N 3.08Å; E323-A327 VanDerWaalsContact O-CB 3.3Å; E323-A327 WeakPolarHBondContact O-CB 3.13Å; E323-A327 PolarHBondContact O-N 2.82Å
324	L	98	Very high	95.8	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-46.9	173.6	178.7	66	0	0	0	112.2	D245 L248 L259 V262 L263 E320 R322 E326 A327 R328	D245-L324 HydrophobicContact CB-CD2 4.2Å; L248-L324 HydrophobicContact CB-CD2 3.84Å; L248-L324 HydrophobicContact CD1-CD2 4.17Å; L259-L324 HydrophobicContact CD1-CB 4.07Å; L259-L324 HydrophobicContact CD1-CD1 3.71Å; V262-L324 HydrophobicContact CG2-CD1 3.91Å; L263-L324 HydrophobicContact CD2-CD1 3.86Å; E320-L324 WeakPolarHBondContact O-CB 3.26Å; E320-L324 PolarHBondContact O-N 3.19Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 3.17Å; L324-E326 PolarHBondContact O-N 3.43Å; L324-A327 PolarHBondContact O-N 3.3Å; L324-R328 WeakPolarHBondContact O-CB 3.3Å; L324-R328 PolarHBondContact O-N 3.37Å
325	R	98.1	Very high	95.8	Very high	99 Å²	99	61.8 Å²	61.8	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-43.4	178.1	-78.2	-179.4	-70.2	166.7	-5.1	112	D245 A321 R322 R328 Q329	D245-R325 WeakPolarHBondContact OD2-CD 3.3Å; D245-R325 WeakPolarHBondContact OD2-CG 3.48Å; A321-R325 VanDerWaalsContact O-CG 3.31Å; A321-R325 WeakPolarHBondContact O-CG 3.23Å; A321-R325 PolarHBondContact O-N 3.21Å; A321-R325 PolarHBondContact O-NE 3.06Å; R322-R325 WeakPolarHBondContact O-CB 3.47Å; R322-R325 PolarHBondContact O-N 2.79Å; R322-R325 VanDerWaalsContact O-N 3.09Å; R325-R328 PolarHBondContact O-N 2.75Å; R325-Q329 WeakPolarHBondContact O-CG 3.45Å; R325-Q329 PolarHBondContact O-N 3.34Å
326	E	98.1	Very high	95.8	Very high	85 Å²	85	59.4 Å²	59.4	40%	0.397	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-46.9	178.1	-69.5	171.9	-166.6	0	0	111.8	R322 E323 L324 R328 Q329 R330	R322-E326 WeakPolarHBondContact O-CG 3.37Å; R322-E326 PolarHBondContact O-N 3.01Å; E323-E326 PolarHBondContact O-N 3.08Å; L324-E326 PolarHBondContact O-N 3.43Å; E326-R328 VanDerWaalsContact C-N 3.32Å; E326-R328 PolarHBondContact O-N 3.23Å; E326-Q329 PolarHBondContact O-N 3.17Å; E326-R330 PolarHBondContact O-N 3.4Å
327	A	98.1	Very high	95.7	Very high	8 Å²	8	60.4 Å²	60.4	7%	0.066	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-41.1	176.3	0	0	0	0	0	111.8	L259 L263 E323 L324 R330 L331	L259-A327 HydrophobicContact CD2-CB 3.75Å; L259-A327 HydrophobicContact CG-CB 4.36Å; L263-A327 HydrophobicContact CD2-CB 3.77Å; E323-A327 VanDerWaalsContact O-CB 3.3Å; E323-A327 WeakPolarHBondContact O-CB 3.13Å; E323-A327 PolarHBondContact O-N 2.82Å; L324-A327 PolarHBondContact O-N 3.3Å; A327-R330 PolarHBondContact O-N 2.96Å; A327-L331 PolarHBondContact O-N 3.2Å
328	R	97.6	Very high	95.2	Very high	33 Å²	33	66.9 Å²	66.9	13%	0.125	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-46.4	173	178.9	-178.1	133.9	-97.6	-15.3	111.4	L263 Y264 L324 R325 E326 R330 L331 L332	L263-R328 HydrophobicContact CD2-CB 4.35Å; Y264-R328 WeakPolarHBondContact O-CD 3.41Å; Y264-R328 VanDerWaalsContact O-CG 3.3Å; Y264-R328 WeakPolarHBondContact O-CG 3.15Å; L324-R328 WeakPolarHBondContact O-CB 3.3Å; L324-R328 PolarHBondContact O-N 3.37Å; R325-R328 PolarHBondContact O-N 2.75Å; E326-R328 VanDerWaalsContact C-N 3.32Å; E326-R328 PolarHBondContact O-N 3.23Å; R328-R330 VanDerWaalsContact C-N 3.34Å; R328-R330 PolarHBondContact O-N 2.76Å; R328-L331 PolarHBondContact O-N 3.3Å; R328-L332 HydrophobicContact CG-CD1 4.11Å; R328-L332 HydrophobicContact CG-CG 4.29Å; R328-L332 VanDerWaalsContact O-CG 3.32Å; R328-L332 WeakPolarHBondContact O-CG 3.42Å; R328-L332 PolarHBondContact O-N 3.02Å
329	Q	96.4	Very high	94.7	Very high	94 Å²	94	70.4 Å²	70.4	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-43.9	177.7	-76.2	176	1	0	0	111.8	R325 E326 L331 L332 R333	R325-Q329 WeakPolarHBondContact O-CG 3.45Å; R325-Q329 PolarHBondContact O-N 3.34Å; E326-Q329 PolarHBondContact O-N 3.17Å; Q329-L331 PolarHBondContact O-N 3.19Å; Q329-L332 PolarHBondContact O-N 3.03Å; Q329-R333 WeakPolarHBondContact O-CG 3.27Å; Q329-R333 PolarHBondContact O-N 3.3Å
330	R	96.2	Very high	94.3	Very high	150 Å²	150	67.1 Å²	67.1	57%	0.566	30%	0.302	S	S	*	.	H	α-helix	trans	-59.8	-45	175	-69.6	-172	-66.2	-91	3.4	111.9	E326 A327 R328 R333 R334	E326-R330 PolarHBondContact O-N 3.4Å; A327-R330 PolarHBondContact O-N 2.96Å; R328-R330 VanDerWaalsContact C-N 3.34Å; R328-R330 PolarHBondContact O-N 2.76Å; R330-R333 PolarHBondContact O-N 3.18Å; R330-R334 PolarHBondContact O-N 3.49Å
331	L	95.8	Very high	94	Very high	19 Å²	19	70.6 Å²	70.6	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-45.7	176.8	177.4	63.8	0	0	0	112	L263 A327 R328 Q329 R333 R334 C335 L384	L263-L331 HydrophobicContact CB-CD2 3.62Å; L263-L331 HydrophobicContact CD1-CB 4.39Å; L263-L331 HydrophobicContact CD1-CD2 3.91Å; L263-L331 HydrophobicContact CG-CD2 4.38Å; A327-L331 PolarHBondContact O-N 3.2Å; R328-L331 PolarHBondContact O-N 3.3Å; Q329-L331 PolarHBondContact O-N 3.19Å; L331-R333 PolarHBondContact O-N 2.88Å; L331-R334 PolarHBondContact O-N 2.85Å; L331-C335 WeakPolarHBondContact O-CB 3.49Å; L331-C335 PolarHBondContact O-N 3.48Å; L331-L384 HydrophobicContact CD1-CD2 4.33Å; L331-L384 HydrophobicContact CD2-CD1 3.94Å; L331-L384 HydrophobicContact CD2-CD2 3.66Å; L331-L384 HydrophobicContact CD2-CG 4.47Å; L331-L384 HydrophobicContact CG-CD2 3.76Å
332	L	95.7	Very high	93.8	Very high	8 Å²	8	73 Å²	73	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-41.1	179.6	-68.3	179.4	0	0	0	111.5	A265 R328 Q329 C335 F336 P340 Y367 L384	A265-L332 HydrophobicContact CB-CD2 3.88Å; R328-L332 HydrophobicContact CG-CD1 4.11Å; R328-L332 HydrophobicContact CG-CG 4.29Å; R328-L332 VanDerWaalsContact O-CG 3.32Å; R328-L332 WeakPolarHBondContact O-CG 3.42Å; R328-L332 PolarHBondContact O-N 3.02Å; Q329-L332 PolarHBondContact O-N 3.03Å; L332-C335 PolarHBondContact O-N 3.4Å; L332-F336 HydrophobicContact CB-CD2 4.37Å; L332-F336 HydrophobicContact CD2-CD2 3.77Å; L332-F336 HydrophobicContact CD2-CE2 3.58Å; L332-F336 WeakPolarHBondContact O-CB 3.4Å; L332-F336 WeakPolarHBondContact O-CD2 3.49Å; L332-F336 PolarHBondContact O-N 2.98Å; L332-P340 VanDerWaalsContact C-CG 3.49Å; L332-P340 HydrophobicContact CB-CB 4.02Å; L332-P340 HydrophobicContact CB-CG 3.75Å; L332-P340 WeakPolarHBondContact O-CG 3.31Å; L332-Y367 HydrophobicContact CD2-CE1 4.39Å; L332-L384 HydrophobicContact CD2-CD2 4.37Å
333	R	94.2	Very high	93.6	Very high	123 Å²	123	72.5 Å²	72.5	46%	0.464	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-46.3	175.7	-71	-175.2	-135.5	-120.6	7.1	112.1	Q329 R330 L331 C335 G337 P340	Q329-R333 WeakPolarHBondContact O-CG 3.27Å; Q329-R333 PolarHBondContact O-N 3.3Å; R330-R333 PolarHBondContact O-N 3.18Å; L331-R333 PolarHBondContact O-N 2.88Å; R333-C335 VanDerWaalsContact C-N 3.26Å; R333-C335 PolarHBondContact O-N 3.36Å; R333-G337 VanDerWaalsContact CA-O 3.25Å; R333-G337 WeakPolarHBondContact CA-O 3.18Å; R333-G337 CarbonylContact O-C 3.43Å; R333-G337 WeakPolarHBondContact O-CA 3.31Å; R333-G337 PolarHBondContact O-N 3.03Å; R333-P340 HydrophobicContact CG-CG 4.18Å
334	R	92.3	Very high	93.4	Very high	173 Å²	173	70.4 Å²	70.4	65%	0.653	33%	0.328	S	S	*	.	H	α-helix	trans	-59	-37.3	176.4	-167.6	-177.5	78.5	-172.5	4.3	112.6	R330 L331	R330-R334 PolarHBondContact O-N 3.49Å; L331-R334 PolarHBondContact O-N 2.85Å
335	C	92.9	Very high	93.1	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.02	33%	0.332	C	S	.	.	H	α-helix	trans	-86.1	-33.7	-175.9	-76.4	0	0	0	0	114.7	L331 L332 R333 P370 C381 L384	L331-C335 WeakPolarHBondContact O-CB 3.49Å; L331-C335 PolarHBondContact O-N 3.48Å; L332-C335 PolarHBondContact O-N 3.4Å; R333-C335 VanDerWaalsContact C-N 3.26Å; R333-C335 PolarHBondContact O-N 3.36Å; C335-P370 WeakPolarHBondContact O-CD 3.44Å; C335-C381 WeakPolarHBondContact CA-SG 3.37Å; C335-C381 HydrophobicContact CB-CB 3.53Å; C335-C381 WeakPolarHBondContact CB-SG 3.36Å; C335-C381 VanDerWaalsContact SG-CA 3.52Å; C335-C381 WeakPolarHBondContact SG-CB 3.36Å; C335-C381 CovalentContact SG-SG 2.04Å; C335-C381 PolarHBondContact SG-SG 3.18Å; C335-L384 HydrophobicContact CB-CD2 4.48Å
336	F	92	Very high	92.8	Very high	20 Å²	20	71 Å²	71	9%	0.088	35%	0.354	C	S	.	.	H	α-helix	trans	-129.9	11.6	-164.8	-50.4	-59.2	0	0	0	113.5	A265 L332 P340 Y367 D368 L369 L384 A385	A265-F336 HydrophobicContact CB-CE2 4.46Å; L332-F336 HydrophobicContact CB-CD2 4.37Å; L332-F336 HydrophobicContact CD2-CD2 3.77Å; L332-F336 HydrophobicContact CD2-CE2 3.58Å; L332-F336 WeakPolarHBondContact O-CB 3.4Å; L332-F336 WeakPolarHBondContact O-CD2 3.49Å; L332-F336 PolarHBondContact O-N 2.98Å; F336-P340 HydrophobicContact CB-CB 4.08Å; F336-Y367 HydrophobicContact CB-CD1 4.31Å; F336-Y367 HydrophobicContact CD1-CD1 4.36Å; F336-Y367 HydrophobicContact CD1-CG 4.34Å; F336-Y367 AromaticContact CD2-CD1 3.58Å; F336-Y367 HydrophobicContact CD2-CD1 3.58Å; F336-Y367 HydrophobicContact CD2-CE1 4.08Å; F336-Y367 AromaticContact CD2-CG 3.99Å; F336-Y367 HydrophobicContact CD2-CG 3.99Å; F336-Y367 HydrophobicContact CE1-CG 4.28Å; F336-Y367 AromaticContact CE2-CD1 3.96Å; F336-Y367 HydrophobicContact CE2-CD1 3.96Å; F336-Y367 HydrophobicContact CE2-CD2 4.4Å; F336-Y367 HydrophobicContact CE2-CE1 4.45Å; F336-Y367 AromaticContact CE2-CG 3.92Å; F336-Y367 HydrophobicContact CE2-CG 3.92Å; F336-Y367 AromaticContact CG-CD1 3.82Å; F336-Y367 HydrophobicContact CG-CD1 3.82Å; F336-Y367 HydrophobicContact CG-CG 4.21Å; F336-Y367 HydrophobicContact CZ-CG 4.1Å; F336-D368 WeakPolarHBondContact CD1-O 3.46Å; F336-L369 HydrophobicContact CD1-CD2 4.18Å; F336-L369 HydrophobicContact CE1-CD2 3.84Å; F336-L384 HydrophobicContact CE2-CD2 4.02Å; F336-L384 HydrophobicContact CZ-CD2 4.26Å; F336-A385 HydrophobicContact CE1-CB 3.94Å; F336-A385 HydrophobicContact CZ-CB 3.62Å
337	G	88.4	Confident	92.6	Very high	30 Å²	30	72.3 Å²	72.3	31%	0.309	36%	0.36	S	S	.	.			trans	90.8	170.3	-179.3	0	0	0	0	0	113.4	R333 E339 P340	R333-G337 VanDerWaalsContact CA-O 3.25Å; R333-G337 WeakPolarHBondContact CA-O 3.18Å; R333-G337 CarbonylContact O-C 3.43Å; R333-G337 WeakPolarHBondContact O-CA 3.31Å; R333-G337 PolarHBondContact O-N 3.03Å; G337-E339 PolarHBondContact O-N 3.22Å; G337-E339 VanDerWaalsContact O-N 3.09Å; G337-P340 VanDerWaalsContact O-CD 3.29Å; G337-P340 WeakPolarHBondContact O-CD 3.27Å; G337-P340 WeakPolarHBondContact O-CG 3.32Å
338	D	84.9	Confident	92.3	Very high	136 Å²	136	72 Å²	72	73%	0.727	36%	0.357	S	S	*	.	S	Bend	trans	-57.5	-29.4	-172	-66.4	-39.4	0	0	0	114.2	P340	D338-P340 WeakPolarHBondContact O-CD 3.48Å
339	E	85.8	Confident	92	Very high	166 Å²	166	78.7 Å²	78.7	78%	0.776	38%	0.382	S	S	*	.	S	Bend	trans	-118.8	87.8	172.4	-64	-169.6	172.6	0	0	111	G337 V341	G337-E339 PolarHBondContact O-N 3.22Å; G337-E339 VanDerWaalsContact O-N 3.09Å; E339-V341 PolarHBondContact O-N 3.37Å
340	P	87.6	Confident	91.6	Very high	43 Å²	43	75.6 Å²	75.6	28%	0.279	37%	0.37	S	S	.	.			trans	-66.8	106.5	177.9	-22.4	34.7	0	0	0	111.4	L332 R333 F336 G337 D338 Y367	L332-P340 VanDerWaalsContact C-CG 3.49Å; L332-P340 HydrophobicContact CB-CB 4.02Å; L332-P340 HydrophobicContact CB-CG 3.75Å; L332-P340 WeakPolarHBondContact O-CG 3.31Å; R333-P340 HydrophobicContact CG-CG 4.18Å; F336-P340 HydrophobicContact CB-CB 4.08Å; G337-P340 VanDerWaalsContact O-CD 3.29Å; G337-P340 WeakPolarHBondContact O-CD 3.27Å; G337-P340 WeakPolarHBondContact O-CG 3.32Å; D338-P340 WeakPolarHBondContact O-CD 3.48Å; P340-Y367 HydrophobicContact CB-CE1 4.27Å
341	V	89.9	Confident	91.3	Very high	84 Å²	84	75.1 Å²	75.1	51%	0.509	37%	0.372	S	S	.	.			trans	-109.1	135.4	178.5	-178	0	0	0	0	110.9	E339	E339-V341 PolarHBondContact O-N 3.37Å
342	L	93	Very high	91.1	Very high	50 Å²	50	79.1 Å²	79.1	26%	0.262	39%	0.39	S	S	.	.			trans	-74.1	128.3	168.6	-78.6	174.6	0	0	0	109.7	A269 M365 G366 Y367	A269-L342 HydrophobicContact CB-CD1 4.12Å; L342-M365 HydrophobicContact CB-CB 3.88Å; L342-M365 HydrophobicContact CD1-CB 4.44Å; L342-M365 HydrophobicContact CD2-CB 4.42Å; L342-M365 HydrophobicContact CG-CB 4.49Å; L342-M365 WeakPolarHBondContact O-CE 2.98Å; L342-G366 CarbonylContact C-O 3.21Å; L342-G366 WeakPolarHBondContact CA-O 3.49Å; L342-Y367 HydrophobicContact CD2-CD1 4.3Å; L342-Y367 HydrophobicContact CD2-CD2 3.73Å; L342-Y367 HydrophobicContact CD2-CE1 4.06Å; L342-Y367 HydrophobicContact CD2-CE2 3.43Å; L342-Y367 VanDerWaalsContact CD2-CE2 3.43Å; L342-Y367 HydrophobicContact CD2-CG 4.15Å; L342-Y367 HydrophobicContact CG-CE1 4.35Å; L342-Y367 HydrophobicContact CG-CE2 4.36Å
343	R	93.4	Very high	91.1	Very high	116 Å²	116	78.8 Å²	78.8	44%	0.438	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	149.2	-177	-62.5	-179.7	-178.3	-101.9	-1.2	111.3	Q347 I348 M365 G366	R343-Q347 HydrophobicContact CB-CB 4.35Å; R343-I348 HydrophobicContact CB-CG1 4.06Å; R343-M365 VanDerWaalsContact C-CE 3.45Å; R343-M365 WeakPolarHBondContact O-CA 2.99Å; R343-G366 PolarHBondContact N-O 3.26Å; R343-G366 PolarHBondContact O-N 3Å
344	P	93.2	Very high	91	Very high	37 Å²	37	75.4 Å²	75.4	24%	0.24	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	147.1	167.8	-20.9	32.8	0	0	0	110.5	A346 Q347 M365	P344-A346 PolarHBondContact O-N 3.02Å; P344-A346 VanDerWaalsContact O-N 3.13Å; P344-Q347 HydrophobicContact CB-CG 4.44Å; P344-Q347 HydrophobicContact CG-CG 4.41Å; P344-Q347 PolarHBondContact O-N 2.98Å; P344-M365 HydrophobicContact CB-SD 4.34Å; P344-M365 HydrophobicContact CG-CE 3.88Å; P344-M365 HydrophobicContact CG-SD 4.16Å
345	A	92.3	Very high	91.1	Very high	11 Å²	11	67.8 Å²	67.8	9%	0.091	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-54.4	-37.7	-176.8	0	0	0	0	0	113.9	Q347 I348 P355 Q357	A345-Q347 PolarHBondContact O-N 2.85Å; A345-I348 PolarHBondContact O-N 2.85Å; A345-P355 HydrophobicContact CB-CG 4.03Å; A345-Q357 HydrophobicContact CB-CG 4.14Å
346	A	91.5	Very high	90.9	Very high	101 Å²	101	70.7 Å²	70.7	84%	0.835	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20.9	178	0	0	0	0	0	113.9	P344	P344-A346 PolarHBondContact O-N 3.02Å; P344-A346 VanDerWaalsContact O-N 3.13Å
347	Q	92.9	Very high	90.9	Very high	114 Å²	114	72.3 Å²	72.3	53%	0.533	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-96.7	-3.8	179.5	-61.1	-178.7	9.5	0	0	113.1	R343 P344 A345	R343-Q347 HydrophobicContact CB-CB 4.35Å; P344-Q347 HydrophobicContact CB-CG 4.44Å; P344-Q347 HydrophobicContact CG-CG 4.41Å; P344-Q347 PolarHBondContact O-N 2.98Å; A345-Q347 PolarHBondContact O-N 2.85Å
348	I	91.8	Very high	90.7	Very high	2 Å²	2	70.9 Å²	70.9	1%	0.01	36%	0.355	C	S	.	.			trans	-86.5	114.6	178.2	-62.6	172.3	0	0	0	108.1	R343 A345 T350 L353 Q354 D368	R343-I348 HydrophobicContact CB-CG1 4.06Å; A345-I348 PolarHBondContact O-N 2.85Å; I348-T350 WeakPolarHBondContact CG2-O 3.36Å; I348-L353 HydrophobicContact CG2-CB 3.89Å; I348-Q354 HydrophobicContact CB-CG 4.01Å; I348-Q354 HydrophobicContact CG2-CG 4.12Å; I348-Q354 PolarHBondContact O-NE2 3.33Å; I348-D368 HydrophobicContact CB-CB 4.47Å; I348-D368 HydrophobicContact CG1-CB 4.44Å; I348-D368 HydrophobicContact CG2-CB 4.09Å
349	R	90.9	Very high	90.8	Very high	172 Å²	172	65.2 Å²	65.2	65%	0.649	33%	0.326	S	S	*	.			trans	-72.1	-36.1	-178.1	-63	174.5	-67.2	178.2	3.3	111.7	K351 D368 L369	R349-K351 PolarHBondContact O-N 2.93Å; R349-K351 VanDerWaalsContact O-N 3.09Å; R349-D368 WeakPolarHBondContact CB-OD2 3.16Å; R349-D368 IonicContact CZ-OD2 2.73Å; R349-D368 PolarHBondContact N-OD1 3.41Å; R349-D368 PolarHBondContact N-OD2 2.97Å; R349-D368 IonicContact NE-OD2 2.59Å; R349-D368 PolarHBondContact NE-OD2 3.24Å; R349-D368 IonicContact NH2-OD2 3.54Å; R349-L369 PolarHBondContact NH2-O 2.74Å
350	T	89.8	Confident	90.6	Very high	29 Å²	29	69 Å²	69	18%	0.178	33%	0.333	C	S	.	.			trans	-73.4	99.8	179.4	-48	0	0	0	0	110.5	I348 Q352 L353 Q354 D368 L369 L382	I348-T350 WeakPolarHBondContact CG2-O 3.36Å; T350-Q352 PolarHBondContact O-N 2.75Å; T350-Q352 VanDerWaalsContact O-N 3.11Å; T350-L353 HydrophobicContact CG2-CB 4.42Å; T350-L353 HydrophobicContact CG2-CD1 4.01Å; T350-L353 HydrophobicContact CG2-CG 3.8Å; T350-L353 WeakPolarHBondContact O-CA 3.18Å; T350-L353 WeakPolarHBondContact O-CB 3.35Å; T350-L353 PolarHBondContact O-N 3.08Å; T350-Q354 PolarHBondContact O-N 3.39Å; T350-D368 WeakPolarHBondContact CB-OD1 3.46Å; T350-D368 PolarHBondContact N-OD1 3.3Å; T350-D368 VanDerWaalsContact N-OD1 3.1Å; T350-D368 PolarHBondContact OG1-OD1 2.82Å; T350-L369 HydrophobicContact CG2-CD1 4.38Å; T350-L382 HydrophobicContact CG2-CD1 3.8Å
351	K	89.9	Confident	90.4	Very high	141 Å²	141	73.8 Å²	73.8	61%	0.613	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-52.7	-36.9	-176.2	-70.6	-172.6	177.1	-176.2	0	113.9	R349 L353 Q354	R349-K351 PolarHBondContact O-N 2.93Å; R349-K351 VanDerWaalsContact O-N 3.09Å; K351-L353 PolarHBondContact O-N 3.15Å; K351-Q354 PolarHBondContact O-N 2.95Å
352	Q	91.8	Very high	90.2	Very high	102 Å²	102	69.9 Å²	69.9	48%	0.477	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.7	-18.3	178.1	-60.3	94.3	-30.8	0	0	113.6	T350 L382 M386 P387	T350-Q352 PolarHBondContact O-N 2.75Å; T350-Q352 VanDerWaalsContact O-N 3.11Å; Q352-L382 HydrophobicContact CB-CD1 4.38Å; Q352-M386 HydrophobicContact CB-CE 4.5Å; Q352-P387 VanDerWaalsContact O-CD 3.27Å; Q352-P387 WeakPolarHBondContact O-CD 3.17Å
353	L	93.9	Very high	90.1	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.005	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-100	-4.5	-179.7	-58.6	-174.1	0	0	0	113.2	I348 T350 K351 P355 L369 L382 A385 M386	I348-L353 HydrophobicContact CG2-CB 3.89Å; T350-L353 HydrophobicContact CG2-CB 4.42Å; T350-L353 HydrophobicContact CG2-CD1 4.01Å; T350-L353 HydrophobicContact CG2-CG 3.8Å; T350-L353 WeakPolarHBondContact O-CA 3.18Å; T350-L353 WeakPolarHBondContact O-CB 3.35Å; T350-L353 PolarHBondContact O-N 3.08Å; K351-L353 PolarHBondContact O-N 3.15Å; L353-P355 WeakPolarHBondContact O-CD 3.31Å; L353-L369 HydrophobicContact CD1-CD1 4.04Å; L353-L369 HydrophobicContact CD1-CG 3.74Å; L353-L382 HydrophobicContact CD1-CD1 4.37Å; L353-L382 HydrophobicContact CD2-CD1 4.04Å; L353-L382 HydrophobicContact CD2-CG 4.24Å; L353-L382 WeakPolarHBondContact CD2-O 3.14Å; L353-L382 HydrophobicContact CG-CD1 4.1Å; L353-A385 HydrophobicContact CD1-CB 4.25Å; L353-A385 HydrophobicContact CD2-CB 3.94Å; L353-M386 HydrophobicContact CD2-CB 4.45Å
354	Q	93.9	Very high	90.1	Very high	52 Å²	52	65 Å²	65	24%	0.243	31%	0.308	C	S	.	.			trans	-69.3	113.4	177.6	-70.7	-177.7	-6.6	0	0	110.2	I348 T350 K351 Q390	I348-Q354 HydrophobicContact CB-CG 4.01Å; I348-Q354 HydrophobicContact CG2-CG 4.12Å; I348-Q354 PolarHBondContact O-NE2 3.33Å; T350-Q354 PolarHBondContact O-N 3.39Å; K351-Q354 PolarHBondContact O-N 2.95Å; Q354-Q390 PolarHBondContact O-NE2 2.92Å
355	P	92.8	Very high	90.2	Very high	14 Å²	14	64.6 Å²	64.6	9%	0.091	30%	0.304	C	S	.	.			trans	-72.3	149.8	176.8	30.8	-34	0	0	0	110.6	A345 L353 Q357 I364 P387	A345-P355 HydrophobicContact CB-CG 4.03Å; L353-P355 WeakPolarHBondContact O-CD 3.31Å; P355-Q357 PolarHBondContact O-NE2 2.87Å; P355-I364 HydrophobicContact CB-CB 4.23Å; P355-I364 HydrophobicContact CB-CG2 3.7Å; P355-I364 HydrophobicContact CG-CB 4.3Å; P355-I364 HydrophobicContact CG-CG2 4.04Å; P355-I364 WeakPolarHBondContact CG-O 2.97Å; P355-P387 HydrophobicContact CB-CG 4.4Å
356	W	89.8	Confident	90.3	Very high	63 Å²	63	64.3 Å²	64.3	24%	0.239	30%	0.302	C	S	.	.			trans	-64.4	142.7	173.3	179.4	74	0	0	0	111.8	Y164 Y168 P358 I364 P417 P418	Y164-W356 AromaticContact CE1-CZ3 3.97Å; Y164-W356 HydrophobicContact CE1-CZ3 3.97Å; Y164-W356 HydrophobicContact CE2-CZ3 4.48Å; Y164-W356 AromaticContact CZ-CZ3 3.66Å; Y164-W356 VanDerWaalsContact OH-CZ3 3.25Å; Y164-W356 WeakPolarHBondContact OH-CZ3 3.38Å; Y168-W356 AromaticContact CE2-CH2 3.84Å; Y168-W356 HydrophobicContact CE2-CH2 3.84Å; Y168-W356 HydrophobicContact CE2-CZ2 4.49Å; Y168-W356 AromaticContact CZ-CH2 3.9Å; Y168-W356 WeakPolarHBondContact OH-CH2 3.4Å; Y168-W356 VanDerWaalsContact OH-CZ2 3.28Å; Y168-W356 WeakPolarHBondContact OH-CZ2 3.27Å; W356-P358 HydrophobicContact CE3-CB 4.21Å; W356-P358 HydrophobicContact CH2-CB 3.74Å; W356-P358 HydrophobicContact CZ3-CB 3.44Å; W356-P358 VanDerWaalsContact CZ3-CB 3.44Å; W356-P358 HydrophobicContact CZ3-CG 4.37Å; W356-I364 WeakPolarHBondContact O-CG1 3.38Å; W356-P417 HydrophobicContact CZ2-CB 4.38Å; W356-P418 HydrophobicContact CD2-CG 3.84Å; W356-P418 VanDerWaalsContact CE2-CD 3.44Å; W356-P418 HydrophobicContact CE3-CG 4.07Å; W356-P418 HydrophobicContact CG-CG 4.28Å; W356-P418 HydrophobicContact CH2-CG 4.16Å; W356-P418 HydrophobicContact CZ2-CG 4.05Å; W356-P418 HydrophobicContact CZ3-CG 4.2Å
357	Q	91.4	Very high	90.4	Very high	54 Å²	54	60 Å²	60	25%	0.252	26%	0.264	S	S	.	.			trans	-108	119.5	-179.4	-57.4	-55.2	-57.9	0	0	110.6	A345 P355 I364	A345-Q357 HydrophobicContact CB-CG 4.14Å; P355-Q357 PolarHBondContact O-NE2 2.87Å; Q357-I364 PolarHBondContact NE2-O 3.41Å
358	P	85	Confident	90.3	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.006	24%	0.242	C	C	.	.	S	Bend	trans	-73.7	-28.2	-177.5	27.8	-34.9	0	0	0	114.4	Y164 Y168 W356 V362 I364	Y164-P358 HydrophobicContact CD1-CB 4.37Å; Y164-P358 HydrophobicContact CD2-CB 4.05Å; Y164-P358 HydrophobicContact CD2-CG 3.66Å; Y164-P358 HydrophobicContact CE1-CB 4.29Å; Y164-P358 HydrophobicContact CE2-CB 3.99Å; Y164-P358 HydrophobicContact CE2-CG 3.69Å; Y164-P358 HydrophobicContact CG-CB 4.26Å; Y164-P358 HydrophobicContact CG-CG 4.28Å; Y168-P358 HydrophobicContact CE2-CB 4.42Å; Y168-P358 WeakPolarHBondContact CE2-O 3.37Å; Y168-P358 PolarHBondContact OH-O 3.04Å; Y168-P358 VanDerWaalsContact OH-O 3.05Å; W356-P358 HydrophobicContact CE3-CB 4.21Å; W356-P358 HydrophobicContact CH2-CB 3.74Å; W356-P358 HydrophobicContact CZ3-CB 3.44Å; W356-P358 VanDerWaalsContact CZ3-CB 3.44Å; W356-P358 HydrophobicContact CZ3-CG 4.37Å; P358-V362 HydrophobicContact CG-CB 3.8Å; P358-V362 HydrophobicContact CG-CG1 3.59Å; P358-I364 HydrophobicContact CG-CG1 4.32Å
359	S	85.3	Confident	90.2	Very high	16 Å²	16	55.9 Å²	55.9	11%	0.112	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-165.2	169.7	176.8	70.8	0	0	0	0	110.5	K361 V362	S359-K361 PolarHBondContact O-N 3.46Å; S359-K361 PolarHBondContact OG-N 3.33Å; S359-V362 PolarHBondContact O-N 3.28Å; S359-V362 PolarHBondContact OG-N 3.46Å
360	R	83.1	Confident	89.9	Confident	247 Å²	247	51.5 Å²	51.5	93%	0.932	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-13.6	171.2	-65.6	-176.5	179.8	161.1	-0.5	114.3
361	K	82.4	Confident	89.1	Confident	143 Å²	143	53.1 Å²	53.1	62%	0.622	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.1	-177.7	-64.1	-174.1	178.7	-176.8	0	113.1	S274 S359	S274-K361 PolarHBondContact OG-O 3.47Å; S359-K361 PolarHBondContact O-N 3.46Å; S359-K361 PolarHBondContact OG-N 3.33Å
362	V	85.8	Confident	87.7	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-132.3	106	-172.7	176.8	0	0	0	0	108.8	S163 R270 P358 S359 I364	S163-V362 VanDerWaalsContact OG-CG2 3.26Å; S163-V362 WeakPolarHBondContact OG-CG2 3.29Å; R270-V362 HydrophobicContact CG-CG1 4.03Å; P358-V362 HydrophobicContact CG-CB 3.8Å; P358-V362 HydrophobicContact CG-CG1 3.59Å; S359-V362 PolarHBondContact O-N 3.28Å; S359-V362 PolarHBondContact OG-N 3.46Å; V362-I364 HydrophobicContact CG1-CD1 4.1Å
363	D	91.3	Very high	86	Confident	63 Å²	63	48 Å²	48	34%	0.337	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-90.7	118.8	178.2	-66.9	-39.6	0	0	0	109.9	R270 A271 S274 M365	R270-D363 CarbonylContact C-O 3.52Å; R270-D363 WeakPolarHBondContact CA-O 3.3Å; A271-D363 HydrophobicContact CB-CB 3.83Å; A271-D363 PolarHBondContact N-O 3.48Å; S274-D363 PolarHBondContact OG-N 3.5Å; D363-M365 HydrophobicContact CB-SD 4.34Å
364	I	93.1	Very high	84.3	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.1	167.8	-51.8	-57	0	0	0	108.3	Y164 R270 P355 W356 Q357 P358 V362	Y164-I364 HydrophobicContact CD2-CD1 4.2Å; Y164-I364 HydrophobicContact CE2-CD1 3.95Å; Y164-I364 HydrophobicContact CE2-CG1 4.33Å; R270-I364 HydrophobicContact CG-CD1 3.68Å; P355-I364 HydrophobicContact CB-CB 4.23Å; P355-I364 HydrophobicContact CB-CG2 3.7Å; P355-I364 HydrophobicContact CG-CB 4.3Å; P355-I364 HydrophobicContact CG-CG2 4.04Å; P355-I364 WeakPolarHBondContact CG-O 2.97Å; W356-I364 WeakPolarHBondContact O-CG1 3.38Å; Q357-I364 PolarHBondContact NE2-O 3.41Å; P358-I364 HydrophobicContact CG-CG1 4.32Å; V362-I364 HydrophobicContact CG1-CD1 4.1Å
365	M	94.9	Very high	82.8	Confident	28 Å²	28	52.6 Å²	52.6	14%	0.138	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	152.9	-175.1	-48.9	-66.9	-79	0	0	110.9	A269 A271 L342 R343 P344 D363	A269-M365 PolarHBondContact O-N 3.03Å; A271-M365 HydrophobicContact CB-CG 4.07Å; A271-M365 HydrophobicContact CB-SD 3.82Å; L342-M365 HydrophobicContact CB-CB 3.88Å; L342-M365 HydrophobicContact CD1-CB 4.44Å; L342-M365 HydrophobicContact CD2-CB 4.42Å; L342-M365 HydrophobicContact CG-CB 4.49Å; L342-M365 WeakPolarHBondContact O-CE 2.98Å; R343-M365 VanDerWaalsContact C-CE 3.45Å; R343-M365 WeakPolarHBondContact O-CA 2.99Å; P344-M365 HydrophobicContact CB-SD 4.34Å; P344-M365 HydrophobicContact CG-CE 3.88Å; P344-M365 HydrophobicContact CG-SD 4.16Å; D363-M365 HydrophobicContact CB-SD 4.34Å
366	G	94.6	Very high	81.4	Confident	6 Å²	6	57.5 Å²	57.5	6%	0.062	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	177.6	177.2	0	0	0	0	0	112.4	L342 R343	L342-G366 CarbonylContact C-O 3.21Å; L342-G366 WeakPolarHBondContact CA-O 3.49Å; R343-G366 PolarHBondContact N-O 3.26Å; R343-G366 PolarHBondContact O-N 3Å
367	Y	94.2	Very high	80.6	Confident	9 Å²	9	57.4 Å²	57.4	4%	0.035	37%	0.371	C	S	.	.			trans	-95.5	146.9	173.2	-63.8	-89	0	0	0	109.5	A265 K266 L332 F336 P340 L342 A385	A265-Y367 HydrophobicContact CB-CD2 4.01Å; A265-Y367 HydrophobicContact CB-CE2 3.61Å; K266-Y367 WeakPolarHBondContact O-CE2 3.42Å; L332-Y367 HydrophobicContact CD2-CE1 4.39Å; F336-Y367 HydrophobicContact CB-CD1 4.31Å; F336-Y367 HydrophobicContact CD1-CD1 4.36Å; F336-Y367 HydrophobicContact CD1-CG 4.34Å; F336-Y367 AromaticContact CD2-CD1 3.58Å; F336-Y367 HydrophobicContact CD2-CD1 3.58Å; F336-Y367 HydrophobicContact CD2-CE1 4.08Å; F336-Y367 AromaticContact CD2-CG 3.99Å; F336-Y367 HydrophobicContact CD2-CG 3.99Å; F336-Y367 HydrophobicContact CE1-CG 4.28Å; F336-Y367 AromaticContact CE2-CD1 3.96Å; F336-Y367 HydrophobicContact CE2-CD1 3.96Å; F336-Y367 HydrophobicContact CE2-CD2 4.4Å; F336-Y367 HydrophobicContact CE2-CE1 4.45Å; F336-Y367 AromaticContact CE2-CG 3.92Å; F336-Y367 HydrophobicContact CE2-CG 3.92Å; F336-Y367 AromaticContact CG-CD1 3.82Å; F336-Y367 HydrophobicContact CG-CD1 3.82Å; F336-Y367 HydrophobicContact CG-CG 4.21Å; F336-Y367 HydrophobicContact CZ-CG 4.1Å; P340-Y367 HydrophobicContact CB-CE1 4.27Å; L342-Y367 HydrophobicContact CD2-CD1 4.3Å; L342-Y367 HydrophobicContact CD2-CD2 3.73Å; L342-Y367 HydrophobicContact CD2-CE1 4.06Å; L342-Y367 HydrophobicContact CD2-CE2 3.43Å; L342-Y367 VanDerWaalsContact CD2-CE2 3.43Å; L342-Y367 HydrophobicContact CD2-CG 4.15Å; L342-Y367 HydrophobicContact CG-CE1 4.35Å; L342-Y367 HydrophobicContact CG-CE2 4.36Å; Y367-A385 HydrophobicContact CD2-CB 4.27Å; Y367-A385 HydrophobicContact CG-CB 4.5Å
368	D	90.4	Very high	80.2	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.07	38%	0.375	C	S	.	.			trans	-108.7	150	165.3	-163.7	24.3	0	0	0	109.3	F336 I348 R349 T350	F336-D368 WeakPolarHBondContact CD1-O 3.46Å; I348-D368 HydrophobicContact CB-CB 4.47Å; I348-D368 HydrophobicContact CG1-CB 4.44Å; I348-D368 HydrophobicContact CG2-CB 4.09Å; R349-D368 WeakPolarHBondContact CB-OD2 3.16Å; R349-D368 IonicContact CZ-OD2 2.73Å; R349-D368 PolarHBondContact N-OD1 3.41Å; R349-D368 PolarHBondContact N-OD2 2.97Å; R349-D368 IonicContact NE-OD2 2.59Å; R349-D368 PolarHBondContact NE-OD2 3.24Å; R349-D368 IonicContact NH2-OD2 3.54Å; T350-D368 WeakPolarHBondContact CB-OD1 3.46Å; T350-D368 PolarHBondContact N-OD1 3.3Å; T350-D368 VanDerWaalsContact N-OD1 3.1Å; T350-D368 PolarHBondContact OG1-OD1 2.82Å
369	L	89.9	Confident	80.4	Confident	18 Å²	18	62 Å²	62	9%	0.094	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-80.5	144.8	174.7	-68.7	169.1	0	0	0	109.9	F336 R349 T350 L353 T378 C381 L382	F336-L369 HydrophobicContact CD1-CD2 4.18Å; F336-L369 HydrophobicContact CE1-CD2 3.84Å; R349-L369 PolarHBondContact NH2-O 2.74Å; T350-L369 HydrophobicContact CG2-CD1 4.38Å; L353-L369 HydrophobicContact CD1-CD1 4.04Å; L353-L369 HydrophobicContact CD1-CG 3.74Å; L369-T378 HydrophobicContact CD1-CG2 4.11Å; L369-C381 HydrophobicContact CD2-CB 3.76Å; L369-L382 HydrophobicContact CD1-CB 4.19Å; L369-L382 HydrophobicContact CD1-CD1 3.81Å
370	P	84.9	Confident	80.8	Confident	80 Å²	80	63.4 Å²	63.4	52%	0.519	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-59.9	147.1	168.5	25.6	-31.2	0	0	0	109.7	C335	C335-P370 WeakPolarHBondContact O-CD 3.44Å
371	G	72.1	Confident	81.3	Confident	63 Å²	63	51.9 Å²	51.9	65%	0.649	37%	0.367	S	S	*	.	S	Bend	trans	-71	143.8	178.1	0	0	0	0	0	111
372	G	60.9	Low	81.9	Confident	88 Å²	88	46.5 Å²	46.5	91%	0.907	34%	0.344	S	S	*	.	S	Bend	trans	99.2	50.6	163.6	0	0	0	0	0	118.1
373	G	56.8	Low	82.4	Confident	48 Å²	48	47 Å²	47	50%	0.495	35%	0.347	S	S	.	.			trans	-177.2	115	162.6	0	0	0	0	0	114.6	T378	G373-T378 WeakPolarHBondContact O-CB 3.4Å; G373-T378 VanDerWaalsContact O-CG2 3.29Å; G373-T378 WeakPolarHBondContact O-CG2 3.43Å; G373-T378 PolarHBondContact O-OG1 3.22Å
374	A	58	Low	82.7	Confident	114 Å²	114	44.1 Å²	44.1	94%	0.942	33%	0.331	S	S	*	.			trans	-89.3	118.3	165.1	0	0	0	0	0	108.7
375	G	61.8	Low	82.9	Confident	34 Å²	34	44.1 Å²	44.1	35%	0.351	33%	0.331	S	S	.	.	S	Bend	trans	-173.5	171.4	178.1	0	0	0	0	0	112.9	A377 T378 E379	G375-A377 VanDerWaalsContact C-N 3.29Å; G375-A377 PolarHBondContact O-N 3.4Å; G375-T378 WeakPolarHBondContact O-CA 3.31Å; G375-T378 VanDerWaalsContact O-CB 3.29Å; G375-T378 WeakPolarHBondContact O-CB 3.48Å; G375-T378 PolarHBondContact O-N 2.68Å; G375-E379 PolarHBondContact O-N 3.07Å; G375-E379 VanDerWaalsContact O-N 3.12Å
376	P	63.2	Low	83	Confident	117 Å²	117	43.1 Å²	43.1	76%	0.76	33%	0.326	S	S	*	.	H	α-helix	trans	-59.2	-35.3	-176.5	-25.7	34.6	0	0	0	114.2	T378 E379 A380	P376-T378 VanDerWaalsContact C-N 3.33Å; P376-E379 PolarHBondContact O-N 2.94Å; P376-A380 PolarHBondContact O-N 3.18Å; P376-A380 VanDerWaalsContact O-N 3.08Å
377	A	72.8	Confident	83	Confident	61 Å²	61	43.7 Å²	43.7	50%	0.504	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-39.6	174.8	0	0	0	0	0	111.7	G375 A380 C381	G375-A377 VanDerWaalsContact C-N 3.29Å; G375-A377 PolarHBondContact O-N 3.4Å; A377-A380 PolarHBondContact O-N 3.09Å; A377-C381 PolarHBondContact O-N 2.83Å; A377-C381 VanDerWaalsContact O-N 3.1Å; A377-C381 PolarHBondContact O-SG 3.17Å
378	T	82.8	Confident	83	Confident	52 Å²	52	44.2 Å²	44.2	32%	0.319	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-40.1	175.6	-47.4	0	0	0	0	111.4	L369 G373 G375 P376 C381 L382	L369-T378 HydrophobicContact CD1-CG2 4.11Å; G373-T378 WeakPolarHBondContact O-CB 3.4Å; G373-T378 VanDerWaalsContact O-CG2 3.29Å; G373-T378 WeakPolarHBondContact O-CG2 3.43Å; G373-T378 PolarHBondContact O-OG1 3.22Å; G375-T378 WeakPolarHBondContact O-CA 3.31Å; G375-T378 VanDerWaalsContact O-CB 3.29Å; G375-T378 WeakPolarHBondContact O-CB 3.48Å; G375-T378 PolarHBondContact O-N 2.68Å; P376-T378 VanDerWaalsContact C-N 3.33Å; T378-C381 PolarHBondContact O-N 3.42Å; T378-L382 WeakPolarHBondContact O-CB 3.27Å; T378-L382 PolarHBondContact O-N 2.83Å
379	E	90.7	Very high	83.1	Confident	99 Å²	99	45.1 Å²	45.1	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-44.9	176.3	-175.3	171.4	-165.5	0	0	111.6	G375 P376 C381 L382 K383	G375-E379 PolarHBondContact O-N 3.07Å; G375-E379 VanDerWaalsContact O-N 3.12Å; P376-E379 PolarHBondContact O-N 2.94Å; E379-C381 VanDerWaalsContact C-N 3.29Å; E379-C381 PolarHBondContact O-N 2.78Å; E379-L382 WeakPolarHBondContact O-CB 3.26Å; E379-L382 PolarHBondContact O-N 3.38Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 3.12Å
380	A	92.6	Very high	83.3	Confident	46 Å²	46	45.8 Å²	45.8	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-40.3	176.9	0	0	0	0	0	112.2	P376 A377 K383 L384	P376-A380 PolarHBondContact O-N 3.18Å; P376-A380 VanDerWaalsContact O-N 3.08Å; A377-A380 PolarHBondContact O-N 3.09Å; A380-K383 PolarHBondContact O-N 3.1Å; A380-L384 WeakPolarHBondContact O-CB 2.98Å; A380-L384 PolarHBondContact O-N 3.41Å
381	C	94.9	Very high	83.9	Confident	6 Å²	6	42.1 Å²	42.1	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-69.6	-37.4	175.8	-65.3	0	0	0	0	112.7	C335 L369 A377 T378 E379 L384 A385	C335-C381 WeakPolarHBondContact CA-SG 3.37Å; C335-C381 HydrophobicContact CB-CB 3.53Å; C335-C381 WeakPolarHBondContact CB-SG 3.36Å; C335-C381 VanDerWaalsContact SG-CA 3.52Å; C335-C381 WeakPolarHBondContact SG-CB 3.36Å; C335-C381 CovalentContact SG-SG 2.04Å; C335-C381 PolarHBondContact SG-SG 3.18Å; L369-C381 HydrophobicContact CD2-CB 3.76Å; A377-C381 PolarHBondContact O-N 2.83Å; A377-C381 VanDerWaalsContact O-N 3.1Å; A377-C381 PolarHBondContact O-SG 3.17Å; T378-C381 PolarHBondContact O-N 3.42Å; E379-C381 VanDerWaalsContact C-N 3.29Å; E379-C381 PolarHBondContact O-N 2.78Å; C381-L384 WeakPolarHBondContact O-CB 3.22Å; C381-L384 PolarHBondContact O-N 3.08Å; C381-A385 PolarHBondContact O-N 3.31Å
382	L	95.1	Very high	85	Confident	30 Å²	30	39.5 Å²	39.5	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-49.9	171	-174.5	95.1	0	0	0	110.4	T350 Q352 L353 L369 T378 E379 L384 A385 M386	T350-L382 HydrophobicContact CG2-CD1 3.8Å; Q352-L382 HydrophobicContact CB-CD1 4.38Å; L353-L382 HydrophobicContact CD1-CD1 4.37Å; L353-L382 HydrophobicContact CD2-CD1 4.04Å; L353-L382 HydrophobicContact CD2-CG 4.24Å; L353-L382 WeakPolarHBondContact CD2-O 3.14Å; L353-L382 HydrophobicContact CG-CD1 4.1Å; L369-L382 HydrophobicContact CD1-CB 4.19Å; L369-L382 HydrophobicContact CD1-CD1 3.81Å; T378-L382 WeakPolarHBondContact O-CB 3.27Å; T378-L382 PolarHBondContact O-N 2.83Å; E379-L382 WeakPolarHBondContact O-CB 3.26Å; E379-L382 PolarHBondContact O-N 3.38Å; L382-L384 VanDerWaalsContact C-N 3.32Å; L382-L384 PolarHBondContact O-N 3.14Å; L382-A385 PolarHBondContact O-N 2.97Å; L382-M386 HydrophobicContact CD2-CE 3.45Å; L382-M386 VanDerWaalsContact CD2-CE 3.45Å; L382-M386 HydrophobicContact CG-CE 3.8Å; L382-M386 WeakPolarHBondContact O-CB 3.44Å; L382-M386 PolarHBondContact O-N 3.47Å
383	K	96.4	Very high	86.6	Confident	12 Å²	12	38.3 Å²	38.3	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-36.7	178.3	-61.3	-55.4	175.9	-175.3	0	112.8	N81 R85 E379 A380 A385 M386 Y391	N81-K383 PolarHBondContact ND2-O 2.9Å; R85-K383 HydrophobicContact CG-CB 4.34Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 3.12Å; A380-K383 PolarHBondContact O-N 3.1Å; K383-A385 VanDerWaalsContact C-N 3.28Å; K383-A385 PolarHBondContact O-N 3.28Å; K383-M386 HydrophobicContact CD-CE 3.95Å; K383-M386 HydrophobicContact CD-SD 4.31Å; K383-M386 PolarHBondContact O-N 2.8Å; K383-Y391 HydrophobicContact CB-CE1 4.4Å; K383-Y391 HydrophobicContact CD-CD2 4.46Å; K383-Y391 HydrophobicContact CD-CE2 3.84Å
384	L	96.9	Very high	88.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-59.1	-38.4	176.3	-177.7	69.5	0	0	0	112.3	N81 A265 L331 L332 C335 F336 A380 C381 L382	N81-L384 PolarHBondContact OD1-O 3.27Å; A265-L384 HydrophobicContact CB-CD1 4.34Å; A265-L384 HydrophobicContact CB-CD2 4.37Å; A265-L384 HydrophobicContact CB-CG 3.85Å; L331-L384 HydrophobicContact CD1-CD2 4.33Å; L331-L384 HydrophobicContact CD2-CD1 3.94Å; L331-L384 HydrophobicContact CD2-CD2 3.66Å; L331-L384 HydrophobicContact CD2-CG 4.47Å; L331-L384 HydrophobicContact CG-CD2 3.76Å; L332-L384 HydrophobicContact CD2-CD2 4.37Å; C335-L384 HydrophobicContact CB-CD2 4.48Å; F336-L384 HydrophobicContact CE2-CD2 4.02Å; F336-L384 HydrophobicContact CZ-CD2 4.26Å; A380-L384 WeakPolarHBondContact O-CB 2.98Å; A380-L384 PolarHBondContact O-N 3.41Å; C381-L384 WeakPolarHBondContact O-CB 3.22Å; C381-L384 PolarHBondContact O-N 3.08Å; L382-L384 VanDerWaalsContact C-N 3.32Å; L382-L384 PolarHBondContact O-N 3.14Å
385	A	96.4	Very high	90.4	Very high	2 Å²	2	34 Å²	34	2%	0.017	21%	0.206	C	C	.	.	H	α-helix	trans	-99.5	-3	-178.8	0	0	0	0	0	114.7	L267 F336 L353 Y367 C381 L382 K383 P387	L267-A385 WeakPolarHBondContact CD2-O 3.39Å; F336-A385 HydrophobicContact CE1-CB 3.94Å; F336-A385 HydrophobicContact CZ-CB 3.62Å; L353-A385 HydrophobicContact CD1-CB 4.25Å; L353-A385 HydrophobicContact CD2-CB 3.94Å; Y367-A385 HydrophobicContact CD2-CB 4.27Å; Y367-A385 HydrophobicContact CG-CB 4.5Å; C381-A385 PolarHBondContact O-N 3.31Å; L382-A385 PolarHBondContact O-N 2.97Å; K383-A385 VanDerWaalsContact C-N 3.28Å; K383-A385 PolarHBondContact O-N 3.28Å; A385-P387 WeakPolarHBondContact O-CD 3.4Å
386	M	96.8	Very high	92	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.034	20%	0.196	C	C	.	.			trans	-66	124.8	-172.8	-168.6	169	-71	0	0	111.4	N81 Q352 L353 L382 K383 Q390 Y391	N81-M386 PolarHBondContact ND2-O 3.01Å; Q352-M386 HydrophobicContact CB-CE 4.5Å; L353-M386 HydrophobicContact CD2-CB 4.45Å; L382-M386 HydrophobicContact CD2-CE 3.45Å; L382-M386 VanDerWaalsContact CD2-CE 3.45Å; L382-M386 HydrophobicContact CG-CE 3.8Å; L382-M386 WeakPolarHBondContact O-CB 3.44Å; L382-M386 PolarHBondContact O-N 3.47Å; K383-M386 HydrophobicContact CD-CE 3.95Å; K383-M386 HydrophobicContact CD-SD 4.31Å; K383-M386 PolarHBondContact O-N 2.8Å; M386-Q390 HydrophobicContact CG-CB 3.87Å; M386-Q390 HydrophobicContact SD-CB 4.33Å; M386-Y391 HydrophobicContact CB-CD1 4.26Å; M386-Y391 HydrophobicContact CB-CG 4.35Å; M386-Y391 HydrophobicContact CG-CG 4.26Å; M386-Y391 VanDerWaalsContact SD-CA 3.56Å; M386-Y391 HydrophobicContact SD-CD2 3.99Å; M386-Y391 HydrophobicContact SD-CG 3.92Å
387	P	95.5	Very high	93.6	Very high	17 Å²	17	33.5 Å²	33.5	11%	0.11	18%	0.18	C	C	.	.			trans	-67.9	157	176.9	-10.6	23.6	0	0	0	112.1	Q352 P355 A385 V389 Q390 Y391	Q352-P387 VanDerWaalsContact O-CD 3.27Å; Q352-P387 WeakPolarHBondContact O-CD 3.17Å; P355-P387 HydrophobicContact CB-CG 4.4Å; A385-P387 WeakPolarHBondContact O-CD 3.4Å; P387-V389 PolarHBondContact O-N 3.35Å; P387-Q390 PolarHBondContact O-N 3.19Å; P387-Q390 PolarHBondContact O-OE1 3.09Å; P387-Y391 PolarHBondContact O-N 2.89Å
388	E	93.2	Very high	94.6	Very high	20 Å²	20	34.6 Å²	34.6	9%	0.093	17%	0.174	C	C	.	.	H	α-helix	trans	-48.5	-50.9	-171.4	162	167.2	-149.5	0	0	115.2	K70 T77 Q80 H103 Y391 S392	K70-E388 IonicContact NZ-OE1 3.94Å; K70-E388 PolarHBondContact NZ-OE1 3.41Å; K70-E388 IonicContact NZ-OE2 2.77Å; K70-E388 PolarHBondContact NZ-OE2 3.04Å; T77-E388 HydrophobicContact CG2-CB 4.09Å; Q80-E388 PolarHBondContact NE2-OE1 2.77Å; Q80-E388 PolarHBondContact OE1-OE1 3.44Å; H103-E388 IonicContact CD2-OE1 2.85Å; E388-Y391 PolarHBondContact O-N 2.92Å; E388-S392 VanDerWaalsContact O-CB 3.31Å; E388-S392 WeakPolarHBondContact O-CB 3.46Å; E388-S392 PolarHBondContact O-N 3.05Å; E388-S392 PolarHBondContact O-OG 3.13Å
389	V	92.4	Very high	95.2	Very high	33 Å²	33	32.5 Å²	32.5	20%	0.2	16%	0.16	C	C	.	.	H	α-helix	trans	-67.8	-43.8	-172.9	176.8	0	0	0	0	109.7	H103 P387 Y391 S392 N393	H103-V389 HydrophobicContact CB-CG2 4.43Å; P387-V389 PolarHBondContact O-N 3.35Å; V389-Y391 PolarHBondContact O-N 3.15Å; V389-S392 PolarHBondContact O-N 3.15Å; V389-N393 WeakPolarHBondContact O-CB 3.39Å; V389-N393 VanDerWaalsContact O-CG 3.25Å; V389-N393 PolarHBondContact O-N 3.32Å; V389-N393 PolarHBondContact O-ND2 2.93Å
390	Q	95.1	Very high	95.4	Very high	32 Å²	32	30.2 Å²	30.2	15%	0.15	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-43.9	176.7	-66.5	87.6	-27.7	0	0	111	Q354 M386 P387 N393 Y394	Q354-Q390 PolarHBondContact O-NE2 2.92Å; M386-Q390 HydrophobicContact CG-CB 3.87Å; M386-Q390 HydrophobicContact SD-CB 4.33Å; P387-Q390 PolarHBondContact O-N 3.19Å; P387-Q390 PolarHBondContact O-OE1 3.09Å; Q390-N393 PolarHBondContact O-N 3.23Å; Q390-Y394 WeakPolarHBondContact O-CB 3.3Å; Q390-Y394 PolarHBondContact O-N 2.51Å
391	Y	97.1	Very high	95.3	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-71.5	-40.3	-179.1	-153.3	170.7	0	0	0	112.2	F84 R85 E88 K383 M386 P387 E388 V389 N393 Y394 L395	F84-Y391 HydrophobicContact CB-CD1 4.03Å; F84-Y391 HydrophobicContact CB-CE1 3.78Å; F84-Y391 HydrophobicContact CD2-CD1 4Å; F84-Y391 AromaticContact CD2-CG 3.98Å; F84-Y391 HydrophobicContact CD2-CG 3.98Å; R85-Y391 WeakPolarHBondContact CA-OH 3.37Å; R85-Y391 HydrophobicContact CG-CE1 3.76Å; R85-Y391 VanDerWaalsContact CG-OH 3.26Å; R85-Y391 WeakPolarHBondContact CG-OH 3.33Å; E88-Y391 WeakPolarHBondContact OE2-CE2 3.43Å; E88-Y391 PolarHBondContact OE2-OH 3.32Å; K383-Y391 HydrophobicContact CB-CE1 4.4Å; K383-Y391 HydrophobicContact CD-CD2 4.46Å; K383-Y391 HydrophobicContact CD-CE2 3.84Å; M386-Y391 HydrophobicContact CB-CD1 4.26Å; M386-Y391 HydrophobicContact CB-CG 4.35Å; M386-Y391 HydrophobicContact CG-CG 4.26Å; M386-Y391 VanDerWaalsContact SD-CA 3.56Å; M386-Y391 HydrophobicContact SD-CD2 3.99Å; M386-Y391 HydrophobicContact SD-CG 3.92Å; P387-Y391 PolarHBondContact O-N 2.89Å; E388-Y391 PolarHBondContact O-N 2.92Å; V389-Y391 PolarHBondContact O-N 3.15Å; Y391-N393 VanDerWaalsContact C-N 3.32Å; Y391-N393 PolarHBondContact O-N 3.26Å; Y391-Y394 AromaticContact CD2-CD1 3.9Å; Y391-Y394 HydrophobicContact CD2-CD1 3.9Å; Y391-Y394 AromaticContact CE2-CD1 3.83Å; Y391-Y394 HydrophobicContact CE2-CD1 3.83Å; Y391-Y394 HydrophobicContact CE2-CE1 4.29Å; Y391-Y394 WeakPolarHBondContact O-CB 3.43Å; Y391-Y394 PolarHBondContact O-N 2.73Å; Y391-L395 HydrophobicContact CD2-CD1 4.19Å; Y391-L395 HydrophobicContact CD2-CD2 4.43Å; Y391-L395 HydrophobicContact CD2-CG 3.85Å; Y391-L395 HydrophobicContact CE2-CD1 4.23Å; Y391-L395 HydrophobicContact CE2-CD2 3.95Å; Y391-L395 HydrophobicContact CE2-CG 3.86Å; Y391-L395 WeakPolarHBondContact O-CG 3.04Å; Y391-L395 PolarHBondContact O-N 2.75Å
392	S	96	Very high	94.9	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.063	18%	0.181	C	C	.	.	H	α-helix	trans	-57.4	-45.8	173.9	-59.3	0	0	0	0	111.3	E388 V389 Y394 L395 L396	E388-S392 VanDerWaalsContact O-CB 3.31Å; E388-S392 WeakPolarHBondContact O-CB 3.46Å; E388-S392 PolarHBondContact O-N 3.05Å; E388-S392 PolarHBondContact O-OG 3.13Å; V389-S392 PolarHBondContact O-N 3.15Å; S392-Y394 PolarHBondContact O-N 3.02Å; S392-L395 PolarHBondContact O-N 2.95Å; S392-L396 WeakPolarHBondContact O-CB 3.39Å; S392-L396 PolarHBondContact O-N 3.25Å
393	N	94.9	Very high	93.9	Very high	63 Å²	63	43.3 Å²	43.3	34%	0.337	21%	0.206	S	C	.	.	H	α-helix	trans	-63.9	-41.3	176.7	-72.8	-24	0	0	0	112.3	V389 Q390 Y391 L396 R397	V389-N393 WeakPolarHBondContact O-CB 3.39Å; V389-N393 VanDerWaalsContact O-CG 3.25Å; V389-N393 PolarHBondContact O-N 3.32Å; V389-N393 PolarHBondContact O-ND2 2.93Å; Q390-N393 PolarHBondContact O-N 3.23Å; Y391-N393 VanDerWaalsContact C-N 3.32Å; Y391-N393 PolarHBondContact O-N 3.26Å; N393-L396 PolarHBondContact O-N 2.74Å; N393-R397 WeakPolarHBondContact O-CG 3.37Å; N393-R397 PolarHBondContact O-N 3.45Å; N393-R397 VanDerWaalsContact O-N 3.11Å
394	Y	96.1	Very high	92.3	Very high	67 Å²	67	46 Å²	46	26%	0.263	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-49.4	175.1	170.2	-90.2	0	0	0	111.6	E88 Q390 Y391 S392 L396 R397 K398	E88-Y394 WeakPolarHBondContact OE1-CE1 3.19Å; E88-Y394 PolarHBondContact OE1-OH 2.58Å; Q390-Y394 WeakPolarHBondContact O-CB 3.3Å; Q390-Y394 PolarHBondContact O-N 2.51Å; Y391-Y394 AromaticContact CD2-CD1 3.9Å; Y391-Y394 HydrophobicContact CD2-CD1 3.9Å; Y391-Y394 AromaticContact CE2-CD1 3.83Å; Y391-Y394 HydrophobicContact CE2-CD1 3.83Å; Y391-Y394 HydrophobicContact CE2-CE1 4.29Å; Y391-Y394 WeakPolarHBondContact O-CB 3.43Å; Y391-Y394 PolarHBondContact O-N 2.73Å; S392-Y394 PolarHBondContact O-N 3.02Å; Y394-L396 PolarHBondContact O-N 3.12Å; Y394-R397 PolarHBondContact O-N 2.83Å; Y394-K398 HydrophobicContact CE1-CD 3.92Å; Y394-K398 WeakPolarHBondContact O-CB 3.4Å; Y394-K398 PolarHBondContact O-N 3.07Å
395	L	97	Very high	90.5	Very high	4 Å²	4	48 Å²	48	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-39.6	179.9	-71.8	177	0	0	0	111.8	F84 E88 V94 L96 Y391 S392 R397 K398 Q399	F84-L395 HydrophobicContact CB-CD1 3.77Å; F84-L395 HydrophobicContact CD1-CD1 3.97Å; F84-L395 HydrophobicContact CD2-CD1 3.54Å; F84-L395 HydrophobicContact CE1-CD1 4.45Å; F84-L395 HydrophobicContact CE2-CD1 4.07Å; F84-L395 HydrophobicContact CG-CD1 3.48Å; F84-L395 VanDerWaalsContact CG-CD1 3.48Å; F84-L395 HydrophobicContact CZ-CD1 4.49Å; E88-L395 HydrophobicContact CB-CD2 4.32Å; V94-L395 HydrophobicContact CB-CD1 4.37Å; V94-L395 HydrophobicContact CG1-CD1 4.49Å; V94-L395 HydrophobicContact CG2-CD1 4.02Å; L96-L395 HydrophobicContact CD1-CB 3.75Å; Y391-L395 HydrophobicContact CD2-CD1 4.19Å; Y391-L395 HydrophobicContact CD2-CD2 4.43Å; Y391-L395 HydrophobicContact CD2-CG 3.85Å; Y391-L395 HydrophobicContact CE2-CD1 4.23Å; Y391-L395 HydrophobicContact CE2-CD2 3.95Å; Y391-L395 HydrophobicContact CE2-CG 3.86Å; Y391-L395 WeakPolarHBondContact O-CG 3.04Å; Y391-L395 PolarHBondContact O-N 2.75Å; S392-L395 PolarHBondContact O-N 2.95Å; L395-R397 PolarHBondContact O-N 3.27Å; L395-K398 PolarHBondContact O-N 3.23Å; L395-Q399 WeakPolarHBondContact O-CB 3.33Å; L395-Q399 WeakPolarHBondContact O-CG 3.3Å; L395-Q399 PolarHBondContact O-N 2.03Å
396	L	96.4	Very high	88	Confident	25 Å²	25	59.7 Å²	59.7	13%	0.131	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-47.1	177.3	-178.9	58.2	0	0	0	111	L96 H117 T120 S392 N393 Y394 K398 Q399 K400	L96-L396 HydrophobicContact CB-CD1 4.48Å; L96-L396 VanDerWaalsContact CD1-CA 3.47Å; L96-L396 HydrophobicContact CD1-CB 3.69Å; L96-L396 HydrophobicContact CD1-CD1 4.39Å; H117-L396 HydrophobicContact CB-CD1 4.13Å; T120-L396 HydrophobicContact CG2-CD1 3.79Å; S392-L396 WeakPolarHBondContact O-CB 3.39Å; S392-L396 PolarHBondContact O-N 3.25Å; N393-L396 PolarHBondContact O-N 2.74Å; Y394-L396 PolarHBondContact O-N 3.12Å; L396-K398 PolarHBondContact O-N 3.32Å; L396-Q399 PolarHBondContact O-N 3.44Å; L396-K400 HydrophobicContact CD1-CD 4.14Å; L396-K400 HydrophobicContact CD1-CG 4.27Å; L396-K400 HydrophobicContact CG-CD 4.13Å; L396-K400 WeakPolarHBondContact O-CB 3.49Å; L396-K400 VanDerWaalsContact O-CG 3.3Å; L396-K400 WeakPolarHBondContact O-CG 3.35Å; L396-K400 PolarHBondContact O-N 3.25Å
397	R	95.5	Very high	85.5	Confident	115 Å²	115	62.2 Å²	62.2	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.1	-70	174.2	-173.5	168.8	3	111.4	N393 Y394 L395 K400 R401	N393-R397 WeakPolarHBondContact O-CG 3.37Å; N393-R397 PolarHBondContact O-N 3.45Å; N393-R397 VanDerWaalsContact O-N 3.11Å; Y394-R397 PolarHBondContact O-N 2.83Å; L395-R397 PolarHBondContact O-N 3.27Å; R397-K400 PolarHBondContact O-N 3.14Å; R397-R401 WeakPolarHBondContact O-CG 3.38Å; R397-R401 PolarHBondContact O-N 3Å; R397-R401 VanDerWaalsContact O-N 3.17Å
398	K	94.9	Very high	83	Confident	85 Å²	85	72 Å²	72	37%	0.37	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-47.4	178.4	-170	175.8	-170.4	174.2	0	111.5	E88 Y394 L395 L396 R401 R402	E88-K398 VanDerWaalsContact CG-NZ 3.25Å; E88-K398 IonicContact OE1-NZ 3.63Å; E88-K398 PolarHBondContact OE1-NZ 2.77Å; Y394-K398 HydrophobicContact CE1-CD 3.92Å; Y394-K398 WeakPolarHBondContact O-CB 3.4Å; Y394-K398 PolarHBondContact O-N 3.07Å; L395-K398 PolarHBondContact O-N 3.23Å; L396-K398 PolarHBondContact O-N 3.32Å; K398-R401 PolarHBondContact O-N 3.15Å; K398-R402 PolarHBondContact O-N 3.01Å; K398-R402 VanDerWaalsContact O-N 3.08Å
399	Q	95.6	Very high	80.3	Confident	8 Å²	8	77.4 Å²	77.4	4%	0.037	39%	0.391	C	S	.	.	H	α-helix	trans	-67.8	-38.3	-179.8	-73.6	175.3	-157	0	0	112.7	V94 L395 L396 R401 R402 G403	V94-Q399 PolarHBondContact O-NE2 3.08Å; V94-Q399 PolarHBondContact O-OE1 3.12Å; L395-Q399 WeakPolarHBondContact O-CB 3.33Å; L395-Q399 WeakPolarHBondContact O-CG 3.3Å; L395-Q399 PolarHBondContact O-N 2.03Å; L396-Q399 PolarHBondContact O-N 3.44Å; Q399-R401 VanDerWaalsContact C-N 3.34Å; Q399-R401 PolarHBondContact O-N 3.05Å; Q399-R402 PolarHBondContact O-N 3.22Å; Q399-G403 PolarHBondContact O-N 3.41Å
400	K	93.8	Very high	78	Confident	50 Å²	50	81.1 Å²	81.1	22%	0.217	41%	0.406	C	S	.	.	H	α-helix	trans	-60.5	-42.1	173.7	-75.2	176.1	79.6	167.1	0	112	A119 L396 R397 G403 G404 A405	A119-K400 HydrophobicContact CB-CG 3.72Å; L396-K400 HydrophobicContact CD1-CD 4.14Å; L396-K400 HydrophobicContact CD1-CG 4.27Å; L396-K400 HydrophobicContact CG-CD 4.13Å; L396-K400 WeakPolarHBondContact O-CB 3.49Å; L396-K400 VanDerWaalsContact O-CG 3.3Å; L396-K400 WeakPolarHBondContact O-CG 3.35Å; L396-K400 PolarHBondContact O-N 3.25Å; R397-K400 PolarHBondContact O-N 3.14Å; K400-G403 PolarHBondContact O-N 3.43Å; K400-G404 PolarHBondContact O-N 3.35Å; K400-A405 HydrophobicContact CB-CB 4.4Å; K400-A405 PolarHBondContact O-N 3Å; K400-A405 VanDerWaalsContact O-N 3.15Å
401	R	91.1	Very high	75	Confident	185 Å²	185	84.4 Å²	84.4	70%	0.698	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-43.4	176	-70.5	177.3	-177.3	-160.5	-0.1	111.9	R397 K398 Q399 G403 G404	R397-R401 WeakPolarHBondContact O-CG 3.38Å; R397-R401 PolarHBondContact O-N 3Å; R397-R401 VanDerWaalsContact O-N 3.17Å; K398-R401 PolarHBondContact O-N 3.15Å; Q399-R401 VanDerWaalsContact C-N 3.34Å; Q399-R401 PolarHBondContact O-N 3.05Å; R401-G403 VanDerWaalsContact C-N 3.26Å; R401-G403 PolarHBondContact O-N 3.35Å; R401-G404 PolarHBondContact O-N 3.41Å
402	R	86.4	Confident	72.1	Confident	106 Å²	106	89.8 Å²	89.8	40%	0.4	46%	0.463	S	S	.	.	H	α-helix	trans	-60	-36.2	176.5	-172.3	174.7	68.8	-161.7	2.4	112.4	N91 L92 T93 K398 Q399 G404	N91-R402 PolarHBondContact O-NH1 3.44Å; N91-R402 WeakPolarHBondContact OD1-CD 3.49Å; N91-R402 PolarHBondContact OD1-NH1 3.05Å; L92-R402 PolarHBondContact O-NH1 3.38Å; L92-R402 PolarHBondContact O-NH2 3.1Å; T93-R402 PolarHBondContact OG1-NH2 3.34Å; K398-R402 PolarHBondContact O-N 3.01Å; K398-R402 VanDerWaalsContact O-N 3.08Å; Q399-R402 PolarHBondContact O-N 3.22Å; R402-G404 VanDerWaalsContact C-N 3.33Å; R402-G404 PolarHBondContact O-N 2.82Å
403	G	75.2	Confident	69.3	Low	66 Å²	66	93.4 Å²	93.4	68%	0.68	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	11.8	179.3	0	0	0	0	0	115.8	Q399 K400 R401 A405	Q399-G403 PolarHBondContact O-N 3.41Å; K400-G403 PolarHBondContact O-N 3.43Å; R401-G403 VanDerWaalsContact C-N 3.26Å; R401-G403 PolarHBondContact O-N 3.35Å; G403-A405 PolarHBondContact O-N 3.22Å
404	G	63	Low	66.5	Low	69 Å²	69	96.5 Å²	96.5	71%	0.711	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	7.6	177.9	0	0	0	0	0	115.4	K400 R401 R402 R406	K400-G404 PolarHBondContact O-N 3.35Å; R401-G404 PolarHBondContact O-N 3.41Å; R402-G404 VanDerWaalsContact C-N 3.33Å; R402-G404 PolarHBondContact O-N 2.82Å; G404-R406 PolarHBondContact O-N 3.28Å
405	A	57.2	Low	63.7	Low	43 Å²	43	97.2 Å²	97.2	36%	0.355	51%	0.506	S	S	.	.			trans	-73.9	113.5	174.9	0	0	0	0	0	109.2	K400 G403 A407	K400-A405 HydrophobicContact CB-CB 4.4Å; K400-A405 PolarHBondContact O-N 3Å; K400-A405 VanDerWaalsContact O-N 3.15Å; G403-A405 PolarHBondContact O-N 3.22Å; A405-A407 PolarHBondContact O-N 3.35Å
406	R	44.3	Very low	60.5	Low	247 Å²	247	98.8 Å²	98.8	93%	0.932	52%	0.517	S	S	*	.			trans	-50.3	114.8	173.2	-87.7	-176.7	175.3	178.2	-1.1	109	G404 R408	G404-R406 PolarHBondContact O-N 3.28Å; R406-R408 PolarHBondContact O-N 2.99Å
407	A	45.1	Very low	57.6	Low	60 Å²	60	100.7 Å²	100.7	50%	0.496	53%	0.53	S	S	.	.			trans	-66.9	103.5	171.1	0	0	0	0	0	107.4	A405	A405-A407 PolarHBondContact O-N 3.35Å
408	R	43.5	Very low	54.9	Low	223 Å²	223	96.6 Å²	96.6	84%	0.842	52%	0.519	S	S	*	.			trans	-56.9	138	158.2	-83.4	-174.5	171.4	179.4	-2.3	106.9	R406 E410	R406-R408 PolarHBondContact O-N 2.99Å; R408-E410 PolarHBondContact O-N 2.84Å
409	P	36.7	Very low	52.2	Low	133 Å²	133	98.9 Å²	98.9	86%	0.864	53%	0.525	S	S	*	.			trans	-62.7	95.1	169.3	24.9	-29.8	0	0	0	107.3
410	E	43.3	Very low	49.5	Very low	111 Å²	111	102.3 Å²	102.3	52%	0.519	55%	0.548	S	S	.	.			trans	-72.8	138.8	163.4	-80.6	-177.3	179.1	0	0	107.2	R408 V412	R408-E410 PolarHBondContact O-N 2.84Å; E410-V412 PolarHBondContact O-N 2.92Å
411	P	32.7	Very low	47.1	Very low	101 Å²	101	101.5 Å²	101.5	66%	0.656	55%	0.546	S	S	*	.			trans	-51.3	139.8	173.5	21.3	-30.5	0	0	0	108.6	L413	P411-L413 PolarHBondContact O-N 3.16Å
412	V	36.2	Very low	44.3	Very low	115 Å²	115	101.6 Å²	101.6	70%	0.697	55%	0.546	S	S	*	.			trans	-54.6	99.1	163.6	176.4	0	0	0	0	105.3	E410 D414	E410-V412 PolarHBondContact O-N 2.92Å; V412-D414 PolarHBondContact O-N 3.36Å
413	L	36.2	Very low	41.9	Very low	86 Å²	86	102.2 Å²	102.2	45%	0.45	56%	0.562	S	S	.	*			trans	-65.4	92.5	167.7	-87.9	143.8	0	0	0	104.8	P411 N415 P416	P411-L413 PolarHBondContact O-N 3.16Å; L413-N415 PolarHBondContact O-N 2.89Å; L413-N415 VanDerWaalsContact O-N 3.08Å; L413-P416 HydrophobicContact CB-CG 3.65Å; L413-P416 HydrophobicContact CD2-CB 4.17Å; L413-P416 HydrophobicContact CD2-CG 3.28Å; L413-P416 HydrophobicContact CG-CG 3.97Å
414	D	35.6	Very low	40.2	Very low	128 Å²	128	106 Å²	106	68%	0.684	57%	0.566	S	S	*	*			trans	-43.7	116.7	153.5	-83.9	-36	0	0	0	106.3	V412 P416	V412-D414 PolarHBondContact O-N 3.36Å; D414-P416 VanDerWaalsContact C-N 3.35Å; D414-P416 WeakPolarHBondContact O-CD 3.44Å
415	N	37.4	Very low	38.7	Very low	82 Å²	82	108 Å²	108	44%	0.439	57%	0.566	S	S	.	*			trans	-0.7	80.2	174.2	-73.5	-28.4	0	0	0	113.2	L413	L413-N415 PolarHBondContact O-N 2.89Å; L413-N415 VanDerWaalsContact O-N 3.08Å
416	P	30.7	Very low	37.7	Very low	37 Å²	37	117.4 Å²	117.4	24%	0.24	59%	0.592	C	S	.	*			trans	-69.9	133.7	170.8	-5	23	0	0	0	103.2	L413 D414	L413-P416 HydrophobicContact CB-CG 3.65Å; L413-P416 HydrophobicContact CD2-CB 4.17Å; L413-P416 HydrophobicContact CD2-CG 3.28Å; L413-P416 HydrophobicContact CG-CG 3.97Å; D414-P416 VanDerWaalsContact C-N 3.35Å; D414-P416 WeakPolarHBondContact O-CD 3.44Å
417	P	35.2	Very low	37.2	Very low	64 Å²	64	108.1 Å²	108.1	42%	0.416	57%	0.574	S	S	.	*			trans	-50.1	153.8	162.7	27.4	-35.3	0	0	0	108.1	W356 R419	W356-P417 HydrophobicContact CZ2-CB 4.38Å; P417-R419 VanDerWaalsContact C-N 3.25Å; P417-R419 PolarHBondContact O-N 2.6Å
418	P	39.8	Very low	36.5	Very low	30 Å²	30	111.6 Å²	111.6	20%	0.195	59%	0.591	C	S	.	*			trans	-45.3	110.2	148.7	8.4	-7	0	0	0	105.5	W356	W356-P418 HydrophobicContact CD2-CG 3.84Å; W356-P418 VanDerWaalsContact CE2-CD 3.44Å; W356-P418 HydrophobicContact CE3-CG 4.07Å; W356-P418 HydrophobicContact CG-CG 4.28Å; W356-P418 HydrophobicContact CH2-CG 4.16Å; W356-P418 HydrophobicContact CZ2-CG 4.05Å; W356-P418 HydrophobicContact CZ3-CG 4.2Å
419	R	38.4	Very low	36.2	Very low	132 Å²	132	110 Å²	110	50%	0.498	59%	0.593	S	S	.	*			trans	-56.6	136.3	178	-70.2	-177.2	175.5	-168.4	-1.6	104.1	P417 I421	P417-R419 VanDerWaalsContact C-N 3.25Å; P417-R419 PolarHBondContact O-N 2.6Å; R419-I421 PolarHBondContact O-N 3.27Å
420	P	37.1	Very low	36.3	Very low	80 Å²	80	106.6 Å²	106.6	52%	0.519	58%	0.582	S	S	.	*			trans	-50.1	123	168.7	20.2	-29.8	0	0	0	106.2	R422	P420-R422 PolarHBondContact O-N 3.34Å
421	I	44.7	Very low	36.1	Very low	34 Å²	34	111.3 Å²	111.3	17%	0.174	62%	0.622	C	S	.	*			trans	-39	107	-172.6	-63	-170.4	0	0	0	108	E102 F197 R419 V423	E102-I421 WeakPolarHBondContact OE1-CA 3.29Å; F197-I421 HydrophobicContact CD1-CD1 4.35Å; F197-I421 HydrophobicContact CE1-CB 3.95Å; F197-I421 HydrophobicContact CE1-CD1 3.43Å; F197-I421 VanDerWaalsContact CE1-CD1 3.43Å; F197-I421 HydrophobicContact CE1-CG1 3.58Å; F197-I421 HydrophobicContact CZ-CB 3.88Å; F197-I421 HydrophobicContact CZ-CD1 4.19Å; F197-I421 HydrophobicContact CZ-CG1 3.8Å; R419-I421 PolarHBondContact O-N 3.27Å; I421-V423 PolarHBondContact O-N 2.62Å
422	R	31	Very low	36.2	Very low	186 Å²	186	111.8 Å²	111.8	70%	0.702	62%	0.62	S	S	*	*			trans	-69.7	126.4	-173.9	-92.8	-172.9	174.5	-171.2	-3.1	107.6	P420 L424	P420-R422 PolarHBondContact O-N 3.34Å; R422-L424 PolarHBondContact O-N 3.13Å; R422-L424 VanDerWaalsContact O-N 3.13Å
423	V	37.2	Very low	36.3	Very low	120 Å²	120	111.6 Å²	111.6	73%	0.727	62%	0.616	S	S	*	*			trans	-58.1	114.8	165.4	178.2	0	0	0	0	107.6	I421	I421-V423 PolarHBondContact O-N 2.62Å
424	L	38.2	Very low	36.3	Very low	146 Å²	146	113.1 Å²	113.1	76%	0.764	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-75.4	136.9	156.1	-78.7	167.1	0	0	0	107.2	R422 R426	R422-L424 PolarHBondContact O-N 3.13Å; R422-L424 VanDerWaalsContact O-N 3.13Å; L424-R426 PolarHBondContact O-N 3.41Å
425	P	31.5	Very low	36.3	Very low	111 Å²	111	112.2 Å²	112.2	72%	0.721	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-55.1	137.5	-176.7	20.9	-30.6	0	0	0	110.2	G427	P425-G427 PolarHBondContact O-N 3.1Å
426	R	36.7	Very low	36.2	Very low	239 Å²	239	114.1 Å²	114.1	90%	0.902	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-53.4	117.5	169	-74.1	-179.9	174.8	173.7	-2.3	107.1	L424	L424-R426 PolarHBondContact O-N 3.41Å
427	G	33.9	Very low	36.6	Very low	53 Å²	53	119.2 Å²	119.2	55%	0.546	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-56.5	148.6	166.6	0	0	0	0	0	109.2	P425 Q429	P425-G427 PolarHBondContact O-N 3.1Å; G427-Q429 PolarHBondContact O-N 3.07Å; G427-Q429 VanDerWaalsContact O-N 3.1Å
428	P	31.5	Very low	36.7	Very low	132 Å²	132	123.1 Å²	123.1	86%	0.857	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.8	119.5	-176.6	24.9	-32.1	0	0	0	109	G430	P428-G430 PolarHBondContact O-N 3.2Å
429	Q	36.5	Very low	36.5	Very low	191 Å²	191	130.3 Å²	130.3	89%	0.893	71%	0.714	S	S	*	*			trans	-72	105.2	160.8	-69.9	-175.5	-0.6	0	0	105.6	G427	G427-Q429 PolarHBondContact O-N 3.07Å; G427-Q429 VanDerWaalsContact O-N 3.1Å
430	G	37.7	Very low	36.3	Very low	60 Å²	60	130.2 Å²	130.2	62%	0.619	73%	0.732	S	S	*	*			trans	-71.8	155.9	166.6	0	0	0	0	0	110.4	P428	P428-G430 PolarHBondContact O-N 3.2Å
431	P	39.6	Very low	36.2	Very low	210 Å²	210	134.7 Å²	134.7	100%	1.364	75%	0.752	S	S	*	*			trans	-63.4	0	-175.3	27.7	-34.9	0	0	0	114

Retrieved 431 of 431 residues in 1895.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).