A0A3Q0KGL3_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KGL3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 581 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	33.3	Very low	241 Å²	241	155.5 Å²	155.5	100%	1.187	85%	0.849	S	S	*	*				0	128.3	0	-80.7	170.9	161.3	0	0	108.1
2	K	36.3	Very low	33	Very low	203 Å²	203	152.3 Å²	152.3	88%	0.883	85%	0.845	S	S	*	*			trans	39.7	125.5	177.6	-62.8	-179.3	-179.8	177.2	0	118.3
3	R	34.4	Very low	33	Very low	224 Å²	224	150.9 Å²	150.9	85%	0.845	84%	0.842	S	S	*	*			cis	-157	126.7	-20.2	-82.8	-175.8	176.9	160.4	-3	102.5
4	C	31.5	Very low	33	Very low	129 Å²	129	149 Å²	149	87%	0.872	84%	0.84	S	S	*	*				42.2	127.3	89.9	-57.1	0	0	0	0	114.5
5	A	36.9	Very low	32.9	Very low	96 Å²	96	144.7 Å²	144.7	79%	0.793	84%	0.842	S	S	*	*			cis	-167.3	154.7	-5.1	0	0	0	0	0	111.2
6	D	30.1	Very low	32.7	Very low	153 Å²	153	140.3 Å²	140.3	82%	0.818	84%	0.837	S	S	*	*			trans	-72.3	-171.7	151.1	-70	-51.7	0	0	0	109.5
7	P	36.1	Very low	32.7	Very low	113 Å²	113	143.5 Å²	143.5	73%	0.734	84%	0.837	S	S	*	*			cis	-143.9	-162.9	5.7	24.6	4.7	0	0	0	115.7
8	V	34.6	Very low	32.7	Very low	117 Å²	117	145.2 Å²	145.2	71%	0.709	84%	0.836	S	S	*	*			trans	104.1	118.4	144.9	-172	0	0	0	0	119.8
9	H	30.7	Very low	32.7	Very low	186 Å²	186	145.4 Å²	145.4	86%	0.861	83%	0.833	S	S	*	*			trans	5.8	147.1	150.4	-49.7	-49.8	0	0	0	122.6
10	G	30.6	Very low	32.6	Very low	67 Å²	67	149.5 Å²	149.5	69%	0.691	83%	0.834	S	S	*	*			trans	166.6	97.5	138.8	0	0	0	0	0	119.4
11	L	32.6	Very low	32.7	Very low	181 Å²	181	150.4 Å²	150.4	95%	0.948	83%	0.832	S	S	*	*			trans	73.7	136.5	136.6	-62.8	161.8	0	0	0	122.4
12	C	29.5	Very low	32.5	Very low	118 Å²	118	149.9 Å²	149.9	80%	0.797	82%	0.816	S	S	*	*			trans	-52.5	157	173.1	-55.6	0	0	0	0	116.6
13	V	32.8	Very low	32.2	Very low	134 Å²	134	145.2 Å²	145.2	81%	0.812	81%	0.808	S	S	*	*				-178.7	138.1	106.3	149.4	0	0	0	0	109.7
14	P	33.4	Very low	32	Very low	124 Å²	124	139 Å²	139	81%	0.805	80%	0.8	S	S	*	*			trans	-86.4	140.6	177.1	34	-33.6	0	0	0	112.8
15	G	31.2	Very low	32	Very low	85 Å²	85	138.1 Å²	138.1	88%	0.876	79%	0.786	S	S	*	*			trans	128.4	118.3	165.1	0	0	0	0	0	114.5
16	G	29.6	Very low	31.9	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	79%	0.789	S	S	*	*			trans	171.1	85	175.6	0	0	0	0	0	116.6
17	K	33.2	Very low	32.2	Very low	196 Å²	196	138.8 Å²	138.8	85%	0.852	78%	0.783	S	S	*	*			trans	67.2	89.1	152.8	-55.8	174.3	-177.2	176	0	117.7	L19	K17-L19 PolarHBondContact O-N 3.28Å
18	Q	32.3	Very low	32.1	Very low	174 Å²	174	135.7 Å²	135.7	81%	0.813	76%	0.764	S	S	*	*			trans	-63.3	115.7	150.8	-75.8	-174.9	-3.8	0	0	109.9	R20	Q18-R20 PolarHBondContact O-N 3.12Å
19	L	32.3	Very low	32.5	Very low	149 Å²	149	133.8 Å²	133.8	78%	0.78	76%	0.756	S	S	*	*			trans	-90.8	79.1	167.1	-80.5	166.4	0	0	0	110.4	K17 H21	K17-L19 PolarHBondContact O-N 3.28Å; L19-H21 VanDerWaalsContact C-N 3.35Å; L19-H21 PolarHBondContact O-N 3.36Å; L19-H21 VanDerWaalsContact O-N 3.12Å
20	R	30.6	Very low	33.1	Very low	227 Å²	227	133.9 Å²	133.9	86%	0.857	75%	0.75	S	S	*	*			trans	-76.8	85.3	163.1	-86.6	-173.6	172	179.1	-1.1	109.7	Q18	Q18-R20 PolarHBondContact O-N 3.12Å
21	H	35.4	Very low	33.7	Very low	168 Å²	168	140.6 Å²	140.6	78%	0.778	76%	0.755	S	S	*	*			trans	-84.7	115.5	161.2	-98.3	-78.8	0	0	0	110.2	L19 C23	L19-H21 VanDerWaalsContact C-N 3.35Å; L19-H21 PolarHBondContact O-N 3.36Å; L19-H21 VanDerWaalsContact O-N 3.12Å; H21-C23 PolarHBondContact O-N 3.21Å
22	R	28.1	Very low	34.5	Very low	230 Å²	230	137 Å²	137	87%	0.868	74%	0.743	S	S	*	*			trans	-60.7	114.9	165.6	-78.8	178.7	168.2	-179.5	-3.9	108.6	S24	R22-S24 VanDerWaalsContact C-N 3.28Å; R22-S24 PolarHBondContact O-N 3.25Å
23	C	29.9	Very low	35.8	Very low	106 Å²	106	134.4 Å²	134.4	72%	0.716	72%	0.721	S	S	*	*			trans	-89.3	70.8	164.7	-158.7	0	0	0	0	109.4	H21 D25	H21-C23 PolarHBondContact O-N 3.21Å; C23-D25 PolarHBondContact O-N 3.12Å; C23-D25 VanDerWaalsContact O-N 3.12Å
24	S	30.3	Very low	37	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	71%	0.706	S	S	*	*			trans	-82.7	70.6	170.5	50	0	0	0	0	109.8	R22	R22-S24 VanDerWaalsContact C-N 3.28Å; R22-S24 PolarHBondContact O-N 3.25Å
25	D	32.4	Very low	38.6	Very low	109 Å²	109	127.5 Å²	127.5	58%	0.583	69%	0.688	S	S	*	*			trans	-159.7	84.9	169	-96.5	-35.9	0	0	0	109.9	C23 S27 S28	C23-D25 PolarHBondContact O-N 3.12Å; C23-D25 VanDerWaalsContact O-N 3.12Å; D25-S27 PolarHBondContact O-N 2.99Å; D25-S28 PolarHBondContact O-N 3.39Å; D25-S28 PolarHBondContact O-OG 3.1Å; D25-S28 VanDerWaalsContact O-OG 3.12Å
26	L	34.8	Very low	40.5	Very low	163 Å²	163	124.9 Å²	124.9	85%	0.853	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-8.4	-174.9	-81.6	88.4	0	0	0	114.6
27	S	35.3	Very low	42.5	Very low	101 Å²	101	123.9 Å²	123.9	71%	0.706	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-15.7	177.2	65.2	0	0	0	0	114.1	D25	D25-S27 PolarHBondContact O-N 2.99Å
28	S	35.5	Very low	44.8	Very low	48 Å²	48	120.3 Å²	120.3	34%	0.336	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.5	-25	-175.5	72.7	0	0	0	0	113.8	D25 Y30 R31	D25-S28 PolarHBondContact O-N 3.39Å; D25-S28 PolarHBondContact O-OG 3.1Å; D25-S28 VanDerWaalsContact O-OG 3.12Å; S28-Y30 VanDerWaalsContact C-N 3.27Å; S28-Y30 PolarHBondContact O-N 3.29Å; S28-Y30 VanDerWaalsContact O-N 3.14Å; S28-R31 PolarHBondContact O-N 2.94Å
29	S	42.3	Very low	47.3	Very low	76 Å²	76	114.8 Å²	114.8	53%	0.531	61%	0.607	S	S	.	*	H	α-helix	trans	-55	-37.5	-171.1	-164.1	0	0	0	0	114	R31 C32	S29-R31 PolarHBondContact O-N 3.35Å; S29-C32 PolarHBondContact O-N 2.67Å
30	Y	42	Very low	50	Low	189 Å²	189	111.3 Å²	111.3	74%	0.741	59%	0.593	S	S	*	*	H	α-helix	trans	-63.9	-21.9	178.5	-69.7	-79.1	0	0	0	114.4	S28	S28-Y30 VanDerWaalsContact C-N 3.27Å; S28-Y30 PolarHBondContact O-N 3.29Å; S28-Y30 VanDerWaalsContact O-N 3.14Å
31	R	43.7	Very low	52.6	Low	208 Å²	208	102.8 Å²	102.8	79%	0.785	56%	0.562	S	S	*	*	H	α-helix	trans	-81.1	-28.3	178.8	-68.6	-170	-176.2	-174.4	3	113.5	S28 S29 L33 S34	S28-R31 PolarHBondContact O-N 2.94Å; S29-R31 PolarHBondContact O-N 3.35Å; R31-L33 VanDerWaalsContact C-N 3.32Å; R31-L33 PolarHBondContact O-N 3.29Å; R31-S34 PolarHBondContact O-N 2.96Å; R31-S34 PolarHBondContact O-OG 3.12Å
32	C	50.6	Low	55	Low	104 Å²	104	98.7 Å²	98.7	70%	0.703	55%	0.546	S	S	*	.	H	α-helix	trans	-68.9	-33.4	179.7	-72.8	0	0	0	0	112.3	S29 S34	S29-C32 PolarHBondContact O-N 2.67Å; C32-S34 VanDerWaalsContact C-N 3.33Å; C32-S34 PolarHBondContact O-N 3.45Å
33	L	57.2	Low	57.8	Low	65 Å²	65	91.1 Å²	91.1	34%	0.34	52%	0.522	S	S	.	.	H	α-helix	trans	-74.2	-21.2	-179.4	-62.1	173.4	0	0	0	113.3	R31 G35 V36 V62 F66	R31-L33 VanDerWaalsContact C-N 3.32Å; R31-L33 PolarHBondContact O-N 3.29Å; L33-G35 PolarHBondContact O-N 3.32Å; L33-V36 PolarHBondContact O-N 3.3Å; L33-V36 VanDerWaalsContact O-N 3.13Å; L33-V62 HydrophobicContact CD1-CG1 3.65Å; L33-F66 HydrophobicContact CB-CE2 4.39Å; L33-F66 HydrophobicContact CD1-CE2 4.28Å; L33-F66 HydrophobicContact CD2-CE2 4.04Å; L33-F66 HydrophobicContact CD2-CZ 4.02Å; L33-F66 HydrophobicContact CG-CE2 4.47Å
34	S	57.2	Low	60.6	Low	71 Å²	71	87.2 Å²	87.2	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-69.1	-18.2	177.6	70.9	0	0	0	0	113.6	R31 C32 V36 S37	R31-S34 PolarHBondContact O-N 2.96Å; R31-S34 PolarHBondContact O-OG 3.12Å; C32-S34 VanDerWaalsContact C-N 3.33Å; C32-S34 PolarHBondContact O-N 3.45Å; S34-V36 VanDerWaalsContact C-N 3.31Å; S34-S37 PolarHBondContact O-OG 3.37Å
35	G	65.9	Low	63.2	Low	42 Å²	42	82.9 Å²	82.9	43%	0.433	46%	0.463	S	S	.	.	H	α-helix	trans	-69	-29.3	171.2	0	0	0	0	0	113	L33 V38	L33-G35 PolarHBondContact O-N 3.32Å; G35-V38 PolarHBondContact O-N 3.45Å
36	V	71.6	Confident	65.8	Low	30 Å²	30	83.5 Å²	83.5	18%	0.182	46%	0.462	C	S	.	.	H	α-helix	trans	-70.4	-36.2	-176.6	-172.8	0	0	0	0	111.2	L33 S34 V38 L39 K44 M69	L33-V36 PolarHBondContact O-N 3.3Å; L33-V36 VanDerWaalsContact O-N 3.13Å; S34-V36 VanDerWaalsContact C-N 3.31Å; V36-V38 PolarHBondContact O-N 3.14Å; V36-L39 HydrophobicContact CG1-CD1 4.45Å; V36-L39 WeakPolarHBondContact O-CB 3.34Å; V36-L39 PolarHBondContact O-N 3.26Å; V36-L39 VanDerWaalsContact O-N 3.14Å; V36-K44 HydrophobicContact CG1-CG 4.5Å; V36-K44 WeakPolarHBondContact O-CE 3.35Å; V36-M69 HydrophobicContact CG1-CE 3.92Å; V36-M69 HydrophobicContact CG1-SD 4.41Å
37	S	71.7	Confident	68.3	Low	51 Å²	51	79.3 Å²	79.3	36%	0.357	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-27.8	-179.6	61.1	0	0	0	0	113.2	S34 L39 K44 E65	S34-S37 PolarHBondContact O-OG 3.37Å; S37-L39 VanDerWaalsContact C-N 3.3Å; S37-L39 PolarHBondContact O-N 3.46Å; S37-K44 PolarHBondContact O-NZ 3.48Å; S37-E65 WeakPolarHBondContact CB-OE1 3.34Å
38	V	81.7	Confident	70.8	Confident	122 Å²	122	74.7 Å²	74.7	74%	0.739	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.5	177.8	-173.9	0	0	0	0	112.7	G35 V36	G35-V38 PolarHBondContact O-N 3.45Å; V36-V38 PolarHBondContact O-N 3.14Å
39	L	84.8	Confident	73.3	Confident	58 Å²	58	74.5 Å²	74.5	30%	0.304	41%	0.406	S	S	.	.	S	Bend	trans	-70.5	143.9	-175.8	-62.1	175.2	0	0	0	112.6	V36 S37 I43 K44 I47	V36-L39 HydrophobicContact CG1-CD1 4.45Å; V36-L39 WeakPolarHBondContact O-CB 3.34Å; V36-L39 PolarHBondContact O-N 3.26Å; V36-L39 VanDerWaalsContact O-N 3.14Å; S37-L39 VanDerWaalsContact C-N 3.3Å; S37-L39 PolarHBondContact O-N 3.46Å; L39-I43 HydrophobicContact CB-CB 4.45Å; L39-I43 HydrophobicContact CD1-CG2 4.1Å; L39-K44 HydrophobicContact CB-CG 4.11Å; L39-K44 WeakPolarHBondContact O-CE 3.42Å; L39-K44 PolarHBondContact O-NZ 2.8Å; L39-I47 HydrophobicContact CD1-CD1 3.62Å
40	P	88.8	Confident	75.4	Confident	76 Å²	76	78.1 Å²	78.1	49%	0.494	42%	0.419	S	S	.	.			trans	-52.3	148.4	165.9	-25.7	34.1	0	0	0	112.2	D42 I43 K44	P40-D42 VanDerWaalsContact C-N 3.31Å; P40-D42 PolarHBondContact O-N 3.47Å; P40-I43 HydrophobicContact CB-CG1 4.42Å; P40-I43 HydrophobicContact CG-CD1 4.27Å; P40-I43 PolarHBondContact O-N 3.31Å; P40-I43 VanDerWaalsContact O-N 3.1Å; P40-K44 PolarHBondContact O-N 3.13Å; P40-K44 VanDerWaalsContact O-N 3.12Å
41	F	85.2	Confident	77.5	Confident	47 Å²	47	70.7 Å²	70.7	21%	0.206	39%	0.393	C	S	.	.	H	α-helix	trans	-59.4	-38.9	-174.6	-177.6	-108.9	0	0	0	112.9	I43 K44 C45 K72	F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 3.14Å; F41-K44 CarbonylContact O-C 3.59Å; F41-K44 WeakPolarHBondContact O-CA 3.08Å; F41-K44 WeakPolarHBondContact O-CB 2.86Å; F41-K44 PolarHBondContact O-N 3.29Å; F41-K44 VanDerWaalsContact O-N 3.09Å; F41-C45 WeakPolarHBondContact CE1-SG 2.97Å; F41-C45 WeakPolarHBondContact CZ-SG 3.32Å; F41-C45 PolarHBondContact O-N 3.02Å; F41-C45 PolarHBondContact O-SG 2.96Å; F41-K72 HydrophobicContact CD1-CD 4.44Å; F41-K72 HydrophobicContact CD2-CD 3.99Å; F41-K72 HydrophobicContact CE1-CD 4Å; F41-K72 HydrophobicContact CE1-CG 4.12Å; F41-K72 HydrophobicContact CE2-CB 3.94Å; F41-K72 HydrophobicContact CE2-CD 3.52Å; F41-K72 HydrophobicContact CE2-CG 3.82Å; F41-K72 HydrophobicContact CG-CD 4.44Å; F41-K72 HydrophobicContact CZ-CB 3.89Å; F41-K72 HydrophobicContact CZ-CD 3.53Å; F41-K72 HydrophobicContact CZ-CG 3.46Å; F41-K72 VanDerWaalsContact CZ-CG 3.46Å
42	D	85.8	Confident	79.5	Confident	83 Å²	83	67.3 Å²	67.3	44%	0.444	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-33.3	178.6	-51.8	-76	0	0	0	112.7	P40 C45 Q46 Q78	P40-D42 VanDerWaalsContact C-N 3.31Å; P40-D42 PolarHBondContact O-N 3.47Å; D42-C45 PolarHBondContact O-N 3.45Å; D42-Q46 WeakPolarHBondContact O-CG 3.29Å; D42-Q46 PolarHBondContact O-N 3.47Å; D42-Q78 PolarHBondContact OD1-NE2 2.9Å
43	I	87.9	Confident	81.1	Confident	71 Å²	71	62.9 Å²	62.9	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-70.9	-38.6	173.6	-55.6	-172.5	0	0	0	110.3	L39 P40 F41 C45 Q46 I47	L39-I43 HydrophobicContact CB-CB 4.45Å; L39-I43 HydrophobicContact CD1-CG2 4.1Å; P40-I43 HydrophobicContact CB-CG1 4.42Å; P40-I43 HydrophobicContact CG-CD1 4.27Å; P40-I43 PolarHBondContact O-N 3.31Å; P40-I43 VanDerWaalsContact O-N 3.1Å; F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 3.14Å; I43-C45 VanDerWaalsContact C-N 3.33Å; I43-C45 PolarHBondContact O-N 3.2Å; I43-Q46 PolarHBondContact O-N 3.22Å; I43-I47 HydrophobicContact CG2-CD1 4.17Å; I43-I47 WeakPolarHBondContact O-CG1 3.33Å; I43-I47 PolarHBondContact O-N 3.12Å
44	K	87.9	Confident	82.4	Confident	24 Å²	24	61.3 Å²	61.3	10%	0.104	35%	0.35	C	S	.	.	H	α-helix	trans	-59.2	-44.3	171.9	-67.2	170.4	171.7	170.3	0	110.7	V36 S37 L39 P40 F41 I47 L48 E65 M69	V36-K44 HydrophobicContact CG1-CG 4.5Å; V36-K44 WeakPolarHBondContact O-CE 3.35Å; S37-K44 PolarHBondContact O-NZ 3.48Å; L39-K44 HydrophobicContact CB-CG 4.11Å; L39-K44 WeakPolarHBondContact O-CE 3.42Å; L39-K44 PolarHBondContact O-NZ 2.8Å; P40-K44 PolarHBondContact O-N 3.13Å; P40-K44 VanDerWaalsContact O-N 3.12Å; F41-K44 CarbonylContact O-C 3.59Å; F41-K44 WeakPolarHBondContact O-CA 3.08Å; F41-K44 WeakPolarHBondContact O-CB 2.86Å; F41-K44 PolarHBondContact O-N 3.29Å; F41-K44 VanDerWaalsContact O-N 3.09Å; K44-I47 PolarHBondContact O-N 3.23Å; K44-L48 WeakPolarHBondContact O-CG 3.46Å; K44-L48 PolarHBondContact O-N 2.87Å; K44-E65 IonicContact NZ-OE1 2.7Å; K44-M69 HydrophobicContact CB-CG 4.15Å; K44-M69 HydrophobicContact CB-SD 3.84Å; K44-M69 HydrophobicContact CD-CE 3.91Å; K44-M69 HydrophobicContact CD-CG 4.18Å; K44-M69 HydrophobicContact CD-SD 4.03Å; K44-M69 HydrophobicContact CG-CE 4.28Å; K44-M69 HydrophobicContact CG-SD 3.99Å
45	C	85.8	Confident	83.8	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-43.4	175.2	-61.3	0	0	0	0	112.4	F41 D42 I43 I47 L48 S49 Y73 Q78	F41-C45 WeakPolarHBondContact CE1-SG 2.97Å; F41-C45 WeakPolarHBondContact CZ-SG 3.32Å; F41-C45 PolarHBondContact O-N 3.02Å; F41-C45 PolarHBondContact O-SG 2.96Å; D42-C45 PolarHBondContact O-N 3.45Å; I43-C45 VanDerWaalsContact C-N 3.33Å; I43-C45 PolarHBondContact O-N 3.2Å; C45-I47 VanDerWaalsContact C-N 3.35Å; C45-I47 PolarHBondContact O-N 3.09Å; C45-L48 PolarHBondContact O-N 3.32Å; C45-S49 WeakPolarHBondContact O-CB 3.17Å; C45-S49 PolarHBondContact O-N 2.63Å; C45-Y73 HydrophobicContact CB-CD2 3.85Å; C45-Y73 HydrophobicContact CB-CE2 4.02Å; C45-Y73 WeakPolarHBondContact O-CE2 3.49Å; C45-Q78 HydrophobicContact CB-CB 4.34Å; C45-Q78 VanDerWaalsContact CB-OE1 3.28Å
46	Q	86	Confident	84.9	Confident	123 Å²	123	59.6 Å²	59.6	58%	0.575	33%	0.325	S	S	*	.	H	α-helix	trans	-60.1	-42.9	175.1	-74.1	174	2.4	0	0	112.2	D42 I43 S49	D42-Q46 WeakPolarHBondContact O-CG 3.29Å; D42-Q46 PolarHBondContact O-N 3.47Å; I43-Q46 PolarHBondContact O-N 3.22Å; Q46-S49 PolarHBondContact O-N 3.04Å; Q46-S49 PolarHBondContact O-OG 3.32Å
47	I	86.9	Confident	85.5	Confident	75 Å²	75	58.9 Å²	58.9	39%	0.385	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-48.1	174.9	-66.8	164.2	0	0	0	110.7	L39 I43 K44 C45 S49 L50	L39-I47 HydrophobicContact CD1-CD1 3.62Å; I43-I47 HydrophobicContact CG2-CD1 4.17Å; I43-I47 WeakPolarHBondContact O-CG1 3.33Å; I43-I47 PolarHBondContact O-N 3.12Å; K44-I47 PolarHBondContact O-N 3.23Å; C45-I47 VanDerWaalsContact C-N 3.35Å; C45-I47 PolarHBondContact O-N 3.09Å; I47-S49 PolarHBondContact O-N 3.42Å; I47-L50 PolarHBondContact O-N 2.84Å; I47-L50 VanDerWaalsContact O-N 3.17Å
48	L	89.1	Confident	86.2	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-23.6	178.6	-65.6	177.3	0	0	0	113	K44 C45 L50 V51 L56 L59 M69 I70 Y73 Q81	K44-L48 WeakPolarHBondContact O-CG 3.46Å; K44-L48 PolarHBondContact O-N 2.87Å; C45-L48 PolarHBondContact O-N 3.32Å; L48-L50 PolarHBondContact O-N 3.26Å; L48-V51 PolarHBondContact O-N 2.95Å; L48-L56 HydrophobicContact CB-CD2 4.25Å; L48-L56 HydrophobicContact CD2-CD2 3.77Å; L48-L56 HydrophobicContact CG-CD2 4.5Å; L48-L59 HydrophobicContact CD2-CD1 3.95Å; L48-M69 HydrophobicContact CD1-CG 3.92Å; L48-M69 HydrophobicContact CD1-SD 4.04Å; L48-I70 HydrophobicContact CD1-CG1 4.3Å; L48-Y73 HydrophobicContact CB-CD1 3.88Å; L48-Y73 HydrophobicContact CB-CD2 4.02Å; L48-Y73 HydrophobicContact CB-CE1 3.78Å; L48-Y73 HydrophobicContact CB-CE2 3.91Å; L48-Y73 HydrophobicContact CB-CG 3.99Å; L48-Y73 HydrophobicContact CD1-CD1 3.96Å; L48-Y73 HydrophobicContact CD1-CD2 4.19Å; L48-Y73 HydrophobicContact CD1-CG 3.66Å; L48-Q81 PolarHBondContact O-NE2 3.42Å
49	S	86.9	Confident	86.5	Confident	44 Å²	44	57.1 Å²	57.1	31%	0.308	30%	0.302	S	S	.	.	H	α-helix	trans	-69.4	-16.1	174.5	78.2	0	0	0	0	114.4	C45 Q46 I47 Y73	C45-S49 WeakPolarHBondContact O-CB 3.17Å; C45-S49 PolarHBondContact O-N 2.63Å; Q46-S49 PolarHBondContact O-N 3.04Å; Q46-S49 PolarHBondContact O-OG 3.32Å; I47-S49 PolarHBondContact O-N 3.42Å; S49-Y73 WeakPolarHBondContact CA-OH 3.49Å; S49-Y73 PolarHBondContact N-OH 3.47Å
50	L	85.9	Confident	86.6	Confident	153 Å²	153	55.3 Å²	55.3	80%	0.801	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.1	174.9	-57.6	175.1	0	0	0	113.3	I47 L48	I47-L50 PolarHBondContact O-N 2.84Å; I47-L50 VanDerWaalsContact O-N 3.17Å; L48-L50 PolarHBondContact O-N 3.26Å
51	V	86.4	Confident	86.3	Confident	33 Å²	33	57.6 Å²	57.6	20%	0.2	30%	0.295	C	S	.	.	S	Bend	trans	-102.6	135.8	-175.6	-176.9	0	0	0	0	109.4	L48 D55 L56 L59 Q81	L48-V51 PolarHBondContact O-N 2.95Å; V51-D55 HydrophobicContact CG1-CB 3.39Å; V51-L56 HydrophobicContact CB-CD2 3.99Å; V51-L56 HydrophobicContact CG1-CD2 3.92Å; V51-L56 HydrophobicContact CG1-CG 4.21Å; V51-L59 HydrophobicContact CG1-CD1 4.07Å; V51-L59 HydrophobicContact CG2-CD1 4.34Å; V51-Q81 PolarHBondContact O-NE2 3.25Å
52	E	86	Confident	86.4	Confident	136 Å²	136	58.7 Å²	58.7	64%	0.636	31%	0.305	S	S	*	.			trans	-68.6	154.9	174.5	-65.5	-169.8	172.5	0	0	111.5	S54 D55 L56	E52-S54 WeakPolarHBondContact CB-OG 3.45Å; E52-S54 PolarHBondContact O-N 3.21Å; E52-S54 PolarHBondContact OE2-OG 2.99Å; E52-S54 VanDerWaalsContact OE2-OG 3.1Å; E52-D55 CarbonylContact O-C 3.57Å; E52-D55 WeakPolarHBondContact O-CA 3.4Å; E52-D55 PolarHBondContact O-N 3.32Å; E52-L56 PolarHBondContact O-N 3.17Å
53	I	85.3	Confident	86.4	Confident	12 Å²	12	56.9 Å²	56.9	6%	0.062	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-31.8	179.6	-67.6	166.3	0	0	0	111.7	D55 L56 M57 Q81 L82 L105 H108 L112	I53-D55 VanDerWaalsContact C-N 3.32Å; I53-D55 PolarHBondContact O-N 3.2Å; I53-L56 HydrophobicContact CG1-CD1 4.33Å; I53-L56 PolarHBondContact O-N 3.05Å; I53-M57 PolarHBondContact O-N 2.72Å; I53-Q81 HydrophobicContact CD1-CB 3.57Å; I53-Q81 HydrophobicContact CG1-CB 3.68Å; I53-Q81 HydrophobicContact CG1-CG 4.35Å; I53-L82 HydrophobicContact CD1-CD2 3.74Å; I53-L82 HydrophobicContact CD1-CG 4.3Å; I53-L105 HydrophobicContact CD1-CD1 3.22Å; I53-H108 HydrophobicContact CB-CB 4.28Å; I53-H108 HydrophobicContact CG2-CB 3.69Å; I53-L112 HydrophobicContact CG2-CB 4.27Å; I53-L112 HydrophobicContact CG2-CD2 3.92Å
54	S	83.8	Confident	86.3	Confident	32 Å²	32	61.5 Å²	61.5	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-49.9	-49.6	166.1	39.7	0	0	0	0	111.9	E52 M57	E52-S54 WeakPolarHBondContact CB-OG 3.45Å; E52-S54 PolarHBondContact O-N 3.21Å; E52-S54 PolarHBondContact OE2-OG 2.99Å; E52-S54 VanDerWaalsContact OE2-OG 3.1Å; S54-M57 WeakPolarHBondContact O-CB 3.35Å; S54-M57 PolarHBondContact O-N 3.44Å
55	D	87.4	Confident	86.2	Confident	76 Å²	76	64.6 Å²	64.6	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-81.5	-24.9	-178.4	-75.6	-37.2	0	0	0	114.1	V51 E52 I53 M57 N58 L59	V51-D55 HydrophobicContact CG1-CB 3.39Å; E52-D55 CarbonylContact O-C 3.57Å; E52-D55 WeakPolarHBondContact O-CA 3.4Å; E52-D55 PolarHBondContact O-N 3.32Å; I53-D55 VanDerWaalsContact C-N 3.32Å; I53-D55 PolarHBondContact O-N 3.2Å; D55-M57 PolarHBondContact O-N 3.48Å; D55-N58 WeakPolarHBondContact O-CA 3.4Å; D55-N58 WeakPolarHBondContact O-CB 3.36Å; D55-N58 PolarHBondContact O-N 3.11Å; D55-N58 PolarHBondContact OD1-ND2 3.13Å; D55-L59 WeakPolarHBondContact O-CG 3.24Å; D55-L59 PolarHBondContact O-N 3.31Å
56	L	89.2	Confident	86.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-37	167.1	-65.5	179.7	0	0	0	111	L48 V51 E52 I53 N58 L59 W60 Y73 L112	L48-L56 HydrophobicContact CB-CD2 4.25Å; L48-L56 HydrophobicContact CD2-CD2 3.77Å; L48-L56 HydrophobicContact CG-CD2 4.5Å; V51-L56 HydrophobicContact CB-CD2 3.99Å; V51-L56 HydrophobicContact CG1-CD2 3.92Å; V51-L56 HydrophobicContact CG1-CG 4.21Å; E52-L56 PolarHBondContact O-N 3.17Å; I53-L56 HydrophobicContact CG1-CD1 4.33Å; I53-L56 PolarHBondContact O-N 3.05Å; L56-N58 VanDerWaalsContact C-N 3.31Å; L56-N58 PolarHBondContact O-N 3.34Å; L56-L59 PolarHBondContact O-N 2.68Å; L56-W60 WeakPolarHBondContact O-CB 3.49Å; L56-W60 PolarHBondContact O-N 3.13Å; L56-Y73 HydrophobicContact CD1-CD1 4.4Å; L56-Y73 HydrophobicContact CD1-CE1 4.04Å; L56-L112 HydrophobicContact CB-CD2 4.43Å; L56-L112 HydrophobicContact CD1-CD2 4.4Å
57	M	83.9	Confident	86.5	Confident	16 Å²	16	62.3 Å²	62.3	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-31.5	173.5	-66.2	-172.8	-70	0	0	113	I53 S54 D55 N111 L112 R115	I53-M57 PolarHBondContact O-N 2.72Å; S54-M57 WeakPolarHBondContact O-CB 3.35Å; S54-M57 PolarHBondContact O-N 3.44Å; D55-M57 PolarHBondContact O-N 3.48Å; M57-N111 HydrophobicContact SD-CB 3.76Å; M57-N111 VanDerWaalsContact SD-CG 3.54Å; M57-L112 HydrophobicContact CG-CB 3.94Å; M57-L112 HydrophobicContact CG-CD1 3.86Å; M57-L112 HydrophobicContact CG-CG 4.48Å; M57-L112 HydrophobicContact SD-CB 4.35Å; M57-R115 PolarHBondContact O-NH1 3.45Å
58	N	85.9	Confident	86.5	Confident	90 Å²	90	64.1 Å²	64.1	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-70.7	-44.5	174.2	-64.9	-32.4	0	0	0	110.6	D55 L56 W60 E61	D55-N58 WeakPolarHBondContact O-CA 3.4Å; D55-N58 WeakPolarHBondContact O-CB 3.36Å; D55-N58 PolarHBondContact O-N 3.11Å; D55-N58 PolarHBondContact OD1-ND2 3.13Å; L56-N58 VanDerWaalsContact C-N 3.31Å; L56-N58 PolarHBondContact O-N 3.34Å; N58-W60 VanDerWaalsContact C-N 3.32Å; N58-W60 PolarHBondContact O-N 3.3Å; N58-E61 PolarHBondContact O-N 3.47Å
59	L	87.8	Confident	86.4	Confident	45 Å²	45	64.5 Å²	64.5	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-34.2	176.6	-68.7	176.8	0	0	0	113	L48 V51 D55 L56 E61 V62 F66 I70	L48-L59 HydrophobicContact CD2-CD1 3.95Å; V51-L59 HydrophobicContact CG1-CD1 4.07Å; V51-L59 HydrophobicContact CG2-CD1 4.34Å; D55-L59 WeakPolarHBondContact O-CG 3.24Å; D55-L59 PolarHBondContact O-N 3.31Å; L56-L59 PolarHBondContact O-N 2.68Å; L59-E61 PolarHBondContact O-N 3.25Å; L59-V62 WeakPolarHBondContact O-CB 3.36Å; L59-V62 PolarHBondContact O-N 3.06Å; L59-F66 HydrophobicContact CB-CD1 4.33Å; L59-F66 HydrophobicContact CD2-CE1 4.43Å; L59-F66 VanDerWaalsContact O-CB 3.32Å; L59-F66 WeakPolarHBondContact O-CB 3.43Å; L59-I70 HydrophobicContact CB-CD1 3.81Å
60	W	86.7	Confident	86.6	Confident	21 Å²	21	62.4 Å²	62.4	8%	0.08	32%	0.318	C	S	.	.	H	α-helix	trans	-57.4	-31.4	175.6	179.9	-87.4	0	0	0	113.5	L56 N58 V62 Q67 I70 E71 I116	L56-W60 WeakPolarHBondContact O-CB 3.49Å; L56-W60 PolarHBondContact O-N 3.13Å; N58-W60 VanDerWaalsContact C-N 3.32Å; N58-W60 PolarHBondContact O-N 3.3Å; W60-V62 VanDerWaalsContact C-N 3.33Å; W60-Q67 HydrophobicContact CD2-CB 4.31Å; W60-Q67 HydrophobicContact CD2-CG 3.78Å; W60-Q67 HydrophobicContact CE3-CB 4.13Å; W60-Q67 HydrophobicContact CE3-CG 4.08Å; W60-Q67 HydrophobicContact CG-CG 4.25Å; W60-Q67 HydrophobicContact CH2-CB 3.72Å; W60-Q67 HydrophobicContact CH2-CG 4.09Å; W60-Q67 HydrophobicContact CZ2-CB 3.94Å; W60-Q67 HydrophobicContact CZ2-CG 3.81Å; W60-Q67 VanDerWaalsContact CZ3-CA 3.49Å; W60-Q67 HydrophobicContact CZ3-CB 3.84Å; W60-Q67 HydrophobicContact CZ3-CG 4.23Å; W60-Q67 WeakPolarHBondContact CZ3-O 3.42Å; W60-Q67 VanDerWaalsContact O-CG 3.26Å; W60-Q67 WeakPolarHBondContact O-CG 3.22Å; W60-Q67 PolarHBondContact O-NE2 3.35Å; W60-Q67 VanDerWaalsContact O-NE2 3.09Å; W60-I70 HydrophobicContact CB-CD1 4.14Å; W60-I70 HydrophobicContact CE3-CB 3.94Å; W60-I70 HydrophobicContact CE3-CD1 4.48Å; W60-I70 HydrophobicContact CE3-CG2 3.88Å; W60-I70 HydrophobicContact CZ3-CB 4.31Å; W60-I70 HydrophobicContact CZ3-CG2 4.37Å; W60-E71 HydrophobicContact CZ3-CB 4.24Å; W60-I116 HydrophobicContact CE3-CG1 3.93Å; W60-I116 HydrophobicContact CH2-CB 4.1Å; W60-I116 HydrophobicContact CH2-CG1 3.95Å; W60-I116 HydrophobicContact CH2-CG2 4.17Å; W60-I116 HydrophobicContact CZ2-CG1 4.49Å; W60-I116 HydrophobicContact CZ3-CB 4.27Å; W60-I116 HydrophobicContact CZ3-CG1 3.61Å; W60-I116 HydrophobicContact CZ3-CG2 4.41Å
61	E	83.6	Confident	86.7	Confident	124 Å²	124	57.7 Å²	57.7	58%	0.579	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.3	179.1	-66.1	-176.8	-171	0	0	113.2	N58 L59 R115	N58-E61 PolarHBondContact O-N 3.47Å; L59-E61 PolarHBondContact O-N 3.25Å; E61-R115 IonicContact OE1-CZ 2.66Å; E61-R115 IonicContact OE1-NH1 3.69Å; E61-R115 PolarHBondContact OE1-NH1 2.84Å; E61-R115 IonicContact OE1-NH2 3.28Å; E61-R115 PolarHBondContact OE1-NH2 2.68Å
62	V	86.4	Confident	86.7	Confident	69 Å²	69	61.6 Å²	61.6	42%	0.418	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-44.5	-170.9	179.9	0	0	0	0	113.2	L33 L59 W60 F66	L33-V62 HydrophobicContact CD1-CG1 3.65Å; L59-V62 WeakPolarHBondContact O-CB 3.36Å; L59-V62 PolarHBondContact O-N 3.06Å; W60-V62 VanDerWaalsContact C-N 3.33Å; V62-F66 HydrophobicContact CB-CD2 4.11Å; V62-F66 HydrophobicContact CG1-CD2 4.11Å; V62-F66 HydrophobicContact CG1-CE2 4.3Å
63	S	86.5	Confident	86.9	Confident	45 Å²	45	55.1 Å²	55.1	32%	0.315	28%	0.275	S	S	.	.			trans	-163.8	160.8	179.9	83	0	0	0	0	113.7	E65 F66 Q67	S63-E65 PolarHBondContact O-N 3.23Å; S63-E65 PolarHBondContact OG-N 3.28Å; S63-F66 PolarHBondContact O-N 3.48Å; S63-F66 VanDerWaalsContact O-N 3.11Å; S63-F66 WeakPolarHBondContact OG-CD2 3.15Å; S63-F66 PolarHBondContact OG-N 3.36Å; S63-Q67 WeakPolarHBondContact O-CG 3.47Å; S63-Q67 PolarHBondContact O-N 3.22Å
64	K	85.8	Confident	87.1	Confident	169 Å²	169	54.6 Å²	54.6	74%	0.735	27%	0.272	S	S	*	.	H	α-helix	trans	-60.2	-29.2	172.6	-67.8	-171.1	177.1	-174.2	0	113.8	Q67 L68	K64-Q67 PolarHBondContact O-N 2.9Å; K64-L68 PolarHBondContact O-N 3.41Å; K64-L68 VanDerWaalsContact O-N 3.09Å
65	E	85.8	Confident	87	Confident	88 Å²	88	57.9 Å²	57.9	41%	0.411	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-44.1	174.4	-177.3	75.4	-169.9	0	0	110.1	S37 K44 S63 Q67 M69	S37-E65 WeakPolarHBondContact CB-OE1 3.34Å; K44-E65 IonicContact NZ-OE1 2.7Å; S63-E65 PolarHBondContact O-N 3.23Å; S63-E65 PolarHBondContact OG-N 3.28Å; E65-Q67 VanDerWaalsContact C-N 3.34Å; E65-M69 HydrophobicContact CG-CE 4.41Å; E65-M69 VanDerWaalsContact O-CB 3.22Å; E65-M69 WeakPolarHBondContact O-CB 3.47Å; E65-M69 PolarHBondContact O-N 2.74Å
66	F	87.5	Confident	86.6	Confident	16 Å²	16	55.2 Å²	55.2	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-36.3	173.6	-83.6	-70.3	0	0	0	112.3	L33 L59 V62 S63 M69 I70	L33-F66 HydrophobicContact CB-CE2 4.39Å; L33-F66 HydrophobicContact CD1-CE2 4.28Å; L33-F66 HydrophobicContact CD2-CE2 4.04Å; L33-F66 HydrophobicContact CD2-CZ 4.02Å; L33-F66 HydrophobicContact CG-CE2 4.47Å; L59-F66 HydrophobicContact CB-CD1 4.33Å; L59-F66 HydrophobicContact CD2-CE1 4.43Å; L59-F66 VanDerWaalsContact O-CB 3.32Å; L59-F66 WeakPolarHBondContact O-CB 3.43Å; V62-F66 HydrophobicContact CB-CD2 4.11Å; V62-F66 HydrophobicContact CG1-CD2 4.11Å; V62-F66 HydrophobicContact CG1-CE2 4.3Å; S63-F66 PolarHBondContact O-N 3.48Å; S63-F66 VanDerWaalsContact O-N 3.11Å; S63-F66 WeakPolarHBondContact OG-CD2 3.15Å; S63-F66 PolarHBondContact OG-N 3.36Å; F66-M69 HydrophobicContact CD1-CE 4.22Å; F66-M69 HydrophobicContact CD1-SD 4.27Å; F66-M69 HydrophobicContact CE1-CE 4.21Å; F66-M69 HydrophobicContact CE1-SD 4.28Å; F66-M69 PolarHBondContact O-N 2.84Å; F66-I70 HydrophobicContact CB-CD1 4.29Å; F66-I70 VanDerWaalsContact O-CB 3.29Å; F66-I70 WeakPolarHBondContact O-CB 3.49Å; F66-I70 WeakPolarHBondContact O-CD1 3.29Å; F66-I70 WeakPolarHBondContact O-CG1 3.19Å; F66-I70 PolarHBondContact O-N 3.24Å
67	Q	89.1	Confident	85.7	Confident	61 Å²	61	61.3 Å²	61.3	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-54.9	175.7	-67	172.9	-7.7	0	0	111.3	W60 S63 K64 E65 M69 I70 E71	W60-Q67 HydrophobicContact CD2-CB 4.31Å; W60-Q67 HydrophobicContact CD2-CG 3.78Å; W60-Q67 HydrophobicContact CE3-CB 4.13Å; W60-Q67 HydrophobicContact CE3-CG 4.08Å; W60-Q67 HydrophobicContact CG-CG 4.25Å; W60-Q67 HydrophobicContact CH2-CB 3.72Å; W60-Q67 HydrophobicContact CH2-CG 4.09Å; W60-Q67 HydrophobicContact CZ2-CB 3.94Å; W60-Q67 HydrophobicContact CZ2-CG 3.81Å; W60-Q67 VanDerWaalsContact CZ3-CA 3.49Å; W60-Q67 HydrophobicContact CZ3-CB 3.84Å; W60-Q67 HydrophobicContact CZ3-CG 4.23Å; W60-Q67 WeakPolarHBondContact CZ3-O 3.42Å; W60-Q67 VanDerWaalsContact O-CG 3.26Å; W60-Q67 WeakPolarHBondContact O-CG 3.22Å; W60-Q67 PolarHBondContact O-NE2 3.35Å; W60-Q67 VanDerWaalsContact O-NE2 3.09Å; S63-Q67 WeakPolarHBondContact O-CG 3.47Å; S63-Q67 PolarHBondContact O-N 3.22Å; K64-Q67 PolarHBondContact O-N 2.9Å; E65-Q67 VanDerWaalsContact C-N 3.34Å; Q67-M69 VanDerWaalsContact C-N 3.28Å; Q67-M69 PolarHBondContact O-N 2.85Å; Q67-I70 PolarHBondContact O-N 3.28Å; Q67-E71 WeakPolarHBondContact O-CB 3.32Å; Q67-E71 PolarHBondContact O-N 2.98Å
68	L	86.7	Confident	84.9	Confident	113 Å²	113	64.5 Å²	64.5	59%	0.592	33%	0.332	S	S	*	.	H	α-helix	trans	-62	-35.6	177.2	-67.1	171.9	0	0	0	112.8	K64 K72	K64-L68 PolarHBondContact O-N 3.41Å; K64-L68 VanDerWaalsContact O-N 3.09Å; L68-K72 WeakPolarHBondContact O-CB 3.41Å; L68-K72 PolarHBondContact O-N 3.32Å; L68-K72 VanDerWaalsContact O-N 3.16Å
69	M	88.5	Confident	84.7	Confident	12 Å²	12	60.4 Å²	60.4	6%	0.059	31%	0.311	C	S	.	.	H	α-helix	trans	-67	-44.2	177.6	-169.3	-169.6	-51	0	0	111.9	V36 K44 L48 E65 F66 Q67 Y73	V36-M69 HydrophobicContact CG1-CE 3.92Å; V36-M69 HydrophobicContact CG1-SD 4.41Å; K44-M69 HydrophobicContact CB-CG 4.15Å; K44-M69 HydrophobicContact CB-SD 3.84Å; K44-M69 HydrophobicContact CD-CE 3.91Å; K44-M69 HydrophobicContact CD-CG 4.18Å; K44-M69 HydrophobicContact CD-SD 4.03Å; K44-M69 HydrophobicContact CG-CE 4.28Å; K44-M69 HydrophobicContact CG-SD 3.99Å; L48-M69 HydrophobicContact CD1-CG 3.92Å; L48-M69 HydrophobicContact CD1-SD 4.04Å; E65-M69 HydrophobicContact CG-CE 4.41Å; E65-M69 VanDerWaalsContact O-CB 3.22Å; E65-M69 WeakPolarHBondContact O-CB 3.47Å; E65-M69 PolarHBondContact O-N 2.74Å; F66-M69 HydrophobicContact CD1-CE 4.22Å; F66-M69 HydrophobicContact CD1-SD 4.27Å; F66-M69 HydrophobicContact CE1-CE 4.21Å; F66-M69 HydrophobicContact CE1-SD 4.28Å; F66-M69 PolarHBondContact O-N 2.84Å; Q67-M69 VanDerWaalsContact C-N 3.28Å; Q67-M69 PolarHBondContact O-N 2.85Å; M69-Y73 WeakPolarHBondContact O-CB 3.08Å; M69-Y73 PolarHBondContact O-N 3.09Å
70	I	90	Very high	84.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-73.9	-40.8	-179	-68.5	162.9	0	0	0	110.7	L48 L59 W60 F66 Q67 Y73 C74 L112	L48-I70 HydrophobicContact CD1-CG1 4.3Å; L59-I70 HydrophobicContact CB-CD1 3.81Å; W60-I70 HydrophobicContact CB-CD1 4.14Å; W60-I70 HydrophobicContact CE3-CB 3.94Å; W60-I70 HydrophobicContact CE3-CD1 4.48Å; W60-I70 HydrophobicContact CE3-CG2 3.88Å; W60-I70 HydrophobicContact CZ3-CB 4.31Å; W60-I70 HydrophobicContact CZ3-CG2 4.37Å; F66-I70 HydrophobicContact CB-CD1 4.29Å; F66-I70 VanDerWaalsContact O-CB 3.29Å; F66-I70 WeakPolarHBondContact O-CB 3.49Å; F66-I70 WeakPolarHBondContact O-CD1 3.29Å; F66-I70 WeakPolarHBondContact O-CG1 3.19Å; F66-I70 PolarHBondContact O-N 3.24Å; Q67-I70 PolarHBondContact O-N 3.28Å; I70-Y73 PolarHBondContact O-N 3.25Å; I70-C74 WeakPolarHBondContact O-CB 3.39Å; I70-C74 PolarHBondContact O-N 3.36Å; I70-C74 PolarHBondContact O-SG 2.82Å; I70-L112 HydrophobicContact CG2-CD1 4.31Å
71	E	88.1	Confident	84.2	Confident	53 Å²	53	62.2 Å²	62.2	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-54.9	-54.5	173.2	-177.1	174.1	-159	0	0	110.1	W60 Q67 Y73 C74 D75 I116	W60-E71 HydrophobicContact CZ3-CB 4.24Å; Q67-E71 WeakPolarHBondContact O-CB 3.32Å; Q67-E71 PolarHBondContact O-N 2.98Å; E71-Y73 VanDerWaalsContact C-N 3.31Å; E71-Y73 PolarHBondContact O-N 2.91Å; E71-C74 PolarHBondContact O-N 3.32Å; E71-D75 PolarHBondContact O-N 3.01Å; E71-D75 VanDerWaalsContact O-N 3.07Å; E71-I116 HydrophobicContact CB-CG2 4.36Å; E71-I116 HydrophobicContact CG-CG2 4.06Å
72	K	87.1	Confident	84.4	Confident	116 Å²	116	56.3 Å²	56.3	50%	0.504	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-29.8	178.3	-165.3	-174.6	166.7	-162.3	0	113.4	F41 L68 S76	F41-K72 HydrophobicContact CD1-CD 4.44Å; F41-K72 HydrophobicContact CD2-CD 3.99Å; F41-K72 HydrophobicContact CE1-CD 4Å; F41-K72 HydrophobicContact CE1-CG 4.12Å; F41-K72 HydrophobicContact CE2-CB 3.94Å; F41-K72 HydrophobicContact CE2-CD 3.52Å; F41-K72 HydrophobicContact CE2-CG 3.82Å; F41-K72 HydrophobicContact CG-CD 4.44Å; F41-K72 HydrophobicContact CZ-CB 3.89Å; F41-K72 HydrophobicContact CZ-CD 3.53Å; F41-K72 HydrophobicContact CZ-CG 3.46Å; F41-K72 VanDerWaalsContact CZ-CG 3.46Å; L68-K72 WeakPolarHBondContact O-CB 3.41Å; L68-K72 PolarHBondContact O-N 3.32Å; L68-K72 VanDerWaalsContact O-N 3.16Å; K72-S76 WeakPolarHBondContact O-CB 3.38Å; K72-S76 PolarHBondContact O-N 3.11Å
73	Y	89.9	Confident	84.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.4	-47.4	175.5	173.2	-109.9	0	0	0	111.6	C45 L48 S49 L56 M69 I70 E71 D75 S76 C79 Q81	C45-Y73 HydrophobicContact CB-CD2 3.85Å; C45-Y73 HydrophobicContact CB-CE2 4.02Å; C45-Y73 WeakPolarHBondContact O-CE2 3.49Å; L48-Y73 HydrophobicContact CB-CD1 3.88Å; L48-Y73 HydrophobicContact CB-CD2 4.02Å; L48-Y73 HydrophobicContact CB-CE1 3.78Å; L48-Y73 HydrophobicContact CB-CE2 3.91Å; L48-Y73 HydrophobicContact CB-CG 3.99Å; L48-Y73 HydrophobicContact CD1-CD1 3.96Å; L48-Y73 HydrophobicContact CD1-CD2 4.19Å; L48-Y73 HydrophobicContact CD1-CG 3.66Å; S49-Y73 WeakPolarHBondContact CA-OH 3.49Å; S49-Y73 PolarHBondContact N-OH 3.47Å; L56-Y73 HydrophobicContact CD1-CD1 4.4Å; L56-Y73 HydrophobicContact CD1-CE1 4.04Å; M69-Y73 WeakPolarHBondContact O-CB 3.08Å; M69-Y73 PolarHBondContact O-N 3.09Å; I70-Y73 PolarHBondContact O-N 3.25Å; E71-Y73 VanDerWaalsContact C-N 3.31Å; E71-Y73 PolarHBondContact O-N 2.91Å; Y73-D75 PolarHBondContact O-N 2.89Å; Y73-S76 WeakPolarHBondContact O-CB 3.38Å; Y73-S76 PolarHBondContact O-N 3.23Å; Y73-S76 PolarHBondContact O-OG 3.3Å; Y73-C79 HydrophobicContact CD1-CB 4.41Å; Y73-C79 HydrophobicContact CE1-CB 3.96Å; Y73-C79 WeakPolarHBondContact CE1-SG 3.49Å; Y73-C79 HydrophobicContact CE2-CB 4.19Å; Y73-Q81 PolarHBondContact OH-NE2 3.38Å; Y73-Q81 PolarHBondContact OH-OE1 2.98Å
74	C	89.1	Confident	84.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-43.5	177.1	-68.8	0	0	0	0	111.5	I70 E71 S76 L82 Y86 F113 I116	I70-C74 WeakPolarHBondContact O-CB 3.39Å; I70-C74 PolarHBondContact O-N 3.36Å; I70-C74 PolarHBondContact O-SG 2.82Å; E71-C74 PolarHBondContact O-N 3.32Å; C74-S76 PolarHBondContact O-N 3.29Å; C74-L82 HydrophobicContact CB-CD1 4.12Å; C74-Y86 WeakPolarHBondContact O-CE2 3.5Å; C74-Y86 PolarHBondContact O-OH 3.26Å; C74-F113 HydrophobicContact CB-CE1 4.09Å; C74-F113 HydrophobicContact CB-CZ 4.22Å; C74-I116 HydrophobicContact CB-CD1 4.29Å
75	D	81.6	Confident	84.4	Confident	101 Å²	101	45.4 Å²	45.4	54%	0.54	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.5	175.6	-76.9	-13.5	0	0	0	113.9	E71 Y73	E71-D75 PolarHBondContact O-N 3.01Å; E71-D75 VanDerWaalsContact O-N 3.07Å; Y73-D75 PolarHBondContact O-N 2.89Å
76	S	78.8	Confident	84.5	Confident	20 Å²	20	44 Å²	44	14%	0.14	24%	0.236	C	C	.	.	S	Bend	trans	-83.1	145.6	179	83.3	0	0	0	0	112.1	K72 Y73 C74 Q78 C79	K72-S76 WeakPolarHBondContact O-CB 3.38Å; K72-S76 PolarHBondContact O-N 3.11Å; Y73-S76 WeakPolarHBondContact O-CB 3.38Å; Y73-S76 PolarHBondContact O-N 3.23Å; Y73-S76 PolarHBondContact O-OG 3.3Å; C74-S76 PolarHBondContact O-N 3.29Å; S76-Q78 PolarHBondContact O-N 3.1Å; S76-Q78 PolarHBondContact OG-N 2.88Å; S76-C79 PolarHBondContact O-N 2.9Å
77	S	71.1	Confident	84.4	Confident	129 Å²	129	46.9 Å²	46.9	90%	0.902	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-1.4	166	55.6	0	0	0	0	113.8
78	Q	67.3	Low	84.4	Confident	82 Å²	82	44 Å²	44	38%	0.383	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	7.4	177.3	-54.3	-173.2	16.7	0	0	113.1	D42 C45 S76 P80	D42-Q78 PolarHBondContact OD1-NE2 2.9Å; C45-Q78 HydrophobicContact CB-CB 4.34Å; C45-Q78 VanDerWaalsContact CB-OE1 3.28Å; S76-Q78 PolarHBondContact O-N 3.1Å; S76-Q78 PolarHBondContact OG-N 2.88Å; Q78-P80 WeakPolarHBondContact O-CD 3.19Å
79	C	82.2	Confident	84.4	Confident	5 Å²	5	40 Å²	40	3%	0.034	22%	0.217	C	C	.	.			trans	-93.2	89.1	175.5	-176.1	0	0	0	0	111.6	Y73 S76 Q81 L82 S83	Y73-C79 HydrophobicContact CD1-CB 4.41Å; Y73-C79 HydrophobicContact CE1-CB 3.96Å; Y73-C79 WeakPolarHBondContact CE1-SG 3.49Å; Y73-C79 HydrophobicContact CE2-CB 4.19Å; S76-C79 PolarHBondContact O-N 2.9Å; C79-Q81 VanDerWaalsContact C-N 3.26Å; C79-Q81 PolarHBondContact O-N 3.04Å; C79-Q81 PolarHBondContact SG-OE1 3.26Å; C79-Q81 VanDerWaalsContact SG-OE1 3.41Å; C79-L82 PolarHBondContact O-N 3.36Å; C79-S83 PolarHBondContact O-N 3.49Å
80	P	81.1	Confident	84.1	Confident	69 Å²	69	41.7 Å²	41.7	45%	0.448	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-63.6	-30	-177.8	26.7	-37.1	0	0	0	112.9	Q78 L82 S83	Q78-P80 WeakPolarHBondContact O-CD 3.19Å; P80-L82 PolarHBondContact O-N 3.07Å; P80-S83 VanDerWaalsContact O-CB 3.24Å; P80-S83 WeakPolarHBondContact O-CB 3.23Å; P80-S83 PolarHBondContact O-N 3.44Å; P80-S83 VanDerWaalsContact O-N 3.13Å; P80-S83 PolarHBondContact O-OG 3.42Å
81	Q	83.1	Confident	83.4	Confident	35 Å²	35	43.4 Å²	43.4	16%	0.164	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-65.5	-28.9	-179.4	-49.2	93.6	-39.1	0	0	112	L48 V51 I53 Y73 C79 L105	L48-Q81 PolarHBondContact O-NE2 3.42Å; V51-Q81 PolarHBondContact O-NE2 3.25Å; I53-Q81 HydrophobicContact CD1-CB 3.57Å; I53-Q81 HydrophobicContact CG1-CB 3.68Å; I53-Q81 HydrophobicContact CG1-CG 4.35Å; Y73-Q81 PolarHBondContact OH-NE2 3.38Å; Y73-Q81 PolarHBondContact OH-OE1 2.98Å; C79-Q81 VanDerWaalsContact C-N 3.26Å; C79-Q81 PolarHBondContact O-N 3.04Å; C79-Q81 PolarHBondContact SG-OE1 3.26Å; C79-Q81 VanDerWaalsContact SG-OE1 3.41Å; Q81-L105 VanDerWaalsContact O-CD1 3.28Å; Q81-L105 WeakPolarHBondContact O-CD1 3.43Å
82	L	87.5	Confident	82.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-97.5	8.8	176.7	-64.6	177.2	0	0	0	113.4	I53 C74 C79 P80 Q84 F85 Y86 A109 F113	I53-L82 HydrophobicContact CD1-CD2 3.74Å; I53-L82 HydrophobicContact CD1-CG 4.3Å; C74-L82 HydrophobicContact CB-CD1 4.12Å; C79-L82 PolarHBondContact O-N 3.36Å; P80-L82 PolarHBondContact O-N 3.07Å; L82-Q84 PolarHBondContact O-N 3.12Å; L82-F85 HydrophobicContact CB-CB 4.49Å; L82-F85 HydrophobicContact CD2-CB 4.43Å; L82-F85 WeakPolarHBondContact O-CA 3.48Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 3.21Å; L82-Y86 HydrophobicContact CB-CD2 3.91Å; L82-Y86 HydrophobicContact CB-CE2 3.7Å; L82-Y86 HydrophobicContact CD1-CE2 4.19Å; L82-Y86 VanDerWaalsContact O-CD2 3.29Å; L82-Y86 WeakPolarHBondContact O-CD2 3.43Å; L82-Y86 PolarHBondContact O-N 3.34Å; L82-A109 HydrophobicContact CD2-CB 3.87Å; L82-F113 HydrophobicContact CD1-CE2 3.94Å; L82-F113 HydrophobicContact CD1-CZ 3.78Å; L82-F113 HydrophobicContact CD2-CE2 4.43Å
83	S	84.9	Confident	81.1	Confident	47 Å²	47	45.4 Å²	45.4	33%	0.329	25%	0.247	S	C	.	.	H	α-helix	trans	-53.2	-48.4	179	55.5	0	0	0	0	112.9	C79 P80 F85 Y86 D87	C79-S83 PolarHBondContact O-N 3.49Å; P80-S83 VanDerWaalsContact O-CB 3.24Å; P80-S83 WeakPolarHBondContact O-CB 3.23Å; P80-S83 PolarHBondContact O-N 3.44Å; P80-S83 VanDerWaalsContact O-N 3.13Å; P80-S83 PolarHBondContact O-OG 3.42Å; S83-F85 VanDerWaalsContact C-N 3.27Å; S83-F85 PolarHBondContact O-N 3.45Å; S83-Y86 PolarHBondContact O-N 3.28Å; S83-D87 PolarHBondContact O-N 2.86Å
84	Q	83.4	Confident	79.6	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.028	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-27.1	176.3	-69.5	-179.1	1.7	0	0	113.7	L82 D87 P88 L93 T102 L105 Y106	L82-Q84 PolarHBondContact O-N 3.12Å; Q84-D87 CarbonylContact O-C 3.51Å; Q84-P88 VanDerWaalsContact O-CA 3.23Å; Q84-P88 WeakPolarHBondContact O-CA 3.41Å; Q84-L93 HydrophobicContact CG-CB 4.1Å; Q84-L93 PolarHBondContact NE2-O 3.28Å; Q84-L93 VanDerWaalsContact NE2-O 3.11Å; Q84-T102 PolarHBondContact OE1-OG1 3.12Å; Q84-L105 HydrophobicContact CB-CD2 3.94Å; Q84-L105 HydrophobicContact CG-CD2 4.47Å; Q84-Y106 PolarHBondContact O-OH 3.29Å; Q84-Y106 VanDerWaalsContact O-OH 3.1Å
85	F	88.8	Confident	78.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-76.6	-32.2	176.1	177.5	-97.5	0	0	0	111.9	L82 S83 Y106 F113 F128 H136 F176	L82-F85 HydrophobicContact CB-CB 4.49Å; L82-F85 HydrophobicContact CD2-CB 4.43Å; L82-F85 WeakPolarHBondContact O-CA 3.48Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 3.21Å; S83-F85 VanDerWaalsContact C-N 3.27Å; S83-F85 PolarHBondContact O-N 3.45Å; F85-Y106 HydrophobicContact CD2-CD1 4.1Å; F85-Y106 AromaticContact CD2-CE1 3.67Å; F85-Y106 HydrophobicContact CD2-CE1 3.67Å; F85-Y106 HydrophobicContact CE2-CE1 4.29Å; F85-F113 HydrophobicContact CD1-CE2 4.13Å; F85-F113 HydrophobicContact CE1-CD2 4.46Å; F85-F113 AromaticContact CE1-CE2 3.78Å; F85-F113 HydrophobicContact CE1-CE2 3.78Å; F85-F113 HydrophobicContact CE1-CZ 4.32Å; F85-F113 HydrophobicContact CZ-CE2 4.25Å; F85-F128 HydrophobicContact CZ-CZ 4.42Å; F85-H136 AromaticContact CD2-CE1 3.96Å; F85-H136 AromaticContact CE2-CE1 3.91Å; F85-H136 PolarHBondContact O-CE1 3.21Å; F85-H136 PolarHBondContact O-NE2 3.37Å; F85-F176 HydrophobicContact CD2-CD2 4.4Å; F85-F176 HydrophobicContact CE2-CB 4.42Å; F85-F176 HydrophobicContact CE2-CD1 4.08Å; F85-F176 AromaticContact CE2-CD2 3.53Å; F85-F176 HydrophobicContact CE2-CD2 3.53Å; F85-F176 HydrophobicContact CE2-CE1 4.24Å; F85-F176 AromaticContact CE2-CE2 3.73Å; F85-F176 HydrophobicContact CE2-CE2 3.73Å; F85-F176 AromaticContact CE2-CG 3.74Å; F85-F176 HydrophobicContact CE2-CG 3.74Å; F85-F176 HydrophobicContact CE2-CZ 4.08Å; F85-F176 HydrophobicContact CZ-CD2 4.05Å; F85-F176 HydrophobicContact CZ-CE1 4.26Å; F85-F176 AromaticContact CZ-CE2 3.73Å; F85-F176 HydrophobicContact CZ-CE2 3.73Å; F85-F176 HydrophobicContact CZ-CG 4.47Å; F85-F176 AromaticContact CZ-CZ 3.85Å; F85-F176 HydrophobicContact CZ-CZ 3.85Å
86	Y	88.4	Confident	76.9	Confident	60 Å²	60	51.8 Å²	51.8	24%	0.235	29%	0.291	C	S	.	.	H	α-helix	trans	-88.1	-24	177.4	-68.3	-57	0	0	0	114.1	C74 L82 S83 P88 F113	C74-Y86 WeakPolarHBondContact O-CE2 3.5Å; C74-Y86 PolarHBondContact O-OH 3.26Å; L82-Y86 HydrophobicContact CB-CD2 3.91Å; L82-Y86 HydrophobicContact CB-CE2 3.7Å; L82-Y86 HydrophobicContact CD1-CE2 4.19Å; L82-Y86 VanDerWaalsContact O-CD2 3.29Å; L82-Y86 WeakPolarHBondContact O-CD2 3.43Å; L82-Y86 PolarHBondContact O-N 3.34Å; S83-Y86 PolarHBondContact O-N 3.28Å; Y86-P88 VanDerWaalsContact C-CD 3.48Å; Y86-F113 WeakPolarHBondContact OH-CZ 3.29Å
87	D	86.6	Confident	75.8	Confident	75 Å²	75	55.9 Å²	55.9	40%	0.401	31%	0.307	S	S	.	.	S	Bend	trans	-126	65.5	175.6	-170.9	11.9	0	0	0	111.4	S83 Q84 H89 N90	S83-D87 PolarHBondContact O-N 2.86Å; Q84-D87 CarbonylContact O-C 3.51Å; D87-H89 PolarHBondContact O-N 2.96Å; D87-N90 HydrophobicContact CB-CB 4.36Å; D87-N90 VanDerWaalsContact CG-CB 3.42Å; D87-N90 WeakPolarHBondContact O-CB 3.44Å; D87-N90 PolarHBondContact O-N 3.04Å; D87-N90 WeakPolarHBondContact OD2-CB 3.32Å; D87-N90 PolarHBondContact OD2-ND2 3.34Å
88	P	87.4	Confident	75.3	Confident	2 Å²	2	53 Å²	53	1%	0.013	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.1	-169.2	34.2	-40.2	0	0	0	114	Q84 Y86 H94 Y106 R135 H136 A169	Q84-P88 VanDerWaalsContact O-CA 3.23Å; Q84-P88 WeakPolarHBondContact O-CA 3.41Å; Y86-P88 VanDerWaalsContact C-CD 3.48Å; P88-H94 PolarHBondContact O-NE2 3.3Å; P88-Y106 WeakPolarHBondContact CB-OH 3.35Å; P88-R135 WeakPolarHBondContact CG-O 3.25Å; P88-H136 VanDerWaalsContact CB-CD2 3.43Å; P88-H136 WeakPolarHBondContact CB-CD2 3.41Å; P88-H136 HydrophobicContact CG-CB 4.39Å; P88-A169 HydrophobicContact CB-CB 3.81Å; P88-A169 HydrophobicContact CG-CB 4.21Å
89	H	86.9	Confident	75.3	Confident	29 Å²	29	52.1 Å²	52.1	13%	0.134	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.8	176.9	-65	-57.2	0	0	0	113.3	D87 H91 R135 H136 C167 A169	D87-H89 PolarHBondContact O-N 2.96Å; H89-H91 PolarHBondContact O-CD2 3.16Å; H89-H91 PolarHBondContact O-N 3.07Å; H89-H91 VanDerWaalsContact O-N 3.12Å; H89-H91 PolarHBondContact O-NE2 3.36Å; H89-R135 PolarHBondContact CD2-O 3.34Å; H89-R135 PolarHBondContact NE2-O 3.09Å; H89-H136 PolarHBondContact CE1-O 3.41Å; H89-C167 PolarHBondContact ND1-SG 3.19Å; H89-A169 VanDerWaalsContact CE1-CB 3.43Å; H89-A169 WeakPolarHBondContact CE1-CB 3.28Å
90	N	82.1	Confident	74.9	Confident	47 Å²	47	59.7 Å²	59.7	25%	0.251	32%	0.317	S	S	.	.			trans	-80.9	91.5	174.3	-175.5	-25.2	0	0	0	110.6	D87 E92 L93 H94	D87-N90 HydrophobicContact CB-CB 4.36Å; D87-N90 VanDerWaalsContact CG-CB 3.42Å; D87-N90 WeakPolarHBondContact O-CB 3.44Å; D87-N90 PolarHBondContact O-N 3.04Å; D87-N90 WeakPolarHBondContact OD2-CB 3.32Å; D87-N90 PolarHBondContact OD2-ND2 3.34Å; N90-E92 VanDerWaalsContact C-N 3.29Å; N90-E92 PolarHBondContact O-N 3.46Å; N90-E92 PolarHBondContact OD1-N 2.88Å; N90-L93 HydrophobicContact CB-CD1 4.05Å; N90-L93 HydrophobicContact CB-CG 4.5Å; N90-L93 WeakPolarHBondContact O-CB 3.1Å; N90-L93 PolarHBondContact O-N 3.32Å; N90-L93 PolarHBondContact OD1-N 2.85Å; N90-H94 PolarHBondContact O-CD2 3.1Å; N90-H94 PolarHBondContact O-N 2.98Å
91	H	75.2	Confident	74.7	Confident	36 Å²	36	59.5 Å²	59.5	17%	0.167	32%	0.317	C	S	.	.	H	α-helix	trans	-75.5	-15.7	-173.9	-65.8	-64.5	0	0	0	114.3	H89 H94 S95 C160 I162	H89-H91 PolarHBondContact O-CD2 3.16Å; H89-H91 PolarHBondContact O-N 3.07Å; H89-H91 VanDerWaalsContact O-N 3.12Å; H89-H91 PolarHBondContact O-NE2 3.36Å; H91-H94 PolarHBondContact O-N 2.83Å; H91-S95 WeakPolarHBondContact O-CB 3.48Å; H91-S95 PolarHBondContact O-N 3.45Å; H91-C160 PolarHBondContact NE2-SG 3.45Å; H91-I162 HydrophobicContact CB-CD1 3.61Å; H91-I162 HydrophobicContact CB-CG1 4.46Å; H91-I162 VanDerWaalsContact CD2-CD1 3.45Å; H91-I162 WeakPolarHBondContact CD2-CD1 3.42Å
92	E	67.4	Low	74.7	Confident	157 Å²	157	58.1 Å²	58.1	73%	0.734	31%	0.311	S	S	*	.	H	α-helix	trans	-64.4	-46.5	169.9	-63.6	-179.4	-178.7	0	0	109.7	N90 H94 S95 V96	N90-E92 VanDerWaalsContact C-N 3.29Å; N90-E92 PolarHBondContact O-N 3.46Å; N90-E92 PolarHBondContact OD1-N 2.88Å; E92-H94 VanDerWaalsContact C-N 3.3Å; E92-H94 PolarHBondContact O-N 2.8Å; E92-S95 PolarHBondContact O-N 3.04Å; E92-S95 VanDerWaalsContact O-N 3.13Å; E92-S95 PolarHBondContact O-OG 3.23Å; E92-V96 PolarHBondContact O-N 3.48Å
93	L	59.7	Low	74.6	Confident	54 Å²	54	59.9 Å²	59.9	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-58	-39.2	172.9	-74	171.6	0	0	0	112.7	Q84 N90 F97	Q84-L93 HydrophobicContact CG-CB 4.1Å; Q84-L93 PolarHBondContact NE2-O 3.28Å; Q84-L93 VanDerWaalsContact NE2-O 3.11Å; N90-L93 HydrophobicContact CB-CD1 4.05Å; N90-L93 HydrophobicContact CB-CG 4.5Å; N90-L93 WeakPolarHBondContact O-CB 3.1Å; N90-L93 PolarHBondContact O-N 3.32Å; N90-L93 PolarHBondContact OD1-N 2.85Å; L93-F97 WeakPolarHBondContact O-CD2 3.29Å
94	H	58.5	Low	74.7	Confident	23 Å²	23	60.8 Å²	60.8	11%	0.106	33%	0.326	C	S	.	.	H	α-helix	trans	-72.5	-28	177.3	-69.6	-68.9	0	0	0	113.4	P88 N90 H91 E92 V96 T102	P88-H94 PolarHBondContact O-NE2 3.3Å; N90-H94 PolarHBondContact O-CD2 3.1Å; N90-H94 PolarHBondContact O-N 2.98Å; H91-H94 PolarHBondContact O-N 2.83Å; E92-H94 VanDerWaalsContact C-N 3.3Å; E92-H94 PolarHBondContact O-N 2.8Å; H94-V96 VanDerWaalsContact C-N 3.32Å; H94-V96 PolarHBondContact O-N 3.29Å; H94-T102 WeakPolarHBondContact ND1-CG2 3.43Å
95	S	58.5	Low	74.9	Confident	97 Å²	97	61.8 Å²	61.8	68%	0.678	33%	0.331	S	S	*	.	H	α-helix	trans	-71.4	-25.7	179.6	74	0	0	0	0	113.8	H91 E92	H91-S95 WeakPolarHBondContact O-CB 3.48Å; H91-S95 PolarHBondContact O-N 3.45Å; E92-S95 PolarHBondContact O-N 3.04Å; E92-S95 VanDerWaalsContact O-N 3.13Å; E92-S95 PolarHBondContact O-OG 3.23Å
96	V	55.2	Low	75	Confident	114 Å²	114	61.8 Å²	61.8	69%	0.691	33%	0.331	S	S	*	.	H	α-helix	trans	-76.8	-24.3	179.9	174.8	0	0	0	0	112.1	E92 H94	E92-V96 PolarHBondContact O-N 3.48Å; H94-V96 VanDerWaalsContact C-N 3.32Å; H94-V96 PolarHBondContact O-N 3.29Å
97	F	56.7	Low	75.2	Confident	107 Å²	107	63.5 Å²	63.5	47%	0.469	34%	0.339	S	S	.	.	S	Bend	trans	-107.1	145.4	-178.3	-71.5	-95.4	0	0	0	111.1	L93 S99 C101	L93-F97 WeakPolarHBondContact O-CD2 3.29Å; F97-S99 PolarHBondContact O-N 3.42Å; F97-C101 HydrophobicContact CB-CB 4.33Å; F97-C101 HydrophobicContact CD1-CB 4.24Å
98	S	60.1	Low	75.4	Confident	68 Å²	68	63.1 Å²	63.1	48%	0.476	34%	0.335	S	S	.	.			trans	-59.2	139.9	166.1	-179.2	0	0	0	0	109.3	R100 C101 T102	S98-R100 PolarHBondContact O-N 3.41Å; S98-C101 WeakPolarHBondContact O-CA 3.46Å; S98-C101 VanDerWaalsContact O-CB 3.29Å; S98-C101 WeakPolarHBondContact O-CB 3.34Å; S98-C101 PolarHBondContact O-N 2.73Å; S98-T102 PolarHBondContact O-N 2.99Å
99	S	68.6	Low	75.7	Confident	63 Å²	63	63 Å²	63	44%	0.441	34%	0.335	S	S	.	.	H	α-helix	trans	-51.5	-32.3	175.4	55.9	0	0	0	0	112.8	F97 T102 V103	F97-S99 PolarHBondContact O-N 3.42Å; S99-T102 PolarHBondContact O-N 2.76Å; S99-V103 WeakPolarHBondContact O-CG2 3.4Å; S99-V103 PolarHBondContact O-N 2.66Å
100	R	73.7	Confident	76	Confident	164 Å²	164	61.7 Å²	61.7	62%	0.619	33%	0.328	S	S	*	.	H	α-helix	trans	-63.6	-37.5	173.5	-65.6	-176.6	176.3	-175.1	-1.5	113.1	S98 T104	S98-R100 PolarHBondContact O-N 3.41Å; R100-T104 WeakPolarHBondContact O-CB 3.42Å; R100-T104 PolarHBondContact O-N 3.2Å; R100-T104 PolarHBondContact O-OG1 3.09Å
101	C	77.1	Confident	76.5	Confident	66 Å²	66	61.3 Å²	61.3	45%	0.446	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-44.8	176.7	-62.6	0	0	0	0	110.9	F97 S98 T104 L105	F97-C101 HydrophobicContact CB-CB 4.33Å; F97-C101 HydrophobicContact CD1-CB 4.24Å; S98-C101 WeakPolarHBondContact O-CA 3.46Å; S98-C101 VanDerWaalsContact O-CB 3.29Å; S98-C101 WeakPolarHBondContact O-CB 3.34Å; S98-C101 PolarHBondContact O-N 2.73Å; C101-T104 WeakPolarHBondContact O-CB 3.26Å; C101-T104 PolarHBondContact O-N 3.4Å; C101-L105 WeakPolarHBondContact O-CB 3.37Å; C101-L105 PolarHBondContact O-N 3.45Å
102	T	81.5	Confident	77.4	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-43.6	177.1	-53.9	0	0	0	0	112.1	Q84 H94 S98 S99 T104 L105 Y106 L172	Q84-T102 PolarHBondContact OE1-OG1 3.12Å; H94-T102 WeakPolarHBondContact ND1-CG2 3.43Å; S98-T102 PolarHBondContact O-N 2.99Å; S99-T102 PolarHBondContact O-N 2.76Å; T102-T104 VanDerWaalsContact C-N 3.31Å; T102-T104 PolarHBondContact O-N 3.19Å; T102-L105 WeakPolarHBondContact O-CB 3.03Å; T102-L105 PolarHBondContact O-N 3.19Å; T102-Y106 HydrophobicContact CG2-CD2 4.14Å; T102-Y106 HydrophobicContact CG2-CE2 4.15Å; T102-Y106 WeakPolarHBondContact O-CD2 3.25Å; T102-Y106 PolarHBondContact O-N 2.9Å; T102-L172 HydrophobicContact CG2-CD1 3.54Å; T102-L172 HydrophobicContact CG2-CD2 3.81Å; T102-L172 HydrophobicContact CG2-CG 4.33Å
103	V	85.5	Confident	78.6	Confident	37 Å²	37	52.1 Å²	52.1	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-41.6	174.7	170	0	0	0	0	111.1	S99 Y106 K107 F171 L172 V175	S99-V103 WeakPolarHBondContact O-CG2 3.4Å; S99-V103 PolarHBondContact O-N 2.66Å; V103-Y106 PolarHBondContact O-N 2.86Å; V103-K107 WeakPolarHBondContact O-CG 3.44Å; V103-K107 PolarHBondContact O-N 2.97Å; V103-K107 VanDerWaalsContact O-N 3.1Å; V103-F171 HydrophobicContact CG2-CE1 4.1Å; V103-L172 HydrophobicContact CG2-CD2 3.95Å; V103-V175 HydrophobicContact CG1-CG1 4.22Å
104	T	86.7	Confident	80.3	Confident	67 Å²	67	53.3 Å²	53.3	41%	0.411	28%	0.284	S	S	.	.	H	α-helix	trans	-64.2	-42.8	176.7	-59.5	0	0	0	0	111.9	R100 C101 T102 Y106 K107 H108	R100-T104 WeakPolarHBondContact O-CB 3.42Å; R100-T104 PolarHBondContact O-N 3.2Å; R100-T104 PolarHBondContact O-OG1 3.09Å; C101-T104 WeakPolarHBondContact O-CB 3.26Å; C101-T104 PolarHBondContact O-N 3.4Å; T102-T104 VanDerWaalsContact C-N 3.31Å; T102-T104 PolarHBondContact O-N 3.19Å; T104-Y106 PolarHBondContact O-N 3.26Å; T104-K107 PolarHBondContact O-N 3.29Å; T104-H108 WeakPolarHBondContact CG2-NE2 3.45Å; T104-H108 PolarHBondContact O-CD2 3.08Å; T104-H108 PolarHBondContact O-N 2.79Å
105	L	88.9	Confident	81.8	Confident	27 Å²	27	55.2 Å²	55.2	14%	0.141	29%	0.29	C	S	.	.	H	α-helix	trans	-55.1	-49.3	172.9	167.6	61.6	0	0	0	111.5	I53 Q81 Q84 C101 T102 K107 H108 A109	I53-L105 HydrophobicContact CD1-CD1 3.22Å; Q81-L105 VanDerWaalsContact O-CD1 3.28Å; Q81-L105 WeakPolarHBondContact O-CD1 3.43Å; Q84-L105 HydrophobicContact CB-CD2 3.94Å; Q84-L105 HydrophobicContact CG-CD2 4.47Å; C101-L105 WeakPolarHBondContact O-CB 3.37Å; C101-L105 PolarHBondContact O-N 3.45Å; T102-L105 WeakPolarHBondContact O-CB 3.03Å; T102-L105 PolarHBondContact O-N 3.19Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 3.05Å; L105-H108 PolarHBondContact O-N 3.43Å; L105-A109 WeakPolarHBondContact O-CB 3.3Å; L105-A109 PolarHBondContact O-N 3.05Å
106	Y	91	Very high	83.4	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-34.6	179.9	-90.6	-103.3	0	0	0	113.1	Q84 F85 P88 T102 V103 T104 G110 H136 L172 F176	Q84-Y106 PolarHBondContact O-OH 3.29Å; Q84-Y106 VanDerWaalsContact O-OH 3.1Å; F85-Y106 HydrophobicContact CD2-CD1 4.1Å; F85-Y106 AromaticContact CD2-CE1 3.67Å; F85-Y106 HydrophobicContact CD2-CE1 3.67Å; F85-Y106 HydrophobicContact CE2-CE1 4.29Å; P88-Y106 WeakPolarHBondContact CB-OH 3.35Å; T102-Y106 HydrophobicContact CG2-CD2 4.14Å; T102-Y106 HydrophobicContact CG2-CE2 4.15Å; T102-Y106 WeakPolarHBondContact O-CD2 3.25Å; T102-Y106 PolarHBondContact O-N 2.9Å; V103-Y106 PolarHBondContact O-N 2.86Å; T104-Y106 PolarHBondContact O-N 3.26Å; Y106-G110 PolarHBondContact O-N 3.32Å; Y106-H136 AromaticContact CE1-CD2 3.85Å; Y106-H136 AromaticContact CE1-NE2 3.25Å; Y106-H136 VanDerWaalsContact CE1-NE2 3.25Å; Y106-H136 WeakPolarHBondContact CE1-NE2 2.75Å; Y106-H136 AromaticContact CZ-NE2 3.44Å; Y106-H136 PolarHBondContact OH-CD2 3.27Å; Y106-H136 PolarHBondContact OH-NE2 2.9Å; Y106-L172 HydrophobicContact CD1-CB 3.64Å; Y106-L172 WeakPolarHBondContact CD1-O 3.39Å; Y106-L172 HydrophobicContact CD2-CB 3.95Å; Y106-L172 HydrophobicContact CD2-CD1 4.33Å; Y106-L172 HydrophobicContact CD2-CD2 4.14Å; Y106-L172 HydrophobicContact CD2-CG 4.36Å; Y106-L172 HydrophobicContact CE1-CB 3.52Å; Y106-L172 HydrophobicContact CE2-CB 3.83Å; Y106-L172 HydrophobicContact CE2-CD1 3.86Å; Y106-L172 HydrophobicContact CE2-CD2 4.5Å; Y106-L172 HydrophobicContact CE2-CG 4.28Å; Y106-L172 HydrophobicContact CG-CB 3.83Å; Y106-L172 HydrophobicContact CG-CD2 4.36Å; Y106-F176 HydrophobicContact CD1-CB 3.69Å
107	K	91.6	Very high	85.1	Confident	95 Å²	95	47.1 Å²	47.1	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-46.6	171.9	-70.4	-176.2	177.4	-174.1	0	112.2	V103 T104 L105 G110 N111 V175 E179	V103-K107 WeakPolarHBondContact O-CG 3.44Å; V103-K107 PolarHBondContact O-N 2.97Å; V103-K107 VanDerWaalsContact O-N 3.1Å; T104-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 3.05Å; K107-G110 PolarHBondContact O-N 3.35Å; K107-N111 PolarHBondContact O-N 3.31Å; K107-V175 HydrophobicContact CD-CG1 4.48Å; K107-V175 HydrophobicContact CG-CG1 3.51Å; K107-E179 HydrophobicContact CB-CG 3.97Å; K107-E179 HydrophobicContact CG-CG 3.94Å
108	H	91.9	Very high	86.7	Confident	68 Å²	68	47 Å²	47	32%	0.315	23%	0.234	S	C	.	.	H	α-helix	trans	-64.8	-39.2	177.4	-68.3	-53.6	0	0	0	112.2	I53 T104 L105 N111 L112	I53-H108 HydrophobicContact CB-CB 4.28Å; I53-H108 HydrophobicContact CG2-CB 3.69Å; T104-H108 WeakPolarHBondContact CG2-NE2 3.45Å; T104-H108 PolarHBondContact O-CD2 3.08Å; T104-H108 PolarHBondContact O-N 2.79Å; L105-H108 PolarHBondContact O-N 3.43Å; H108-N111 PolarHBondContact O-N 3.31Å; H108-L112 WeakPolarHBondContact O-CB 3.2Å; H108-L112 PolarHBondContact O-N 3.48Å
109	A	92.6	Very high	88.1	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-46.3	172.9	0	0	0	0	0	111.5	L82 L105 N111 L112 F113 F176	L82-A109 HydrophobicContact CD2-CB 3.87Å; L105-A109 WeakPolarHBondContact O-CB 3.3Å; L105-A109 PolarHBondContact O-N 3.05Å; A109-N111 VanDerWaalsContact C-N 3.35Å; A109-N111 PolarHBondContact O-N 2.86Å; A109-L112 PolarHBondContact O-N 3.06Å; A109-F113 HydrophobicContact CB-CD2 4.41Å; A109-F113 WeakPolarHBondContact O-CB 3.5Å; A109-F113 WeakPolarHBondContact O-CD2 3.39Å; A109-F113 PolarHBondContact O-N 3.09Å; A109-F176 HydrophobicContact CB-CD2 4.38Å
110	G	93.7	Very high	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.8	-45	177.1	0	0	0	0	0	112.4	Y106 K107 R114 F176	Y106-G110 PolarHBondContact O-N 3.32Å; K107-G110 PolarHBondContact O-N 3.35Å; G110-R114 VanDerWaalsContact O-CB 3.26Å; G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 PolarHBondContact O-N 3.04Å; G110-F176 VanDerWaalsContact CA-CD2 3.42Å
111	N	93.2	Very high	90.1	Very high	39 Å²	39	48 Å²	48	21%	0.209	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-42.5	177.2	-166.2	6.2	0	0	0	112.9	M57 K107 H108 A109 R114 R115	M57-N111 HydrophobicContact SD-CB 3.76Å; M57-N111 VanDerWaalsContact SD-CG 3.54Å; K107-N111 PolarHBondContact O-N 3.31Å; H108-N111 PolarHBondContact O-N 3.31Å; A109-N111 VanDerWaalsContact C-N 3.35Å; A109-N111 PolarHBondContact O-N 2.86Å; N111-R114 WeakPolarHBondContact O-CB 3.04Å; N111-R114 PolarHBondContact O-N 2.75Å; N111-R114 PolarHBondContact OD1-NH2 3.37Å; N111-R115 PolarHBondContact O-N 3.41Å
112	L	92.9	Very high	91	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.1	-52	176	175.2	60.5	0	0	0	111.1	I53 L56 M57 I70 H108 A109 R114 R115 I116	I53-L112 HydrophobicContact CG2-CB 4.27Å; I53-L112 HydrophobicContact CG2-CD2 3.92Å; L56-L112 HydrophobicContact CB-CD2 4.43Å; L56-L112 HydrophobicContact CD1-CD2 4.4Å; M57-L112 HydrophobicContact CG-CB 3.94Å; M57-L112 HydrophobicContact CG-CD1 3.86Å; M57-L112 HydrophobicContact CG-CG 4.48Å; M57-L112 HydrophobicContact SD-CB 4.35Å; I70-L112 HydrophobicContact CG2-CD1 4.31Å; H108-L112 WeakPolarHBondContact O-CB 3.2Å; H108-L112 PolarHBondContact O-N 3.48Å; A109-L112 PolarHBondContact O-N 3.06Å; L112-R114 VanDerWaalsContact C-N 3.3Å; L112-R114 PolarHBondContact O-N 3.22Å; L112-R115 WeakPolarHBondContact O-CB 3.44Å; L112-R115 PolarHBondContact O-N 3.24Å; L112-R115 VanDerWaalsContact O-N 3.07Å; L112-I116 HydrophobicContact CD1-CD1 4.08Å; L112-I116 HydrophobicContact CD1-CG1 4.32Å; L112-I116 HydrophobicContact CG-CD1 3.89Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.41Å
113	F	93.9	Very high	91.6	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-33.5	179.1	-76.7	-64.6	0	0	0	112.3	C74 L82 F85 Y86 A109 R115 I116 Y117 F128 F176 F180	C74-F113 HydrophobicContact CB-CE1 4.09Å; C74-F113 HydrophobicContact CB-CZ 4.22Å; L82-F113 HydrophobicContact CD1-CE2 3.94Å; L82-F113 HydrophobicContact CD1-CZ 3.78Å; L82-F113 HydrophobicContact CD2-CE2 4.43Å; F85-F113 HydrophobicContact CD1-CE2 4.13Å; F85-F113 HydrophobicContact CE1-CD2 4.46Å; F85-F113 AromaticContact CE1-CE2 3.78Å; F85-F113 HydrophobicContact CE1-CE2 3.78Å; F85-F113 HydrophobicContact CE1-CZ 4.32Å; F85-F113 HydrophobicContact CZ-CE2 4.25Å; Y86-F113 WeakPolarHBondContact OH-CZ 3.29Å; A109-F113 HydrophobicContact CB-CD2 4.41Å; A109-F113 WeakPolarHBondContact O-CB 3.5Å; A109-F113 WeakPolarHBondContact O-CD2 3.39Å; A109-F113 PolarHBondContact O-N 3.09Å; F113-R115 PolarHBondContact O-N 3.07Å; F113-I116 HydrophobicContact CD1-CD1 3.87Å; F113-I116 HydrophobicContact CE1-CD1 4.14Å; F113-I116 PolarHBondContact O-N 3.1Å; F113-Y117 HydrophobicContact CB-CD2 4.45Å; F113-Y117 HydrophobicContact CD1-CD2 4.3Å; F113-Y117 HydrophobicContact CD1-CE2 4Å; F113-Y117 WeakPolarHBondContact O-CB 3.39Å; F113-Y117 WeakPolarHBondContact O-CD2 3.39Å; F113-Y117 PolarHBondContact O-N 3.37Å; F113-F128 HydrophobicContact CB-CE1 3.85Å; F113-F128 HydrophobicContact CB-CZ 3.93Å; F113-F128 HydrophobicContact CD1-CE1 4.11Å; F113-F128 AromaticContact CD1-CE2 3.99Å; F113-F128 HydrophobicContact CD1-CE2 3.99Å; F113-F128 AromaticContact CD1-CZ 3.46Å; F113-F128 HydrophobicContact CD1-CZ 3.46Å; F113-F128 VanDerWaalsContact CD1-CZ 3.46Å; F113-F128 AromaticContact CD2-CZ 3.82Å; F113-F128 HydrophobicContact CD2-CZ 3.82Å; F113-F128 AromaticContact CE1-CE2 3.97Å; F113-F128 HydrophobicContact CE1-CE2 3.97Å; F113-F128 AromaticContact CE1-CZ 3.83Å; F113-F128 HydrophobicContact CE1-CZ 3.83Å; F113-F128 HydrophobicContact CE2-CZ 4.15Å; F113-F128 AromaticContact CG-CE1 3.93Å; F113-F128 HydrophobicContact CG-CE1 3.93Å; F113-F128 HydrophobicContact CG-CE2 4.4Å; F113-F128 AromaticContact CG-CZ 3.46Å; F113-F128 HydrophobicContact CG-CZ 3.46Å; F113-F128 VanDerWaalsContact CG-CZ 3.46Å; F113-F128 HydrophobicContact CZ-CE2 4.37Å; F113-F128 HydrophobicContact CZ-CZ 4.16Å; F113-F176 HydrophobicContact CB-CE2 4.25Å; F113-F176 AromaticContact CD2-CE2 3.91Å; F113-F176 HydrophobicContact CD2-CE2 3.91Å; F113-F176 HydrophobicContact CG-CE2 4.45Å; F113-F180 HydrophobicContact CB-CD2 3.76Å; F113-F180 HydrophobicContact CB-CE2 3.79Å; F113-F180 WeakPolarHBondContact O-CE2 3.45Å
114	R	93.6	Very high	92.1	Very high	79 Å²	79	56.4 Å²	56.4	30%	0.298	25%	0.254	S	S	.	.	H	α-helix	trans	-57.1	-38.1	171.9	-178.9	174.4	61.5	141.9	-2.4	112.3	G110 N111 L112 Q118 E179 F180 I182	G110-R114 VanDerWaalsContact O-CB 3.26Å; G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 PolarHBondContact O-N 3.04Å; N111-R114 WeakPolarHBondContact O-CB 3.04Å; N111-R114 PolarHBondContact O-N 2.75Å; N111-R114 PolarHBondContact OD1-NH2 3.37Å; L112-R114 VanDerWaalsContact C-N 3.3Å; L112-R114 PolarHBondContact O-N 3.22Å; R114-Q118 WeakPolarHBondContact O-CA 3.49Å; R114-Q118 WeakPolarHBondContact O-CB 3.29Å; R114-Q118 PolarHBondContact O-N 3.04Å; R114-E179 WeakPolarHBondContact CD-O 3.48Å; R114-E179 PolarHBondContact NE-O 2.83Å; R114-F180 HydrophobicContact CB-CD2 4.32Å; R114-F180 WeakPolarHBondContact CB-O 3.15Å; R114-F180 VanDerWaalsContact CD-O 3.32Å; R114-F180 WeakPolarHBondContact CD-O 3.34Å; R114-F180 VanDerWaalsContact CG-O 3.24Å; R114-F180 WeakPolarHBondContact CG-O 3.1Å; R114-I182 PolarHBondContact NH1-O 3.01Å
115	R	91.1	Very high	92.5	Very high	62 Å²	62	54.8 Å²	54.8	23%	0.234	24%	0.241	C	C	.	.	H	α-helix	trans	-73.2	-47.2	175.9	-69.7	174.4	167.8	-142.9	-15.4	112.1	M57 E61 N111 L112 F113 Y117 Q118	M57-R115 PolarHBondContact O-NH1 3.45Å; E61-R115 IonicContact OE1-CZ 2.66Å; E61-R115 IonicContact OE1-NH1 3.69Å; E61-R115 PolarHBondContact OE1-NH1 2.84Å; E61-R115 IonicContact OE1-NH2 3.28Å; E61-R115 PolarHBondContact OE1-NH2 2.68Å; N111-R115 PolarHBondContact O-N 3.41Å; L112-R115 WeakPolarHBondContact O-CB 3.44Å; L112-R115 PolarHBondContact O-N 3.24Å; L112-R115 VanDerWaalsContact O-N 3.07Å; F113-R115 PolarHBondContact O-N 3.07Å; R115-Y117 VanDerWaalsContact C-N 3.3Å; R115-Y117 PolarHBondContact O-N 3.31Å; R115-Q118 VanDerWaalsContact O-CB 3.29Å; R115-Q118 WeakPolarHBondContact O-CB 3.48Å; R115-Q118 PolarHBondContact O-N 2.96Å; R115-Q118 VanDerWaalsContact O-N 3.13Å
116	I	91.4	Very high	92.8	Very high	10 Å²	10	54.6 Å²	54.6	5%	0.051	24%	0.24	C	C	.	.	H	α-helix	trans	-54.1	-49.4	176	-65.1	169	0	0	0	110.4	W60 E71 C74 L112 F113 Q118	W60-I116 HydrophobicContact CE3-CG1 3.93Å; W60-I116 HydrophobicContact CH2-CB 4.1Å; W60-I116 HydrophobicContact CH2-CG1 3.95Å; W60-I116 HydrophobicContact CH2-CG2 4.17Å; W60-I116 HydrophobicContact CZ2-CG1 4.49Å; W60-I116 HydrophobicContact CZ3-CB 4.27Å; W60-I116 HydrophobicContact CZ3-CG1 3.61Å; W60-I116 HydrophobicContact CZ3-CG2 4.41Å; E71-I116 HydrophobicContact CB-CG2 4.36Å; E71-I116 HydrophobicContact CG-CG2 4.06Å; C74-I116 HydrophobicContact CB-CD1 4.29Å; L112-I116 HydrophobicContact CD1-CD1 4.08Å; L112-I116 HydrophobicContact CD1-CG1 4.32Å; L112-I116 HydrophobicContact CG-CD1 3.89Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.41Å; F113-I116 HydrophobicContact CD1-CD1 3.87Å; F113-I116 HydrophobicContact CE1-CD1 4.14Å; F113-I116 PolarHBondContact O-N 3.1Å; I116-Q118 PolarHBondContact O-N 3.11Å
117	Y	92.1	Very high	93	Very high	31 Å²	31	58.9 Å²	58.9	12%	0.122	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-3	-178	-77.8	-87	0	0	0	114.2	F113 R115 Y119 Q120 K125 F128 F180	F113-Y117 HydrophobicContact CB-CD2 4.45Å; F113-Y117 HydrophobicContact CD1-CD2 4.3Å; F113-Y117 HydrophobicContact CD1-CE2 4Å; F113-Y117 WeakPolarHBondContact O-CB 3.39Å; F113-Y117 WeakPolarHBondContact O-CD2 3.39Å; F113-Y117 PolarHBondContact O-N 3.37Å; R115-Y117 VanDerWaalsContact C-N 3.3Å; R115-Y117 PolarHBondContact O-N 3.31Å; Y117-Y119 VanDerWaalsContact C-N 3.3Å; Y117-Y119 PolarHBondContact O-N 2.88Å; Y117-Y119 VanDerWaalsContact O-N 3.09Å; Y117-Q120 HydrophobicContact CD1-CB 4.03Å; Y117-Q120 HydrophobicContact CD1-CG 3.88Å; Y117-Q120 WeakPolarHBondContact O-CB 3.42Å; Y117-Q120 PolarHBondContact O-N 3.42Å; Y117-K125 HydrophobicContact CD1-CG 4.33Å; Y117-K125 WeakPolarHBondContact O-CE 3.27Å; Y117-K125 PolarHBondContact O-NZ 3.39Å; Y117-F128 AromaticContact CD2-CD1 3.94Å; Y117-F128 HydrophobicContact CD2-CD1 3.94Å; Y117-F128 HydrophobicContact CD2-CE1 4.13Å; Y117-F128 HydrophobicContact CD2-CG 4.28Å; Y117-F128 HydrophobicContact CE1-CB 3.77Å; Y117-F128 HydrophobicContact CE1-CG 4.11Å; Y117-F128 HydrophobicContact CE2-CB 4.14Å; Y117-F128 AromaticContact CE2-CD1 3.62Å; Y117-F128 HydrophobicContact CE2-CD1 3.62Å; Y117-F128 AromaticContact CE2-CD2 3.72Å; Y117-F128 HydrophobicContact CE2-CD2 3.72Å; Y117-F128 AromaticContact CE2-CE1 3.87Å; Y117-F128 HydrophobicContact CE2-CE1 3.87Å; Y117-F128 AromaticContact CE2-CE2 3.99Å; Y117-F128 HydrophobicContact CE2-CE2 3.99Å; Y117-F128 AromaticContact CE2-CG 3.54Å; Y117-F128 HydrophobicContact CE2-CG 3.54Å; Y117-F128 HydrophobicContact CE2-CZ 4.07Å; Y117-F128 AromaticContact CZ-CD1 3.98Å; Y117-F128 AromaticContact CZ-CD2 3.69Å; Y117-F128 AromaticContact CZ-CG 3.46Å; Y117-F128 VanDerWaalsContact CZ-CG 3.46Å; Y117-F128 VanDerWaalsContact OH-CD2 3.3Å; Y117-F128 WeakPolarHBondContact OH-CD2 3.29Å; Y117-F180 HydrophobicContact CD2-CE2 4.11Å; Y117-F180 HydrophobicContact CD2-CZ 4.4Å; Y117-F180 HydrophobicContact CG-CE2 4.35Å; Y117-F180 HydrophobicContact CG-CZ 4.26Å
118	Q	89.9	Confident	93.2	Very high	104 Å²	104	55.1 Å²	55.1	49%	0.486	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-48.8	-168.8	-176.8	175.8	3.5	0	0	113.1	R114 R115 I116 K125	R114-Q118 WeakPolarHBondContact O-CA 3.49Å; R114-Q118 WeakPolarHBondContact O-CB 3.29Å; R114-Q118 PolarHBondContact O-N 3.04Å; R115-Q118 VanDerWaalsContact O-CB 3.29Å; R115-Q118 WeakPolarHBondContact O-CB 3.48Å; R115-Q118 PolarHBondContact O-N 2.96Å; R115-Q118 VanDerWaalsContact O-N 3.13Å; I116-Q118 PolarHBondContact O-N 3.11Å; Q118-K125 PolarHBondContact O-NZ 3.3Å
119	Y	88.3	Confident	93.3	Very high	194 Å²	194	51.9 Å²	51.9	76%	0.761	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-0.8	-177.2	-57.1	-74.5	0	0	0	114.4	Y117	Y117-Y119 VanDerWaalsContact C-N 3.3Å; Y117-Y119 PolarHBondContact O-N 2.88Å; Y117-Y119 VanDerWaalsContact O-N 3.09Å
120	Q	91.5	Very high	93.4	Very high	63 Å²	63	54.4 Å²	54.4	29%	0.294	24%	0.241	S	C	.	.	S	Bend	trans	-72.3	146.7	176.9	-64.4	-68.6	-9	0	0	111.1	Y117 R124 K125	Y117-Q120 HydrophobicContact CD1-CB 4.03Å; Y117-Q120 HydrophobicContact CD1-CG 3.88Å; Y117-Q120 WeakPolarHBondContact O-CB 3.42Å; Y117-Q120 PolarHBondContact O-N 3.42Å; Q120-R124 HydrophobicContact CB-CB 4.2Å; Q120-K125 HydrophobicContact CB-CG 4.35Å; Q120-K125 WeakPolarHBondContact O-CE 3.44Å; Q120-K125 PolarHBondContact O-NZ 2.87Å
121	P	94.8	Very high	93.3	Very high	61 Å²	61	56.8 Å²	56.8	40%	0.396	26%	0.257	S	S	.	.			trans	-65.4	152.1	175.5	29.2	-35.6	0	0	0	110.8	F123 R124 K125	P121-F123 VanDerWaalsContact C-N 3.25Å; P121-F123 HydrophobicContact CB-CD1 3.81Å; P121-F123 HydrophobicContact CB-CE1 3.69Å; P121-F123 HydrophobicContact CG-CD1 3.83Å; P121-F123 HydrophobicContact CG-CE1 3.32Å; P121-F123 HydrophobicContact CG-CZ 3.91Å; P121-F123 PolarHBondContact O-N 3.07Å; P121-F123 VanDerWaalsContact O-N 3.11Å; P121-R124 HydrophobicContact CG-CB 4.36Å; P121-R124 HydrophobicContact CG-CG 3.94Å; P121-R124 WeakPolarHBondContact O-CB 3.42Å; P121-R124 PolarHBondContact O-N 3.25Å; P121-K125 PolarHBondContact O-N 2.92Å
122	L	94.1	Very high	93.3	Very high	36 Å²	36	54.9 Å²	54.9	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-53.4	-39.4	-171.6	-176.2	65.5	0	0	0	113.3	R124 K125 L126 W184 N188	L122-R124 VanDerWaalsContact C-N 3.3Å; L122-R124 PolarHBondContact O-N 3.37Å; L122-K125 WeakPolarHBondContact O-CB 3.3Å; L122-K125 PolarHBondContact O-N 2.99Å; L122-K125 VanDerWaalsContact O-N 3.12Å; L122-L126 HydrophobicContact CD1-CG 4.3Å; L122-L126 HydrophobicContact CD2-CD1 4.39Å; L122-L126 HydrophobicContact CG-CD1 3.97Å; L122-L126 HydrophobicContact CG-CG 4.2Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.13Å; L122-W184 HydrophobicContact CD1-CE3 4.49Å; L122-W184 HydrophobicContact CD1-CH2 4.31Å; L122-W184 HydrophobicContact CD1-CZ3 3.73Å; L122-N188 HydrophobicContact CD1-CB 4.28Å; L122-N188 WeakPolarHBondContact CD2-OD1 3.4Å
123	F	95.3	Very high	93.4	Very high	130 Å²	130	54.9 Å²	54.9	57%	0.57	25%	0.247	S	C	*	.	H	α-helix	trans	-61.6	-34.7	179.9	78.5	-93.4	0	0	0	113.2	P121 Q127	P121-F123 VanDerWaalsContact C-N 3.25Å; P121-F123 HydrophobicContact CB-CD1 3.81Å; P121-F123 HydrophobicContact CB-CE1 3.69Å; P121-F123 HydrophobicContact CG-CD1 3.83Å; P121-F123 HydrophobicContact CG-CE1 3.32Å; P121-F123 HydrophobicContact CG-CZ 3.91Å; P121-F123 PolarHBondContact O-N 3.07Å; P121-F123 VanDerWaalsContact O-N 3.11Å; F123-Q127 VanDerWaalsContact O-CB 3.29Å; F123-Q127 WeakPolarHBondContact O-CB 3.43Å; F123-Q127 PolarHBondContact O-N 3.11Å
124	R	94.8	Very high	93.2	Very high	118 Å²	118	60.3 Å²	60.3	45%	0.445	27%	0.267	S	S	.	.	H	α-helix	trans	-68.8	-39.9	174.7	-74.1	-60.4	-162.9	-165.7	4.9	111.6	Q120 P121 L122 Q127 F128	Q120-R124 HydrophobicContact CB-CB 4.2Å; P121-R124 HydrophobicContact CG-CB 4.36Å; P121-R124 HydrophobicContact CG-CG 3.94Å; P121-R124 WeakPolarHBondContact O-CB 3.42Å; P121-R124 PolarHBondContact O-N 3.25Å; L122-R124 VanDerWaalsContact C-N 3.3Å; L122-R124 PolarHBondContact O-N 3.37Å; R124-Q127 PolarHBondContact O-N 3.43Å; R124-F128 WeakPolarHBondContact O-CB 3.49Å; R124-F128 PolarHBondContact O-N 2.79Å
125	K	95.9	Very high	93	Very high	32 Å²	32	61.1 Å²	61.1	14%	0.139	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-45.4	176.6	-58.5	173.6	159.6	159	0	110.9	Y117 Q118 Q120 P121 L122 F128 L129 W184	Y117-K125 HydrophobicContact CD1-CG 4.33Å; Y117-K125 WeakPolarHBondContact O-CE 3.27Å; Y117-K125 PolarHBondContact O-NZ 3.39Å; Q118-K125 PolarHBondContact O-NZ 3.3Å; Q120-K125 HydrophobicContact CB-CG 4.35Å; Q120-K125 WeakPolarHBondContact O-CE 3.44Å; Q120-K125 PolarHBondContact O-NZ 2.87Å; P121-K125 PolarHBondContact O-N 2.92Å; L122-K125 WeakPolarHBondContact O-CB 3.3Å; L122-K125 PolarHBondContact O-N 2.99Å; L122-K125 VanDerWaalsContact O-N 3.12Å; K125-F128 PolarHBondContact O-N 3.47Å; K125-L129 WeakPolarHBondContact O-CG 3.41Å; K125-L129 PolarHBondContact O-N 2.97Å; K125-L129 VanDerWaalsContact O-N 3.08Å; K125-W184 HydrophobicContact CB-CH2 3.74Å; K125-W184 HydrophobicContact CB-CZ2 4.32Å; K125-W184 HydrophobicContact CD-CH2 3.75Å; K125-W184 HydrophobicContact CD-CZ2 3.8Å; K125-W184 HydrophobicContact CG-CH2 4.28Å; K125-W184 HydrophobicContact CG-CZ2 4.47Å
126	L	95.9	Very high	93	Very high	23 Å²	23	58.1 Å²	58.1	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-49.4	175.4	-67.9	175.7	0	0	0	111.1	L122 F128 L129 E130 V192 T195	L122-L126 HydrophobicContact CD1-CG 4.3Å; L122-L126 HydrophobicContact CD2-CD1 4.39Å; L122-L126 HydrophobicContact CG-CD1 3.97Å; L122-L126 HydrophobicContact CG-CG 4.2Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.13Å; L126-F128 VanDerWaalsContact C-N 3.27Å; L126-F128 PolarHBondContact O-N 2.85Å; L126-L129 CarbonylContact O-C 3.48Å; L126-L129 PolarHBondContact O-N 3.39Å; L126-E130 WeakPolarHBondContact O-CG 3.46Å; L126-E130 PolarHBondContact O-N 2.94Å; L126-V192 HydrophobicContact CD2-CB 4.36Å; L126-V192 HydrophobicContact CD2-CG2 3.68Å; L126-T195 HydrophobicContact CB-CG2 4.37Å; L126-T195 HydrophobicContact CD2-CG2 4.39Å
127	Q	95.1	Very high	92.7	Very high	91 Å²	91	59.1 Å²	59.1	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-54.1	-42	176.6	-175.7	177.4	28.9	0	0	112.6	F123 R124 C131	F123-Q127 VanDerWaalsContact O-CB 3.29Å; F123-Q127 WeakPolarHBondContact O-CB 3.43Å; F123-Q127 PolarHBondContact O-N 3.11Å; R124-Q127 PolarHBondContact O-N 3.43Å; Q127-C131 WeakPolarHBondContact O-CB 3.32Å; Q127-C131 PolarHBondContact O-N 3.43Å; Q127-C131 VanDerWaalsContact O-N 3.09Å; Q127-C131 PolarHBondContact O-SG 2.98Å; Q127-C131 VanDerWaalsContact O-SG 3.36Å
128	F	94.7	Very high	91.6	Very high	16 Å²	16	58.1 Å²	58.1	7%	0.07	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-43.8	175	168.5	-110.5	0	0	0	112.7	F85 F113 Y117 R124 K125 L126 C131 S132 F176 F180	F85-F128 HydrophobicContact CZ-CZ 4.42Å; F113-F128 HydrophobicContact CB-CE1 3.85Å; F113-F128 HydrophobicContact CB-CZ 3.93Å; F113-F128 HydrophobicContact CD1-CE1 4.11Å; F113-F128 AromaticContact CD1-CE2 3.99Å; F113-F128 HydrophobicContact CD1-CE2 3.99Å; F113-F128 AromaticContact CD1-CZ 3.46Å; F113-F128 HydrophobicContact CD1-CZ 3.46Å; F113-F128 VanDerWaalsContact CD1-CZ 3.46Å; F113-F128 AromaticContact CD2-CZ 3.82Å; F113-F128 HydrophobicContact CD2-CZ 3.82Å; F113-F128 AromaticContact CE1-CE2 3.97Å; F113-F128 HydrophobicContact CE1-CE2 3.97Å; F113-F128 AromaticContact CE1-CZ 3.83Å; F113-F128 HydrophobicContact CE1-CZ 3.83Å; F113-F128 HydrophobicContact CE2-CZ 4.15Å; F113-F128 AromaticContact CG-CE1 3.93Å; F113-F128 HydrophobicContact CG-CE1 3.93Å; F113-F128 HydrophobicContact CG-CE2 4.4Å; F113-F128 AromaticContact CG-CZ 3.46Å; F113-F128 HydrophobicContact CG-CZ 3.46Å; F113-F128 VanDerWaalsContact CG-CZ 3.46Å; F113-F128 HydrophobicContact CZ-CE2 4.37Å; F113-F128 HydrophobicContact CZ-CZ 4.16Å; Y117-F128 AromaticContact CD2-CD1 3.94Å; Y117-F128 HydrophobicContact CD2-CD1 3.94Å; Y117-F128 HydrophobicContact CD2-CE1 4.13Å; Y117-F128 HydrophobicContact CD2-CG 4.28Å; Y117-F128 HydrophobicContact CE1-CB 3.77Å; Y117-F128 HydrophobicContact CE1-CG 4.11Å; Y117-F128 HydrophobicContact CE2-CB 4.14Å; Y117-F128 AromaticContact CE2-CD1 3.62Å; Y117-F128 HydrophobicContact CE2-CD1 3.62Å; Y117-F128 AromaticContact CE2-CD2 3.72Å; Y117-F128 HydrophobicContact CE2-CD2 3.72Å; Y117-F128 AromaticContact CE2-CE1 3.87Å; Y117-F128 HydrophobicContact CE2-CE1 3.87Å; Y117-F128 AromaticContact CE2-CE2 3.99Å; Y117-F128 HydrophobicContact CE2-CE2 3.99Å; Y117-F128 AromaticContact CE2-CG 3.54Å; Y117-F128 HydrophobicContact CE2-CG 3.54Å; Y117-F128 HydrophobicContact CE2-CZ 4.07Å; Y117-F128 AromaticContact CZ-CD1 3.98Å; Y117-F128 AromaticContact CZ-CD2 3.69Å; Y117-F128 AromaticContact CZ-CG 3.46Å; Y117-F128 VanDerWaalsContact CZ-CG 3.46Å; Y117-F128 VanDerWaalsContact OH-CD2 3.3Å; Y117-F128 WeakPolarHBondContact OH-CD2 3.29Å; R124-F128 WeakPolarHBondContact O-CB 3.49Å; R124-F128 PolarHBondContact O-N 2.79Å; K125-F128 PolarHBondContact O-N 3.47Å; L126-F128 VanDerWaalsContact C-N 3.27Å; L126-F128 PolarHBondContact O-N 2.85Å; F128-C131 PolarHBondContact O-N 3.39Å; F128-S132 VanDerWaalsContact O-CB 3.32Å; F128-S132 WeakPolarHBondContact O-CB 3.49Å; F128-S132 PolarHBondContact O-N 2.91Å; F128-S132 PolarHBondContact O-OG 3.42Å; F128-F176 HydrophobicContact CE1-CE2 4.4Å; F128-F176 AromaticContact CE1-CZ 3.75Å; F128-F176 HydrophobicContact CE1-CZ 3.75Å; F128-F176 HydrophobicContact CZ-CE2 4.47Å; F128-F176 HydrophobicContact CZ-CZ 4.06Å; F128-F180 AromaticContact CD1-CE2 3.93Å; F128-F180 HydrophobicContact CD1-CE2 3.93Å; F128-F180 AromaticContact CD1-CZ 3.86Å; F128-F180 HydrophobicContact CD1-CZ 3.86Å; F128-F180 HydrophobicContact CE1-CD2 4.2Å; F128-F180 AromaticContact CE1-CE2 3.68Å; F128-F180 HydrophobicContact CE1-CE2 3.68Å; F128-F180 HydrophobicContact CE1-CZ 4.08Å
129	L	95.7	Very high	90.4	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-41.2	176.1	-72	178.8	0	0	0	112.2	K125 L126 S132 L133 Y173 F176 L177 F180 V192 L196	K125-L129 WeakPolarHBondContact O-CG 3.41Å; K125-L129 PolarHBondContact O-N 2.97Å; K125-L129 VanDerWaalsContact O-N 3.08Å; L126-L129 CarbonylContact O-C 3.48Å; L126-L129 PolarHBondContact O-N 3.39Å; L129-S132 PolarHBondContact O-N 3.43Å; L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 PolarHBondContact O-N 2.96Å; L129-Y173 PolarHBondContact O-OH 3.47Å; L129-F176 HydrophobicContact CD2-CE1 3.72Å; L129-F176 HydrophobicContact CD2-CZ 4.1Å; L129-L177 HydrophobicContact CD1-CD1 4.09Å; L129-L177 HydrophobicContact CD2-CD1 3.92Å; L129-F180 HydrophobicContact CD1-CD1 3.97Å; L129-F180 HydrophobicContact CD1-CE1 3.76Å; L129-F180 HydrophobicContact CD2-CD1 3.64Å; L129-F180 HydrophobicContact CD2-CE1 3.78Å; L129-F180 HydrophobicContact CD2-CG 4.22Å; L129-F180 HydrophobicContact CD2-CZ 4.47Å; L129-F180 HydrophobicContact CG-CD1 4.08Å; L129-F180 HydrophobicContact CG-CE1 3.76Å; L129-F180 HydrophobicContact CG-CZ 4.49Å; L129-V192 HydrophobicContact CD1-CG1 3.98Å; L129-V192 HydrophobicContact CD1-CG2 3.98Å; L129-L196 HydrophobicContact CB-CD2 4.09Å
130	E	94.2	Very high	88.8	Confident	52 Å²	52	48.4 Å²	48.4	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-51.5	174.1	-65.1	-172.7	-155.6	0	0	111.9	L126 S132 L133 R134 T195 V199	L126-E130 WeakPolarHBondContact O-CG 3.46Å; L126-E130 PolarHBondContact O-N 2.94Å; E130-S132 PolarHBondContact O-N 3.12Å; E130-L133 PolarHBondContact O-N 3.28Å; E130-R134 WeakPolarHBondContact O-CG 3.46Å; E130-R134 PolarHBondContact O-N 2.78Å; E130-R134 IonicContact OE2-CZ 2.73Å; E130-R134 IonicContact OE2-NH1 3.42Å; E130-R134 PolarHBondContact OE2-NH1 3.27Å; E130-R134 VanDerWaalsContact OE2-NH1 3.15Å; E130-R134 IonicContact OE2-NH2 3.05Å; E130-R134 PolarHBondContact OE2-NH2 2.94Å; E130-T195 HydrophobicContact CG-CG2 3.63Å; E130-T195 WeakPolarHBondContact OE1-CG2 3.39Å; E130-V199 HydrophobicContact CB-CG2 3.96Å; E130-V199 HydrophobicContact CG-CG2 3.63Å
131	C	91.8	Very high	86.7	Confident	50 Å²	50	51.4 Å²	51.4	34%	0.338	24%	0.24	S	C	.	.	H	α-helix	trans	-62.5	-31.7	178.8	-71.8	0	0	0	0	112	Q127 F128 R135	Q127-C131 WeakPolarHBondContact O-CB 3.32Å; Q127-C131 PolarHBondContact O-N 3.43Å; Q127-C131 VanDerWaalsContact O-N 3.09Å; Q127-C131 PolarHBondContact O-SG 2.98Å; Q127-C131 VanDerWaalsContact O-SG 3.36Å; F128-C131 PolarHBondContact O-N 3.39Å; C131-R135 PolarHBondContact O-NH1 3.48Å
132	S	93	Very high	84	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-73	-47.3	175.4	-59.4	0	0	0	0	111.4	F128 L129 E130 R134 R135 H136	F128-S132 VanDerWaalsContact O-CB 3.32Å; F128-S132 WeakPolarHBondContact O-CB 3.49Å; F128-S132 PolarHBondContact O-N 2.91Å; F128-S132 PolarHBondContact O-OG 3.42Å; L129-S132 PolarHBondContact O-N 3.43Å; E130-S132 PolarHBondContact O-N 3.12Å; S132-R134 PolarHBondContact O-N 3.32Å; S132-R135 PolarHBondContact O-N 3.31Å; S132-R135 VanDerWaalsContact O-N 3.13Å; S132-H136 PolarHBondContact O-N 3.31Å; S132-H136 PolarHBondContact O-ND1 3.13Å
133	L	93.6	Very high	81.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-44.8	176.2	175.1	59.6	0	0	0	111.8	L129 E130 R135 H136 M137 L170 Y173 L196 V199 F230	L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 PolarHBondContact O-N 2.96Å; E130-L133 PolarHBondContact O-N 3.28Å; L133-R135 PolarHBondContact O-N 3.36Å; L133-R135 VanDerWaalsContact O-N 3.12Å; L133-H136 PolarHBondContact O-N 2.86Å; L133-M137 HydrophobicContact CD1-CB 4.45Å; L133-M137 PolarHBondContact O-N 3.3Å; L133-L170 HydrophobicContact CD1-CD1 3.66Å; L133-Y173 HydrophobicContact CB-CE1 4.06Å; L133-Y173 HydrophobicContact CB-CE2 4.12Å; L133-Y173 HydrophobicContact CD1-CD1 3.85Å; L133-Y173 HydrophobicContact CD1-CE1 3.81Å; L133-Y173 HydrophobicContact CD1-CG 4.43Å; L133-Y173 HydrophobicContact CG-CE1 4.4Å; L133-L196 HydrophobicContact CB-CD2 4.04Å; L133-L196 HydrophobicContact CD2-CB 3.98Å; L133-L196 HydrophobicContact CD2-CD2 3.75Å; L133-L196 HydrophobicContact CD2-CG 4.42Å; L133-L196 WeakPolarHBondContact CD2-O 3.48Å; L133-V199 HydrophobicContact CD2-CB 4.16Å; L133-V199 HydrophobicContact CD2-CG1 3.96Å; L133-V199 HydrophobicContact CG-CG1 4.35Å; L133-F230 HydrophobicContact CD1-CE2 4.04Å; L133-F230 HydrophobicContact CD2-CE2 3.8Å; L133-F230 HydrophobicContact CD2-CZ 4.21Å
134	R	90.6	Very high	77.8	Confident	115 Å²	115	59.2 Å²	59.2	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-55.4	-30.3	177.6	-73.4	-179.2	-171.6	109	9	112.9	E130 S132 L157 V199	E130-R134 WeakPolarHBondContact O-CG 3.46Å; E130-R134 PolarHBondContact O-N 2.78Å; E130-R134 IonicContact OE2-CZ 2.73Å; E130-R134 IonicContact OE2-NH1 3.42Å; E130-R134 PolarHBondContact OE2-NH1 3.27Å; E130-R134 VanDerWaalsContact OE2-NH1 3.15Å; E130-R134 IonicContact OE2-NH2 3.05Å; E130-R134 PolarHBondContact OE2-NH2 2.94Å; S132-R134 PolarHBondContact O-N 3.32Å; R134-L157 WeakPolarHBondContact O-CD2 3.26Å; R134-V199 HydrophobicContact CG-CG1 3.79Å
135	R	89.2	Confident	74.9	Confident	95 Å²	95	64.5 Å²	64.5	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-78.1	-24.9	175.3	-63.6	-179.3	-165.1	106.1	-3.5	114.1	P88 H89 C131 S132 L133	P88-R135 WeakPolarHBondContact CG-O 3.25Å; H89-R135 PolarHBondContact CD2-O 3.34Å; H89-R135 PolarHBondContact NE2-O 3.09Å; C131-R135 PolarHBondContact O-NH1 3.48Å; S132-R135 PolarHBondContact O-N 3.31Å; S132-R135 VanDerWaalsContact O-N 3.13Å; L133-R135 PolarHBondContact O-N 3.36Å; L133-R135 VanDerWaalsContact O-N 3.12Å
136	H	90.8	Very high	71.7	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-99.2	-16.5	-173.6	-70	81.3	0	0	0	113.9	F85 P88 H89 Y106 S132 L133 P138 A169 L170 Y173	F85-H136 AromaticContact CD2-CE1 3.96Å; F85-H136 AromaticContact CE2-CE1 3.91Å; F85-H136 PolarHBondContact O-CE1 3.21Å; F85-H136 PolarHBondContact O-NE2 3.37Å; P88-H136 VanDerWaalsContact CB-CD2 3.43Å; P88-H136 WeakPolarHBondContact CB-CD2 3.41Å; P88-H136 HydrophobicContact CG-CB 4.39Å; H89-H136 PolarHBondContact CE1-O 3.41Å; Y106-H136 AromaticContact CE1-CD2 3.85Å; Y106-H136 AromaticContact CE1-NE2 3.25Å; Y106-H136 VanDerWaalsContact CE1-NE2 3.25Å; Y106-H136 WeakPolarHBondContact CE1-NE2 2.75Å; Y106-H136 AromaticContact CZ-NE2 3.44Å; Y106-H136 PolarHBondContact OH-CD2 3.27Å; Y106-H136 PolarHBondContact OH-NE2 2.9Å; S132-H136 PolarHBondContact O-N 3.31Å; S132-H136 PolarHBondContact O-ND1 3.13Å; L133-H136 PolarHBondContact O-N 2.86Å; H136-P138 WeakPolarHBondContact O-CD 3.04Å; H136-A169 HydrophobicContact CB-CB 4.42Å; H136-A169 PolarHBondContact CD2-O 3.09Å; H136-A169 VanDerWaalsContact CD2-O 3.3Å; H136-A169 VanDerWaalsContact O-CB 3.28Å; H136-A169 WeakPolarHBondContact O-CB 3.42Å; H136-L170 PolarHBondContact O-N 2.94Å; H136-Y173 HydrophobicContact CB-CD2 4.33Å; H136-Y173 HydrophobicContact CB-CG 4.21Å; H136-Y173 AromaticContact ND1-CD2 3.89Å
137	M	85.4	Confident	68.8	Low	30 Å²	30	74.5 Å²	74.5	15%	0.148	38%	0.381	C	S	.	.	S	Bend	trans	-84.9	114.5	176.6	-174.6	172.4	170	0	0	109.4	L133 L140 C200	L133-M137 HydrophobicContact CD1-CB 4.45Å; L133-M137 PolarHBondContact O-N 3.3Å; M137-L140 HydrophobicContact CE-CD1 3.79Å; M137-L140 HydrophobicContact CG-CD1 4.4Å; M137-C200 HydrophobicContact CE-CB 4.46Å; M137-C200 VanDerWaalsContact CE-SG 3.52Å; M137-C200 HydrophobicContact SD-CB 4.27Å
138	P	69.7	Low	65.8	Low	11 Å²	11	78.7 Å²	78.7	7%	0.071	40%	0.4	C	S	.	.			trans	-65.8	143.1	172	29.7	-33.1	0	0	0	108.8	H136 L140 C160 P164	H136-P138 WeakPolarHBondContact O-CD 3.04Å; P138-L140 PolarHBondContact O-N 2.88Å; P138-C160 HydrophobicContact CB-CB 3.88Å; P138-P164 HydrophobicContact CG-CB 4.02Å
139	N	63.7	Low	62.6	Low	73 Å²	73	85.3 Å²	85.3	39%	0.39	44%	0.437	S	S	.	.			trans	-55.9	102	176.3	-94.2	-18.1	0	0	0	111	E141 L157	N139-E141 VanDerWaalsContact C-N 3.34Å; N139-L157 VanDerWaalsContact ND2-CB 3.3Å; N139-L157 WeakPolarHBondContact ND2-CB 3.36Å; N139-L157 PolarHBondContact ND2-O 3.12Å
140	L	55.7	Low	59.7	Low	21 Å²	21	93.7 Å²	93.7	11%	0.11	48%	0.48	C	S	.	.			trans	-86.8	-9	175.2	-78.4	144.4	0	0	0	111.8	M137 P138 K142 P164 Q222 T226	M137-L140 HydrophobicContact CE-CD1 3.79Å; M137-L140 HydrophobicContact CG-CD1 4.4Å; P138-L140 PolarHBondContact O-N 2.88Å; L140-K142 PolarHBondContact O-N 2.77Å; L140-P164 HydrophobicContact CD2-CB 3.99Å; L140-P164 HydrophobicContact CD2-CG 4.16Å; L140-Q222 PolarHBondContact O-NE2 2.83Å; L140-T226 HydrophobicContact CD1-CG2 4.19Å
141	E	46.1	Very low	56.6	Low	126 Å²	126	100.6 Å²	100.6	59%	0.589	51%	0.513	S	S	*	.			trans	-83.4	101.9	174.8	-67.5	-172.3	173.5	0	0	111.8	N139	N139-E141 VanDerWaalsContact C-N 3.34Å
142	K	38.4	Very low	53.7	Low	189 Å²	189	105.9 Å²	105.9	82%	0.822	53%	0.532	S	S	*	.			trans	-111.1	67.1	148.5	-79.7	-171.1	178.1	-179.9	0	109.2	L140	L140-K142 PolarHBondContact O-N 2.77Å
143	S	32.8	Very low	50.6	Low	97 Å²	97	112 Å²	112	68%	0.678	57%	0.572	S	S	*	*	S	Bend	trans	-147.2	124.3	168.4	-153.5	0	0	0	0	113.2
144	S	28	Very low	47.7	Very low	105 Å²	105	118 Å²	118	73%	0.734	61%	0.605	S	S	*	*			trans	47	72.7	157	58.5	0	0	0	0	119.3
145	R	32.4	Very low	44.8	Very low	229 Å²	229	123.9 Å²	123.9	86%	0.864	63%	0.627	S	S	*	*			trans	-132.6	62.6	147.3	-72	-163.7	-175.3	-174	4.8	113	S147	R145-S147 PolarHBondContact O-N 3.29Å
146	T	29.5	Very low	42.3	Very low	145 Å²	145	129.6 Å²	129.6	89%	0.89	65%	0.65	S	S	*	*			trans	-81.6	84.9	153.5	36.9	0	0	0	0	109.7
147	S	34.2	Very low	40.2	Very low	119 Å²	119	133.7 Å²	133.7	83%	0.832	67%	0.671	S	S	*	*			trans	-161.7	127.2	140.6	-130.4	0	0	0	0	110.5	R145	R145-S147 PolarHBondContact O-N 3.29Å
148	Q	31.5	Very low	38.6	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	69%	0.693	S	S	*	*			trans	-75.6	134.9	-178.3	-63.3	147.8	-22.9	0	0	109.4
149	N	28.5	Very low	38.4	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	72%	0.715	S	S	*	*			trans	167	103.6	139.5	-86.9	-31.8	0	0	0	110.2
150	L	34.4	Very low	39	Very low	176 Å²	176	137.8 Å²	137.8	92%	0.921	70%	0.699	S	S	*	*			trans	170.2	138.3	135.2	-91.3	156	0	0	0	109	E152	L150-E152 PolarHBondContact O-N 3.03Å
151	Q	29.5	Very low	40	Very low	197 Å²	197	142.1 Å²	142.1	92%	0.921	73%	0.731	S	S	*	*			trans	-91.2	91.1	-176.5	-70.2	170.5	-38.6	0	0	110.4
152	E	30.2	Very low	41.5	Very low	161 Å²	161	139.9 Å²	139.9	75%	0.752	72%	0.722	S	S	*	*			trans	-130.7	141.6	151.5	-71.7	-157.4	155	0	0	109.5	L150 D154	L150-E152 PolarHBondContact O-N 3.03Å; E152-D154 PolarHBondContact O-N 3.25Å
153	P	29.4	Very low	43.3	Very low	129 Å²	129	131.8 Å²	131.8	84%	0.838	69%	0.693	S	S	*	*			trans	-79.6	68	176.9	35.1	-34.9	0	0	0	109.5	R155	P153-R155 PolarHBondContact O-N 3.08Å; P153-R155 VanDerWaalsContact O-N 3.12Å
154	D	32.4	Very low	45.4	Very low	127 Å²	127	129.3 Å²	129.3	68%	0.679	67%	0.674	S	S	*	*			trans	-52.2	121.9	163.1	-99.5	-29.8	0	0	0	107.6	E152 Y156	E152-D154 PolarHBondContact O-N 3.25Å; D154-Y156 WeakPolarHBondContact O-CD2 3.37Å; D154-Y156 PolarHBondContact O-N 3.45Å
155	R	30	Very low	47.7	Very low	237 Å²	237	126.6 Å²	126.6	89%	0.894	65%	0.651	S	S	*	*			trans	-65.8	89.3	171.2	-76.9	-175.3	175.5	-164.4	-0.4	107	P153 L157	P153-R155 PolarHBondContact O-N 3.08Å; P153-R155 VanDerWaalsContact O-N 3.12Å; R155-L157 PolarHBondContact O-N 3.01Å
156	Y	35.8	Very low	49.9	Very low	216 Å²	216	122.3 Å²	122.3	85%	0.847	64%	0.639	S	S	*	*			trans	-41.8	111.5	-177.8	-72.7	-85.3	0	0	0	110.2	D154 S158	D154-Y156 WeakPolarHBondContact O-CD2 3.37Å; D154-Y156 PolarHBondContact O-N 3.45Å; Y156-S158 PolarHBondContact O-N 3.38Å
157	L	47.2	Very low	52.5	Low	86 Å²	86	115.5 Å²	115.5	45%	0.45	60%	0.597	S	S	.	*			trans	-55.2	104.4	171	-104.4	65.3	0	0	0	107.1	R134 N139 R155 I159	R134-L157 WeakPolarHBondContact O-CD2 3.26Å; N139-L157 VanDerWaalsContact ND2-CB 3.3Å; N139-L157 WeakPolarHBondContact ND2-CB 3.36Å; N139-L157 PolarHBondContact ND2-O 3.12Å; R155-L157 PolarHBondContact O-N 3.01Å; L157-I159 PolarHBondContact O-N 2.9Å
158	S	50.2	Low	54.9	Low	86 Å²	86	113.7 Å²	113.7	60%	0.601	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-65.8	136.4	-178	49.3	0	0	0	0	108.9	Y156 C160	Y156-S158 PolarHBondContact O-N 3.38Å; S158-C160 PolarHBondContact O-N 3.46Å; S158-C160 VanDerWaalsContact O-N 3.08Å
159	I	65.6	Low	57.6	Low	106 Å²	106	105.1 Å²	105.1	54%	0.544	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-58.4	119.5	169	-60.1	173.4	0	0	0	106.5	L157 S161	L157-I159 PolarHBondContact O-N 2.9Å; I159-S161 PolarHBondContact O-N 3.05Å
160	C	78.1	Confident	60.5	Low	8 Å²	8	98.1 Å²	98.1	5%	0.054	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-54.7	123.3	-179.6	167.6	0	0	0	0	110.3	H91 P138 S158 I162 G163 C167	H91-C160 PolarHBondContact NE2-SG 3.45Å; P138-C160 HydrophobicContact CB-CB 3.88Å; S158-C160 PolarHBondContact O-N 3.46Å; S158-C160 VanDerWaalsContact O-N 3.08Å; C160-I162 PolarHBondContact O-N 3.04Å; C160-G163 PolarHBondContact O-N 3.33Å; C160-C167 VanDerWaalsContact SG-CB 3.58Å; C160-C167 PolarHBondContact SG-SG 3.43Å
161	S	75.5	Confident	63	Low	111 Å²	111	91.7 Å²	91.7	78%	0.776	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.1	-172.6	53.6	0	0	0	0	114.2	I159	I159-S161 PolarHBondContact O-N 3.05Å
162	I	78.5	Confident	65.8	Low	79 Å²	79	82.4 Å²	82.4	41%	0.405	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-9.1	178.7	-38.9	-172	0	0	0	111.8	H91 C160 K166	H91-I162 HydrophobicContact CB-CD1 3.61Å; H91-I162 HydrophobicContact CB-CG1 4.46Å; H91-I162 VanDerWaalsContact CD2-CD1 3.45Å; H91-I162 WeakPolarHBondContact CD2-CD1 3.42Å; C160-I162 PolarHBondContact O-N 3.04Å; I162-K166 HydrophobicContact CB-CB 4.37Å; I162-K166 HydrophobicContact CG2-CB 3.52Å; I162-K166 HydrophobicContact CG2-CD 3.71Å; I162-K166 HydrophobicContact CG2-CG 4.25Å
163	G	75.8	Confident	68.8	Low	20 Å²	20	74.8 Å²	74.8	21%	0.206	39%	0.386	C	S	.	.	H	α-helix	trans	79.2	164	179.1	0	0	0	0	0	114.9	C160 L165 K166 C167	C160-G163 PolarHBondContact O-N 3.33Å; G163-L165 VanDerWaalsContact C-N 3.33Å; G163-L165 PolarHBondContact O-N 3.41Å; G163-K166 PolarHBondContact O-N 3.32Å; G163-C167 VanDerWaalsContact O-CB 3.27Å; G163-C167 WeakPolarHBondContact O-CB 3.26Å; G163-C167 PolarHBondContact O-N 3.49Å
164	P	77.6	Confident	71.7	Confident	44 Å²	44	69 Å²	69	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-69.8	-25.2	-165.9	28.6	-36.9	0	0	0	114.4	P138 L140 L229 K233	P138-P164 HydrophobicContact CG-CB 4.02Å; L140-P164 HydrophobicContact CD2-CB 3.99Å; L140-P164 HydrophobicContact CD2-CG 4.16Å; P164-L229 HydrophobicContact CB-CD1 3.85Å; P164-L229 HydrophobicContact CG-CD1 4.44Å; P164-K233 PolarHBondContact O-NZ 2.81Å
165	L	76.2	Confident	74.4	Confident	48 Å²	48	63.8 Å²	63.8	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-55.6	175.3	-60.1	179.3	0	0	0	111	G163 L225 L229 K233 L399	G163-L165 VanDerWaalsContact C-N 3.33Å; G163-L165 PolarHBondContact O-N 3.41Å; L165-L225 HydrophobicContact CD2-CD1 3.75Å; L165-L225 HydrophobicContact CD2-CD2 4.46Å; L165-L229 HydrophobicContact CD2-CD1 4.33Å; L165-L229 HydrophobicContact CD2-CD2 4.22Å; L165-K233 PolarHBondContact O-NZ 3.34Å; L165-L399 HydrophobicContact CD2-CD2 3.73Å
166	K	78.3	Confident	77.4	Confident	139 Å²	139	52.5 Å²	52.5	60%	0.604	28%	0.28	S	S	*	.	H	α-helix	trans	-81.1	-23.4	-174.7	-66.3	-178.5	174.2	-174.4	0	113.5	I162 G163 L168	I162-K166 HydrophobicContact CB-CB 4.37Å; I162-K166 HydrophobicContact CG2-CB 3.52Å; I162-K166 HydrophobicContact CG2-CD 3.71Å; I162-K166 HydrophobicContact CG2-CG 4.25Å; G163-K166 PolarHBondContact O-N 3.32Å; K166-L168 PolarHBondContact O-N 2.93Å
167	C	83.4	Confident	80.2	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.014	24%	0.24	C	C	.	.			trans	-63.3	125.9	178.5	-166.5	0	0	0	0	111.5	H89 C160 G163 K233	H89-C167 PolarHBondContact ND1-SG 3.19Å; C160-C167 VanDerWaalsContact SG-CB 3.58Å; C160-C167 PolarHBondContact SG-SG 3.43Å; G163-C167 VanDerWaalsContact O-CB 3.27Å; G163-C167 WeakPolarHBondContact O-CB 3.26Å; G163-C167 PolarHBondContact O-N 3.49Å; C167-K233 PolarHBondContact O-NZ 3.16Å
168	L	84.9	Confident	82.3	Confident	81 Å²	81	40.7 Å²	40.7	42%	0.424	23%	0.229	S	C	.	.			trans	-84.8	-14.3	179.2	-60.7	-178.2	0	0	0	113.6	K166 L170 F171 L172	K166-L168 PolarHBondContact O-N 2.93Å; L168-L170 VanDerWaalsContact C-N 3.35Å; L168-L170 PolarHBondContact O-N 3.41Å; L168-F171 WeakPolarHBondContact O-CA 3.24Å; L168-F171 WeakPolarHBondContact O-CB 3.46Å; L168-F171 PolarHBondContact O-N 3.15Å; L168-L172 HydrophobicContact CB-CD1 4.06Å; L168-L172 HydrophobicContact CB-CG 4.26Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 3.47Å
169	A	88.7	Confident	84.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-48.7	-50.9	-173.5	0	0	0	0	0	113.4	P88 H89 H136 F171 L172 Y173	P88-A169 HydrophobicContact CB-CB 3.81Å; P88-A169 HydrophobicContact CG-CB 4.21Å; H89-A169 VanDerWaalsContact CE1-CB 3.43Å; H89-A169 WeakPolarHBondContact CE1-CB 3.28Å; H136-A169 HydrophobicContact CB-CB 4.42Å; H136-A169 PolarHBondContact CD2-O 3.09Å; H136-A169 VanDerWaalsContact CD2-O 3.3Å; H136-A169 VanDerWaalsContact O-CB 3.28Å; H136-A169 WeakPolarHBondContact O-CB 3.42Å; A169-F171 VanDerWaalsContact C-N 3.33Å; A169-F171 PolarHBondContact O-N 3.49Å; A169-L172 PolarHBondContact O-N 2.93Å; A169-Y173 PolarHBondContact O-N 3.04Å
170	L	88.5	Confident	85.6	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-68.6	-29.7	-179.8	-168.2	60.2	0	0	0	113.3	L133 H136 L168 G174 F230 K233	L133-L170 HydrophobicContact CD1-CD1 3.66Å; H136-L170 PolarHBondContact O-N 2.94Å; L168-L170 VanDerWaalsContact C-N 3.35Å; L168-L170 PolarHBondContact O-N 3.41Å; L170-G174 PolarHBondContact O-N 2.87Å; L170-G174 VanDerWaalsContact O-N 3.16Å; L170-F230 HydrophobicContact CD1-CD2 4.31Å; L170-F230 HydrophobicContact CD2-CD2 4.49Å; L170-K233 HydrophobicContact CB-CB 4.14Å; L170-K233 HydrophobicContact CB-CD 4.12Å; L170-K233 HydrophobicContact CD2-CB 4.24Å; L170-K233 HydrophobicContact CD2-CD 4.46Å; L170-K233 HydrophobicContact CG-CB 3.88Å
171	F	87.2	Confident	86.3	Confident	41 Å²	41	33.6 Å²	33.6	18%	0.18	18%	0.184	C	C	.	.	H	α-helix	trans	-72.1	-44.8	174.7	162	-105.6	0	0	0	111.3	V103 L168 A169 Y173 G174 V175 K233 P238	V103-F171 HydrophobicContact CG2-CE1 4.1Å; L168-F171 WeakPolarHBondContact O-CA 3.24Å; L168-F171 WeakPolarHBondContact O-CB 3.46Å; L168-F171 PolarHBondContact O-N 3.15Å; A169-F171 VanDerWaalsContact C-N 3.33Å; A169-F171 PolarHBondContact O-N 3.49Å; F171-Y173 VanDerWaalsContact C-N 3.26Å; F171-Y173 PolarHBondContact O-N 3.26Å; F171-G174 WeakPolarHBondContact O-CA 3.36Å; F171-G174 PolarHBondContact O-N 3.41Å; F171-V175 HydrophobicContact CE1-CG2 4.27Å; F171-V175 HydrophobicContact CE2-CG2 4.1Å; F171-V175 HydrophobicContact CZ-CG2 3.91Å; F171-V175 PolarHBondContact O-N 3.46Å; F171-K233 WeakPolarHBondContact CA-O 3.45Å; F171-K233 HydrophobicContact CB-CB 4.21Å; F171-K233 HydrophobicContact CB-CD 4.33Å; F171-K233 HydrophobicContact CB-CG 4.24Å; F171-P238 HydrophobicContact CD2-CG 3.77Å; F171-P238 HydrophobicContact CE2-CG 3.77Å
172	L	89.2	Confident	86.9	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-39.5	174.6	-65.8	170.2	0	0	0	110.6	T102 V103 Y106 L168 A169 G174 V175 F176	T102-L172 HydrophobicContact CG2-CD1 3.54Å; T102-L172 HydrophobicContact CG2-CD2 3.81Å; T102-L172 HydrophobicContact CG2-CG 4.33Å; V103-L172 HydrophobicContact CG2-CD2 3.95Å; Y106-L172 HydrophobicContact CD1-CB 3.64Å; Y106-L172 WeakPolarHBondContact CD1-O 3.39Å; Y106-L172 HydrophobicContact CD2-CB 3.95Å; Y106-L172 HydrophobicContact CD2-CD1 4.33Å; Y106-L172 HydrophobicContact CD2-CD2 4.14Å; Y106-L172 HydrophobicContact CD2-CG 4.36Å; Y106-L172 HydrophobicContact CE1-CB 3.52Å; Y106-L172 HydrophobicContact CE2-CB 3.83Å; Y106-L172 HydrophobicContact CE2-CD1 3.86Å; Y106-L172 HydrophobicContact CE2-CD2 4.5Å; Y106-L172 HydrophobicContact CE2-CG 4.28Å; Y106-L172 HydrophobicContact CG-CB 3.83Å; Y106-L172 HydrophobicContact CG-CD2 4.36Å; L168-L172 HydrophobicContact CB-CD1 4.06Å; L168-L172 HydrophobicContact CB-CG 4.26Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 3.47Å; A169-L172 PolarHBondContact O-N 2.93Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 3.4Å; L172-V175 WeakPolarHBondContact O-CB 3.38Å; L172-V175 PolarHBondContact O-N 2.82Å; L172-V175 VanDerWaalsContact O-N 3.16Å; L172-F176 PolarHBondContact O-N 3.37Å
173	Y	92.2	Very high	87.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.9	-42.5	170.9	-178.7	-97.8	0	0	0	112.6	L129 L133 H136 A169 F171 V175 F176 L177 L196 T234	L129-Y173 PolarHBondContact O-OH 3.47Å; L133-Y173 HydrophobicContact CB-CE1 4.06Å; L133-Y173 HydrophobicContact CB-CE2 4.12Å; L133-Y173 HydrophobicContact CD1-CD1 3.85Å; L133-Y173 HydrophobicContact CD1-CE1 3.81Å; L133-Y173 HydrophobicContact CD1-CG 4.43Å; L133-Y173 HydrophobicContact CG-CE1 4.4Å; H136-Y173 HydrophobicContact CB-CD2 4.33Å; H136-Y173 HydrophobicContact CB-CG 4.21Å; H136-Y173 AromaticContact ND1-CD2 3.89Å; A169-Y173 PolarHBondContact O-N 3.04Å; F171-Y173 VanDerWaalsContact C-N 3.26Å; F171-Y173 PolarHBondContact O-N 3.26Å; Y173-V175 PolarHBondContact O-N 3.03Å; Y173-F176 AromaticContact CD2-CD1 3.92Å; Y173-F176 HydrophobicContact CD2-CD1 3.92Å; Y173-F176 HydrophobicContact CD2-CE1 4.3Å; Y173-F176 AromaticContact CE2-CD1 3.87Å; Y173-F176 HydrophobicContact CE2-CD1 3.87Å; Y173-F176 AromaticContact CE2-CE1 3.82Å; Y173-F176 HydrophobicContact CE2-CE1 3.82Å; Y173-F176 PolarHBondContact O-N 2.84Å; Y173-L177 HydrophobicContact CE1-CB 4.42Å; Y173-L177 HydrophobicContact CE1-CD2 4.18Å; Y173-L177 VanDerWaalsContact O-CB 3.25Å; Y173-L177 WeakPolarHBondContact O-CB 3.43Å; Y173-L177 PolarHBondContact O-N 3.15Å; Y173-L196 HydrophobicContact CE1-CD1 4.14Å; Y173-L196 WeakPolarHBondContact OH-CD1 3.21Å; Y173-L196 WeakPolarHBondContact OH-CD2 3.43Å; Y173-T234 HydrophobicContact CD1-CG2 3.91Å; Y173-T234 HydrophobicContact CE1-CG2 3.86Å
174	G	90.6	Very high	88.1	Confident	7 Å²	7	33.4 Å²	33.4	7%	0.072	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-41.3	172.8	0	0	0	0	0	113.6	L170 F171 L172 L177 K178 K233	L170-G174 PolarHBondContact O-N 2.87Å; L170-G174 VanDerWaalsContact O-N 3.16Å; F171-G174 WeakPolarHBondContact O-CA 3.36Å; F171-G174 PolarHBondContact O-N 3.41Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 3.4Å; G174-L177 PolarHBondContact O-N 2.88Å; G174-K178 WeakPolarHBondContact O-CB 3.49Å; G174-K178 PolarHBondContact O-N 3.06Å; G174-K233 WeakPolarHBondContact CA-O 3.43Å
175	V	89	Confident	88.8	Confident	19 Å²	19	35 Å²	35	12%	0.115	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-48	173.7	174.6	0	0	0	0	111.2	V103 K107 F171 L172 Y173 E179	V103-V175 HydrophobicContact CG1-CG1 4.22Å; K107-V175 HydrophobicContact CD-CG1 4.48Å; K107-V175 HydrophobicContact CG-CG1 3.51Å; F171-V175 HydrophobicContact CE1-CG2 4.27Å; F171-V175 HydrophobicContact CE2-CG2 4.1Å; F171-V175 HydrophobicContact CZ-CG2 3.91Å; F171-V175 PolarHBondContact O-N 3.46Å; L172-V175 WeakPolarHBondContact O-CB 3.38Å; L172-V175 PolarHBondContact O-N 2.82Å; L172-V175 VanDerWaalsContact O-N 3.16Å; Y173-V175 PolarHBondContact O-N 3.03Å; V175-E179 PolarHBondContact O-N 3.31Å
176	F	93.3	Very high	89.3	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-44.2	175.4	152.1	-90.2	0	0	0	112	F85 Y106 A109 G110 F113 F128 L129 L172 Y173 K178 E179 F180	F85-F176 HydrophobicContact CD2-CD2 4.4Å; F85-F176 HydrophobicContact CE2-CB 4.42Å; F85-F176 HydrophobicContact CE2-CD1 4.08Å; F85-F176 AromaticContact CE2-CD2 3.53Å; F85-F176 HydrophobicContact CE2-CD2 3.53Å; F85-F176 HydrophobicContact CE2-CE1 4.24Å; F85-F176 AromaticContact CE2-CE2 3.73Å; F85-F176 HydrophobicContact CE2-CE2 3.73Å; F85-F176 AromaticContact CE2-CG 3.74Å; F85-F176 HydrophobicContact CE2-CG 3.74Å; F85-F176 HydrophobicContact CE2-CZ 4.08Å; F85-F176 HydrophobicContact CZ-CD2 4.05Å; F85-F176 HydrophobicContact CZ-CE1 4.26Å; F85-F176 AromaticContact CZ-CE2 3.73Å; F85-F176 HydrophobicContact CZ-CE2 3.73Å; F85-F176 HydrophobicContact CZ-CG 4.47Å; F85-F176 AromaticContact CZ-CZ 3.85Å; F85-F176 HydrophobicContact CZ-CZ 3.85Å; Y106-F176 HydrophobicContact CD1-CB 3.69Å; A109-F176 HydrophobicContact CB-CD2 4.38Å; G110-F176 VanDerWaalsContact CA-CD2 3.42Å; F113-F176 HydrophobicContact CB-CE2 4.25Å; F113-F176 AromaticContact CD2-CE2 3.91Å; F113-F176 HydrophobicContact CD2-CE2 3.91Å; F113-F176 HydrophobicContact CG-CE2 4.45Å; F128-F176 HydrophobicContact CE1-CE2 4.4Å; F128-F176 AromaticContact CE1-CZ 3.75Å; F128-F176 HydrophobicContact CE1-CZ 3.75Å; F128-F176 HydrophobicContact CZ-CE2 4.47Å; F128-F176 HydrophobicContact CZ-CZ 4.06Å; L129-F176 HydrophobicContact CD2-CE1 3.72Å; L129-F176 HydrophobicContact CD2-CZ 4.1Å; L172-F176 PolarHBondContact O-N 3.37Å; Y173-F176 AromaticContact CD2-CD1 3.92Å; Y173-F176 HydrophobicContact CD2-CD1 3.92Å; Y173-F176 HydrophobicContact CD2-CE1 4.3Å; Y173-F176 AromaticContact CE2-CD1 3.87Å; Y173-F176 HydrophobicContact CE2-CD1 3.87Å; Y173-F176 AromaticContact CE2-CE1 3.82Å; Y173-F176 HydrophobicContact CE2-CE1 3.82Å; Y173-F176 PolarHBondContact O-N 2.84Å; F176-K178 PolarHBondContact O-N 2.79Å; F176-E179 PolarHBondContact O-N 3.04Å; F176-F180 HydrophobicContact CE2-CB 4.39Å; F176-F180 HydrophobicContact CE2-CD2 4.36Å; F176-F180 HydrophobicContact CZ-CB 4.23Å; F176-F180 HydrophobicContact CZ-CD2 4.16Å; F176-F180 HydrophobicContact CZ-CG 4.23Å; F176-F180 WeakPolarHBondContact O-CB 3.37Å; F176-F180 PolarHBondContact O-N 3.16Å
177	L	94	Very high	89.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-44.5	-177.3	-179.3	64.9	0	0	0	110.9	L129 Y173 G174 E179 F180 I181 V192 L196 T234 F235 W370	L129-L177 HydrophobicContact CD1-CD1 4.09Å; L129-L177 HydrophobicContact CD2-CD1 3.92Å; Y173-L177 HydrophobicContact CE1-CB 4.42Å; Y173-L177 HydrophobicContact CE1-CD2 4.18Å; Y173-L177 VanDerWaalsContact O-CB 3.25Å; Y173-L177 WeakPolarHBondContact O-CB 3.43Å; Y173-L177 PolarHBondContact O-N 3.15Å; G174-L177 PolarHBondContact O-N 2.88Å; L177-E179 VanDerWaalsContact C-N 3.33Å; L177-E179 PolarHBondContact O-N 3.01Å; L177-F180 PolarHBondContact O-N 2.78Å; L177-F180 VanDerWaalsContact O-N 3.15Å; L177-I181 HydrophobicContact CD1-CD1 4.38Å; L177-I181 HydrophobicContact CD1-CG2 4.08Å; L177-I181 HydrophobicContact CG-CD1 4.14Å; L177-I181 VanDerWaalsContact O-CG1 3.3Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 2.92Å; L177-I181 VanDerWaalsContact O-N 3.1Å; L177-V192 HydrophobicContact CD1-CG1 4.04Å; L177-L196 HydrophobicContact CD1-CD1 3.94Å; L177-L196 HydrophobicContact CD2-CD1 3.68Å; L177-L196 HydrophobicContact CG-CD1 4.5Å; L177-T234 HydrophobicContact CD2-CG2 3.6Å; L177-F235 HydrophobicContact CD2-CD1 4.32Å; L177-F235 HydrophobicContact CD2-CE1 3.85Å; L177-F235 HydrophobicContact CD2-CZ 4.41Å; L177-W370 HydrophobicContact CD2-CZ2 4.23Å; L177-W370 HydrophobicContact CG-CZ2 4.47Å
178	K	90.6	Very high	90.3	Very high	53 Å²	53	38.2 Å²	38.2	23%	0.23	21%	0.212	C	C	.	.	H	α-helix	trans	-54.6	-46.8	176.3	-167.2	175.9	-171	176	0	111.3	G174 F176 I182 D237 W370	G174-K178 WeakPolarHBondContact O-CB 3.49Å; G174-K178 PolarHBondContact O-N 3.06Å; F176-K178 PolarHBondContact O-N 2.79Å; K178-I182 WeakPolarHBondContact O-CB 3.46Å; K178-I182 PolarHBondContact O-N 2.98Å; K178-D237 IonicContact NZ-OD2 3.43Å; K178-D237 PolarHBondContact NZ-OD2 3.06Å; K178-W370 HydrophobicContact CG-CG 4.4Å
179	E	91.3	Very high	90.5	Very high	47 Å²	47	34.6 Å²	34.6	22%	0.22	19%	0.194	C	C	.	.	H	α-helix	trans	-76.1	-26.8	177.9	-59.8	-62.6	163.7	0	0	113.7	K107 R114 V175 F176 L177 I182	K107-E179 HydrophobicContact CB-CG 3.97Å; K107-E179 HydrophobicContact CG-CG 3.94Å; R114-E179 WeakPolarHBondContact CD-O 3.48Å; R114-E179 PolarHBondContact NE-O 2.83Å; V175-E179 PolarHBondContact O-N 3.31Å; F176-E179 PolarHBondContact O-N 3.04Å; L177-E179 VanDerWaalsContact C-N 3.33Å; L177-E179 PolarHBondContact O-N 3.01Å; E179-I182 VanDerWaalsContact O-CG2 3.26Å; E179-I182 WeakPolarHBondContact O-CG2 3.44Å
180	F	93.9	Very high	90.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-72.4	-39.6	179.8	-179.2	-96.6	0	0	0	112.9	F113 R114 Y117 F128 L129 F176 L177 W184	F113-F180 HydrophobicContact CB-CD2 3.76Å; F113-F180 HydrophobicContact CB-CE2 3.79Å; F113-F180 WeakPolarHBondContact O-CE2 3.45Å; R114-F180 HydrophobicContact CB-CD2 4.32Å; R114-F180 WeakPolarHBondContact CB-O 3.15Å; R114-F180 VanDerWaalsContact CD-O 3.32Å; R114-F180 WeakPolarHBondContact CD-O 3.34Å; R114-F180 VanDerWaalsContact CG-O 3.24Å; R114-F180 WeakPolarHBondContact CG-O 3.1Å; Y117-F180 HydrophobicContact CD2-CE2 4.11Å; Y117-F180 HydrophobicContact CD2-CZ 4.4Å; Y117-F180 HydrophobicContact CG-CE2 4.35Å; Y117-F180 HydrophobicContact CG-CZ 4.26Å; F128-F180 AromaticContact CD1-CE2 3.93Å; F128-F180 HydrophobicContact CD1-CE2 3.93Å; F128-F180 AromaticContact CD1-CZ 3.86Å; F128-F180 HydrophobicContact CD1-CZ 3.86Å; F128-F180 HydrophobicContact CE1-CD2 4.2Å; F128-F180 AromaticContact CE1-CE2 3.68Å; F128-F180 HydrophobicContact CE1-CE2 3.68Å; F128-F180 HydrophobicContact CE1-CZ 4.08Å; L129-F180 HydrophobicContact CD1-CD1 3.97Å; L129-F180 HydrophobicContact CD1-CE1 3.76Å; L129-F180 HydrophobicContact CD2-CD1 3.64Å; L129-F180 HydrophobicContact CD2-CE1 3.78Å; L129-F180 HydrophobicContact CD2-CG 4.22Å; L129-F180 HydrophobicContact CD2-CZ 4.47Å; L129-F180 HydrophobicContact CG-CD1 4.08Å; L129-F180 HydrophobicContact CG-CE1 3.76Å; L129-F180 HydrophobicContact CG-CZ 4.49Å; F176-F180 HydrophobicContact CE2-CB 4.39Å; F176-F180 HydrophobicContact CE2-CD2 4.36Å; F176-F180 HydrophobicContact CZ-CB 4.23Å; F176-F180 HydrophobicContact CZ-CD2 4.16Å; F176-F180 HydrophobicContact CZ-CG 4.23Å; F176-F180 WeakPolarHBondContact O-CB 3.37Å; F176-F180 PolarHBondContact O-N 3.16Å; L177-F180 PolarHBondContact O-N 2.78Å; L177-F180 VanDerWaalsContact O-N 3.15Å; F180-W184 HydrophobicContact CD1-CZ2 4.07Å; F180-W184 AromaticContact CE1-CH2 3.83Å; F180-W184 HydrophobicContact CE1-CH2 3.83Å; F180-W184 AromaticContact CE1-CZ2 3.53Å; F180-W184 HydrophobicContact CE1-CZ2 3.53Å; F180-W184 HydrophobicContact CZ-CZ2 4.23Å; F180-W184 PolarHBondContact O-NE1 2.84Å
181	I	92.4	Very high	90.7	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-96.1	-2.7	-177.4	71	-161.7	0	0	0	114	L177 G183 W184 V192 W370	L177-I181 HydrophobicContact CD1-CD1 4.38Å; L177-I181 HydrophobicContact CD1-CG2 4.08Å; L177-I181 HydrophobicContact CG-CD1 4.14Å; L177-I181 VanDerWaalsContact O-CG1 3.3Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 2.92Å; L177-I181 VanDerWaalsContact O-N 3.1Å; I181-G183 PolarHBondContact O-N 2.91Å; I181-G183 VanDerWaalsContact O-N 3.14Å; I181-W184 HydrophobicContact CB-CD2 4.18Å; I181-W184 HydrophobicContact CB-CG 4.19Å; I181-W184 HydrophobicContact CG2-CD2 4.3Å; I181-W184 HydrophobicContact CG2-CE3 4.37Å; I181-W184 HydrophobicContact CG2-CH2 4.48Å; I181-W184 HydrophobicContact CG2-CZ2 4.41Å; I181-W184 HydrophobicContact CG2-CZ3 4.48Å; I181-W184 VanDerWaalsContact O-CB 3.25Å; I181-W184 WeakPolarHBondContact O-CB 3.44Å; I181-W184 VanDerWaalsContact O-CG 3.27Å; I181-W184 PolarHBondContact O-N 3.32Å; I181-V192 HydrophobicContact CG2-CG2 4.42Å; I181-W370 HydrophobicContact CD1-CE3 4.28Å; I181-W370 HydrophobicContact CD1-CH2 3.07Å; I181-W370 HydrophobicContact CD1-CZ2 3.68Å; I181-W370 HydrophobicContact CD1-CZ3 3.38Å; I181-W370 HydrophobicContact CG1-CH2 4.41Å; I181-W370 HydrophobicContact CG1-CZ3 4.38Å
182	I	89.2	Confident	90.9	Very high	86 Å²	86	42.4 Å²	42.4	44%	0.441	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	120.8	-176.1	-167.8	176.1	0	0	0	111.3	R114 K178 E179	R114-I182 PolarHBondContact NH1-O 3.01Å; K178-I182 WeakPolarHBondContact O-CB 3.46Å; K178-I182 PolarHBondContact O-N 2.98Å; E179-I182 VanDerWaalsContact O-CG2 3.26Å; E179-I182 WeakPolarHBondContact O-CG2 3.44Å
183	G	88.4	Confident	91	Very high	80 Å²	80	42.3 Å²	42.3	83%	0.825	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.8	4.7	-174	0	0	0	0	0	115.6	I181	I181-G183 PolarHBondContact O-N 2.91Å; I181-G183 VanDerWaalsContact O-N 3.14Å
184	W	91.4	Very high	90.8	Very high	40 Å²	40	46 Å²	46	15%	0.152	24%	0.241	C	C	.	.			trans	-74.6	151.6	172.3	-73	34.9	0	0	0	111.7	L122 K125 F180 I181 N188 I189 V192	L122-W184 HydrophobicContact CD1-CE3 4.49Å; L122-W184 HydrophobicContact CD1-CH2 4.31Å; L122-W184 HydrophobicContact CD1-CZ3 3.73Å; K125-W184 HydrophobicContact CB-CH2 3.74Å; K125-W184 HydrophobicContact CB-CZ2 4.32Å; K125-W184 HydrophobicContact CD-CH2 3.75Å; K125-W184 HydrophobicContact CD-CZ2 3.8Å; K125-W184 HydrophobicContact CG-CH2 4.28Å; K125-W184 HydrophobicContact CG-CZ2 4.47Å; F180-W184 HydrophobicContact CD1-CZ2 4.07Å; F180-W184 AromaticContact CE1-CH2 3.83Å; F180-W184 HydrophobicContact CE1-CH2 3.83Å; F180-W184 AromaticContact CE1-CZ2 3.53Å; F180-W184 HydrophobicContact CE1-CZ2 3.53Å; F180-W184 HydrophobicContact CZ-CZ2 4.23Å; F180-W184 PolarHBondContact O-NE1 2.84Å; I181-W184 HydrophobicContact CB-CD2 4.18Å; I181-W184 HydrophobicContact CB-CG 4.19Å; I181-W184 HydrophobicContact CG2-CD2 4.3Å; I181-W184 HydrophobicContact CG2-CE3 4.37Å; I181-W184 HydrophobicContact CG2-CH2 4.48Å; I181-W184 HydrophobicContact CG2-CZ2 4.41Å; I181-W184 HydrophobicContact CG2-CZ3 4.48Å; I181-W184 VanDerWaalsContact O-CB 3.25Å; I181-W184 WeakPolarHBondContact O-CB 3.44Å; I181-W184 VanDerWaalsContact O-CG 3.27Å; I181-W184 PolarHBondContact O-N 3.32Å; W184-N188 HydrophobicContact CE3-CB 3.74Å; W184-N188 HydrophobicContact CZ3-CB 4.35Å; W184-I189 HydrophobicContact CB-CG1 4.12Å; W184-V192 HydrophobicContact CE3-CG2 4.18Å; W184-V192 HydrophobicContact CH2-CG2 4.3Å; W184-V192 HydrophobicContact CZ3-CG2 3.56Å
185	P	91.1	Very high	90.8	Very high	77 Å²	77	47.1 Å²	47.1	50%	0.5	25%	0.246	S	C	.	.			trans	-72.9	148.1	174	31.5	-35.6	0	0	0	111.4	Q187 N188 I189	P185-Q187 VanDerWaalsContact C-N 3.31Å; P185-Q187 PolarHBondContact O-N 3.11Å; P185-Q187 VanDerWaalsContact O-N 3.16Å; P185-N188 HydrophobicContact CG-CB 4.2Å; P185-N188 WeakPolarHBondContact CG-ND2 3.4Å; P185-N188 WeakPolarHBondContact O-CB 3.4Å; P185-N188 PolarHBondContact O-N 2.72Å; P185-I189 PolarHBondContact O-N 3.03Å
186	E	87.1	Confident	90.9	Very high	72 Å²	72	46.2 Å²	46.2	34%	0.336	24%	0.241	S	C	.	.	H	α-helix	trans	-50.9	-44.1	-173	-166.2	54	-125.8	0	0	113.8	N188 I189 Q190	E186-N188 PolarHBondContact O-N 3.01Å; E186-N188 VanDerWaalsContact O-N 3.12Å; E186-I189 CarbonylContact O-C 3.54Å; E186-I189 WeakPolarHBondContact O-CA 3.48Å; E186-I189 WeakPolarHBondContact O-CB 3.42Å; E186-I189 PolarHBondContact O-N 3.02Å; E186-Q190 PolarHBondContact O-N 3.1Å
187	Q	90.2	Very high	90.7	Very high	143 Å²	143	46.2 Å²	46.2	67%	0.668	24%	0.241	S	C	*	.	H	α-helix	trans	-56.4	-31.6	177.1	-63.5	176.2	-2.8	0	0	113.6	P185 R191	P185-Q187 VanDerWaalsContact C-N 3.31Å; P185-Q187 PolarHBondContact O-N 3.11Å; P185-Q187 VanDerWaalsContact O-N 3.16Å; Q187-R191 WeakPolarHBondContact O-CG 3.47Å; Q187-R191 PolarHBondContact O-N 2.93Å
188	N	92.4	Very high	90.4	Very high	42 Å²	42	51 Å²	51	23%	0.225	26%	0.263	C	S	.	.	H	α-helix	trans	-82	-30.2	175.3	-69.8	-18.9	0	0	0	111.7	L122 W184 P185 E186 R191 V192	L122-N188 HydrophobicContact CD1-CB 4.28Å; L122-N188 WeakPolarHBondContact CD2-OD1 3.4Å; W184-N188 HydrophobicContact CE3-CB 3.74Å; W184-N188 HydrophobicContact CZ3-CB 4.35Å; P185-N188 HydrophobicContact CG-CB 4.2Å; P185-N188 WeakPolarHBondContact CG-ND2 3.4Å; P185-N188 WeakPolarHBondContact O-CB 3.4Å; P185-N188 PolarHBondContact O-N 2.72Å; E186-N188 PolarHBondContact O-N 3.01Å; E186-N188 VanDerWaalsContact O-N 3.12Å; N188-R191 PolarHBondContact O-N 3.14Å; N188-V192 WeakPolarHBondContact O-CG2 3.3Å; N188-V192 PolarHBondContact O-N 2.76Å
189	I	90.7	Very high	90.3	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-43.9	174.3	-58	-179.2	0	0	0	110	W184 P185 E186 R191 V192 F193 W370 P371 A372 I375	W184-I189 HydrophobicContact CB-CG1 4.12Å; P185-I189 PolarHBondContact O-N 3.03Å; E186-I189 CarbonylContact O-C 3.54Å; E186-I189 WeakPolarHBondContact O-CA 3.48Å; E186-I189 WeakPolarHBondContact O-CB 3.42Å; E186-I189 PolarHBondContact O-N 3.02Å; I189-R191 VanDerWaalsContact C-N 3.32Å; I189-R191 PolarHBondContact O-N 3.37Å; I189-V192 WeakPolarHBondContact O-CB 3.48Å; I189-V192 PolarHBondContact O-N 2.93Å; I189-V192 VanDerWaalsContact O-N 3.14Å; I189-F193 PolarHBondContact O-N 2.86Å; I189-W370 HydrophobicContact CG2-CH2 4.12Å; I189-W370 HydrophobicContact CG2-CZ3 3.69Å; I189-P371 HydrophobicContact CD1-CB 3.74Å; I189-P371 HydrophobicContact CD1-CG 4.16Å; I189-P371 HydrophobicContact CG2-CB 4.43Å; I189-A372 HydrophobicContact CG2-CB 4.38Å; I189-I375 HydrophobicContact CB-CD1 4.48Å; I189-I375 HydrophobicContact CG2-CD1 3.81Å
190	Q	88.4	Confident	90.1	Very high	67 Å²	67	47.4 Å²	47.4	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-56.3	-43.4	170.9	-70.4	177	-18.3	0	0	112.2	E186 F193 H194 I375	E186-Q190 PolarHBondContact O-N 3.1Å; Q190-F193 PolarHBondContact O-N 2.7Å; Q190-H194 PolarHBondContact O-CD2 2.93Å; Q190-H194 PolarHBondContact O-N 2.87Å; Q190-I375 HydrophobicContact CB-CD1 4.37Å; Q190-I375 HydrophobicContact CG-CD1 3.73Å; Q190-I375 HydrophobicContact CG-CG1 4.12Å
191	R	91.5	Very high	89.6	Confident	144 Å²	144	48.4 Å²	48.4	54%	0.543	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-43.1	173.9	-73.1	172.7	177.5	-171.7	-2.8	112.5	Q187 N188 I189 H194 T195	Q187-R191 WeakPolarHBondContact O-CG 3.47Å; Q187-R191 PolarHBondContact O-N 2.93Å; N188-R191 PolarHBondContact O-N 3.14Å; I189-R191 VanDerWaalsContact C-N 3.32Å; I189-R191 PolarHBondContact O-N 3.37Å; R191-H194 PolarHBondContact O-N 3.14Å; R191-T195 WeakPolarHBondContact O-CB 3.28Å; R191-T195 PolarHBondContact O-N 3Å; R191-T195 PolarHBondContact O-OG1 3.28Å
192	V	92.6	Very high	89.3	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-47.2	174	167.9	0	0	0	0	110.9	L126 L129 L177 I181 W184 N188 I189 T195 L196	L126-V192 HydrophobicContact CD2-CB 4.36Å; L126-V192 HydrophobicContact CD2-CG2 3.68Å; L129-V192 HydrophobicContact CD1-CG1 3.98Å; L129-V192 HydrophobicContact CD1-CG2 3.98Å; L177-V192 HydrophobicContact CD1-CG1 4.04Å; I181-V192 HydrophobicContact CG2-CG2 4.42Å; W184-V192 HydrophobicContact CE3-CG2 4.18Å; W184-V192 HydrophobicContact CH2-CG2 4.3Å; W184-V192 HydrophobicContact CZ3-CG2 3.56Å; N188-V192 WeakPolarHBondContact O-CG2 3.3Å; N188-V192 PolarHBondContact O-N 2.76Å; I189-V192 WeakPolarHBondContact O-CB 3.48Å; I189-V192 PolarHBondContact O-N 2.93Å; I189-V192 VanDerWaalsContact O-N 3.14Å; V192-T195 PolarHBondContact O-N 3.18Å; V192-L196 HydrophobicContact CG1-CD1 3.72Å; V192-L196 HydrophobicContact CG1-CG 4.27Å; V192-L196 WeakPolarHBondContact O-CB 3.47Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.4Å; V192-L196 PolarHBondContact O-N 3.39Å
193	F	90	Very high	88.9	Confident	1 Å²	1	52 Å²	52	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-55.9	-57.8	176.5	178.4	-95.5	0	0	0	110.9	I189 Q190 T195 L196 V197 F205 L231 F235 I375 L376 I379	I189-F193 PolarHBondContact O-N 2.86Å; Q190-F193 PolarHBondContact O-N 2.7Å; F193-T195 VanDerWaalsContact C-N 3.35Å; F193-T195 PolarHBondContact O-N 3.05Å; F193-L196 PolarHBondContact O-N 2.87Å; F193-V197 HydrophobicContact CD1-CG2 4.14Å; F193-V197 HydrophobicContact CD2-CG2 4.12Å; F193-V197 HydrophobicContact CE1-CG2 3.93Å; F193-V197 HydrophobicContact CE2-CG2 3.92Å; F193-V197 HydrophobicContact CG-CG2 4.22Å; F193-V197 HydrophobicContact CZ-CG2 3.81Å; F193-V197 WeakPolarHBondContact O-CB 3.43Å; F193-V197 WeakPolarHBondContact O-CG2 3.25Å; F193-V197 PolarHBondContact O-N 2.9Å; F193-F205 AromaticContact CE1-CD1 3.96Å; F193-F205 HydrophobicContact CE1-CD1 3.96Å; F193-F205 AromaticContact CE1-CE1 4Å; F193-F205 HydrophobicContact CE1-CE1 4Å; F193-F205 HydrophobicContact CZ-CD1 4.33Å; F193-F205 AromaticContact CZ-CE1 3.99Å; F193-F205 HydrophobicContact CZ-CE1 3.99Å; F193-F205 HydrophobicContact CZ-CZ 4.12Å; F193-L231 HydrophobicContact CE2-CD2 4.07Å; F193-L231 HydrophobicContact CZ-CD2 4.4Å; F193-F235 HydrophobicContact CB-CE1 4.44Å; F193-F235 HydrophobicContact CD2-CD1 4.01Å; F193-F235 HydrophobicContact CD2-CD2 4.11Å; F193-F235 AromaticContact CD2-CE1 3.83Å; F193-F235 HydrophobicContact CD2-CE1 3.83Å; F193-F235 AromaticContact CD2-CE2 3.93Å; F193-F235 HydrophobicContact CD2-CE2 3.93Å; F193-F235 HydrophobicContact CD2-CG 4.15Å; F193-F235 AromaticContact CD2-CZ 3.79Å; F193-F235 HydrophobicContact CD2-CZ 3.79Å; F193-F235 HydrophobicContact CE2-CD2 4.09Å; F193-F235 HydrophobicContact CE2-CE2 4.14Å; F193-F235 HydrophobicContact CE2-CG 4.35Å; F193-F235 HydrophobicContact CE2-CZ 4.46Å; F193-I375 HydrophobicContact CB-CD1 4.3Å; F193-I375 HydrophobicContact CD1-CG2 4.06Å; F193-I375 HydrophobicContact CE1-CG2 4.32Å; F193-I375 HydrophobicContact CG-CG2 4.24Å; F193-L376 HydrophobicContact CE2-CD2 3.88Å; F193-L376 HydrophobicContact CE2-CG 4.13Å; F193-L376 HydrophobicContact CZ-CD2 3.82Å; F193-L376 HydrophobicContact CZ-CG 4.46Å; F193-I379 HydrophobicContact CE1-CD1 3.62Å; F193-I379 HydrophobicContact CZ-CD1 3.65Å
194	H	88	Confident	88.7	Confident	78 Å²	78	52.9 Å²	52.9	36%	0.361	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-41.3	-179.4	-70.1	-53.4	0	0	0	113.5	Q190 R191 H198 W206	Q190-H194 PolarHBondContact O-CD2 2.93Å; Q190-H194 PolarHBondContact O-N 2.87Å; R191-H194 PolarHBondContact O-N 3.14Å; H194-H198 WeakPolarHBondContact O-CB 3.38Å; H194-H198 PolarHBondContact O-N 3.44Å; H194-W206 AromaticContact CE1-NE1 3.69Å
195	T	91.2	Very high	88.3	Confident	30 Å²	30	51.3 Å²	51.3	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-49.2	177.5	-63.7	0	0	0	0	112	L126 E130 R191 V192 F193 V197 H198 V199	L126-T195 HydrophobicContact CB-CG2 4.37Å; L126-T195 HydrophobicContact CD2-CG2 4.39Å; E130-T195 HydrophobicContact CG-CG2 3.63Å; E130-T195 WeakPolarHBondContact OE1-CG2 3.39Å; R191-T195 WeakPolarHBondContact O-CB 3.28Å; R191-T195 PolarHBondContact O-N 3Å; R191-T195 PolarHBondContact O-OG1 3.28Å; V192-T195 PolarHBondContact O-N 3.18Å; F193-T195 VanDerWaalsContact C-N 3.35Å; F193-T195 PolarHBondContact O-N 3.05Å; T195-V197 VanDerWaalsContact C-N 3.34Å; T195-V197 PolarHBondContact O-N 2.92Å; T195-H198 PolarHBondContact O-N 3.06Å; T195-V199 WeakPolarHBondContact O-CG2 3.44Å; T195-V199 PolarHBondContact O-N 3.05Å
196	L	92.2	Very high	87.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-36.2	-177.9	-68.5	-178.6	0	0	0	112.3	L129 L133 Y173 L177 V192 F193 V199 C200 F230 F235	L129-L196 HydrophobicContact CB-CD2 4.09Å; L133-L196 HydrophobicContact CB-CD2 4.04Å; L133-L196 HydrophobicContact CD2-CB 3.98Å; L133-L196 HydrophobicContact CD2-CD2 3.75Å; L133-L196 HydrophobicContact CD2-CG 4.42Å; L133-L196 WeakPolarHBondContact CD2-O 3.48Å; Y173-L196 HydrophobicContact CE1-CD1 4.14Å; Y173-L196 WeakPolarHBondContact OH-CD1 3.21Å; Y173-L196 WeakPolarHBondContact OH-CD2 3.43Å; L177-L196 HydrophobicContact CD1-CD1 3.94Å; L177-L196 HydrophobicContact CD2-CD1 3.68Å; L177-L196 HydrophobicContact CG-CD1 4.5Å; V192-L196 HydrophobicContact CG1-CD1 3.72Å; V192-L196 HydrophobicContact CG1-CG 4.27Å; V192-L196 WeakPolarHBondContact O-CB 3.47Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.4Å; V192-L196 PolarHBondContact O-N 3.39Å; F193-L196 PolarHBondContact O-N 2.87Å; L196-V199 PolarHBondContact O-N 3.38Å; L196-C200 PolarHBondContact O-N 3.02Å; L196-F230 HydrophobicContact CB-CZ 4.21Å; L196-F230 WeakPolarHBondContact O-CZ 3.3Å; L196-F235 HydrophobicContact CB-CZ 4.11Å; L196-F235 HydrophobicContact CD1-CE1 4.48Å; L196-F235 HydrophobicContact CD1-CZ 4.1Å
197	V	87.8	Confident	87.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-42.2	174.7	-177.4	0	0	0	0	110.9	F193 T195 V199 C200 F201 F205 F230 F235	F193-V197 HydrophobicContact CD1-CG2 4.14Å; F193-V197 HydrophobicContact CD2-CG2 4.12Å; F193-V197 HydrophobicContact CE1-CG2 3.93Å; F193-V197 HydrophobicContact CE2-CG2 3.92Å; F193-V197 HydrophobicContact CG-CG2 4.22Å; F193-V197 HydrophobicContact CZ-CG2 3.81Å; F193-V197 WeakPolarHBondContact O-CB 3.43Å; F193-V197 WeakPolarHBondContact O-CG2 3.25Å; F193-V197 PolarHBondContact O-N 2.9Å; T195-V197 VanDerWaalsContact C-N 3.34Å; T195-V197 PolarHBondContact O-N 2.92Å; V197-V199 VanDerWaalsContact C-N 3.29Å; V197-V199 PolarHBondContact O-N 3.32Å; V197-C200 WeakPolarHBondContact O-CB 3.22Å; V197-C200 PolarHBondContact O-N 3.29Å; V197-F201 HydrophobicContact CG1-CD2 3.68Å; V197-F201 HydrophobicContact CG1-CE2 3.97Å; V197-F201 WeakPolarHBondContact O-CD2 3.49Å; V197-F201 PolarHBondContact O-N 2.99Å; V197-F205 HydrophobicContact CB-CB 4.3Å; V197-F205 HydrophobicContact CG1-CB 3.49Å; V197-F205 VanDerWaalsContact CG1-CB 3.49Å; V197-F205 HydrophobicContact CG1-CD2 3.29Å; V197-F205 HydrophobicContact CG1-CE2 4.16Å; V197-F205 HydrophobicContact CG1-CG 3.61Å; V197-F230 HydrophobicContact CB-CE1 4.14Å; V197-F230 HydrophobicContact CG1-CE1 4.43Å; V197-F230 HydrophobicContact CG2-CE1 3.7Å; V197-F230 HydrophobicContact CG2-CZ 4.41Å; V197-F235 HydrophobicContact CG2-CE2 4.34Å
198	H	88	Confident	87.7	Confident	99 Å²	99	51.6 Å²	51.6	46%	0.458	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-38.1	173.8	-179.7	-87.5	0	0	0	112.1	H194 T195 C200 N202	H194-H198 WeakPolarHBondContact O-CB 3.38Å; H194-H198 PolarHBondContact O-N 3.44Å; T195-H198 PolarHBondContact O-N 3.06Å; H198-C200 VanDerWaalsContact C-N 3.34Å; H198-N202 VanDerWaalsContact O-CA 3.28Å; H198-N202 WeakPolarHBondContact O-CA 3.01Å; H198-N202 PolarHBondContact O-N 2.91Å
199	V	88.8	Confident	87.5	Confident	15 Å²	15	49.8 Å²	49.8	9%	0.091	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-35.8	172.6	171.3	0	0	0	0	112.6	E130 L133 R134 T195 L196 V197	E130-V199 HydrophobicContact CB-CG2 3.96Å; E130-V199 HydrophobicContact CG-CG2 3.63Å; L133-V199 HydrophobicContact CD2-CB 4.16Å; L133-V199 HydrophobicContact CD2-CG1 3.96Å; L133-V199 HydrophobicContact CG-CG1 4.35Å; R134-V199 HydrophobicContact CG-CG1 3.79Å; T195-V199 WeakPolarHBondContact O-CG2 3.44Å; T195-V199 PolarHBondContact O-N 3.05Å; L196-V199 PolarHBondContact O-N 3.38Å; V197-V199 VanDerWaalsContact C-N 3.29Å; V197-V199 PolarHBondContact O-N 3.32Å
200	C	87.5	Confident	87.5	Confident	10 Å²	10	51.4 Å²	51.4	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-72.9	-34.3	-179.9	-174.8	0	0	0	0	113.4	M137 L196 V197 H198 F230	M137-C200 HydrophobicContact CE-CB 4.46Å; M137-C200 VanDerWaalsContact CE-SG 3.52Å; M137-C200 HydrophobicContact SD-CB 4.27Å; L196-C200 PolarHBondContact O-N 3.02Å; V197-C200 WeakPolarHBondContact O-CB 3.22Å; V197-C200 PolarHBondContact O-N 3.29Å; H198-C200 VanDerWaalsContact C-N 3.34Å; C200-F230 HydrophobicContact CB-CD1 4.01Å; C200-F230 HydrophobicContact CB-CD2 3.88Å; C200-F230 HydrophobicContact CB-CE1 3.89Å; C200-F230 HydrophobicContact CB-CE2 3.78Å; C200-F230 HydrophobicContact CB-CG 4Å; C200-F230 HydrophobicContact CB-CZ 3.78Å; C200-F230 VanDerWaalsContact SG-CD2 3.57Å; C200-F230 WeakPolarHBondContact SG-CG 3.4Å
201	F	83.8	Confident	87.6	Confident	21 Å²	21	50.5 Å²	50.5	9%	0.092	24%	0.241	C	C	.	.	H	α-helix	trans	-113.8	-6.2	-172.5	-64.8	-75.8	0	0	0	114.9	V197 E203 R208 T226 L227 F230	V197-F201 HydrophobicContact CG1-CD2 3.68Å; V197-F201 HydrophobicContact CG1-CE2 3.97Å; V197-F201 WeakPolarHBondContact O-CD2 3.49Å; V197-F201 PolarHBondContact O-N 2.99Å; F201-E203 PolarHBondContact O-N 3.47Å; F201-R208 HydrophobicContact CB-CG 4.22Å; F201-R208 HydrophobicContact CD1-CG 3.83Å; F201-R208 HydrophobicContact CE1-CG 4.44Å; F201-R208 HydrophobicContact CG-CG 4.06Å; F201-T226 HydrophobicContact CD1-CG2 4.42Å; F201-T226 HydrophobicContact CE1-CG2 3.64Å; F201-T226 HydrophobicContact CZ-CG2 4.09Å; F201-L227 HydrophobicContact CE2-CD1 4.24Å; F201-L227 HydrophobicContact CZ-CB 4.24Å; F201-L227 HydrophobicContact CZ-CD1 3.86Å; F201-F230 HydrophobicContact CE2-CD1 4.03Å
202	N	84.6	Confident	87.6	Confident	104 Å²	104	44.1 Å²	44.1	56%	0.556	22%	0.218	S	C	*	.	S	Bend	trans	54.1	19	-171.9	-66.5	-46.4	0	0	0	114.4	H198	H198-N202 VanDerWaalsContact O-CA 3.28Å; H198-N202 WeakPolarHBondContact O-CA 3.01Å; H198-N202 PolarHBondContact O-N 2.91Å
203	E	81.6	Confident	87.6	Confident	61 Å²	61	44.1 Å²	44.1	29%	0.285	22%	0.218	S	C	.	.	S	Bend	trans	-144.8	167	-171.6	-71.3	178.1	-136.9	0	0	110.4	F201 F205 R208	F201-E203 PolarHBondContact O-N 3.47Å; E203-F205 PolarHBondContact O-N 3.45Å; E203-R208 IonicContact OE1-CZ 2.65Å; E203-R208 IonicContact OE1-NH1 2.71Å; E203-R208 PolarHBondContact OE1-NH1 2.94Å; E203-R208 WeakPolarHBondContact OE2-CD 3.31Å; E203-R208 IonicContact OE2-NH1 3.82Å
204	N	83.2	Confident	87.7	Confident	99 Å²	99	48 Å²	48	53%	0.529	24%	0.244	S	C	.	.			trans	-66.2	128.5	169.6	-174.1	-59	0	0	0	110.1	W206 F207 R208	N204-W206 VanDerWaalsContact C-N 3.31Å; N204-W206 PolarHBondContact O-N 3.06Å; N204-W206 WeakPolarHBondContact OD1-CB 3.4Å; N204-W206 PolarHBondContact OD1-N 2.94Å; N204-F207 HydrophobicContact CB-CB 4.21Å; N204-F207 WeakPolarHBondContact O-CB 3.37Å; N204-F207 PolarHBondContact O-N 2.95Å; N204-F207 VanDerWaalsContact O-N 3.13Å; N204-R208 PolarHBondContact O-N 2.96Å
205	F	84	Confident	87.9	Confident	7 Å²	7	47.8 Å²	47.8	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-50.3	-48.5	179.9	176.8	-122.8	0	0	0	113.6	F193 V197 E203 F207 R208 L209 L227 I379	F193-F205 AromaticContact CE1-CD1 3.96Å; F193-F205 HydrophobicContact CE1-CD1 3.96Å; F193-F205 AromaticContact CE1-CE1 4Å; F193-F205 HydrophobicContact CE1-CE1 4Å; F193-F205 HydrophobicContact CZ-CD1 4.33Å; F193-F205 AromaticContact CZ-CE1 3.99Å; F193-F205 HydrophobicContact CZ-CE1 3.99Å; F193-F205 HydrophobicContact CZ-CZ 4.12Å; V197-F205 HydrophobicContact CB-CB 4.3Å; V197-F205 HydrophobicContact CG1-CB 3.49Å; V197-F205 VanDerWaalsContact CG1-CB 3.49Å; V197-F205 HydrophobicContact CG1-CD2 3.29Å; V197-F205 HydrophobicContact CG1-CE2 4.16Å; V197-F205 HydrophobicContact CG1-CG 3.61Å; E203-F205 PolarHBondContact O-N 3.45Å; F205-F207 VanDerWaalsContact C-N 3.3Å; F205-F207 PolarHBondContact O-N 3.05Å; F205-R208 PolarHBondContact O-N 3.32Å; F205-L209 HydrophobicContact CD2-CB 4.34Å; F205-L209 HydrophobicContact CE1-CD2 3.79Å; F205-L209 HydrophobicContact CE2-CB 4.1Å; F205-L209 HydrophobicContact CE2-CD1 4.47Å; F205-L209 HydrophobicContact CE2-CD2 4.26Å; F205-L209 HydrophobicContact CZ-CB 4.26Å; F205-L209 HydrophobicContact CZ-CD1 4.42Å; F205-L209 HydrophobicContact CZ-CD2 3.6Å; F205-L209 HydrophobicContact CZ-CG 4.31Å; F205-L209 WeakPolarHBondContact O-CB 3.27Å; F205-L209 PolarHBondContact O-N 3.47Å; F205-L227 HydrophobicContact CE2-CD1 4Å; F205-I379 HydrophobicContact CD1-CD1 4.48Å; F205-I379 HydrophobicContact CE1-CD1 3.69Å; F205-I379 HydrophobicContact CE1-CG1 4.34Å; F205-I379 HydrophobicContact CE1-CG2 4.14Å; F205-I379 HydrophobicContact CZ-CD1 4.43Å
206	W	83.2	Confident	87.9	Confident	89 Å²	89	56.1 Å²	56.1	34%	0.337	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-37.3	-176	-64	107.8	0	0	0	111.5	H194 N204 S210 I379 Y383	H194-W206 AromaticContact CE1-NE1 3.69Å; N204-W206 VanDerWaalsContact C-N 3.31Å; N204-W206 PolarHBondContact O-N 3.06Å; N204-W206 WeakPolarHBondContact OD1-CB 3.4Å; N204-W206 PolarHBondContact OD1-N 2.94Å; W206-S210 WeakPolarHBondContact O-CB 2.95Å; W206-S210 PolarHBondContact O-N 2.8Å; W206-S210 PolarHBondContact O-OG 2.91Å; W206-I379 HydrophobicContact CH2-CB 4.09Å; W206-I379 HydrophobicContact CH2-CG1 3.51Å; W206-I379 HydrophobicContact CH2-CG2 4.12Å; W206-I379 HydrophobicContact CZ2-CG1 3.93Å; W206-I379 HydrophobicContact CZ3-CB 4.39Å; W206-I379 HydrophobicContact CZ3-CG1 4.15Å; W206-I379 HydrophobicContact CZ3-CG2 3.91Å; W206-Y383 HydrophobicContact CE3-CE2 4.1Å; W206-Y383 AromaticContact CZ3-CE2 3.79Å; W206-Y383 HydrophobicContact CZ3-CE2 3.79Å
207	F	85.8	Confident	88	Confident	141 Å²	141	57.5 Å²	57.5	62%	0.618	28%	0.28	S	S	*	.	H	α-helix	trans	-65.5	-48.3	174.2	-176	-98.4	0	0	0	110.9	N204 F205 S210 S211	N204-F207 HydrophobicContact CB-CB 4.21Å; N204-F207 WeakPolarHBondContact O-CB 3.37Å; N204-F207 PolarHBondContact O-N 2.95Å; N204-F207 VanDerWaalsContact O-N 3.13Å; F205-F207 VanDerWaalsContact C-N 3.3Å; F205-F207 PolarHBondContact O-N 3.05Å; F207-S210 PolarHBondContact O-N 3.3Å; F207-S211 VanDerWaalsContact O-CB 3.24Å; F207-S211 WeakPolarHBondContact O-CB 3.4Å; F207-S211 PolarHBondContact O-N 2.71Å
208	R	85.7	Confident	88.1	Confident	68 Å²	68	59.2 Å²	59.2	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-64.9	-45.4	-179.6	-169.7	67.8	-176.7	-163.4	7.2	112.6	F201 E203 N204 F205 S211 L212 D220 S223	F201-R208 HydrophobicContact CB-CG 4.22Å; F201-R208 HydrophobicContact CD1-CG 3.83Å; F201-R208 HydrophobicContact CE1-CG 4.44Å; F201-R208 HydrophobicContact CG-CG 4.06Å; E203-R208 IonicContact OE1-CZ 2.65Å; E203-R208 IonicContact OE1-NH1 2.71Å; E203-R208 PolarHBondContact OE1-NH1 2.94Å; E203-R208 WeakPolarHBondContact OE2-CD 3.31Å; E203-R208 IonicContact OE2-NH1 3.82Å; N204-R208 PolarHBondContact O-N 2.96Å; F205-R208 PolarHBondContact O-N 3.32Å; R208-S211 PolarHBondContact O-N 3.44Å; R208-L212 WeakPolarHBondContact O-CB 3.28Å; R208-L212 PolarHBondContact O-N 3Å; R208-D220 IonicContact NH2-OD2 2.73Å; R208-S223 PolarHBondContact NH2-OG 2.78Å
209	L	89.3	Confident	88.3	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-49.7	177.3	-177.5	67.1	0	0	0	110.7	F205 S211 L212 I213 L227 I379 Y383 I391	F205-L209 HydrophobicContact CD2-CB 4.34Å; F205-L209 HydrophobicContact CE1-CD2 3.79Å; F205-L209 HydrophobicContact CE2-CB 4.1Å; F205-L209 HydrophobicContact CE2-CD1 4.47Å; F205-L209 HydrophobicContact CE2-CD2 4.26Å; F205-L209 HydrophobicContact CZ-CB 4.26Å; F205-L209 HydrophobicContact CZ-CD1 4.42Å; F205-L209 HydrophobicContact CZ-CD2 3.6Å; F205-L209 HydrophobicContact CZ-CG 4.31Å; F205-L209 WeakPolarHBondContact O-CB 3.27Å; F205-L209 PolarHBondContact O-N 3.47Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.03Å; L209-L212 PolarHBondContact O-N 2.66Å; L209-L212 VanDerWaalsContact O-N 3.15Å; L209-I213 HydrophobicContact CD1-CG2 4.05Å; L209-I213 HydrophobicContact CG-CD1 4.32Å; L209-I213 HydrophobicContact CG-CG2 4.42Å; L209-I213 WeakPolarHBondContact O-CG1 3.34Å; L209-I213 WeakPolarHBondContact O-CG2 3.45Å; L209-I213 PolarHBondContact O-N 3.02Å; L209-L227 HydrophobicContact CD1-CD2 3.54Å; L209-I379 HydrophobicContact CD2-CG2 3.94Å; L209-Y383 HydrophobicContact CD2-CE2 3.56Å; L209-Y383 HydrophobicContact CG-CE2 4.4Å; L209-I391 HydrophobicContact CD1-CD1 4.41Å; L209-I391 HydrophobicContact CD1-CG1 4.21Å; L209-I391 HydrophobicContact CD2-CD1 4.14Å
210	S	90.1	Very high	88.4	Confident	40 Å²	40	60.3 Å²	60.3	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-41.6	178.5	-55.2	0	0	0	0	111.6	W206 F207 L212 C214 Y383	W206-S210 WeakPolarHBondContact O-CB 2.95Å; W206-S210 PolarHBondContact O-N 2.8Å; W206-S210 PolarHBondContact O-OG 2.91Å; F207-S210 PolarHBondContact O-N 3.3Å; S210-L212 VanDerWaalsContact C-N 3.3Å; S210-L212 PolarHBondContact O-N 2.88Å; S210-C214 WeakPolarHBondContact O-CB 3.48Å; S210-C214 PolarHBondContact O-N 2.85Å; S210-C214 PolarHBondContact O-SG 2.8Å; S210-Y383 PolarHBondContact OG-OH 3.47Å
211	S	90.2	Very high	88.6	Confident	49 Å²	49	62 Å²	62	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-57.9	-43	174.4	-176.9	0	0	0	0	111.7	F207 R208 L209 Q215	F207-S211 VanDerWaalsContact O-CB 3.24Å; F207-S211 WeakPolarHBondContact O-CB 3.4Å; F207-S211 PolarHBondContact O-N 2.71Å; R208-S211 PolarHBondContact O-N 3.44Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.03Å; S211-Q215 VanDerWaalsContact O-CG 3.24Å; S211-Q215 WeakPolarHBondContact O-CG 3.43Å; S211-Q215 PolarHBondContact O-N 3.14Å; S211-Q215 PolarHBondContact O-NE2 3.37Å; S211-Q215 PolarHBondContact OG-NE2 3.4Å
212	L	92.1	Very high	88.8	Confident	10 Å²	10	65.2 Å²	65.2	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-70.4	-47.1	-179.3	-167.5	66.7	0	0	0	113	R208 L209 S210 C214 D220 E224 L227 I394	R208-L212 WeakPolarHBondContact O-CB 3.28Å; R208-L212 PolarHBondContact O-N 3Å; L209-L212 PolarHBondContact O-N 2.66Å; L209-L212 VanDerWaalsContact O-N 3.15Å; S210-L212 VanDerWaalsContact C-N 3.3Å; S210-L212 PolarHBondContact O-N 2.88Å; L212-C214 VanDerWaalsContact C-N 3.32Å; L212-C214 PolarHBondContact O-N 2.98Å; L212-D220 HydrophobicContact CD1-CB 4.3Å; L212-E224 HydrophobicContact CD1-CG 3.98Å; L212-E224 HydrophobicContact CD2-CG 4.23Å; L212-E224 HydrophobicContact CG-CG 4.27Å; L212-L227 HydrophobicContact CD2-CB 4.29Å; L212-L227 HydrophobicContact CD2-CD2 3.67Å; L212-I394 HydrophobicContact CD2-CD1 4.17Å; L212-I394 HydrophobicContact CG-CD1 4.44Å
213	I	92.7	Very high	89.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-78.3	-13.3	-175.5	73	-167.1	0	0	0	113.6	L209 Y383 H387 R390 I391 I394	L209-I213 HydrophobicContact CD1-CG2 4.05Å; L209-I213 HydrophobicContact CG-CD1 4.32Å; L209-I213 HydrophobicContact CG-CG2 4.42Å; L209-I213 WeakPolarHBondContact O-CG1 3.34Å; L209-I213 WeakPolarHBondContact O-CG2 3.45Å; L209-I213 PolarHBondContact O-N 3.02Å; I213-Y383 HydrophobicContact CD1-CD1 3.81Å; I213-Y383 HydrophobicContact CD1-CD2 4.48Å; I213-Y383 HydrophobicContact CD1-CE1 3.5Å; I213-Y383 VanDerWaalsContact CD1-CE1 3.5Å; I213-Y383 HydrophobicContact CD1-CE2 4.22Å; I213-Y383 HydrophobicContact CD1-CG 4.29Å; I213-H387 HydrophobicContact CD1-CB 3.87Å; I213-H387 HydrophobicContact CG1-CB 4.35Å; I213-H387 PolarHBondContact O-CD2 3.35Å; I213-R390 PolarHBondContact O-NE 3.17Å; I213-R390 PolarHBondContact O-NH1 3.03Å; I213-I391 HydrophobicContact CD1-CD1 4.28Å; I213-I391 HydrophobicContact CG2-CD1 4.48Å; I213-I391 HydrophobicContact CG2-CG1 3.79Å; I213-I394 HydrophobicContact CG2-CD1 4.42Å
214	C	92.1	Very high	89.6	Confident	83 Å²	83	57.9 Å²	57.9	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-93.3	-17.5	174.7	-68.7	0	0	0	0	113.9	S210 L212	S210-C214 WeakPolarHBondContact O-CB 3.48Å; S210-C214 PolarHBondContact O-N 2.85Å; S210-C214 PolarHBondContact O-SG 2.8Å; L212-C214 VanDerWaalsContact C-N 3.32Å; L212-C214 PolarHBondContact O-N 2.98Å
215	Q	92.3	Very high	89.9	Confident	73 Å²	73	53.7 Å²	53.7	34%	0.341	28%	0.277	S	S	.	.	S	Bend	trans	-71.4	-179	172.9	-75.7	172.1	49.8	0	0	111.3	S211 R390	S211-Q215 VanDerWaalsContact O-CG 3.24Å; S211-Q215 WeakPolarHBondContact O-CG 3.43Å; S211-Q215 PolarHBondContact O-N 3.14Å; S211-Q215 PolarHBondContact O-NE2 3.37Å; S211-Q215 PolarHBondContact OG-NE2 3.4Å; Q215-R390 PolarHBondContact O-NH1 2.93Å; Q215-R390 PolarHBondContact O-NH2 3.4Å
216	R	92.2	Very high	90.2	Very high	206 Å²	206	54 Å²	54	78%	0.777	28%	0.279	S	S	*	.			trans	-77.3	147.9	168.2	-66.6	-179.6	-175.8	158.9	0.2	110.5	V219	R216-V219 HydrophobicContact CB-CG2 3.72Å; R216-V219 WeakPolarHBondContact O-CB 3.43Å; R216-V219 VanDerWaalsContact O-CG2 3.24Å; R216-V219 WeakPolarHBondContact O-CG2 3.46Å; R216-V219 PolarHBondContact O-N 3.26Å
217	P	92.5	Very high	90.5	Very high	29 Å²	29	50 Å²	50	19%	0.188	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	140.1	178	-21.6	32.4	0	0	0	111.8	V219 W406 T455 P456	P217-V219 VanDerWaalsContact C-N 3.27Å; P217-V219 PolarHBondContact O-N 3.28Å; P217-W406 HydrophobicContact CB-CD2 3.53Å; P217-W406 HydrophobicContact CB-CE3 3.8Å; P217-W406 HydrophobicContact CB-CG 3.92Å; P217-W406 HydrophobicContact CB-CH2 4.2Å; P217-W406 HydrophobicContact CB-CZ2 3.95Å; P217-W406 HydrophobicContact CB-CZ3 4.13Å; P217-W406 HydrophobicContact CG-CE3 4.45Å; P217-W406 HydrophobicContact CG-CZ3 4.49Å; P217-T455 HydrophobicContact CG-CG2 3.66Å; P217-P456 HydrophobicContact CB-CB 4.17Å; P217-P456 HydrophobicContact CG-CB 3.93Å
218	G	90.6	Very high	90.8	Very high	36 Å²	36	44 Å²	44	37%	0.371	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	9	-179.9	0	0	0	0	0	115.7	E224	G218-E224 PolarHBondContact N-OE1 3.09Å
219	V	92.2	Very high	90.9	Very high	90 Å²	90	41.3 Å²	41.3	55%	0.545	23%	0.229	S	C	.	.	S	Bend	trans	-70.1	-38.8	173.3	168.2	0	0	0	0	111.8	R216 P217	R216-V219 HydrophobicContact CB-CG2 3.72Å; R216-V219 WeakPolarHBondContact O-CB 3.43Å; R216-V219 VanDerWaalsContact O-CG2 3.24Å; R216-V219 WeakPolarHBondContact O-CG2 3.46Å; R216-V219 PolarHBondContact O-N 3.26Å; P217-V219 VanDerWaalsContact C-N 3.27Å; P217-V219 PolarHBondContact O-N 3.28Å
220	D	91.6	Very high	90.9	Very high	47 Å²	47	41.2 Å²	41.2	25%	0.251	23%	0.228	S	C	.	.	S	Bend	trans	-125.7	75.7	174.8	-173.9	-7.2	0	0	0	110.4	R208 L212 Q222 S223 E224	R208-D220 IonicContact NH2-OD2 2.73Å; L212-D220 HydrophobicContact CD1-CB 4.3Å; D220-Q222 PolarHBondContact O-N 3.3Å; D220-Q222 PolarHBondContact OD1-N 2.98Å; D220-S223 PolarHBondContact O-N 3.32Å; D220-S223 PolarHBondContact OD1-N 3.25Å; D220-S223 PolarHBondContact OD1-OG 2.91Å; D220-S223 WeakPolarHBondContact OD2-CB 3.3Å; D220-S223 PolarHBondContact OD2-OG 3.16Å; D220-E224 WeakPolarHBondContact O-CG 3.4Å; D220-E224 PolarHBondContact O-N 3.46Å
221	P	90.9	Very high	90.9	Very high	46 Å²	46	39.5 Å²	39.5	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-23.2	-177.1	27.3	-34.8	0	0	0	112.4	L225	P221-L225 VanDerWaalsContact O-CB 3.24Å; P221-L225 WeakPolarHBondContact O-CB 3.36Å; P221-L225 PolarHBondContact O-N 2.87Å
222	Q	88.9	Confident	90.7	Very high	88 Å²	88	38.8 Å²	38.8	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-72.4	-40	177.2	-176.5	64.3	7.5	0	0	111.1	L140 D220 T226	L140-Q222 PolarHBondContact O-NE2 2.83Å; D220-Q222 PolarHBondContact O-N 3.3Å; D220-Q222 PolarHBondContact OD1-N 2.98Å; Q222-T226 VanDerWaalsContact O-CB 3.27Å; Q222-T226 WeakPolarHBondContact O-CB 3.17Å; Q222-T226 PolarHBondContact O-N 3.49Å; Q222-T226 PolarHBondContact O-OG1 2.95Å
223	S	89.2	Confident	90.5	Very high	9 Å²	9	39.7 Å²	39.7	6%	0.063	21%	0.209	C	C	.	.	H	α-helix	trans	-69.9	-40.7	171.9	-69.7	0	0	0	0	112.6	R208 D220 L225 T226 L227	R208-S223 PolarHBondContact NH2-OG 2.78Å; D220-S223 PolarHBondContact O-N 3.32Å; D220-S223 PolarHBondContact OD1-N 3.25Å; D220-S223 PolarHBondContact OD1-OG 2.91Å; D220-S223 WeakPolarHBondContact OD2-CB 3.3Å; D220-S223 PolarHBondContact OD2-OG 3.16Å; S223-L225 PolarHBondContact O-N 2.82Å; S223-T226 PolarHBondContact O-N 2.54Å; S223-L227 WeakPolarHBondContact O-CB 3.43Å; S223-L227 PolarHBondContact O-N 3.21Å
224	E	92.1	Very high	90.3	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-57.5	-47.8	173.3	-69.3	178.5	166.2	0	0	111	L212 G218 D220 L227 R228 I394 L404 W406	L212-E224 HydrophobicContact CD1-CG 3.98Å; L212-E224 HydrophobicContact CD2-CG 4.23Å; L212-E224 HydrophobicContact CG-CG 4.27Å; G218-E224 PolarHBondContact N-OE1 3.09Å; D220-E224 WeakPolarHBondContact O-CG 3.4Å; D220-E224 PolarHBondContact O-N 3.46Å; E224-L227 PolarHBondContact O-N 3.2Å; E224-R228 WeakPolarHBondContact O-CB 3.27Å; E224-R228 PolarHBondContact O-N 3.14Å; E224-I394 HydrophobicContact CB-CG2 4.48Å; E224-I394 HydrophobicContact CG-CD1 4.28Å; E224-I394 HydrophobicContact CG-CG1 4.28Å; E224-L404 HydrophobicContact CB-CD1 3.75Å; E224-L404 HydrophobicContact CB-CG 4.39Å; E224-L404 HydrophobicContact CG-CD1 4.23Å; E224-L404 WeakPolarHBondContact OE2-CD1 3.47Å; E224-W406 PolarHBondContact OE1-NE1 3.2Å; E224-W406 PolarHBondContact OE2-NE1 2.89Å
225	L	90.5	Very high	90	Very high	11 Å²	11	35.9 Å²	35.9	6%	0.058	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-42.5	175.6	179.6	64.1	0	0	0	112.5	L165 P221 S223 R228 L229 L399 G402	L165-L225 HydrophobicContact CD2-CD1 3.75Å; L165-L225 HydrophobicContact CD2-CD2 4.46Å; P221-L225 VanDerWaalsContact O-CB 3.24Å; P221-L225 WeakPolarHBondContact O-CB 3.36Å; P221-L225 PolarHBondContact O-N 2.87Å; S223-L225 PolarHBondContact O-N 2.82Å; L225-R228 PolarHBondContact O-N 2.8Å; L225-L229 HydrophobicContact CD1-CD1 3.8Å; L225-L229 HydrophobicContact CD1-CD2 4.38Å; L225-L229 HydrophobicContact CD1-CG 3.8Å; L225-L229 HydrophobicContact CD2-CD1 4.32Å; L225-L229 HydrophobicContact CG-CD1 3.81Å; L225-L229 HydrophobicContact CG-CG 4.19Å; L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.43Å; L225-L229 PolarHBondContact O-N 3.16Å; L225-L399 HydrophobicContact CD1-CD1 4.21Å; L225-L399 HydrophobicContact CD1-CD2 4.33Å; L225-G402 WeakPolarHBondContact CD2-O 3.33Å
226	T	89.7	Confident	89.5	Confident	14 Å²	14	33.3 Å²	33.3	9%	0.086	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-46.1	179	-62.8	0	0	0	0	110.7	L140 F201 Q222 S223 L229 F230	L140-T226 HydrophobicContact CD1-CG2 4.19Å; F201-T226 HydrophobicContact CD1-CG2 4.42Å; F201-T226 HydrophobicContact CE1-CG2 3.64Å; F201-T226 HydrophobicContact CZ-CG2 4.09Å; Q222-T226 VanDerWaalsContact O-CB 3.27Å; Q222-T226 WeakPolarHBondContact O-CB 3.17Å; Q222-T226 PolarHBondContact O-N 3.49Å; Q222-T226 PolarHBondContact O-OG1 2.95Å; S223-T226 PolarHBondContact O-N 2.54Å; T226-L229 PolarHBondContact O-N 2.73Å; T226-F230 WeakPolarHBondContact O-CB 3.24Å; T226-F230 PolarHBondContact O-N 3.02Å
227	L	90.6	Very high	88.1	Confident	5 Å²	5	26 Å²	26	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-47.2	176.3	-175.3	66.2	0	0	0	111.9	F201 F205 L209 L212 S223 E224 L231 I394	F201-L227 HydrophobicContact CE2-CD1 4.24Å; F201-L227 HydrophobicContact CZ-CB 4.24Å; F201-L227 HydrophobicContact CZ-CD1 3.86Å; F205-L227 HydrophobicContact CE2-CD1 4Å; L209-L227 HydrophobicContact CD1-CD2 3.54Å; L212-L227 HydrophobicContact CD2-CB 4.29Å; L212-L227 HydrophobicContact CD2-CD2 3.67Å; S223-L227 WeakPolarHBondContact O-CB 3.43Å; S223-L227 PolarHBondContact O-N 3.21Å; E224-L227 PolarHBondContact O-N 3.2Å; L227-L231 HydrophobicContact CD1-CD1 3.55Å; L227-L231 HydrophobicContact CD1-CG 3.97Å; L227-L231 HydrophobicContact CG-CD1 4.04Å; L227-L231 WeakPolarHBondContact O-CB 3.33Å; L227-L231 WeakPolarHBondContact O-CG 3.34Å; L227-L231 PolarHBondContact O-N 3.49Å; L227-I394 HydrophobicContact CB-CG2 4.42Å; L227-I394 HydrophobicContact CD2-CG2 4.08Å; L227-I394 HydrophobicContact CG-CG2 4.43Å
228	R	90.5	Very high	85.9	Confident	13 Å²	13	27 Å²	27	5%	0.049	15%	0.154	C	C	.	.	H	α-helix	trans	-52.4	-59.9	172.9	173.4	174.2	-73.8	-141.5	-6.4	111.3	E224 L225 F230 R232 F393 I394 L395 G397	E224-R228 WeakPolarHBondContact O-CB 3.27Å; E224-R228 PolarHBondContact O-N 3.14Å; L225-R228 PolarHBondContact O-N 2.8Å; R228-F230 PolarHBondContact O-N 2.89Å; R228-R232 VanDerWaalsContact O-CB 3.22Å; R228-R232 WeakPolarHBondContact O-CB 3.43Å; R228-R232 PolarHBondContact O-N 3.39Å; R228-F393 PolarHBondContact NH2-O 3.36Å; R228-I394 WeakPolarHBondContact CB-O 3.28Å; R228-I394 VanDerWaalsContact CZ-O 3.3Å; R228-I394 PolarHBondContact NE-O 3.22Å; R228-I394 PolarHBondContact NH2-O 2.78Å; R228-L395 VanDerWaalsContact CZ-O 3.22Å; R228-L395 PolarHBondContact NE-O 2.9Å; R228-L395 PolarHBondContact NH2-O 3.06Å; R228-G397 PolarHBondContact NH1-O 3.37Å; R228-G397 VanDerWaalsContact NH2-N 3.12Å; R228-G397 PolarHBondContact NH2-O 3.45Å
229	L	88.9	Confident	83.8	Confident	13 Å²	13	30.6 Å²	30.6	7%	0.068	17%	0.165	C	C	.	.	H	α-helix	trans	-64.3	-42	-172.2	-70.3	177.9	0	0	0	111.4	P164 L165 L225 T226 K233	P164-L229 HydrophobicContact CB-CD1 3.85Å; P164-L229 HydrophobicContact CG-CD1 4.44Å; L165-L229 HydrophobicContact CD2-CD1 4.33Å; L165-L229 HydrophobicContact CD2-CD2 4.22Å; L225-L229 HydrophobicContact CD1-CD1 3.8Å; L225-L229 HydrophobicContact CD1-CD2 4.38Å; L225-L229 HydrophobicContact CD1-CG 3.8Å; L225-L229 HydrophobicContact CD2-CD1 4.32Å; L225-L229 HydrophobicContact CG-CD1 3.81Å; L225-L229 HydrophobicContact CG-CG 4.19Å; L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.43Å; L225-L229 PolarHBondContact O-N 3.16Å; T226-L229 PolarHBondContact O-N 2.73Å; L229-K233 HydrophobicContact CD2-CD 4.46Å; L229-K233 WeakPolarHBondContact O-CB 3.45Å; L229-K233 WeakPolarHBondContact O-CG 3.28Å; L229-K233 PolarHBondContact O-N 3.4Å
230	F	90.2	Very high	81.3	Confident	2 Å²	2	29 Å²	29	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-52.4	-179.7	-180	-111.8	0	0	0	112.1	L133 L170 L196 V197 C200 F201 T226 R228 T234 F235	L133-F230 HydrophobicContact CD1-CE2 4.04Å; L133-F230 HydrophobicContact CD2-CE2 3.8Å; L133-F230 HydrophobicContact CD2-CZ 4.21Å; L170-F230 HydrophobicContact CD1-CD2 4.31Å; L170-F230 HydrophobicContact CD2-CD2 4.49Å; L196-F230 HydrophobicContact CB-CZ 4.21Å; L196-F230 WeakPolarHBondContact O-CZ 3.3Å; V197-F230 HydrophobicContact CB-CE1 4.14Å; V197-F230 HydrophobicContact CG1-CE1 4.43Å; V197-F230 HydrophobicContact CG2-CE1 3.7Å; V197-F230 HydrophobicContact CG2-CZ 4.41Å; C200-F230 HydrophobicContact CB-CD1 4.01Å; C200-F230 HydrophobicContact CB-CD2 3.88Å; C200-F230 HydrophobicContact CB-CE1 3.89Å; C200-F230 HydrophobicContact CB-CE2 3.78Å; C200-F230 HydrophobicContact CB-CG 4Å; C200-F230 HydrophobicContact CB-CZ 3.78Å; C200-F230 VanDerWaalsContact SG-CD2 3.57Å; C200-F230 WeakPolarHBondContact SG-CG 3.4Å; F201-F230 HydrophobicContact CE2-CD1 4.03Å; T226-F230 WeakPolarHBondContact O-CB 3.24Å; T226-F230 PolarHBondContact O-N 3.02Å; R228-F230 PolarHBondContact O-N 2.89Å; F230-T234 HydrophobicContact CE2-CG2 4.42Å; F230-T234 WeakPolarHBondContact O-CB 3.33Å; F230-T234 PolarHBondContact O-N 3.02Å; F230-T234 PolarHBondContact O-OG1 2.73Å; F230-F235 HydrophobicContact CE1-CD2 4.44Å; F230-F235 AromaticContact CE1-CE2 3.69Å; F230-F235 HydrophobicContact CE1-CE2 3.69Å; F230-F235 AromaticContact CZ-CE2 3.71Å; F230-F235 HydrophobicContact CZ-CE2 3.71Å; F230-F235 HydrophobicContact CZ-CZ 4.4Å
231	L	89.5	Confident	78.4	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-66.8	-42.3	-179.2	-64.8	-176.9	0	0	0	111.9	F193 L227 F235 L236 L376 L395	F193-L231 HydrophobicContact CE2-CD2 4.07Å; F193-L231 HydrophobicContact CZ-CD2 4.4Å; L227-L231 HydrophobicContact CD1-CD1 3.55Å; L227-L231 HydrophobicContact CD1-CG 3.97Å; L227-L231 HydrophobicContact CG-CD1 4.04Å; L227-L231 WeakPolarHBondContact O-CB 3.33Å; L227-L231 WeakPolarHBondContact O-CG 3.34Å; L227-L231 PolarHBondContact O-N 3.49Å; L231-F235 HydrophobicContact CD2-CD2 3.95Å; L231-F235 HydrophobicContact CD2-CE2 4.46Å; L231-F235 PolarHBondContact O-N 2.96Å; L231-L236 HydrophobicContact CB-CD1 4.31Å; L231-L236 PolarHBondContact O-N 2.85Å; L231-L376 HydrophobicContact CD1-CD2 3.96Å; L231-L376 HydrophobicContact CD2-CD1 4.48Å; L231-L376 HydrophobicContact CD2-CD2 4.1Å; L231-L395 HydrophobicContact CB-CD2 3.85Å; L231-L395 HydrophobicContact CD1-CD2 4.04Å
232	R	86.5	Confident	75.4	Confident	35 Å²	35	29.2 Å²	29.2	13%	0.132	16%	0.163	C	C	.	.	H	α-helix	trans	-77.5	-22.7	-178.5	-71.6	-170.9	57.6	-170.4	-0.2	116.2	R228 L236 L395 E426	R228-R232 VanDerWaalsContact O-CB 3.22Å; R228-R232 WeakPolarHBondContact O-CB 3.43Å; R228-R232 PolarHBondContact O-N 3.39Å; R232-L236 HydrophobicContact CG-CD1 3.82Å; R232-L236 VanDerWaalsContact O-O 3.06Å; R232-L395 WeakPolarHBondContact CD-O 3.4Å; R232-L395 HydrophobicContact CG-CD2 4.15Å; R232-L395 PolarHBondContact NH1-O 3.49Å; R232-E426 IonicContact CZ-OE1 3.12Å; R232-E426 IonicContact CZ-OE2 2.76Å; R232-E426 VanDerWaalsContact CZ-OE2 3.24Å; R232-E426 IonicContact NH1-OE1 2.68Å; R232-E426 IonicContact NH1-OE2 3.15Å; R232-E426 PolarHBondContact NH1-OE2 2.87Å; R232-E426 IonicContact NH2-OE1 3.3Å; R232-E426 PolarHBondContact NH2-OE1 2.62Å; R232-E426 IonicContact NH2-OE2 2.79Å; R232-E426 PolarHBondContact NH2-OE2 2.74Å
233	K	86.6	Confident	72.5	Confident	29 Å²	29	32.5 Å²	32.5	13%	0.126	18%	0.179	C	C	.	.	H	α-helix	trans	-93.3	-21.5	174.5	-66.6	-174.5	172.1	-176.6	0	112.6	P164 L165 C167 L170 F171 G174 L229	P164-K233 PolarHBondContact O-NZ 2.81Å; L165-K233 PolarHBondContact O-NZ 3.34Å; C167-K233 PolarHBondContact O-NZ 3.16Å; L170-K233 HydrophobicContact CB-CB 4.14Å; L170-K233 HydrophobicContact CB-CD 4.12Å; L170-K233 HydrophobicContact CD2-CB 4.24Å; L170-K233 HydrophobicContact CD2-CD 4.46Å; L170-K233 HydrophobicContact CG-CB 3.88Å; F171-K233 WeakPolarHBondContact CA-O 3.45Å; F171-K233 HydrophobicContact CB-CB 4.21Å; F171-K233 HydrophobicContact CB-CD 4.33Å; F171-K233 HydrophobicContact CB-CG 4.24Å; G174-K233 WeakPolarHBondContact CA-O 3.43Å; L229-K233 HydrophobicContact CD2-CD 4.46Å; L229-K233 WeakPolarHBondContact O-CB 3.45Å; L229-K233 WeakPolarHBondContact O-CG 3.28Å; L229-K233 PolarHBondContact O-N 3.4Å
234	T	88.7	Confident	69.4	Low	1 Å²	1	39.8 Å²	39.8	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-104.2	-41.8	-173.9	-46	0	0	0	0	114.4	Y173 L177 F230	Y173-T234 HydrophobicContact CD1-CG2 3.91Å; Y173-T234 HydrophobicContact CE1-CG2 3.86Å; L177-T234 HydrophobicContact CD2-CG2 3.6Å; F230-T234 HydrophobicContact CE2-CG2 4.42Å; F230-T234 WeakPolarHBondContact O-CB 3.33Å; F230-T234 PolarHBondContact O-N 3.02Å; F230-T234 PolarHBondContact O-OG1 2.73Å
235	F	86.5	Confident	66.3	Low	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-38.6	-167.1	-63.5	-71.9	0	0	0	114.2	L177 F193 L196 V197 F230 L231 W370 A372 L376	L177-F235 HydrophobicContact CD2-CD1 4.32Å; L177-F235 HydrophobicContact CD2-CE1 3.85Å; L177-F235 HydrophobicContact CD2-CZ 4.41Å; F193-F235 HydrophobicContact CB-CE1 4.44Å; F193-F235 HydrophobicContact CD2-CD1 4.01Å; F193-F235 HydrophobicContact CD2-CD2 4.11Å; F193-F235 AromaticContact CD2-CE1 3.83Å; F193-F235 HydrophobicContact CD2-CE1 3.83Å; F193-F235 AromaticContact CD2-CE2 3.93Å; F193-F235 HydrophobicContact CD2-CE2 3.93Å; F193-F235 HydrophobicContact CD2-CG 4.15Å; F193-F235 AromaticContact CD2-CZ 3.79Å; F193-F235 HydrophobicContact CD2-CZ 3.79Å; F193-F235 HydrophobicContact CE2-CD2 4.09Å; F193-F235 HydrophobicContact CE2-CE2 4.14Å; F193-F235 HydrophobicContact CE2-CG 4.35Å; F193-F235 HydrophobicContact CE2-CZ 4.46Å; L196-F235 HydrophobicContact CB-CZ 4.11Å; L196-F235 HydrophobicContact CD1-CE1 4.48Å; L196-F235 HydrophobicContact CD1-CZ 4.1Å; V197-F235 HydrophobicContact CG2-CE2 4.34Å; F230-F235 HydrophobicContact CE1-CD2 4.44Å; F230-F235 AromaticContact CE1-CE2 3.69Å; F230-F235 HydrophobicContact CE1-CE2 3.69Å; F230-F235 AromaticContact CZ-CE2 3.71Å; F230-F235 HydrophobicContact CZ-CE2 3.71Å; F230-F235 HydrophobicContact CZ-CZ 4.4Å; L231-F235 HydrophobicContact CD2-CD2 3.95Å; L231-F235 HydrophobicContact CD2-CE2 4.46Å; L231-F235 PolarHBondContact O-N 2.96Å; F235-W370 HydrophobicContact CD1-CH2 4.01Å; F235-W370 AromaticContact CD1-CZ2 3.63Å; F235-W370 HydrophobicContact CD1-CZ2 3.63Å; F235-W370 HydrophobicContact CE1-CH2 4.42Å; F235-W370 HydrophobicContact CE1-CZ2 4.27Å; F235-W370 PolarHBondContact O-NE1 3.33Å; F235-A372 HydrophobicContact CB-CB 4.38Å; F235-A372 HydrophobicContact CD1-CB 3.71Å; F235-A372 HydrophobicContact CE1-CB 4.47Å; F235-A372 HydrophobicContact CG-CB 4.42Å; F235-L376 HydrophobicContact CB-CD1 4Å
236	L	80.8	Confident	63.4	Low	19 Å²	19	57.6 Å²	57.6	10%	0.099	29%	0.294	C	S	.	.	S	Bend	trans	-86.9	139.8	173.7	-54.8	159.5	0	0	0	108.1	L231 R232 P238 L376 L395	L231-L236 HydrophobicContact CB-CD1 4.31Å; L231-L236 PolarHBondContact O-N 2.85Å; R232-L236 HydrophobicContact CG-CD1 3.82Å; R232-L236 VanDerWaalsContact O-O 3.06Å; L236-P238 WeakPolarHBondContact O-CD 3.32Å; L236-L376 HydrophobicContact CD1-CD1 4.1Å; L236-L376 HydrophobicContact CD2-CD1 3.6Å; L236-L376 HydrophobicContact CG-CD1 3.66Å; L236-L395 HydrophobicContact CD1-CD1 4.05Å; L236-L395 HydrophobicContact CD1-CD2 4.03Å
237	D	62.5	Low	60.5	Low	53 Å²	53	65.7 Å²	65.7	28%	0.283	33%	0.331	S	S	.	.			trans	-81.1	121.9	178.2	-161.1	-44.9	0	0	0	109.1	K178 N239 A240	K178-D237 IonicContact NZ-OD2 3.43Å; K178-D237 PolarHBondContact NZ-OD2 3.06Å; D237-N239 PolarHBondContact O-N 3.25Å; D237-N239 PolarHBondContact OD1-N 2.72Å; D237-N239 PolarHBondContact OD1-ND2 2.9Å; D237-N239 VanDerWaalsContact OD1-ND2 3.14Å; D237-A240 HydrophobicContact CB-CB 3.82Å; D237-A240 PolarHBondContact O-N 3.31Å; D237-A240 VanDerWaalsContact O-N 3.09Å
238	P	47.8	Very low	57.5	Low	50 Å²	50	72.7 Å²	72.7	33%	0.325	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-17.2	177	-25.9	36.7	0	0	0	113.9	F171 L236	F171-P238 HydrophobicContact CD2-CG 3.77Å; F171-P238 HydrophobicContact CE2-CG 3.77Å; L236-P238 WeakPolarHBondContact O-CD 3.32Å
239	N	45.1	Very low	54.5	Low	112 Å²	112	77.3 Å²	77.3	60%	0.599	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	7.4	-179.7	-42	-80.8	0	0	0	113.3	D237 L241	D237-N239 PolarHBondContact O-N 3.25Å; D237-N239 PolarHBondContact OD1-N 2.72Å; D237-N239 PolarHBondContact OD1-ND2 2.9Å; D237-N239 VanDerWaalsContact OD1-ND2 3.14Å; N239-L241 PolarHBondContact O-N 3.26Å
240	A	39.7	Very low	51.7	Low	56 Å²	56	81.3 Å²	81.3	46%	0.463	43%	0.43	S	S	.	.			trans	-83.9	4.8	174.4	0	0	0	0	0	113.8	D237 P242 N433	D237-A240 HydrophobicContact CB-CB 3.82Å; D237-A240 PolarHBondContact O-N 3.31Å; D237-A240 VanDerWaalsContact O-N 3.09Å; A240-P242 WeakPolarHBondContact O-CD 3.38Å; A240-N433 PolarHBondContact O-ND2 3.39Å; A240-N433 VanDerWaalsContact O-ND2 3.14Å
241	L	31	Very low	48.7	Very low	30 Å²	30	89.3 Å²	89.3	16%	0.157	47%	0.472	C	S	.	.	S	Bend	trans	-85.2	113.8	164.4	-64.5	165.1	0	0	0	107.2	N239 Q243 Y396 E426 V430	N239-L241 PolarHBondContact O-N 3.26Å; L241-Q243 PolarHBondContact O-N 2.96Å; L241-Y396 HydrophobicContact CD1-CD1 4.41Å; L241-Y396 HydrophobicContact CD1-CE1 4.49Å; L241-Y396 HydrophobicContact CD2-CD1 4.48Å; L241-Y396 HydrophobicContact CD2-CE1 4.39Å; L241-E426 HydrophobicContact CD1-CB 3.84Å; L241-E426 HydrophobicContact CD1-CG 3.8Å; L241-V430 HydrophobicContact CD2-CB 4.28Å
242	P	28.9	Very low	45.9	Very low	68 Å²	68	94.9 Å²	94.9	44%	0.442	51%	0.511	S	S	.	.			trans	-56.9	127.5	-176.7	17.3	-32	0	0	0	113.1	A240 M244 S429 N433	A240-P242 WeakPolarHBondContact O-CD 3.38Å; P242-M244 VanDerWaalsContact C-N 3.32Å; P242-M244 PolarHBondContact O-N 3.27Å; P242-S429 VanDerWaalsContact CD-OG 3.29Å; P242-S429 WeakPolarHBondContact CD-OG 3.39Å; P242-N433 WeakPolarHBondContact CD-ND2 3.45Å
243	Q	26.4	Very low	43	Very low	156 Å²	156	98.6 Å²	98.6	73%	0.729	54%	0.543	S	S	*	.			trans	-66.1	92.2	158.1	-71.7	178.8	-67.2	0	0	108.6	L241 Y245 Q277	L241-Q243 PolarHBondContact O-N 2.96Å; Q243-Y245 PolarHBondContact O-N 3.11Å; Q243-Q277 VanDerWaalsContact NE2-NE2 3.14Å
244	M	25.4	Very low	40.3	Very low	162 Å²	162	102.7 Å²	102.7	80%	0.798	58%	0.575	S	S	*	*			trans	-83.8	85.1	163.1	-75.2	-144.5	74.7	0	0	109.6	P242	P242-M244 VanDerWaalsContact C-N 3.32Å; P242-M244 PolarHBondContact O-N 3.27Å
245	Y	27.5	Very low	37.4	Very low	221 Å²	221	108 Å²	108	87%	0.867	61%	0.607	S	S	*	*			trans	-171.3	78.7	144.9	-76.7	-52.8	0	0	0	108.9	Q243	Q243-Y245 PolarHBondContact O-N 3.11Å
246	D	28.1	Very low	34.7	Very low	166 Å²	166	116.7 Å²	116.7	89%	0.888	65%	0.645	S	S	*	*			trans	-91.9	110.7	150.5	-99.8	-32.2	0	0	0	106.7	I248	D246-I248 PolarHBondContact O-N 3.4Å
247	E	29.1	Very low	32.3	Very low	184 Å²	184	122.5 Å²	122.5	86%	0.86	68%	0.677	S	S	*	*			trans	-59.6	136.1	174.1	-73	-173.3	130.6	0	0	110.1	S249	E247-S249 PolarHBondContact O-N 2.84Å
248	I	28.4	Very low	30.5	Very low	152 Å²	152	124.5 Å²	124.5	78%	0.779	70%	0.701	S	S	*	*			trans	-60.3	109.6	170.9	-65.2	172	0	0	0	107.8	D246 S250	D246-I248 PolarHBondContact O-N 3.4Å; I248-S250 PolarHBondContact O-N 3.49Å
249	S	26.3	Very low	29.5	Very low	110 Å²	110	131 Å²	131	77%	0.769	72%	0.724	S	S	*	*			trans	-66.1	78.8	169.3	40.9	0	0	0	0	110.6	E247	E247-S249 PolarHBondContact O-N 2.84Å
250	S	30.2	Very low	28.7	Very low	98 Å²	98	132.8 Å²	132.8	69%	0.685	73%	0.728	S	S	*	*			trans	-95.3	102.8	162.6	60.6	0	0	0	0	109.2	I248 S252	I248-S250 PolarHBondContact O-N 3.49Å; S250-S252 PolarHBondContact O-N 3.37Å
251	L	27.4	Very low	28.1	Very low	169 Å²	169	139 Å²	139	89%	0.885	75%	0.745	S	S	*	*			trans	-61.6	117.5	179.7	-70.9	76	0	0	0	110.6
252	S	30.4	Very low	27.8	Very low	120 Å²	120	145.2 Å²	145.2	84%	0.839	78%	0.778	S	S	*	*			trans	-156.6	128.6	142.2	49.1	0	0	0	0	112	S250	S250-S252 PolarHBondContact O-N 3.37Å
253	S	26.5	Very low	27.6	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	80%	0.795	S	S	*	*			trans	-76.8	140.1	-174.8	51.7	0	0	0	0	113.8
254	S	30.6	Very low	27.8	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	80%	0.8	S	S	*	*				-179.7	112.8	116.1	36.4	0	0	0	0	114.8
255	V	26	Very low	27.8	Very low	114 Å²	114	145.5 Å²	145.5	69%	0.691	80%	0.802	S	S	*	*			trans	11.3	124.6	137.1	-175.1	0	0	0	0	118.1
256	F	30.7	Very low	28	Very low	183 Å²	183	143 Å²	143	80%	0.803	80%	0.804	S	S	*	*				-170.6	114.1	116	-108.4	-72.5	0	0	0	115.5
257	N	29.5	Very low	27.8	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	80%	0.799	S	S	*	*			trans	34.2	130.7	149.6	-64.7	-17.7	0	0	0	124.1
258	A	25	Very low	27.6	Very low	95 Å²	95	136.8 Å²	136.8	79%	0.785	79%	0.794	S	S	*	*			trans	-82.3	160.3	167.8	0	0	0	0	0	114.8
259	K	28.4	Very low	27.4	Very low	186 Å²	186	137.4 Å²	137.4	81%	0.809	80%	0.798	S	S	*	*			trans	-174.2	134	141.2	-109.6	170.4	-174.3	178.1	0	114.4
260	Q	27.9	Very low	27.4	Very low	149 Å²	149	137 Å²	137	70%	0.696	79%	0.79	S	S	*	*			trans	67.7	148.8	156.7	-53.1	166.1	-46.4	0	0	115.8
261	F	26.7	Very low	27.2	Very low	186 Å²	186	138.1 Å²	138.1	82%	0.816	79%	0.788	S	S	*	*			cis	-135.2	167.2	18.6	-89.2	-89.3	0	0	0	113.8
262	L	24.2	Very low	27.2	Very low	161 Å²	161	135.6 Å²	135.6	84%	0.843	77%	0.772	S	S	*	*			trans	-95.6	166.6	174.2	-82.1	162.5	0	0	0	112.6
263	S	26	Very low	27.1	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	76%	0.764	S	S	*	*			trans	68.6	111.1	160.8	66.4	0	0	0	0	119.5
264	S	29.7	Very low	27.1	Very low	119 Å²	119	136.5 Å²	136.5	83%	0.832	75%	0.746	S	S	*	*				-157.5	135.6	104.2	51	0	0	0	0	110.3
265	D	26.1	Very low	27	Very low	160 Å²	160	135.4 Å²	135.4	86%	0.856	74%	0.744	S	S	*	*			trans	-78.2	132.7	173.4	-65.3	-66.6	0	0	0	110.2
266	N	30.3	Very low	27.1	Very low	168 Å²	168	136.2 Å²	136.2	90%	0.898	74%	0.744	S	S	*	*			trans	-156.3	142.6	143.6	-111.2	-28.1	0	0	0	111.7
267	S	23.8	Very low	27	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	74%	0.735	S	S	*	*			trans	-95	126.6	-159.8	55.9	0	0	0	0	114.4
268	S	25.4	Very low	26.8	Very low	107 Å²	107	134 Å²	134	75%	0.748	74%	0.736	S	S	*	*			trans	-139.8	128.2	156.3	42.3	0	0	0	0	109.9	T270	S268-T270 PolarHBondContact O-N 3.44Å
269	L	23.9	Very low	26.9	Very low	165 Å²	165	135.8 Å²	135.8	86%	0.864	73%	0.731	S	S	*	*			trans	-81.5	81.4	-167.6	-81.3	160.1	0	0	0	112.6
270	T	26.2	Very low	26.9	Very low	100 Å²	100	135.5 Å²	135.5	61%	0.613	73%	0.733	S	S	*	*			trans	-85.5	111.4	166.9	-52.8	0	0	0	0	109.6	S268 Q272	S268-T270 PolarHBondContact O-N 3.44Å; T270-Q272 VanDerWaalsContact C-N 3.32Å; T270-Q272 PolarHBondContact O-N 3.3Å
271	I	26.7	Very low	26.9	Very low	122 Å²	122	133.8 Å²	133.8	63%	0.626	74%	0.735	S	S	*	*			trans	-79.2	86.5	173.9	-59.7	175.8	0	0	0	108.1
272	Q	26.7	Very low	26.8	Very low	117 Å²	117	129.1 Å²	129.1	55%	0.547	73%	0.73	S	S	.	*			trans	-61.6	138.1	166.8	-76.4	176.3	-84.4	0	0	110.5	T270 D274	T270-Q272 VanDerWaalsContact C-N 3.32Å; T270-Q272 PolarHBondContact O-N 3.3Å; Q272-D274 HydrophobicContact CB-CB 4.11Å; Q272-D274 WeakPolarHBondContact CB-OD2 3.07Å; Q272-D274 WeakPolarHBondContact CG-OD2 3.26Å; Q272-D274 PolarHBondContact NE2-OD2 3.48Å; Q272-D274 PolarHBondContact O-N 2.92Å
273	Y	28.4	Very low	27	Very low	176 Å²	176	130.6 Å²	130.6	69%	0.69	73%	0.733	S	S	*	*			trans	-83.1	18.7	168.6	-104.5	-92.5	0	0	0	112.3	A275	Y273-A275 PolarHBondContact O-N 3.49Å
274	D	26	Very low	27	Very low	76 Å²	76	129.9 Å²	129.9	41%	0.406	73%	0.733	S	S	.	*			trans	-81.2	53.9	-172.2	-68.1	-47.5	0	0	0	114.3	Q272	Q272-D274 HydrophobicContact CB-CB 4.11Å; Q272-D274 WeakPolarHBondContact CB-OD2 3.07Å; Q272-D274 WeakPolarHBondContact CG-OD2 3.26Å; Q272-D274 PolarHBondContact NE2-OD2 3.48Å; Q272-D274 PolarHBondContact O-N 2.92Å
275	A	29.1	Very low	26.8	Very low	92 Å²	92	134 Å²	134	76%	0.76	74%	0.739	S	S	*	*	S	Bend	trans	-103.1	5	172.5	0	0	0	0	0	113.8	Y273	Y273-A275 PolarHBondContact O-N 3.49Å
276	L	29.4	Very low	26.9	Very low	131 Å²	131	131.6 Å²	131.6	69%	0.686	74%	0.735	S	S	*	*	S	Bend	trans	-135.8	-5.9	-179.4	-82.4	173.5	0	0	0	117
277	Q	27.2	Very low	26.7	Very low	134 Å²	134	132.7 Å²	132.7	63%	0.626	74%	0.735	S	S	*	*	S	Bend	trans	-100.4	-6.8	178.9	-73.5	-161.4	2.4	0	0	116	Q243 L279	Q243-Q277 VanDerWaalsContact NE2-NE2 3.14Å; Q277-L279 PolarHBondContact O-N 2.89Å; Q277-L279 VanDerWaalsContact O-N 3.11Å
278	N	26.4	Very low	26.9	Very low	144 Å²	144	134 Å²	134	77%	0.77	74%	0.738	S	S	*	*			trans	-82.3	87.5	172.6	-74.9	-50.5	0	0	0	111.1
279	L	26.8	Very low	26.8	Very low	131 Å²	131	133 Å²	133	69%	0.686	73%	0.731	S	S	*	*			trans	-174.5	70.2	156.1	-102.2	168.8	0	0	0	111.6	Q277	Q277-L279 PolarHBondContact O-N 2.89Å; Q277-L279 VanDerWaalsContact O-N 3.11Å
280	H	27.6	Very low	27.1	Very low	181 Å²	181	135.7 Å²	135.7	84%	0.838	73%	0.73	S	S	*	*			trans	-111.4	160.6	157.6	-131.4	-128.2	0	0	0	108.6
281	P	27.6	Very low	27.3	Very low	113 Å²	113	136.4 Å²	136.4	73%	0.734	74%	0.735	S	S	*	*				-111.1	125.6	-111.5	11.6	10.6	0	0	0	111.7
282	A	26	Very low	27.2	Very low	87 Å²	87	141.8 Å²	141.8	72%	0.719	75%	0.747	S	S	*	*			trans	-123.2	148.5	168.4	0	0	0	0	0	110
283	E	27.6	Very low	27.2	Very low	193 Å²	193	145.2 Å²	145.2	90%	0.902	76%	0.763	S	S	*	*			trans	71.6	82.5	164.9	-57.2	179.2	-174.8	0	0	117.8
284	A	27.2	Very low	27	Very low	98 Å²	98	142.9 Å²	142.9	81%	0.81	77%	0.767	S	S	*	*			trans	-148.9	46.8	151.6	0	0	0	0	0	113.1	S286	A284-S286 PolarHBondContact O-N 2.79Å
285	H	24.4	Very low	27	Very low	205 Å²	205	144.8 Å²	144.8	95%	0.949	78%	0.776	S	S	*	*			trans	-90.5	85.9	159.2	-81.3	-56	0	0	0	109.8
286	S	28.8	Very low	26.8	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	77%	0.771	S	S	*	*			trans	-152.8	122.8	156.3	62.9	0	0	0	0	110	A284	A284-S286 PolarHBondContact O-N 2.79Å
287	E	25.3	Very low	26.7	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	78%	0.775	S	S	*	*			trans	-62.2	137.9	-179.6	-56.9	167.5	129.4	0	0	111.6
288	T	29	Very low	26.6	Very low	142 Å²	142	149.8 Å²	149.8	87%	0.871	78%	0.783	S	S	*	*				-164	138.7	128.5	10.5	0	0	0	0	111.1
289	S	22.8	Very low	26.7	Very low	85 Å²	85	148.6 Å²	148.6	59%	0.594	78%	0.781	S	S	*	*			trans	-67.2	154.5	177.7	45.4	0	0	0	0	112.7
290	W	29.7	Very low	26.6	Very low	221 Å²	221	147.6 Å²	147.6	84%	0.837	79%	0.785	S	S	*	*				-174.3	103.4	109.1	-86.6	109.1	0	0	0	111.6
291	T	30.7	Very low	26.7	Very low	116 Å²	116	144.3 Å²	144.3	71%	0.712	78%	0.779	S	S	*	*			trans	44.9	116.6	143	51.8	0	0	0	0	122.1
292	R	24	Very low	26.6	Very low	235 Å²	235	150.3 Å²	150.3	89%	0.887	79%	0.787	S	S	*	*			trans	-19.9	139	143.4	-74.7	171.5	163.6	150.7	-5	115.3
293	E	27.9	Very low	26.5	Very low	188 Å²	188	157.2 Å²	157.2	88%	0.879	80%	0.797	S	S	*	*				-147.3	132.3	126.7	-126.6	169.3	-144.1	0	0	111.5
294	T	24	Very low	26.7	Very low	127 Å²	127	153.8 Å²	153.8	78%	0.779	79%	0.791	S	S	*	*			trans	-95.1	123.7	-176.4	-55.4	0	0	0	0	109.2
295	I	26.6	Very low	26.8	Very low	116 Å²	116	153.7 Å²	153.7	60%	0.595	78%	0.784	S	S	*	*			trans	-131.5	112.1	165.5	-50.7	-178.2	0	0	0	110.9	Y297	I295-Y297 HydrophobicContact CB-CE2 4.36Å; I295-Y297 HydrophobicContact CG2-CD2 3.74Å; I295-Y297 HydrophobicContact CG2-CE1 4.42Å; I295-Y297 HydrophobicContact CG2-CE2 3.3Å; I295-Y297 HydrophobicContact CG2-CG 4.46Å
296	S	23.4	Very low	27.1	Very low	94 Å²	94	149.8 Å²	149.8	66%	0.657	77%	0.77	S	S	*	*			trans	-83	135.5	164.6	172.6	0	0	0	0	109.3
297	Y	29.1	Very low	27.1	Very low	194 Å²	194	151.2 Å²	151.2	76%	0.761	77%	0.77	S	S	*	*			trans	-121.5	94	167.4	-81.6	-67.3	0	0	0	111.2	I295	I295-Y297 HydrophobicContact CB-CE2 4.36Å; I295-Y297 HydrophobicContact CG2-CD2 3.74Å; I295-Y297 HydrophobicContact CG2-CE1 4.42Å; I295-Y297 HydrophobicContact CG2-CE2 3.3Å; I295-Y297 HydrophobicContact CG2-CG 4.46Å
298	H	23.5	Very low	27.4	Very low	175 Å²	175	146.2 Å²	146.2	81%	0.81	76%	0.761	S	S	*	*			trans	-70.9	124	152.9	-96.2	-88.1	0	0	0	109.2
299	V	28.6	Very low	27.4	Very low	119 Å²	119	146.8 Å²	146.8	72%	0.721	76%	0.758	S	S	*	*			trans	-140.2	111.3	159.5	-176.3	0	0	0	0	110.1
300	S	24.6	Very low	27.6	Very low	110 Å²	110	149.8 Å²	149.8	77%	0.769	77%	0.766	S	S	*	*			trans	-98.5	145.4	158.8	-58.9	0	0	0	0	109.4
301	P	29.4	Very low	27.6	Very low	111 Å²	111	145.4 Å²	145.4	72%	0.721	76%	0.764	S	S	*	*			trans	-133.5	116.4	139.1	20.8	-1.3	0	0	0	110.5
302	R	25.6	Very low	27.4	Very low	239 Å²	239	144.6 Å²	144.6	90%	0.902	76%	0.763	S	S	*	*				58.4	98.3	89.1	-75.2	-169.8	176.3	-179.7	0.2	114.3
303	Y	23.8	Very low	27.6	Very low	233 Å²	233	139.4 Å²	139.4	91%	0.914	76%	0.757	S	S	*	*			trans	-64.5	151.5	153.3	-75.1	-92.4	0	0	0	111.1
304	P	32.2	Very low	27.6	Very low	121 Å²	121	135 Å²	135	79%	0.786	75%	0.748	S	S	*	*			trans	-110.1	143.1	141.7	4.8	15.8	0	0	0	110.6
305	S	28.4	Very low	27.7	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	75%	0.749	S	S	*	*			trans	-88.6	171.3	174.3	47.6	0	0	0	0	112.7
306	D	32.4	Very low	27.8	Very low	123 Å²	123	134.4 Å²	134.4	66%	0.658	76%	0.759	S	S	*	*			trans	110.7	102	144.6	-61.5	-55.4	0	0	0	119.8
307	N	28.3	Very low	28.2	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	76%	0.764	S	S	*	*				58.5	119.4	126.4	-49.8	-37.6	0	0	0	119.9
308	A	31.5	Very low	28.1	Very low	86 Å²	86	130 Å²	130	71%	0.711	76%	0.757	S	S	*	*				175.9	135.5	90.5	0	0	0	0	0	114
309	L	30	Very low	28.5	Very low	153 Å²	153	132.9 Å²	132.9	80%	0.801	76%	0.762	S	S	*	*			trans	54.6	108.5	144.9	-54.8	170.5	0	0	0	118.8
310	L	25.5	Very low	28.5	Very low	148 Å²	148	133.8 Å²	133.8	78%	0.775	76%	0.763	S	S	*	*				81.3	141	69.1	-81	-179.8	0	0	0	116.3
311	T	29.6	Very low	28.9	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	77%	0.765	S	S	*	*			trans	81.1	144.4	168.5	74.8	0	0	0	0	117.8
312	S	27.5	Very low	28.8	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	77%	0.766	S	S	*	*			cis	-174.9	156	-29	53.2	0	0	0	0	111.8
313	V	27.5	Very low	29	Very low	126 Å²	126	129 Å²	129	76%	0.764	76%	0.757	S	S	*	*			trans	74.6	98.1	144	169.3	0	0	0	0	120.5
314	S	27.2	Very low	29.3	Very low	97 Å²	97	128.5 Å²	128.5	68%	0.678	76%	0.759	S	S	*	*				73.7	144.6	113.5	-50.4	0	0	0	0	125.2
315	S	27.3	Very low	29	Very low	116 Å²	116	127.2 Å²	127.2	81%	0.811	75%	0.753	S	S	*	*			trans	64.2	142.8	151.6	43.4	0	0	0	0	117.8
316	S	29	Very low	29.2	Very low	114 Å²	114	128.3 Å²	128.3	80%	0.797	76%	0.761	S	S	*	*			cis	-163.2	-173.6	-7.9	56.9	0	0	0	0	107.1
317	S	31.2	Very low	29	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	76%	0.763	S	S	*	*			cis	-155.5	-165.5	14.4	63.4	0	0	0	0	112.5
318	S	27.6	Very low	29	Very low	87 Å²	87	129.6 Å²	129.6	61%	0.608	77%	0.768	S	S	*	*			trans	-72.8	155.4	178.7	52	0	0	0	0	117.3
319	Y	31.7	Very low	28.8	Very low	235 Å²	235	132.1 Å²	132.1	92%	0.922	77%	0.769	S	S	*	*				-150.6	135.6	122.7	-111.2	-78.7	0	0	0	111
320	N	28.7	Very low	28.8	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	77%	0.771	S	S	*	*			trans	-87.7	158.8	176.3	-67.1	-20.1	0	0	0	110.9
321	D	31.8	Very low	28.7	Very low	153 Å²	153	131.4 Å²	131.4	82%	0.818	77%	0.77	S	S	*	*				-149.5	166.5	123	-140.5	-23.1	0	0	0	112.4
322	N	28.9	Very low	28.6	Very low	140 Å²	140	131.4 Å²	131.4	75%	0.749	77%	0.77	S	S	*	*			trans	-102.8	164.3	-155.1	-56.7	-89.3	0	0	0	113.5
323	G	29.1	Very low	28.6	Very low	68 Å²	68	131.6 Å²	131.6	70%	0.701	77%	0.767	S	S	*	*			trans	-177.3	52.6	178.1	0	0	0	0	0	120.4
324	F	30	Very low	28.5	Very low	222 Å²	222	134.3 Å²	134.3	97%	0.974	77%	0.771	S	S	*	*			trans	70.8	145.6	159.2	-77	-87.9	0	0	0	121.8
325	S	25.7	Very low	28.4	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	78%	0.782	S	S	*	*			trans	-115.6	152.8	-178.7	175.9	0	0	0	0	110.7
326	S	33.3	Very low	28.4	Very low	118 Å²	118	137.5 Å²	137.5	83%	0.825	78%	0.776	S	S	*	*			trans	-149.8	133.1	134.3	-170.6	0	0	0	0	108.9
327	D	27	Very low	28.1	Very low	132 Å²	132	141.2 Å²	141.2	71%	0.706	78%	0.781	S	S	*	*			trans	-67.4	150.8	178.1	-53.6	-82.6	0	0	0	112.1
328	D	29.9	Very low	28	Very low	159 Å²	159	143.8 Å²	143.8	85%	0.85	79%	0.785	S	S	*	*				-161	151.3	111	-120.2	-29.8	0	0	0	114.5
329	L	26.1	Very low	27.8	Very low	140 Å²	140	146.1 Å²	146.1	73%	0.733	80%	0.796	S	S	*	*			trans	-48.6	145.7	-174.7	-96.6	57.2	0	0	0	117
330	L	29.8	Very low	27.5	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	79%	0.785	S	S	*	*				-165.6	117	98.5	-97.9	174.5	0	0	0	112.1
331	T	23.1	Very low	27.5	Very low	123 Å²	123	139 Å²	139	76%	0.755	80%	0.795	S	S	*	*			trans	-117.1	124.8	178.2	-51.8	0	0	0	0	109.5
332	V	29	Very low	27.2	Very low	129 Å²	129	136.5 Å²	136.5	78%	0.782	80%	0.795	S	S	*	*			trans	-137.5	79.9	170.6	-178.7	0	0	0	0	107.6
333	T	27.8	Very low	27	Very low	102 Å²	102	132.7 Å²	132.7	63%	0.626	79%	0.789	S	S	*	*				64.5	91.4	99.6	57.7	0	0	0	0	116.3
334	Q	25	Very low	26.9	Very low	184 Å²	184	141 Å²	141	86%	0.86	80%	0.801	S	S	*	*				36.1	116	126.5	-65.8	176.2	-18.5	0	0	119.2
335	L	24.5	Very low	26.6	Very low	172 Å²	172	135.7 Å²	135.7	90%	0.901	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.6	131	158	-97.3	75.3	0	0	0	111.3
336	P	26.9	Very low	26.7	Very low	108 Å²	108	140 Å²	140	70%	0.701	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81.2	127.2	161.7	-5.3	23.3	0	0	0	110.5
337	Q	24.2	Very low	26.4	Very low	191 Å²	191	139 Å²	139	89%	0.893	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.8	129.3	157.8	-68.1	175.2	-29.5	0	0	108.5
338	L	27.6	Very low	26.3	Very low	163 Å²	163	137.8 Å²	137.8	85%	0.853	80%	0.801	S	S	*	*			trans	-125.8	104.5	174	-115.7	161.8	0	0	0	110.7
339	V	25	Very low	26.3	Very low	137 Å²	137	139 Å²	139	83%	0.83	80%	0.799	S	S	*	*			trans	-89	114.7	175.7	172.5	0	0	0	0	109
340	G	24.6	Very low	26.4	Very low	67 Å²	67	137.6 Å²	137.6	69%	0.691	80%	0.799	S	S	*	*			trans	52	116.5	148.6	0	0	0	0	0	121
341	V	28.1	Very low	26.1	Very low	156 Å²	156	136.3 Å²	136.3	95%	0.945	80%	0.798	S	S	*	*			trans	-136.2	147.5	132.8	176.9	0	0	0	0	108.2
342	A	24.9	Very low	26.2	Very low	100 Å²	100	138.6 Å²	138.6	83%	0.826	80%	0.804	S	S	*	*			trans	-88	163	-168.6	0	0	0	0	0	114.9
343	G	24.7	Very low	26	Very low	60 Å²	60	138.1 Å²	138.1	62%	0.619	80%	0.802	S	S	*	*			trans	110.1	100.4	157.3	0	0	0	0	0	114.9
344	Y	27.5	Very low	25.8	Very low	241 Å²	241	142.3 Å²	142.3	95%	0.945	81%	0.811	S	S	*	*				179	127.9	110.3	-82.6	-60.4	0	0	0	108.2
345	S	23.5	Very low	25.9	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	81%	0.807	S	S	*	*			trans	-81	120.8	-175	54.4	0	0	0	0	111.9
346	L	29.4	Very low	25.7	Very low	183 Å²	183	140.9 Å²	140.9	96%	0.958	81%	0.805	S	S	*	*			trans	-102	98.6	158.5	-83.4	163.2	0	0	0	108.5
347	S	26	Very low	25.7	Very low	96 Å²	96	143.4 Å²	143.4	67%	0.671	81%	0.812	S	S	*	*			trans	-81.7	154.6	-180	50.9	0	0	0	0	112.6
348	S	25.6	Very low	25.7	Very low	108 Å²	108	139 Å²	139	76%	0.755	80%	0.802	S	S	*	*			trans	60.8	85	156.4	49.4	0	0	0	0	117.8
349	F	29.4	Very low	25.5	Very low	184 Å²	184	136.7 Å²	136.7	81%	0.807	81%	0.807	S	S	*	*			trans	-75.8	143.1	139.1	-78.1	-87.2	0	0	0	109.4
350	P	27.2	Very low	25.4	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	80%	0.798	S	S	*	*			trans	-66.1	134.7	172.7	-16.3	30	0	0	0	111.1	L352	P350-L352 PolarHBondContact O-N 3.33Å; P350-L352 VanDerWaalsContact O-N 3.11Å
351	T	23.5	Very low	25.4	Very low	137 Å²	137	137.1 Å²	137.1	84%	0.84	81%	0.805	S	S	*	*			trans	-71.7	101.5	177.2	-56	0	0	0	0	110.4
352	L	26	Very low	25.3	Very low	170 Å²	170	134 Å²	134	89%	0.89	79%	0.79	S	S	*	*			trans	-69.9	138.7	165.6	-137.5	85.1	0	0	0	109.9	P350 K354	P350-L352 PolarHBondContact O-N 3.33Å; P350-L352 VanDerWaalsContact O-N 3.11Å; L352-K354 PolarHBondContact O-N 2.87Å
353	V	25.7	Very low	25.3	Very low	120 Å²	120	138.9 Å²	138.9	73%	0.727	79%	0.793	S	S	*	*			trans	-66.8	124.8	-162.5	174.6	0	0	0	0	112.5	Q355	V353-Q355 HydrophobicContact CG1-CG 4.37Å; V353-Q355 PolarHBondContact O-N 2.93Å
354	K	23.2	Very low	25.5	Very low	189 Å²	189	143.6 Å²	143.6	82%	0.822	80%	0.803	S	S	*	*			trans	-64.7	96.3	162.6	-75.9	-178.6	175.2	177.9	0	110	L352	L352-K354 PolarHBondContact O-N 2.87Å
355	Q	25.7	Very low	25.5	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	78%	0.784	S	S	*	*			trans	-80.6	119.8	157.2	-75	-168.3	-8.7	0	0	109.1	V353 L357	V353-Q355 HydrophobicContact CG1-CG 4.37Å; V353-Q355 PolarHBondContact O-N 2.93Å; Q355-L357 PolarHBondContact O-N 2.93Å
356	N	21.7	Very low	25.8	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	79%	0.787	S	S	*	*			trans	-69.7	98.9	177.5	-69.6	-47.1	0	0	0	109.9
357	L	26.4	Very low	26.1	Very low	162 Å²	162	134.1 Å²	134.1	85%	0.848	77%	0.767	S	S	*	*			trans	-96.6	133.9	162.1	-79.4	163.4	0	0	0	109.7	Q355	Q355-L357 PolarHBondContact O-N 2.93Å
358	S	24.1	Very low	26.9	Very low	99 Å²	99	139 Å²	139	69%	0.692	77%	0.772	S	S	*	*			trans	-63.5	140	-163.6	47.4	0	0	0	0	114	S360	S358-S360 PolarHBondContact O-N 3.49Å
359	A	22.9	Very low	28.1	Very low	114 Å²	114	138.7 Å²	138.7	94%	0.942	76%	0.758	S	S	*	*			trans	-68.6	86.6	174.5	0	0	0	0	0	112.3
360	S	23.8	Very low	29.6	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	72%	0.722	S	S	*	*			trans	-154.3	122.4	166.3	47.9	0	0	0	0	112.7	S358	S358-S360 PolarHBondContact O-N 3.49Å
361	S	24.1	Very low	31.2	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	70%	0.703	S	S	*	*			trans	61.1	94.9	158.4	-171.5	0	0	0	0	119.1
362	S	26.1	Very low	33	Very low	91 Å²	91	121.3 Å²	121.3	64%	0.636	66%	0.663	S	S	*	*				-162.7	126.2	99.5	48.3	0	0	0	0	112.2	L364	S362-L364 PolarHBondContact O-N 2.89Å; S362-L364 VanDerWaalsContact O-N 3.16Å
363	K	25.5	Very low	34.9	Very low	202 Å²	202	113.8 Å²	113.8	88%	0.878	63%	0.625	S	S	*	*			trans	-79.3	79.7	158	-71.9	178.4	178.1	178	0	107.3	T365	K363-T365 PolarHBondContact O-N 3.37Å; K363-T365 VanDerWaalsContact O-N 3.14Å
364	L	27.3	Very low	37.1	Very low	160 Å²	160	111 Å²	111	84%	0.838	61%	0.606	S	S	*	*			trans	-73.9	101.2	163.1	-93.2	154.4	0	0	0	107	S362	S362-L364 PolarHBondContact O-N 2.89Å; S362-L364 VanDerWaalsContact O-N 3.16Å
365	T	27.7	Very low	39.5	Very low	90 Å²	90	102.4 Å²	102.4	55%	0.552	57%	0.569	S	S	*	*			trans	-71.9	132.3	-167.9	48	0	0	0	0	111	K363 T367	K363-T365 PolarHBondContact O-N 3.37Å; K363-T365 VanDerWaalsContact O-N 3.14Å; T365-T367 WeakPolarHBondContact CB-OG1 3.13Å; T365-T367 PolarHBondContact O-N 2.91Å; T365-T367 PolarHBondContact O-OG1 3.02Å; T365-T367 PolarHBondContact OG1-OG1 2.6Å
366	N	31	Very low	42	Very low	156 Å²	156	95 Å²	95	83%	0.834	54%	0.535	S	S	*	.	S	Bend	trans	-72.2	51.8	176.4	-166.1	8.1	0	0	0	111.8
367	T	35.2	Very low	44.7	Very low	90 Å²	90	88.5 Å²	88.5	55%	0.552	50%	0.5	S	S	*	.			trans	-115	9.1	-160.1	46.5	0	0	0	0	115.1	T365	T365-T367 WeakPolarHBondContact CB-OG1 3.13Å; T365-T367 PolarHBondContact O-N 2.91Å; T365-T367 PolarHBondContact O-OG1 3.02Å; T365-T367 PolarHBondContact OG1-OG1 2.6Å
368	Y	42.3	Very low	47.3	Very low	198 Å²	198	86.1 Å²	86.1	78%	0.776	48%	0.484	S	S	*	.			trans	-119	-0.1	-179.3	-81.6	-75.8	0	0	0	115.7	W370	Y368-W370 PolarHBondContact O-N 2.95Å
369	F	51.9	Low	50.1	Low	102 Å²	102	81.8 Å²	81.8	45%	0.447	45%	0.453	S	S	.	.			trans	-70.6	118.9	168.4	-131.7	-103.7	0	0	0	109.5	P371 S373 N374	F369-P371 VanDerWaalsContact O-CD 3.3Å; F369-P371 WeakPolarHBondContact O-CD 3.09Å; F369-S373 WeakPolarHBondContact CD1-OG 3.4Å; F369-S373 WeakPolarHBondContact CE1-OG 3.29Å; F369-N374 WeakPolarHBondContact CD1-OD1 3.39Å; F369-N374 WeakPolarHBondContact CE1-OD1 3.15Å
370	W	61.2	Low	53.1	Low	18 Å²	18	76.8 Å²	76.8	7%	0.068	41%	0.411	C	S	.	.			trans	-74.8	115.9	177.9	-179.5	168.6	0	0	0	107	L177 K178 I181 I189 F235 Y368 A372 S373	L177-W370 HydrophobicContact CD2-CZ2 4.23Å; L177-W370 HydrophobicContact CG-CZ2 4.47Å; K178-W370 HydrophobicContact CG-CG 4.4Å; I181-W370 HydrophobicContact CD1-CE3 4.28Å; I181-W370 HydrophobicContact CD1-CH2 3.07Å; I181-W370 HydrophobicContact CD1-CZ2 3.68Å; I181-W370 HydrophobicContact CD1-CZ3 3.38Å; I181-W370 HydrophobicContact CG1-CH2 4.41Å; I181-W370 HydrophobicContact CG1-CZ3 4.38Å; I189-W370 HydrophobicContact CG2-CH2 4.12Å; I189-W370 HydrophobicContact CG2-CZ3 3.69Å; F235-W370 HydrophobicContact CD1-CH2 4.01Å; F235-W370 AromaticContact CD1-CZ2 3.63Å; F235-W370 HydrophobicContact CD1-CZ2 3.63Å; F235-W370 HydrophobicContact CE1-CH2 4.42Å; F235-W370 HydrophobicContact CE1-CZ2 4.27Å; F235-W370 PolarHBondContact O-NE1 3.33Å; Y368-W370 PolarHBondContact O-N 2.95Å; W370-A372 VanDerWaalsContact C-N 3.26Å; W370-A372 HydrophobicContact CD2-CB 4.22Å; W370-A372 HydrophobicContact CE3-CB 3.84Å; W370-A372 HydrophobicContact CH2-CB 3.16Å; W370-A372 HydrophobicContact CZ2-CB 3.72Å; W370-A372 HydrophobicContact CZ3-CB 3.29Å; W370-A372 PolarHBondContact O-N 2.77Å; W370-S373 WeakPolarHBondContact O-CA 3.4Å; W370-S373 WeakPolarHBondContact O-CB 3.5Å; W370-S373 PolarHBondContact O-N 2.94Å; W370-S373 PolarHBondContact O-OG 3.11Å
371	P	59.3	Low	55.9	Low	48 Å²	48	76.1 Å²	76.1	31%	0.312	40%	0.397	S	S	.	.	H	α-helix	trans	-34	-41.2	178.3	-35.5	32.2	0	0	0	118.7	I189 F369 S373 N374 I375	I189-P371 HydrophobicContact CD1-CB 3.74Å; I189-P371 HydrophobicContact CD1-CG 4.16Å; I189-P371 HydrophobicContact CG2-CB 4.43Å; F369-P371 VanDerWaalsContact O-CD 3.3Å; F369-P371 WeakPolarHBondContact O-CD 3.09Å; P371-S373 VanDerWaalsContact C-N 3.28Å; P371-S373 PolarHBondContact O-N 3.29Å; P371-N374 WeakPolarHBondContact O-CA 3.11Å; P371-N374 WeakPolarHBondContact O-CB 3.35Å; P371-N374 PolarHBondContact O-N 3Å; P371-I375 PolarHBondContact O-N 3.43Å
372	A	61.4	Low	59	Low	0 Å²	0	74 Å²	74	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-72.5	-15.4	177.2	0	0	0	0	0	115.1	I189 F235 W370 N374 I375 L376	I189-A372 HydrophobicContact CG2-CB 4.38Å; F235-A372 HydrophobicContact CB-CB 4.38Å; F235-A372 HydrophobicContact CD1-CB 3.71Å; F235-A372 HydrophobicContact CE1-CB 4.47Å; F235-A372 HydrophobicContact CG-CB 4.42Å; W370-A372 VanDerWaalsContact C-N 3.26Å; W370-A372 HydrophobicContact CD2-CB 4.22Å; W370-A372 HydrophobicContact CE3-CB 3.84Å; W370-A372 HydrophobicContact CH2-CB 3.16Å; W370-A372 HydrophobicContact CZ2-CB 3.72Å; W370-A372 HydrophobicContact CZ3-CB 3.29Å; W370-A372 PolarHBondContact O-N 2.77Å; A372-N374 VanDerWaalsContact C-N 3.29Å; A372-I375 HydrophobicContact CB-CD1 4.16Å; A372-I375 PolarHBondContact O-N 3.32Å; A372-L376 PolarHBondContact O-N 3.35Å
373	S	66.8	Low	62	Low	13 Å²	13	71.2 Å²	71.2	9%	0.091	36%	0.358	C	S	.	.	H	α-helix	trans	-67.1	-31.2	162.9	61.8	0	0	0	0	111.3	F369 W370 P371 L376 M377	F369-S373 WeakPolarHBondContact CD1-OG 3.4Å; F369-S373 WeakPolarHBondContact CE1-OG 3.29Å; W370-S373 WeakPolarHBondContact O-CA 3.4Å; W370-S373 WeakPolarHBondContact O-CB 3.5Å; W370-S373 PolarHBondContact O-N 2.94Å; W370-S373 PolarHBondContact O-OG 3.11Å; P371-S373 VanDerWaalsContact C-N 3.28Å; P371-S373 PolarHBondContact O-N 3.29Å; S373-L376 PolarHBondContact O-N 3.33Å; S373-M377 WeakPolarHBondContact O-CG 3.18Å; S373-M377 PolarHBondContact O-N 3.12Å
374	N	70.8	Confident	65.3	Low	62 Å²	62	64.6 Å²	64.6	33%	0.332	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-44.5	167.6	-59.7	-28.1	0	0	0	110.9	F369 P371 A372 L376 M377 E378	F369-N374 WeakPolarHBondContact CD1-OD1 3.39Å; F369-N374 WeakPolarHBondContact CE1-OD1 3.15Å; P371-N374 WeakPolarHBondContact O-CA 3.11Å; P371-N374 WeakPolarHBondContact O-CB 3.35Å; P371-N374 PolarHBondContact O-N 3Å; A372-N374 VanDerWaalsContact C-N 3.29Å; N374-L376 VanDerWaalsContact C-N 3.28Å; N374-L376 PolarHBondContact O-N 2.87Å; N374-M377 CarbonylContact O-C 3.58Å; N374-M377 WeakPolarHBondContact O-CA 3.47Å; N374-M377 WeakPolarHBondContact O-CB 3.46Å; N374-M377 PolarHBondContact O-N 3.04Å; N374-E378 WeakPolarHBondContact O-CG 3.45Å; N374-E378 PolarHBondContact O-N 3.23Å
375	I	74.6	Confident	68.5	Low	7 Å²	7	60.8 Å²	60.8	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-56.6	-44	176	-58.1	172.8	0	0	0	110.5	I189 Q190 F193 P371 A372 M377 E378 I379	I189-I375 HydrophobicContact CB-CD1 4.48Å; I189-I375 HydrophobicContact CG2-CD1 3.81Å; Q190-I375 HydrophobicContact CB-CD1 4.37Å; Q190-I375 HydrophobicContact CG-CD1 3.73Å; Q190-I375 HydrophobicContact CG-CG1 4.12Å; F193-I375 HydrophobicContact CB-CD1 4.3Å; F193-I375 HydrophobicContact CD1-CG2 4.06Å; F193-I375 HydrophobicContact CE1-CG2 4.32Å; F193-I375 HydrophobicContact CG-CG2 4.24Å; P371-I375 PolarHBondContact O-N 3.43Å; A372-I375 HydrophobicContact CB-CD1 4.16Å; A372-I375 PolarHBondContact O-N 3.32Å; I375-M377 VanDerWaalsContact C-N 3.32Å; I375-M377 PolarHBondContact O-N 3.14Å; I375-E378 PolarHBondContact O-N 2.89Å; I375-I379 HydrophobicContact CG2-CD1 3.89Å; I375-I379 WeakPolarHBondContact O-CB 3.49Å; I375-I379 VanDerWaalsContact O-CD1 3.3Å; I375-I379 WeakPolarHBondContact O-CD1 3.5Å; I375-I379 WeakPolarHBondContact O-CG1 3.5Å; I375-I379 PolarHBondContact O-N 2.99Å
376	L	78	Confident	71.6	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-31.3	175.6	-73.5	169.2	0	0	0	113.3	F193 L231 F235 L236 A372 S373 N374 I379 L380	F193-L376 HydrophobicContact CE2-CD2 3.88Å; F193-L376 HydrophobicContact CE2-CG 4.13Å; F193-L376 HydrophobicContact CZ-CD2 3.82Å; F193-L376 HydrophobicContact CZ-CG 4.46Å; L231-L376 HydrophobicContact CD1-CD2 3.96Å; L231-L376 HydrophobicContact CD2-CD1 4.48Å; L231-L376 HydrophobicContact CD2-CD2 4.1Å; F235-L376 HydrophobicContact CB-CD1 4Å; L236-L376 HydrophobicContact CD1-CD1 4.1Å; L236-L376 HydrophobicContact CD2-CD1 3.6Å; L236-L376 HydrophobicContact CG-CD1 3.66Å; A372-L376 PolarHBondContact O-N 3.35Å; S373-L376 PolarHBondContact O-N 3.33Å; N374-L376 VanDerWaalsContact C-N 3.28Å; N374-L376 PolarHBondContact O-N 2.87Å; L376-I379 HydrophobicContact CD2-CD1 4.02Å; L376-L380 WeakPolarHBondContact O-CG 3.16Å; L376-L380 PolarHBondContact O-N 3.47Å
377	M	78.4	Confident	74.7	Confident	23 Å²	23	53.9 Å²	53.9	11%	0.113	27%	0.272	C	S	.	.	H	α-helix	trans	-74.2	-38.2	174.2	-65.6	-76.8	-85.1	0	0	112.1	S373 N374 I375 L380 H381 M434	S373-M377 WeakPolarHBondContact O-CG 3.18Å; S373-M377 PolarHBondContact O-N 3.12Å; N374-M377 CarbonylContact O-C 3.58Å; N374-M377 WeakPolarHBondContact O-CA 3.47Å; N374-M377 WeakPolarHBondContact O-CB 3.46Å; N374-M377 PolarHBondContact O-N 3.04Å; I375-M377 VanDerWaalsContact C-N 3.32Å; I375-M377 PolarHBondContact O-N 3.14Å; M377-L380 WeakPolarHBondContact O-CB 3.46Å; M377-L380 PolarHBondContact O-N 3.13Å; M377-L380 HydrophobicContact SD-CD1 4.06Å; M377-H381 PolarHBondContact O-CD2 2.78Å; M377-H381 VanDerWaalsContact O-CD2 3.27Å; M377-H381 PolarHBondContact O-N 2.85Å; M377-M434 HydrophobicContact CE-CG 4.09Å
378	E	81.6	Confident	77.5	Confident	112 Å²	112	50 Å²	50	52%	0.523	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-42.8	169.9	-70.9	176.9	176.2	0	0	111.1	N374 I375 H381 S382	N374-E378 WeakPolarHBondContact O-CG 3.45Å; N374-E378 PolarHBondContact O-N 3.23Å; I375-E378 PolarHBondContact O-N 2.89Å; E378-H381 PolarHBondContact O-N 3.33Å; E378-S382 PolarHBondContact O-N 3.13Å; E378-S382 VanDerWaalsContact O-N 3.08Å
379	I	81.9	Confident	79.9	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-48.7	172.1	-71	156.3	0	0	0	110.3	F193 F205 W206 L209 I375 L376 S382 Y383	F193-I379 HydrophobicContact CE1-CD1 3.62Å; F193-I379 HydrophobicContact CZ-CD1 3.65Å; F205-I379 HydrophobicContact CD1-CD1 4.48Å; F205-I379 HydrophobicContact CE1-CD1 3.69Å; F205-I379 HydrophobicContact CE1-CG1 4.34Å; F205-I379 HydrophobicContact CE1-CG2 4.14Å; F205-I379 HydrophobicContact CZ-CD1 4.43Å; W206-I379 HydrophobicContact CH2-CB 4.09Å; W206-I379 HydrophobicContact CH2-CG1 3.51Å; W206-I379 HydrophobicContact CH2-CG2 4.12Å; W206-I379 HydrophobicContact CZ2-CG1 3.93Å; W206-I379 HydrophobicContact CZ3-CB 4.39Å; W206-I379 HydrophobicContact CZ3-CG1 4.15Å; W206-I379 HydrophobicContact CZ3-CG2 3.91Å; L209-I379 HydrophobicContact CD2-CG2 3.94Å; I375-I379 HydrophobicContact CG2-CD1 3.89Å; I375-I379 WeakPolarHBondContact O-CB 3.49Å; I375-I379 VanDerWaalsContact O-CD1 3.3Å; I375-I379 WeakPolarHBondContact O-CD1 3.5Å; I375-I379 WeakPolarHBondContact O-CG1 3.5Å; I375-I379 PolarHBondContact O-N 2.99Å; L376-I379 HydrophobicContact CD2-CD1 4.02Å; I379-S382 PolarHBondContact O-N 2.93Å; I379-S382 PolarHBondContact O-OG 3.16Å; I379-Y383 HydrophobicContact CG2-CD2 4.38Å; I379-Y383 HydrophobicContact CG2-CE2 4.11Å; I379-Y383 VanDerWaalsContact O-CD2 3.31Å; I379-Y383 WeakPolarHBondContact O-CD2 3.21Å
380	L	85.4	Confident	82	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-52.2	177.2	-77.2	166.8	0	0	0	111.5	L376 M377 S382 Y383 Q388 I391 L392 W440	L376-L380 WeakPolarHBondContact O-CG 3.16Å; L376-L380 PolarHBondContact O-N 3.47Å; M377-L380 WeakPolarHBondContact O-CB 3.46Å; M377-L380 PolarHBondContact O-N 3.13Å; M377-L380 HydrophobicContact SD-CD1 4.06Å; L380-S382 PolarHBondContact O-N 3.26Å; L380-S382 VanDerWaalsContact O-N 3.12Å; L380-Y383 PolarHBondContact O-N 3.29Å; L380-Y383 VanDerWaalsContact O-N 3.07Å; L380-Q388 HydrophobicContact CD2-CB 4.42Å; L380-Q388 WeakPolarHBondContact O-CG 3.46Å; L380-Q388 PolarHBondContact O-NE2 2.98Å; L380-Q388 VanDerWaalsContact O-NE2 3.16Å; L380-I391 HydrophobicContact CD2-CB 3.71Å; L380-I391 HydrophobicContact CD2-CD1 4.07Å; L380-I391 HydrophobicContact CD2-CG1 4.5Å; L380-I391 HydrophobicContact CD2-CG2 3.6Å; L380-I391 HydrophobicContact CG-CG2 4.5Å; L380-L392 HydrophobicContact CD1-CD2 4.17Å; L380-L392 HydrophobicContact CD2-CG 4.4Å; L380-W440 HydrophobicContact CB-CH2 4.12Å; L380-W440 HydrophobicContact CB-CZ2 4.03Å
381	H	84.3	Confident	83.6	Confident	78 Å²	78	36.2 Å²	36.2	36%	0.361	19%	0.192	S	C	.	.	H	α-helix	trans	-58.8	-24.3	178	-82.3	-72.2	0	0	0	114	M377 E378 Y383 L439 W440	M377-H381 PolarHBondContact O-CD2 2.78Å; M377-H381 VanDerWaalsContact O-CD2 3.27Å; M377-H381 PolarHBondContact O-N 2.85Å; E378-H381 PolarHBondContact O-N 3.33Å; H381-Y383 VanDerWaalsContact C-N 3.29Å; H381-Y383 PolarHBondContact O-N 3.23Å; H381-L439 PolarHBondContact CE1-O 3.41Å; H381-W440 AromaticContact CD2-CE2 3.85Å; H381-W440 AromaticContact CD2-CZ2 3.54Å; H381-W440 AromaticContact CE1-CD2 3.44Å; H381-W440 VanDerWaalsContact CE1-CD2 3.44Å; H381-W440 AromaticContact CE1-CE2 3.4Å; H381-W440 VanDerWaalsContact CE1-CE2 3.4Å; H381-W440 AromaticContact CE1-CE3 3.59Å; H381-W440 AromaticContact CE1-CH2 3.73Å; H381-W440 AromaticContact CE1-CZ2 3.58Å; H381-W440 AromaticContact CE1-CZ3 3.72Å; H381-W440 AromaticContact CE1-NE1 3.95Å; H381-W440 AromaticContact CG-CH2 3.8Å; H381-W440 AromaticContact CG-CZ2 3.79Å; H381-W440 AromaticContact ND1-CH2 3.6Å; H381-W440 AromaticContact ND1-CZ2 3.81Å; H381-W440 AromaticContact ND1-CZ3 3.7Å; H381-W440 AromaticContact NE2-CD1 3.97Å; H381-W440 AromaticContact NE2-CD2 3.7Å; H381-W440 AromaticContact NE2-CE2 3.21Å; H381-W440 AromaticContact NE2-CZ2 3.41Å; H381-W440 WeakPolarHBondContact NE2-CZ2 3.12Å; H381-W440 AromaticContact NE2-NE1 3.4Å; H381-W440 PolarHBondContact NE2-NE1 3.44Å
382	S	87.9	Confident	85.2	Confident	74 Å²	74	34 Å²	34	52%	0.517	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.1	177.6	77	0	0	0	0	114.8	E378 I379 L380	E378-S382 PolarHBondContact O-N 3.13Å; E378-S382 VanDerWaalsContact O-N 3.08Å; I379-S382 PolarHBondContact O-N 2.93Å; I379-S382 PolarHBondContact O-OG 3.16Å; L380-S382 PolarHBondContact O-N 3.26Å; L380-S382 VanDerWaalsContact O-N 3.12Å
383	Y	90.5	Very high	86.8	Confident	34 Å²	34	34.1 Å²	34.1	13%	0.133	18%	0.178	C	C	.	.	S	Bend	trans	-102.6	162.5	-178.4	-80.4	-68.8	0	0	0	112.9	W206 L209 S210 I213 I379 L380 H381 H387 Q388 I391	W206-Y383 HydrophobicContact CE3-CE2 4.1Å; W206-Y383 AromaticContact CZ3-CE2 3.79Å; W206-Y383 HydrophobicContact CZ3-CE2 3.79Å; L209-Y383 HydrophobicContact CD2-CE2 3.56Å; L209-Y383 HydrophobicContact CG-CE2 4.4Å; S210-Y383 PolarHBondContact OG-OH 3.47Å; I213-Y383 HydrophobicContact CD1-CD1 3.81Å; I213-Y383 HydrophobicContact CD1-CD2 4.48Å; I213-Y383 HydrophobicContact CD1-CE1 3.5Å; I213-Y383 VanDerWaalsContact CD1-CE1 3.5Å; I213-Y383 HydrophobicContact CD1-CE2 4.22Å; I213-Y383 HydrophobicContact CD1-CG 4.29Å; I379-Y383 HydrophobicContact CG2-CD2 4.38Å; I379-Y383 HydrophobicContact CG2-CE2 4.11Å; I379-Y383 VanDerWaalsContact O-CD2 3.31Å; I379-Y383 WeakPolarHBondContact O-CD2 3.21Å; L380-Y383 PolarHBondContact O-N 3.29Å; L380-Y383 VanDerWaalsContact O-N 3.07Å; H381-Y383 VanDerWaalsContact C-N 3.29Å; H381-Y383 PolarHBondContact O-N 3.23Å; Y383-H387 HydrophobicContact CD1-CB 4.07Å; Y383-H387 AromaticContact CD1-ND1 3.91Å; Y383-H387 HydrophobicContact CG-CB 4.15Å; Y383-Q388 PolarHBondContact O-NE2 2.85Å; Y383-I391 HydrophobicContact CD2-CD1 3.84Å; Y383-I391 HydrophobicContact CE2-CD1 4.21Å; Y383-I391 HydrophobicContact CG-CD1 4.45Å
384	S	93.4	Very high	88.1	Confident	62 Å²	62	33.5 Å²	33.5	43%	0.434	17%	0.174	S	C	.	.			trans	-67.2	157.1	170.5	60.6	0	0	0	0	112.1	T386 H387 Q388	S384-T386 PolarHBondContact O-N 3.44Å; S384-H387 WeakPolarHBondContact O-CA 3.44Å; S384-H387 WeakPolarHBondContact O-CB 3.26Å; S384-H387 PolarHBondContact O-N 2.78Å; S384-H387 PolarHBondContact OG-ND1 2.91Å; S384-Q388 WeakPolarHBondContact O-CG 3.34Å; S384-Q388 PolarHBondContact O-N 2.89Å
385	Y	94.6	Very high	89.1	Confident	80 Å²	80	30.8 Å²	30.8	31%	0.314	16%	0.159	S	C	.	.	H	α-helix	trans	-54.1	-37.8	179.4	-56.4	-58.6	0	0	0	113.6	H387 Q388 A389 D444 N447 I448	Y385-H387 VanDerWaalsContact C-N 3.31Å; Y385-H387 PolarHBondContact O-N 3.31Å; Y385-Q388 PolarHBondContact O-N 3.26Å; Y385-A389 VanDerWaalsContact O-CB 3.23Å; Y385-A389 WeakPolarHBondContact O-CB 3.29Å; Y385-A389 PolarHBondContact O-N 3.49Å; Y385-D444 HydrophobicContact CE1-CB 4.04Å; Y385-D444 WeakPolarHBondContact CE1-OD1 3.29Å; Y385-D444 PolarHBondContact OH-OD1 3.48Å; Y385-N447 HydrophobicContact CD1-CB 3.86Å; Y385-N447 HydrophobicContact CD2-CB 3.54Å; Y385-N447 HydrophobicContact CE1-CB 4.06Å; Y385-N447 HydrophobicContact CE2-CB 3.73Å; Y385-N447 HydrophobicContact CG-CB 3.6Å; Y385-I448 HydrophobicContact CD1-CG1 4.19Å
386	T	94.1	Very high	89.9	Confident	57 Å²	57	31.8 Å²	31.8	35%	0.35	16%	0.163	S	C	.	.	H	α-helix	trans	-58.5	-42.6	174.1	-42	0	0	0	0	112.1	S384 R390 Q451	S384-T386 PolarHBondContact O-N 3.44Å; T386-R390 VanDerWaalsContact O-CG 3.29Å; T386-R390 WeakPolarHBondContact O-CG 3.46Å; T386-R390 PolarHBondContact O-N 3.21Å; T386-Q451 PolarHBondContact OG1-OE1 3.35Å
387	H	94.2	Very high	90.6	Very high	45 Å²	45	31.3 Å²	31.3	21%	0.208	16%	0.161	C	C	.	.	H	α-helix	trans	-76.3	-38.5	179.3	-71.3	159.7	0	0	0	111.7	I213 Y383 S384 Y385 R390 I391	I213-H387 HydrophobicContact CD1-CB 3.87Å; I213-H387 HydrophobicContact CG1-CB 4.35Å; I213-H387 PolarHBondContact O-CD2 3.35Å; Y383-H387 HydrophobicContact CD1-CB 4.07Å; Y383-H387 AromaticContact CD1-ND1 3.91Å; Y383-H387 HydrophobicContact CG-CB 4.15Å; S384-H387 WeakPolarHBondContact O-CA 3.44Å; S384-H387 WeakPolarHBondContact O-CB 3.26Å; S384-H387 PolarHBondContact O-N 2.78Å; S384-H387 PolarHBondContact OG-ND1 2.91Å; Y385-H387 VanDerWaalsContact C-N 3.31Å; Y385-H387 PolarHBondContact O-N 3.31Å; H387-R390 PolarHBondContact O-N 2.9Å; H387-I391 VanDerWaalsContact O-CG1 3.26Å; H387-I391 WeakPolarHBondContact O-CG1 3.36Å; H387-I391 PolarHBondContact O-N 2.91Å
388	Q	94.1	Very high	91.3	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.033	16%	0.157	C	C	.	.	H	α-helix	trans	-58.2	-50.5	172.1	-68.4	172.1	10.7	0	0	111.7	L380 Y383 S384 Y385 R390 I391 L392 W440 I448	L380-Q388 HydrophobicContact CD2-CB 4.42Å; L380-Q388 WeakPolarHBondContact O-CG 3.46Å; L380-Q388 PolarHBondContact O-NE2 2.98Å; L380-Q388 VanDerWaalsContact O-NE2 3.16Å; Y383-Q388 PolarHBondContact O-NE2 2.85Å; S384-Q388 WeakPolarHBondContact O-CG 3.34Å; S384-Q388 PolarHBondContact O-N 2.89Å; Y385-Q388 PolarHBondContact O-N 3.26Å; Q388-R390 VanDerWaalsContact C-N 3.26Å; Q388-R390 PolarHBondContact O-N 3.47Å; Q388-I391 PolarHBondContact O-N 3.34Å; Q388-I391 VanDerWaalsContact O-N 3.14Å; Q388-L392 WeakPolarHBondContact O-CG 3.28Å; Q388-L392 PolarHBondContact O-N 2.77Å; Q388-W440 VanDerWaalsContact OE1-CZ3 3.27Å; Q388-I448 HydrophobicContact CB-CG1 4.36Å
389	A	94.5	Very high	91.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-51.8	-45.4	174.8	0	0	0	0	0	112	Y385 L392 F393 Q451 I452	Y385-A389 VanDerWaalsContact O-CB 3.23Å; Y385-A389 WeakPolarHBondContact O-CB 3.29Å; Y385-A389 PolarHBondContact O-N 3.49Å; A389-L392 PolarHBondContact O-N 2.91Å; A389-F393 PolarHBondContact O-N 3.09Å; A389-Q451 HydrophobicContact CB-CB 3.65Å; A389-I452 HydrophobicContact CB-CB 4.35Å; A389-I452 HydrophobicContact CB-CG1 3.46Å; A389-I452 VanDerWaalsContact CB-CG1 3.46Å
390	R	94.9	Very high	91.9	Very high	20 Å²	20	31.8 Å²	31.8	8%	0.075	16%	0.164	C	C	.	.	H	α-helix	trans	-68.4	-40	178	-72.7	-178	69.9	169.3	2.2	113.5	I213 Q215 T386 H387 Q388 F393 I394 W406 T455	I213-R390 PolarHBondContact O-NE 3.17Å; I213-R390 PolarHBondContact O-NH1 3.03Å; Q215-R390 PolarHBondContact O-NH1 2.93Å; Q215-R390 PolarHBondContact O-NH2 3.4Å; T386-R390 VanDerWaalsContact O-CG 3.29Å; T386-R390 WeakPolarHBondContact O-CG 3.46Å; T386-R390 PolarHBondContact O-N 3.21Å; H387-R390 PolarHBondContact O-N 2.9Å; Q388-R390 VanDerWaalsContact C-N 3.26Å; Q388-R390 PolarHBondContact O-N 3.47Å; R390-F393 PolarHBondContact O-N 2.7Å; R390-I394 WeakPolarHBondContact O-CB 3.43Å; R390-I394 WeakPolarHBondContact O-CD1 3.09Å; R390-I394 WeakPolarHBondContact O-CG1 3.46Å; R390-I394 PolarHBondContact O-N 2.87Å; R390-W406 HydrophobicContact CG-CH2 4.45Å; R390-T455 HydrophobicContact CG-CG2 3.9Å
391	I	94.1	Very high	91.7	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.046	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-45	174.7	-64.2	164.1	0	0	0	109.8	L209 I213 L380 Y383 H387 Q388 I394 L395	L209-I391 HydrophobicContact CD1-CD1 4.41Å; L209-I391 HydrophobicContact CD1-CG1 4.21Å; L209-I391 HydrophobicContact CD2-CD1 4.14Å; I213-I391 HydrophobicContact CD1-CD1 4.28Å; I213-I391 HydrophobicContact CG2-CD1 4.48Å; I213-I391 HydrophobicContact CG2-CG1 3.79Å; L380-I391 HydrophobicContact CD2-CB 3.71Å; L380-I391 HydrophobicContact CD2-CD1 4.07Å; L380-I391 HydrophobicContact CD2-CG1 4.5Å; L380-I391 HydrophobicContact CD2-CG2 3.6Å; L380-I391 HydrophobicContact CG-CG2 4.5Å; Y383-I391 HydrophobicContact CD2-CD1 3.84Å; Y383-I391 HydrophobicContact CE2-CD1 4.21Å; Y383-I391 HydrophobicContact CG-CD1 4.45Å; H387-I391 VanDerWaalsContact O-CG1 3.26Å; H387-I391 WeakPolarHBondContact O-CG1 3.36Å; H387-I391 PolarHBondContact O-N 2.91Å; Q388-I391 PolarHBondContact O-N 3.34Å; Q388-I391 VanDerWaalsContact O-N 3.14Å; I391-I394 PolarHBondContact O-N 2.9Å; I391-L395 HydrophobicContact CG2-CD1 3.89Å; I391-L395 HydrophobicContact CG2-CG 4.41Å; I391-L395 VanDerWaalsContact O-CG 3.28Å; I391-L395 WeakPolarHBondContact O-CG 3.39Å; I391-L395 PolarHBondContact O-N 2.96Å
392	L	93.2	Very high	91.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-44.1	177.9	-70.9	169.5	0	0	0	112.2	L380 Q388 A389 L395 Y396 L427 V430 L431 M434 I448 I452	L380-L392 HydrophobicContact CD1-CD2 4.17Å; L380-L392 HydrophobicContact CD2-CG 4.4Å; Q388-L392 WeakPolarHBondContact O-CG 3.28Å; Q388-L392 PolarHBondContact O-N 2.77Å; A389-L392 PolarHBondContact O-N 2.91Å; L392-L395 PolarHBondContact O-N 3.33Å; L392-Y396 HydrophobicContact CD2-CD2 4.4Å; L392-Y396 HydrophobicContact CD2-CE2 4.47Å; L392-Y396 PolarHBondContact O-N 2.97Å; L392-L427 HydrophobicContact CB-CD1 4.33Å; L392-V430 HydrophobicContact CD2-CG1 4.38Å; L392-V430 HydrophobicContact CD2-CG2 4.34Å; L392-L431 HydrophobicContact CD1-CD2 4.42Å; L392-M434 HydrophobicContact CD1-CE 4.01Å; L392-M434 HydrophobicContact CD1-SD 3.81Å; L392-M434 HydrophobicContact CD2-SD 3.75Å; L392-M434 HydrophobicContact CG-SD 4.45Å; L392-I448 HydrophobicContact CD1-CG2 3.56Å; L392-I452 HydrophobicContact CB-CD1 4.42Å; L392-I452 HydrophobicContact CD1-CD1 4.48Å
393	F	94.9	Very high	91.6	Very high	2 Å²	2	38 Å²	38	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-40.5	174.5	-166.1	-80.7	0	0	0	111.9	R228 A389 R390 L395 G397 P398 L404 W406 M409 L427 W459	R228-F393 PolarHBondContact NH2-O 3.36Å; A389-F393 PolarHBondContact O-N 3.09Å; R390-F393 PolarHBondContact O-N 2.7Å; F393-L395 PolarHBondContact O-N 3.35Å; F393-G397 WeakPolarHBondContact O-CA 3.41Å; F393-G397 PolarHBondContact O-N 2.92Å; F393-P398 HydrophobicContact CZ-CG 4.29Å; F393-L404 HydrophobicContact CE1-CB 4.3Å; F393-W406 HydrophobicContact CB-CH2 3.73Å; F393-W406 HydrophobicContact CB-CZ3 3.67Å; F393-W406 AromaticContact CD1-CD2 3.64Å; F393-W406 HydrophobicContact CD1-CD2 3.64Å; F393-W406 AromaticContact CD1-CE2 3.81Å; F393-W406 AromaticContact CD1-CE3 3.3Å; F393-W406 HydrophobicContact CD1-CE3 3.3Å; F393-W406 AromaticContact CD1-CH2 3.41Å; F393-W406 HydrophobicContact CD1-CH2 3.41Å; F393-W406 VanDerWaalsContact CD1-CH2 3.41Å; F393-W406 AromaticContact CD1-CZ2 3.73Å; F393-W406 HydrophobicContact CD1-CZ2 3.73Å; F393-W406 AromaticContact CD1-CZ3 3.17Å; F393-W406 HydrophobicContact CD1-CZ3 3.17Å; F393-W406 HydrophobicContact CD2-CE3 4.48Å; F393-W406 HydrophobicContact CD2-CZ3 4.27Å; F393-W406 AromaticContact CE1-CD2 3.49Å; F393-W406 HydrophobicContact CE1-CD2 3.49Å; F393-W406 VanDerWaalsContact CE1-CD2 3.49Å; F393-W406 AromaticContact CE1-CE2 3.99Å; F393-W406 AromaticContact CE1-CE3 3.38Å; F393-W406 HydrophobicContact CE1-CE3 3.38Å; F393-W406 HydrophobicContact CE1-CG 4.05Å; F393-W406 HydrophobicContact CE1-CH2 4.29Å; F393-W406 HydrophobicContact CE1-CZ2 4.37Å; F393-W406 AromaticContact CE1-CZ3 3.81Å; F393-W406 HydrophobicContact CE1-CZ3 3.81Å; F393-W406 AromaticContact CG-CE3 3.88Å; F393-W406 HydrophobicContact CG-CE3 3.88Å; F393-W406 AromaticContact CG-CH2 3.83Å; F393-W406 HydrophobicContact CG-CH2 3.83Å; F393-W406 AromaticContact CG-CZ3 3.44Å; F393-W406 HydrophobicContact CG-CZ3 3.44Å; F393-W406 VanDerWaalsContact CG-CZ3 3.44Å; F393-W406 HydrophobicContact CZ-CD2 4.39Å; F393-W406 HydrophobicContact CZ-CE3 4.04Å; F393-M409 HydrophobicContact CE2-CG 3.94Å; F393-M409 HydrophobicContact CZ-CG 3.93Å; F393-L427 HydrophobicContact CD2-CD2 4.06Å; F393-W459 HydrophobicContact CD2-CH2 4.04Å; F393-W459 AromaticContact CD2-CZ2 3.73Å; F393-W459 HydrophobicContact CD2-CZ2 3.73Å; F393-W459 AromaticContact CE2-CH2 3.77Å; F393-W459 HydrophobicContact CE2-CH2 3.77Å; F393-W459 AromaticContact CE2-CZ2 3.45Å; F393-W459 HydrophobicContact CE2-CZ2 3.45Å; F393-W459 VanDerWaalsContact CE2-CZ2 3.45Å
394	I	94.3	Very high	91.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-35.2	173.8	-70.1	164.3	0	0	0	111.1	L212 I213 E224 L227 R228 R390 I391 L404 W406	L212-I394 HydrophobicContact CD2-CD1 4.17Å; L212-I394 HydrophobicContact CG-CD1 4.44Å; I213-I394 HydrophobicContact CG2-CD1 4.42Å; E224-I394 HydrophobicContact CB-CG2 4.48Å; E224-I394 HydrophobicContact CG-CD1 4.28Å; E224-I394 HydrophobicContact CG-CG1 4.28Å; L227-I394 HydrophobicContact CB-CG2 4.42Å; L227-I394 HydrophobicContact CD2-CG2 4.08Å; L227-I394 HydrophobicContact CG-CG2 4.43Å; R228-I394 WeakPolarHBondContact CB-O 3.28Å; R228-I394 VanDerWaalsContact CZ-O 3.3Å; R228-I394 PolarHBondContact NE-O 3.22Å; R228-I394 PolarHBondContact NH2-O 2.78Å; R390-I394 WeakPolarHBondContact O-CB 3.43Å; R390-I394 WeakPolarHBondContact O-CD1 3.09Å; R390-I394 WeakPolarHBondContact O-CG1 3.46Å; R390-I394 PolarHBondContact O-N 2.87Å; I391-I394 PolarHBondContact O-N 2.9Å; I394-L404 HydrophobicContact CB-CD1 4.19Å; I394-L404 HydrophobicContact CG1-CD1 3.83Å; I394-L404 HydrophobicContact CG2-CD1 4.4Å; I394-W406 HydrophobicContact CD1-CZ2 4.41Å; I394-W406 HydrophobicContact CG1-CH2 4.13Å; I394-W406 HydrophobicContact CG1-CZ2 3.68Å
395	L	92.1	Very high	91.7	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-80.5	-50.4	177.7	-66.4	172	0	0	0	113.1	R228 L231 R232 L236 I391 L392 F393	R228-L395 VanDerWaalsContact CZ-O 3.22Å; R228-L395 PolarHBondContact NE-O 2.9Å; R228-L395 PolarHBondContact NH2-O 3.06Å; L231-L395 HydrophobicContact CB-CD2 3.85Å; L231-L395 HydrophobicContact CD1-CD2 4.04Å; R232-L395 WeakPolarHBondContact CD-O 3.4Å; R232-L395 HydrophobicContact CG-CD2 4.15Å; R232-L395 PolarHBondContact NH1-O 3.49Å; L236-L395 HydrophobicContact CD1-CD1 4.05Å; L236-L395 HydrophobicContact CD1-CD2 4.03Å; I391-L395 HydrophobicContact CG2-CD1 3.89Å; I391-L395 HydrophobicContact CG2-CG 4.41Å; I391-L395 VanDerWaalsContact O-CG 3.28Å; I391-L395 WeakPolarHBondContact O-CG 3.39Å; I391-L395 PolarHBondContact O-N 2.96Å; L392-L395 PolarHBondContact O-N 3.33Å; F393-L395 PolarHBondContact O-N 3.35Å
396	Y	92.1	Very high	91.6	Very high	29 Å²	29	32.6 Å²	32.6	11%	0.114	15%	0.153	C	C	.	.	H	α-helix	trans	-122.8	-4.6	-163.2	-56.1	-78.2	0	0	0	115.5	L241 L392 E426 V430	L241-Y396 HydrophobicContact CD1-CD1 4.41Å; L241-Y396 HydrophobicContact CD1-CE1 4.49Å; L241-Y396 HydrophobicContact CD2-CD1 4.48Å; L241-Y396 HydrophobicContact CD2-CE1 4.39Å; L392-Y396 HydrophobicContact CD2-CD2 4.4Å; L392-Y396 HydrophobicContact CD2-CE2 4.47Å; L392-Y396 PolarHBondContact O-N 2.97Å; Y396-E426 HydrophobicContact CD1-CB 4.43Å; Y396-V430 HydrophobicContact CD2-CB 4.11Å; Y396-V430 HydrophobicContact CD2-CG1 3.67Å; Y396-V430 HydrophobicContact CD2-CG2 4.12Å; Y396-V430 HydrophobicContact CE2-CB 4.17Å; Y396-V430 HydrophobicContact CE2-CG1 4.18Å; Y396-V430 HydrophobicContact CE2-CG2 3.74Å; Y396-V430 HydrophobicContact CG-CB 4.33Å; Y396-V430 HydrophobicContact CG-CG1 3.91Å
397	G	92.6	Very high	91.5	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-66.2	169.5	172.5	0	0	0	0	0	113.3	R228 F393	R228-G397 PolarHBondContact NH1-O 3.37Å; R228-G397 VanDerWaalsContact NH2-N 3.12Å; R228-G397 PolarHBondContact NH2-O 3.45Å; F393-G397 WeakPolarHBondContact O-CA 3.41Å; F393-G397 PolarHBondContact O-N 2.92Å
398	P	92.3	Very high	91.4	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.026	17%	0.168	C	C	.	.			trans	-62.8	148.6	-177.2	8.5	-14.1	0	0	0	114.5	F393 M405 M409 C423	F393-P398 HydrophobicContact CZ-CG 4.29Å; P398-M405 HydrophobicContact CB-CB 3.93Å; P398-M405 HydrophobicContact CB-CG 4.09Å; P398-M405 HydrophobicContact CB-SD 3.69Å; P398-M405 HydrophobicContact CG-CB 4.09Å; P398-M405 PolarHBondContact O-N 3.38Å; P398-M409 HydrophobicContact CG-CE 3.95Å; P398-M409 HydrophobicContact CG-SD 3.34Å; P398-M409 WeakPolarHBondContact CG-SD 3.31Å; P398-C423 HydrophobicContact CB-CB 4.21Å; P398-C423 VanDerWaalsContact CD-O 3.29Å; P398-C423 WeakPolarHBondContact CD-O 3.37Å; P398-C423 HydrophobicContact CG-CB 4.26Å; P398-C423 WeakPolarHBondContact CG-O 3.39Å
399	L	89.5	Confident	91.3	Very high	50 Å²	50	37.3 Å²	37.3	26%	0.262	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.9	179.7	-164.8	81.1	0	0	0	111.5	L165 L225 N403 L404	L165-L399 HydrophobicContact CD2-CD2 3.73Å; L225-L399 HydrophobicContact CD1-CD1 4.21Å; L225-L399 HydrophobicContact CD1-CD2 4.33Å; L399-N403 WeakPolarHBondContact CA-O 3.3Å; L399-N403 WeakPolarHBondContact CD1-O 3.19Å; L399-L404 HydrophobicContact CD1-CD2 3.87Å
400	H	85.9	Confident	91.2	Very high	98 Å²	98	38.3 Å²	38.3	45%	0.454	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.3	172	-168.9	83.8	0	0	0	111.1	G402 N403 M405	H400-G402 PolarHBondContact O-N 3.43Å; H400-N403 PolarHBondContact N-O 3.42Å; H400-N403 PolarHBondContact O-N 3.19Å; H400-M405 HydrophobicContact CB-CE 4.27Å; H400-M405 HydrophobicContact CB-CG 3.75Å; H400-M405 HydrophobicContact CB-SD 3.59Å; H400-M405 VanDerWaalsContact CB-SD 3.59Å
401	R	82.6	Confident	91	Very high	199 Å²	199	43.2 Å²	43.2	75%	0.751	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	27.8	179.1	-63.6	173.9	-170.8	-167.7	0.7	114.5
402	G	81.8	Confident	90.9	Very high	6 Å²	6	47.1 Å²	47.1	6%	0.062	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.7	-5.9	-179.4	0	0	0	0	0	115.5	L225 H400	L225-G402 WeakPolarHBondContact CD2-O 3.33Å; H400-G402 PolarHBondContact O-N 3.43Å
403	N	88	Confident	90.8	Very high	88 Å²	88	49.9 Å²	49.9	47%	0.471	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.1	175.5	-60.8	-50.5	0	0	0	110.9	L399 H400	L399-N403 WeakPolarHBondContact CA-O 3.3Å; L399-N403 WeakPolarHBondContact CD1-O 3.19Å; H400-N403 PolarHBondContact N-O 3.42Å; H400-N403 PolarHBondContact O-N 3.19Å
404	L	92.6	Very high	90.5	Very high	16 Å²	16	50 Å²	50	8%	0.084	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.5	169.5	-66.6	-175.5	0	0	0	110	E224 F393 I394 L399 W406	E224-L404 HydrophobicContact CB-CD1 3.75Å; E224-L404 HydrophobicContact CB-CG 4.39Å; E224-L404 HydrophobicContact CG-CD1 4.23Å; E224-L404 WeakPolarHBondContact OE2-CD1 3.47Å; F393-L404 HydrophobicContact CE1-CB 4.3Å; I394-L404 HydrophobicContact CB-CD1 4.19Å; I394-L404 HydrophobicContact CG1-CD1 3.83Å; I394-L404 HydrophobicContact CG2-CD1 4.4Å; L399-L404 HydrophobicContact CD1-CD2 3.87Å; L404-W406 HydrophobicContact CB-CG 4.31Å; L404-W406 HydrophobicContact CD1-CZ2 3.78Å; L404-W406 PolarHBondContact O-N 2.97Å
405	M	92.4	Very high	90.1	Very high	35 Å²	35	53 Å²	53	17%	0.172	26%	0.262	C	S	.	.			trans	-84.3	43	-173.8	-60.8	179.5	64.4	0	0	112.9	P398 H400 R407 T408 M409	P398-M405 HydrophobicContact CB-CB 3.93Å; P398-M405 HydrophobicContact CB-CG 4.09Å; P398-M405 HydrophobicContact CB-SD 3.69Å; P398-M405 HydrophobicContact CG-CB 4.09Å; P398-M405 PolarHBondContact O-N 3.38Å; H400-M405 HydrophobicContact CB-CE 4.27Å; H400-M405 HydrophobicContact CB-CG 3.75Å; H400-M405 HydrophobicContact CB-SD 3.59Å; H400-M405 VanDerWaalsContact CB-SD 3.59Å; M405-R407 PolarHBondContact O-N 3.25Å; M405-T408 HydrophobicContact CE-CG2 3.65Å; M405-T408 PolarHBondContact O-N 3.17Å; M405-T408 VanDerWaalsContact O-N 3.13Å; M405-M409 WeakPolarHBondContact O-CG 3.21Å
406	W	93.3	Very high	89.9	Confident	11 Å²	11	55.8 Å²	55.8	4%	0.042	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-52.8	-174.6	-69.1	112.7	0	0	0	113.6	P217 E224 R390 F393 I394 L404 T455 P456	P217-W406 HydrophobicContact CB-CD2 3.53Å; P217-W406 HydrophobicContact CB-CE3 3.8Å; P217-W406 HydrophobicContact CB-CG 3.92Å; P217-W406 HydrophobicContact CB-CH2 4.2Å; P217-W406 HydrophobicContact CB-CZ2 3.95Å; P217-W406 HydrophobicContact CB-CZ3 4.13Å; P217-W406 HydrophobicContact CG-CE3 4.45Å; P217-W406 HydrophobicContact CG-CZ3 4.49Å; E224-W406 PolarHBondContact OE1-NE1 3.2Å; E224-W406 PolarHBondContact OE2-NE1 2.89Å; R390-W406 HydrophobicContact CG-CH2 4.45Å; F393-W406 HydrophobicContact CB-CH2 3.73Å; F393-W406 HydrophobicContact CB-CZ3 3.67Å; F393-W406 AromaticContact CD1-CD2 3.64Å; F393-W406 HydrophobicContact CD1-CD2 3.64Å; F393-W406 AromaticContact CD1-CE2 3.81Å; F393-W406 AromaticContact CD1-CE3 3.3Å; F393-W406 HydrophobicContact CD1-CE3 3.3Å; F393-W406 AromaticContact CD1-CH2 3.41Å; F393-W406 HydrophobicContact CD1-CH2 3.41Å; F393-W406 VanDerWaalsContact CD1-CH2 3.41Å; F393-W406 AromaticContact CD1-CZ2 3.73Å; F393-W406 HydrophobicContact CD1-CZ2 3.73Å; F393-W406 AromaticContact CD1-CZ3 3.17Å; F393-W406 HydrophobicContact CD1-CZ3 3.17Å; F393-W406 HydrophobicContact CD2-CE3 4.48Å; F393-W406 HydrophobicContact CD2-CZ3 4.27Å; F393-W406 AromaticContact CE1-CD2 3.49Å; F393-W406 HydrophobicContact CE1-CD2 3.49Å; F393-W406 VanDerWaalsContact CE1-CD2 3.49Å; F393-W406 AromaticContact CE1-CE2 3.99Å; F393-W406 AromaticContact CE1-CE3 3.38Å; F393-W406 HydrophobicContact CE1-CE3 3.38Å; F393-W406 HydrophobicContact CE1-CG 4.05Å; F393-W406 HydrophobicContact CE1-CH2 4.29Å; F393-W406 HydrophobicContact CE1-CZ2 4.37Å; F393-W406 AromaticContact CE1-CZ3 3.81Å; F393-W406 HydrophobicContact CE1-CZ3 3.81Å; F393-W406 AromaticContact CG-CE3 3.88Å; F393-W406 HydrophobicContact CG-CE3 3.88Å; F393-W406 AromaticContact CG-CH2 3.83Å; F393-W406 HydrophobicContact CG-CH2 3.83Å; F393-W406 AromaticContact CG-CZ3 3.44Å; F393-W406 HydrophobicContact CG-CZ3 3.44Å; F393-W406 VanDerWaalsContact CG-CZ3 3.44Å; F393-W406 HydrophobicContact CZ-CD2 4.39Å; F393-W406 HydrophobicContact CZ-CE3 4.04Å; I394-W406 HydrophobicContact CD1-CZ2 4.41Å; I394-W406 HydrophobicContact CG1-CH2 4.13Å; I394-W406 HydrophobicContact CG1-CZ2 3.68Å; L404-W406 HydrophobicContact CB-CG 4.31Å; L404-W406 HydrophobicContact CD1-CZ2 3.78Å; L404-W406 PolarHBondContact O-N 2.97Å; W406-T455 HydrophobicContact CE3-CG2 4.43Å; W406-T455 HydrophobicContact CZ3-CG2 3.92Å; W406-P456 HydrophobicContact CB-CG 4.1Å; W406-P456 VanDerWaalsContact O-CD 3.3Å; W406-P456 WeakPolarHBondContact O-CD 3.38Å
407	R	92.5	Very high	89.7	Confident	161 Å²	161	57.5 Å²	57.5	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-28.4	-179.1	-73.2	-167.1	-177.4	136.1	3.3	114.1	M405 M409 C410 E411	M405-R407 PolarHBondContact O-N 3.25Å; R407-M409 PolarHBondContact O-N 2.85Å; R407-M409 VanDerWaalsContact O-N 3.15Å; R407-C410 WeakPolarHBondContact O-CA 3.48Å; R407-C410 WeakPolarHBondContact O-CB 3.21Å; R407-C410 PolarHBondContact O-N 3.2Å; R407-E411 WeakPolarHBondContact CD-OE1 3.47Å; R407-E411 WeakPolarHBondContact O-CG 3.46Å; R407-E411 PolarHBondContact O-N 3.31Å
408	T	91.3	Very high	89.7	Confident	43 Å²	43	62.6 Å²	62.6	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-30.6	-178.9	-46.5	0	0	0	0	111.3	M405 C410 E411 N412	M405-T408 HydrophobicContact CE-CG2 3.65Å; M405-T408 PolarHBondContact O-N 3.17Å; M405-T408 VanDerWaalsContact O-N 3.13Å; T408-C410 PolarHBondContact O-N 3.4Å; T408-E411 PolarHBondContact O-N 2.95Å; T408-N412 HydrophobicContact CG2-CB 3.89Å; T408-N412 PolarHBondContact O-N 2.8Å
409	M	92.1	Very high	89.6	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.02	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-23.7	175.1	-43.7	-47.9	-70.9	0	0	113.9	F393 P398 M405 R407 F424 W459 L460 N463	F393-M409 HydrophobicContact CE2-CG 3.94Å; F393-M409 HydrophobicContact CZ-CG 3.93Å; P398-M409 HydrophobicContact CG-CE 3.95Å; P398-M409 HydrophobicContact CG-SD 3.34Å; P398-M409 WeakPolarHBondContact CG-SD 3.31Å; M405-M409 WeakPolarHBondContact O-CG 3.21Å; R407-M409 PolarHBondContact O-N 2.85Å; R407-M409 VanDerWaalsContact O-N 3.15Å; M409-F424 HydrophobicContact CE-CD1 3.95Å; M409-F424 HydrophobicContact CE-CE1 3.15Å; M409-F424 HydrophobicContact CE-CE2 4.23Å; M409-F424 HydrophobicContact CE-CZ 3.32Å; M409-W459 HydrophobicContact CB-CD2 3.6Å; M409-W459 HydrophobicContact CB-CE3 4.12Å; M409-W459 HydrophobicContact CB-CG 3.85Å; M409-W459 HydrophobicContact CB-CZ2 4.07Å; M409-W459 HydrophobicContact CE-CE3 4.08Å; M409-W459 HydrophobicContact CE-CH2 3.84Å; M409-W459 HydrophobicContact CE-CZ2 4.42Å; M409-W459 HydrophobicContact CE-CZ3 3.64Å; M409-W459 HydrophobicContact CG-CD2 4.33Å; M409-W459 HydrophobicContact CG-CH2 4.27Å; M409-W459 HydrophobicContact CG-CZ2 3.91Å; M409-W459 WeakPolarHBondContact O-CA 3.34Å; M409-L460 PolarHBondContact O-N 3Å; M409-L460 VanDerWaalsContact O-N 3.11Å; M409-N463 PolarHBondContact O-ND2 3.03Å
410	C	93.1	Very high	89.8	Confident	22 Å²	22	64.5 Å²	64.5	15%	0.149	32%	0.324	C	S	.	.	H	α-helix	trans	-95.1	-21.9	177.7	-53.1	0	0	0	0	112.4	R407 T408 E457 D458 L460	R407-C410 WeakPolarHBondContact O-CA 3.48Å; R407-C410 WeakPolarHBondContact O-CB 3.21Å; R407-C410 PolarHBondContact O-N 3.2Å; T408-C410 PolarHBondContact O-N 3.4Å; C410-E457 PolarHBondContact SG-O 3.41Å; C410-E457 VanDerWaalsContact SG-O 3.38Å; C410-D458 PolarHBondContact SG-O 3.02Å; C410-L460 VanDerWaalsContact O-CD2 3.29Å; C410-L460 WeakPolarHBondContact O-CD2 3.47Å; C410-L460 WeakPolarHBondContact O-CG 3.21Å
411	E	90.8	Very high	90	Very high	122 Å²	122	63.3 Å²	63.3	57%	0.57	33%	0.327	S	S	*	.	H	α-helix	trans	-112	-28.4	-168	-67.9	168.8	-179.2	0	0	114.5	R407 T408	R407-E411 WeakPolarHBondContact CD-OE1 3.47Å; R407-E411 WeakPolarHBondContact O-CG 3.46Å; R407-E411 PolarHBondContact O-N 3.31Å; T408-E411 PolarHBondContact O-N 2.95Å
412	N	90.9	Very high	90.3	Very high	91 Å²	91	57.5 Å²	57.5	49%	0.487	32%	0.321	S	S	.	.			trans	-139.3	144.2	-171.7	-58.2	-102.1	0	0	0	111.5	T408 N463	T408-N412 HydrophobicContact CG2-CB 3.89Å; T408-N412 PolarHBondContact O-N 2.8Å; N412-N463 PolarHBondContact O-ND2 3.38Å
413	T	90.6	Very high	90.8	Very high	59 Å²	59	58.6 Å²	58.6	36%	0.362	33%	0.328	S	S	.	.			trans	-93.7	165.2	173.6	59.5	0	0	0	0	111.9	L460 E462	T413-L460 HydrophobicContact CG2-CB 4.45Å; T413-L460 HydrophobicContact CG2-CD1 3.65Å; T413-E462 WeakPolarHBondContact CB-OE1 3.42Å; T413-E462 HydrophobicContact CG2-CB 3.78Å; T413-E462 HydrophobicContact CG2-CG 4.41Å
414	A	89.7	Confident	91.1	Very high	6 Å²	6	54.5 Å²	54.5	5%	0.05	31%	0.306	C	S	.	.			trans	-72.2	131.3	170.2	0	0	0	0	0	110	Q419 L420 F424 K505	A414-Q419 HydrophobicContact CB-CB 4.14Å; A414-L420 HydrophobicContact CB-CB 4.05Å; A414-F424 HydrophobicContact CB-CE2 4.42Å; A414-K505 VanDerWaalsContact O-CD 3.28Å; A414-K505 WeakPolarHBondContact O-CD 3.25Å; A414-K505 PolarHBondContact O-NZ 3.46Å
415	A	85.7	Confident	91.1	Very high	63 Å²	63	54.7 Å²	54.7	52%	0.521	31%	0.311	S	S	.	.			trans	-75.8	-31.8	179	0	0	0	0	0	112.8
416	D	87.1	Confident	90.9	Very high	63 Å²	63	56.4 Å²	56.4	34%	0.337	32%	0.319	S	S	.	.	S	Bend	trans	-150.7	177	-172.4	63.8	53.5	0	0	0	112.6	Q418 Q419 L420	D416-Q418 VanDerWaalsContact C-N 3.31Å; D416-Q418 PolarHBondContact O-N 3.18Å; D416-Q418 VanDerWaalsContact OD1-CA 3.31Å; D416-Q418 WeakPolarHBondContact OD1-CA 3.35Å; D416-Q418 VanDerWaalsContact OD1-CB 3.28Å; D416-Q418 WeakPolarHBondContact OD1-CB 3.46Å; D416-Q418 PolarHBondContact OD1-N 2.81Å; D416-Q419 PolarHBondContact O-N 3.41Å; D416-Q419 PolarHBondContact OD1-N 2.98Å; D416-L420 WeakPolarHBondContact O-CB 3.17Å; D416-L420 PolarHBondContact O-N 3.45Å
417	S	89.8	Confident	90.9	Very high	65 Å²	65	55.9 Å²	55.9	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-32.2	178.9	-175.3	0	0	0	0	113.7	S421	S417-S421 VanDerWaalsContact O-CB 3.32Å; S417-S421 WeakPolarHBondContact O-CB 3.24Å; S417-S421 PolarHBondContact O-N 3.23Å
418	Q	90.6	Very high	91	Very high	109 Å²	109	48.2 Å²	48.2	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-71.7	-43.6	178.6	-174.8	178.4	3.9	0	0	110.8	D416 S421 A422	D416-Q418 VanDerWaalsContact C-N 3.31Å; D416-Q418 PolarHBondContact O-N 3.18Å; D416-Q418 VanDerWaalsContact OD1-CA 3.31Å; D416-Q418 WeakPolarHBondContact OD1-CA 3.35Å; D416-Q418 VanDerWaalsContact OD1-CB 3.28Å; D416-Q418 WeakPolarHBondContact OD1-CB 3.46Å; D416-Q418 PolarHBondContact OD1-N 2.81Å; Q418-S421 PolarHBondContact O-N 3.45Å; Q418-A422 VanDerWaalsContact O-CB 3.27Å; Q418-A422 WeakPolarHBondContact O-CB 3.49Å; Q418-A422 PolarHBondContact O-N 3.36Å
419	Q	91.1	Very high	90.9	Very high	84 Å²	84	46.9 Å²	46.9	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-42.4	173.3	-66.1	-173.4	17.5	0	0	111.6	A414 D416 S421 A422 C423	A414-Q419 HydrophobicContact CB-CB 4.14Å; D416-Q419 PolarHBondContact O-N 3.41Å; D416-Q419 PolarHBondContact OD1-N 2.98Å; Q419-S421 PolarHBondContact O-N 2.85Å; Q419-A422 PolarHBondContact O-N 2.88Å; Q419-C423 VanDerWaalsContact O-CB 3.28Å; Q419-C423 WeakPolarHBondContact O-CB 3.44Å; Q419-C423 PolarHBondContact O-N 2.94Å; Q419-C423 PolarHBondContact O-SG 3.33Å
420	L	93	Very high	90.8	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-58.5	-49.2	175.4	-177.6	157	0	0	0	110.9	A414 D416 A422 C423 F424 C466 T470 V502 I506	A414-L420 HydrophobicContact CB-CB 4.05Å; D416-L420 WeakPolarHBondContact O-CB 3.17Å; D416-L420 PolarHBondContact O-N 3.45Å; L420-A422 PolarHBondContact O-N 3.44Å; L420-C423 PolarHBondContact O-N 3.43Å; L420-F424 HydrophobicContact CG-CD2 4.38Å; L420-F424 WeakPolarHBondContact O-CB 3.37Å; L420-F424 WeakPolarHBondContact O-CD2 3.42Å; L420-F424 PolarHBondContact O-N 3.5Å; L420-C466 HydrophobicContact CD1-CB 4.12Å; L420-C466 VanDerWaalsContact CD1-SG 3.52Å; L420-C466 HydrophobicContact CG-CB 4.15Å; L420-T470 HydrophobicContact CD2-CG2 3.43Å; L420-T470 VanDerWaalsContact CD2-CG2 3.43Å; L420-V502 HydrophobicContact CD1-CG1 3.52Å; L420-I506 HydrophobicContact CD1-CG2 4Å
421	S	91	Very high	90.7	Very high	74 Å²	74	46.3 Å²	46.3	52%	0.517	28%	0.276	S	S	.	.	H	α-helix	trans	-61.2	-44.6	177	-173.6	0	0	0	0	111.9	S417 Q418 Q419 C423 G425	S417-S421 VanDerWaalsContact O-CB 3.32Å; S417-S421 WeakPolarHBondContact O-CB 3.24Å; S417-S421 PolarHBondContact O-N 3.23Å; Q418-S421 PolarHBondContact O-N 3.45Å; Q419-S421 PolarHBondContact O-N 2.85Å; S421-C423 PolarHBondContact O-N 2.83Å; S421-G425 VanDerWaalsContact O-CA 3.26Å; S421-G425 WeakPolarHBondContact O-CA 3.46Å; S421-G425 PolarHBondContact O-N 3.25Å
422	A	88.4	Confident	90.7	Very high	76 Å²	76	41.6 Å²	41.6	63%	0.628	26%	0.257	S	S	*	.	H	α-helix	trans	-66.9	-32.5	179.1	0	0	0	0	0	113.9	Q418 Q419 L420	Q418-A422 VanDerWaalsContact O-CB 3.27Å; Q418-A422 WeakPolarHBondContact O-CB 3.49Å; Q418-A422 PolarHBondContact O-N 3.36Å; Q419-A422 PolarHBondContact O-N 2.88Å; L420-A422 PolarHBondContact O-N 3.44Å
423	C	92.2	Very high	90.6	Very high	29 Å²	29	40.1 Å²	40.1	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-89.8	-34	-177.9	-73.2	0	0	0	0	113.9	P398 Q419 L420 S421	P398-C423 HydrophobicContact CB-CB 4.21Å; P398-C423 VanDerWaalsContact CD-O 3.29Å; P398-C423 WeakPolarHBondContact CD-O 3.37Å; P398-C423 HydrophobicContact CG-CB 4.26Å; P398-C423 WeakPolarHBondContact CG-O 3.39Å; Q419-C423 VanDerWaalsContact O-CB 3.28Å; Q419-C423 WeakPolarHBondContact O-CB 3.44Å; Q419-C423 PolarHBondContact O-N 2.94Å; Q419-C423 PolarHBondContact O-SG 3.33Å; L420-C423 PolarHBondContact O-N 3.43Å; S421-C423 PolarHBondContact O-N 2.83Å
424	F	94.4	Very high	90.4	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-121.7	-15.7	-170.4	-57.6	-91.2	0	0	0	114	M409 A414 L420 L427 G428 W459 N463 C466 L467 T470	M409-F424 HydrophobicContact CE-CD1 3.95Å; M409-F424 HydrophobicContact CE-CE1 3.15Å; M409-F424 HydrophobicContact CE-CE2 4.23Å; M409-F424 HydrophobicContact CE-CZ 3.32Å; A414-F424 HydrophobicContact CB-CE2 4.42Å; L420-F424 HydrophobicContact CG-CD2 4.38Å; L420-F424 WeakPolarHBondContact O-CB 3.37Å; L420-F424 WeakPolarHBondContact O-CD2 3.42Å; L420-F424 PolarHBondContact O-N 3.5Å; F424-L427 PolarHBondContact O-N 3.22Å; F424-G428 PolarHBondContact O-N 2.95Å; F424-W459 HydrophobicContact CD1-CZ3 4.36Å; F424-W459 HydrophobicContact CE1-CE3 4.35Å; F424-W459 AromaticContact CE1-CZ3 3.89Å; F424-W459 HydrophobicContact CE1-CZ3 3.89Å; F424-N463 HydrophobicContact CE1-CB 3.92Å; F424-N463 WeakPolarHBondContact CE1-O 3.5Å; F424-N463 HydrophobicContact CZ-CB 3.65Å; F424-N463 WeakPolarHBondContact CZ-OD1 3.49Å; F424-C466 HydrophobicContact CB-CB 4.47Å; F424-C466 HydrophobicContact CD1-CB 3.8Å; F424-C466 HydrophobicContact CD2-CB 3.5Å; F424-C466 HydrophobicContact CE1-CB 3.76Å; F424-C466 HydrophobicContact CE2-CB 3.49Å; F424-C466 VanDerWaalsContact CE2-CB 3.49Å; F424-C466 HydrophobicContact CG-CB 3.66Å; F424-C466 HydrophobicContact CZ-CB 3.63Å; F424-L467 HydrophobicContact CD1-CB 3.96Å; F424-L467 HydrophobicContact CE1-CB 4.48Å; F424-T470 HydrophobicContact CB-CG2 3.8Å; F424-T470 WeakPolarHBondContact CB-OG1 3.32Å; F424-T470 PolarHBondContact O-OG1 2.8Å
425	G	92.2	Very high	90.4	Very high	19 Å²	19	39.5 Å²	39.5	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-50.8	-172	0	0	0	0	0	113.3	S421 L427 S429	S421-G425 VanDerWaalsContact O-CA 3.26Å; S421-G425 WeakPolarHBondContact O-CA 3.46Å; S421-G425 PolarHBondContact O-N 3.25Å; G425-L427 PolarHBondContact O-N 3.33Å; G425-S429 WeakPolarHBondContact O-CB 3.24Å; G425-S429 PolarHBondContact O-N 2.97Å
426	E	89.9	Confident	90.4	Very high	71 Å²	71	42 Å²	42	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-65.2	-39.9	178.9	-57.1	-164.6	138	0	0	112.5	R232 L241 Y396 V430	R232-E426 IonicContact CZ-OE1 3.12Å; R232-E426 IonicContact CZ-OE2 2.76Å; R232-E426 VanDerWaalsContact CZ-OE2 3.24Å; R232-E426 IonicContact NH1-OE1 2.68Å; R232-E426 IonicContact NH1-OE2 3.15Å; R232-E426 PolarHBondContact NH1-OE2 2.87Å; R232-E426 IonicContact NH2-OE1 3.3Å; R232-E426 PolarHBondContact NH2-OE1 2.62Å; R232-E426 IonicContact NH2-OE2 2.79Å; R232-E426 PolarHBondContact NH2-OE2 2.74Å; L241-E426 HydrophobicContact CD1-CB 3.84Å; L241-E426 HydrophobicContact CD1-CG 3.8Å; Y396-E426 HydrophobicContact CD1-CB 4.43Å; E426-V430 PolarHBondContact O-N 2.8Å
427	L	93.2	Very high	90.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-71.6	-41.1	-178.1	-171	61	0	0	0	112.1	L392 F393 F424 G425 V430 L431 I452 W459 L467	L392-L427 HydrophobicContact CB-CD1 4.33Å; F393-L427 HydrophobicContact CD2-CD2 4.06Å; F424-L427 PolarHBondContact O-N 3.22Å; G425-L427 PolarHBondContact O-N 3.33Å; L427-V430 HydrophobicContact CD1-CG1 4.32Å; L427-V430 WeakPolarHBondContact O-CG1 3.4Å; L427-L431 VanDerWaalsContact O-CG 3.31Å; L427-L431 WeakPolarHBondContact O-CG 3.49Å; L427-L431 PolarHBondContact O-N 3.43Å; L427-I452 HydrophobicContact CD1-CD1 4.36Å; L427-I452 HydrophobicContact CD2-CG2 4.18Å; L427-W459 HydrophobicContact CD2-CH2 4.06Å; L427-L467 HydrophobicContact CB-CD1 4.14Å; L427-L467 HydrophobicContact CD2-CD1 3.93Å; L427-L467 HydrophobicContact CG-CD1 3.84Å
428	G	93.7	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-43.4	173.7	0	0	0	0	0	111.9	F424 V430 L431 S432 T470 S471	F424-G428 PolarHBondContact O-N 2.95Å; G428-V430 PolarHBondContact O-N 3.28Å; G428-L431 PolarHBondContact O-N 3.26Å; G428-S432 WeakPolarHBondContact O-CB 3.4Å; G428-S432 PolarHBondContact O-N 3.2Å; G428-T470 CarbonylContact C-O 3.59Å; G428-S471 WeakPolarHBondContact CA-OG 3.24Å; G428-S471 WeakPolarHBondContact O-CA 3.43Å
429	S	90.4	Very high	89.5	Confident	15 Å²	15	41 Å²	41	11%	0.105	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-40.8	177.2	179.8	0	0	0	0	112.6	P242 G425 S432 N433	P242-S429 VanDerWaalsContact CD-OG 3.29Å; P242-S429 WeakPolarHBondContact CD-OG 3.39Å; G425-S429 WeakPolarHBondContact O-CB 3.24Å; G425-S429 PolarHBondContact O-N 2.97Å; S429-S432 PolarHBondContact O-N 3.3Å; S429-N433 WeakPolarHBondContact O-CB 3.24Å; S429-N433 VanDerWaalsContact O-CG 3.3Å; S429-N433 PolarHBondContact O-N 3.17Å
430	V	88.6	Confident	89.4	Confident	13 Å²	13	37.5 Å²	37.5	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-40.2	174	70.2	0	0	0	0	112.5	L241 L392 Y396 E426 L427 G428 S432 N433 M434	L241-V430 HydrophobicContact CD2-CB 4.28Å; L392-V430 HydrophobicContact CD2-CG1 4.38Å; L392-V430 HydrophobicContact CD2-CG2 4.34Å; Y396-V430 HydrophobicContact CD2-CB 4.11Å; Y396-V430 HydrophobicContact CD2-CG1 3.67Å; Y396-V430 HydrophobicContact CD2-CG2 4.12Å; Y396-V430 HydrophobicContact CE2-CB 4.17Å; Y396-V430 HydrophobicContact CE2-CG1 4.18Å; Y396-V430 HydrophobicContact CE2-CG2 3.74Å; Y396-V430 HydrophobicContact CG-CB 4.33Å; Y396-V430 HydrophobicContact CG-CG1 3.91Å; E426-V430 PolarHBondContact O-N 2.8Å; L427-V430 HydrophobicContact CD1-CG1 4.32Å; L427-V430 WeakPolarHBondContact O-CG1 3.4Å; G428-V430 PolarHBondContact O-N 3.28Å; V430-S432 VanDerWaalsContact C-N 3.32Å; V430-S432 PolarHBondContact O-N 3.04Å; V430-N433 PolarHBondContact O-N 3.44Å; V430-M434 HydrophobicContact CG2-CG 4.31Å; V430-M434 HydrophobicContact CG2-SD 4.28Å; V430-M434 WeakPolarHBondContact O-CB 3.29Å; V430-M434 WeakPolarHBondContact O-CG 3.3Å; V430-M434 PolarHBondContact O-N 3.15Å
431	L	92	Very high	89.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-41.6	175.5	-70.9	166.9	0	0	0	111.6	L392 L427 G428 M434 F435 I448 I449 I452 L467	L392-L431 HydrophobicContact CD1-CD2 4.42Å; L427-L431 VanDerWaalsContact O-CG 3.31Å; L427-L431 WeakPolarHBondContact O-CG 3.49Å; L427-L431 PolarHBondContact O-N 3.43Å; G428-L431 PolarHBondContact O-N 3.26Å; L431-M434 PolarHBondContact O-N 2.87Å; L431-F435 PolarHBondContact O-N 3.15Å; L431-F435 VanDerWaalsContact O-N 3.08Å; L431-I448 HydrophobicContact CD2-CG2 3.8Å; L431-I449 HydrophobicContact CD1-CD1 4.43Å; L431-I449 HydrophobicContact CD1-CG1 3.94Å; L431-I449 HydrophobicContact CD2-CG1 4.23Å; L431-I452 HydrophobicContact CD1-CD1 4.47Å; L431-I452 HydrophobicContact CD2-CD1 4.34Å; L431-L467 HydrophobicContact CD1-CD1 3.9Å; L431-L467 HydrophobicContact CD1-CD2 4.29Å; L431-L467 HydrophobicContact CD1-CG 4.23Å
432	S	91.3	Very high	89.5	Confident	24 Å²	24	39.6 Å²	39.6	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-47.9	174.2	-148.9	0	0	0	0	111.3	G428 S429 V430 M434 F435 H436 S471	G428-S432 WeakPolarHBondContact O-CB 3.4Å; G428-S432 PolarHBondContact O-N 3.2Å; S429-S432 PolarHBondContact O-N 3.3Å; V430-S432 VanDerWaalsContact C-N 3.32Å; V430-S432 PolarHBondContact O-N 3.04Å; S432-M434 VanDerWaalsContact C-N 3.34Å; S432-M434 PolarHBondContact O-N 3.43Å; S432-F435 PolarHBondContact O-N 2.77Å; S432-H436 WeakPolarHBondContact O-CB 3.42Å; S432-H436 PolarHBondContact O-N 2.66Å; S432-H436 PolarHBondContact O-ND1 3.48Å; S432-S471 VanDerWaalsContact CB-O 3.24Å; S432-S471 WeakPolarHBondContact CB-O 3.37Å; S432-S471 PolarHBondContact OG-O 2.99Å
433	N	86.8	Confident	89.8	Confident	59 Å²	59	40.6 Å²	40.6	32%	0.316	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-38.8	176	-76.2	-15.9	0	0	0	112.7	A240 P242 S429 V430 H436 S437	A240-N433 PolarHBondContact O-ND2 3.39Å; A240-N433 VanDerWaalsContact O-ND2 3.14Å; P242-N433 WeakPolarHBondContact CD-ND2 3.45Å; S429-N433 WeakPolarHBondContact O-CB 3.24Å; S429-N433 VanDerWaalsContact O-CG 3.3Å; S429-N433 PolarHBondContact O-N 3.17Å; V430-N433 PolarHBondContact O-N 3.44Å; N433-H436 PolarHBondContact O-N 3.28Å; N433-S437 WeakPolarHBondContact O-CB 3.47Å; N433-S437 PolarHBondContact O-N 3.01Å
434	M	87.8	Confident	89.9	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-46.5	177.1	-72.8	172.4	70.1	0	0	111	M377 L392 V430 L431 S432 S437 W440 I445 I448	M377-M434 HydrophobicContact CE-CG 4.09Å; L392-M434 HydrophobicContact CD1-CE 4.01Å; L392-M434 HydrophobicContact CD1-SD 3.81Å; L392-M434 HydrophobicContact CD2-SD 3.75Å; L392-M434 HydrophobicContact CG-SD 4.45Å; V430-M434 HydrophobicContact CG2-CG 4.31Å; V430-M434 HydrophobicContact CG2-SD 4.28Å; V430-M434 WeakPolarHBondContact O-CB 3.29Å; V430-M434 WeakPolarHBondContact O-CG 3.3Å; V430-M434 PolarHBondContact O-N 3.15Å; L431-M434 PolarHBondContact O-N 2.87Å; S432-M434 VanDerWaalsContact C-N 3.34Å; S432-M434 PolarHBondContact O-N 3.43Å; M434-S437 WeakPolarHBondContact O-CB 3.38Å; M434-S437 PolarHBondContact O-N 3.49Å; M434-S437 PolarHBondContact O-OG 3.05Å; M434-W440 HydrophobicContact CB-CG 4.26Å; M434-W440 HydrophobicContact CE-CD2 3.65Å; M434-W440 HydrophobicContact CE-CE3 4.06Å; M434-W440 HydrophobicContact CE-CG 4.23Å; M434-W440 HydrophobicContact CE-CH2 3.99Å; M434-W440 HydrophobicContact CE-CZ2 3.55Å; M434-W440 HydrophobicContact CE-CZ3 4.24Å; M434-I445 HydrophobicContact CB-CD1 3.75Å; M434-I445 HydrophobicContact CE-CD1 4.46Å; M434-I448 HydrophobicContact CE-CD1 3.77Å
435	F	88.8	Confident	90	Very high	49 Å²	49	40.3 Å²	40.3	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-50.4	175.4	-179.4	-110.4	0	0	0	112.1	L431 S432 S437 G438 I445 E474 I475 L478	L431-F435 PolarHBondContact O-N 3.15Å; L431-F435 VanDerWaalsContact O-N 3.08Å; S432-F435 PolarHBondContact O-N 2.77Å; F435-S437 PolarHBondContact O-N 2.68Å; F435-G438 PolarHBondContact O-N 3.07Å; F435-I445 HydrophobicContact CB-CD1 4.43Å; F435-I445 HydrophobicContact CB-CG1 4.18Å; F435-I445 HydrophobicContact CD2-CG1 4.21Å; F435-E474 HydrophobicContact CE1-CB 4.12Å; F435-E474 WeakPolarHBondContact CE1-OE2 3.41Å; F435-I475 HydrophobicContact CB-CD1 3.57Å; F435-I475 HydrophobicContact CD1-CD1 3.7Å; F435-I475 HydrophobicContact CD2-CD1 4.09Å; F435-I475 HydrophobicContact CE1-CD1 4.38Å; F435-I475 HydrophobicContact CG-CD1 3.52Å; F435-L478 HydrophobicContact CD2-CD2 4.43Å; F435-L478 HydrophobicContact CE2-CD2 4.01Å
436	H	87.1	Confident	90.2	Very high	117 Å²	117	39.6 Å²	39.6	54%	0.542	23%	0.232	S	C	.	.	H	α-helix	trans	-67.1	-17.5	179.9	-73	87.7	0	0	0	114.3	S432 N433 G438 E474	S432-H436 WeakPolarHBondContact O-CB 3.42Å; S432-H436 PolarHBondContact O-N 2.66Å; S432-H436 PolarHBondContact O-ND1 3.48Å; N433-H436 PolarHBondContact O-N 3.28Å; H436-G438 PolarHBondContact O-N 3.13Å; H436-E474 IonicContact CE1-OE2 3.24Å; H436-E474 PolarHBondContact CE1-OE2 2.88Å; H436-E474 IonicContact NE2-OE2 2.66Å; H436-E474 PolarHBondContact NE2-OE2 2.97Å
437	S	82.8	Confident	90.5	Very high	49 Å²	49	39.2 Å²	39.2	34%	0.343	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.5	176.2	75.7	0	0	0	0	113.6	N433 M434 F435 L439	N433-S437 WeakPolarHBondContact O-CB 3.47Å; N433-S437 PolarHBondContact O-N 3.01Å; M434-S437 WeakPolarHBondContact O-CB 3.38Å; M434-S437 PolarHBondContact O-N 3.49Å; M434-S437 PolarHBondContact O-OG 3.05Å; F435-S437 PolarHBondContact O-N 2.68Å; S437-L439 PolarHBondContact O-N 3.12Å; S437-L439 PolarHBondContact OG-N 3.26Å
438	G	82.3	Confident	90.6	Very high	66 Å²	66	39.1 Å²	39.1	68%	0.68	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	3.7	-173.6	0	0	0	0	0	115	F435 H436	F435-G438 PolarHBondContact O-N 3.07Å; H436-G438 PolarHBondContact O-N 3.13Å
439	L	82.6	Confident	90.8	Very high	100 Å²	100	39.3 Å²	39.3	52%	0.524	23%	0.232	S	C	.	.	S	Bend	trans	-84.4	-25	175.1	-59.9	176.8	0	0	0	112.7	H381 S437	H381-L439 PolarHBondContact CE1-O 3.41Å; S437-L439 PolarHBondContact O-N 3.12Å; S437-L439 PolarHBondContact OG-N 3.26Å
440	W	88.4	Confident	91.1	Very high	11 Å²	11	40.5 Å²	40.5	4%	0.042	24%	0.237	C	C	.	.	S	Bend	trans	-106.8	133.7	-177.3	-63.9	82.4	0	0	0	109.9	L380 H381 Q388 M434 D444 I445 I448	L380-W440 HydrophobicContact CB-CH2 4.12Å; L380-W440 HydrophobicContact CB-CZ2 4.03Å; H381-W440 AromaticContact CD2-CE2 3.85Å; H381-W440 AromaticContact CD2-CZ2 3.54Å; H381-W440 AromaticContact CE1-CD2 3.44Å; H381-W440 VanDerWaalsContact CE1-CD2 3.44Å; H381-W440 AromaticContact CE1-CE2 3.4Å; H381-W440 VanDerWaalsContact CE1-CE2 3.4Å; H381-W440 AromaticContact CE1-CE3 3.59Å; H381-W440 AromaticContact CE1-CH2 3.73Å; H381-W440 AromaticContact CE1-CZ2 3.58Å; H381-W440 AromaticContact CE1-CZ3 3.72Å; H381-W440 AromaticContact CE1-NE1 3.95Å; H381-W440 AromaticContact CG-CH2 3.8Å; H381-W440 AromaticContact CG-CZ2 3.79Å; H381-W440 AromaticContact ND1-CH2 3.6Å; H381-W440 AromaticContact ND1-CZ2 3.81Å; H381-W440 AromaticContact ND1-CZ3 3.7Å; H381-W440 AromaticContact NE2-CD1 3.97Å; H381-W440 AromaticContact NE2-CD2 3.7Å; H381-W440 AromaticContact NE2-CE2 3.21Å; H381-W440 AromaticContact NE2-CZ2 3.41Å; H381-W440 WeakPolarHBondContact NE2-CZ2 3.12Å; H381-W440 AromaticContact NE2-NE1 3.4Å; H381-W440 PolarHBondContact NE2-NE1 3.44Å; Q388-W440 VanDerWaalsContact OE1-CZ3 3.27Å; M434-W440 HydrophobicContact CB-CG 4.26Å; M434-W440 HydrophobicContact CE-CD2 3.65Å; M434-W440 HydrophobicContact CE-CE3 4.06Å; M434-W440 HydrophobicContact CE-CG 4.23Å; M434-W440 HydrophobicContact CE-CH2 3.99Å; M434-W440 HydrophobicContact CE-CZ2 3.55Å; M434-W440 HydrophobicContact CE-CZ3 4.24Å; W440-D444 HydrophobicContact CE3-CB 3.67Å; W440-D444 HydrophobicContact CZ3-CB 4.3Å; W440-I445 HydrophobicContact CB-CD1 3.74Å; W440-I445 HydrophobicContact CB-CG1 4.01Å; W440-I445 HydrophobicContact CG-CD1 4.13Å; W440-I448 HydrophobicContact CE3-CD1 3.71Å; W440-I448 HydrophobicContact CH2-CD1 4.25Å; W440-I448 HydrophobicContact CZ3-CD1 3.55Å
441	T	92.5	Very high	91.5	Very high	76 Å²	76	42.2 Å²	42.2	47%	0.466	24%	0.244	S	C	.	.			trans	-76.6	160.7	171.9	72.3	0	0	0	0	110.5	D443 D444 I445	T441-D443 PolarHBondContact O-N 3.38Å; T441-D443 PolarHBondContact OG1-N 2.91Å; T441-D444 WeakPolarHBondContact CA-OD2 3.26Å; T441-D444 VanDerWaalsContact CB-OD2 3.25Å; T441-D444 WeakPolarHBondContact CB-OD2 3.31Å; T441-D444 WeakPolarHBondContact CG2-OD2 3.48Å; T441-D444 PolarHBondContact N-OD2 3.07Å; T441-D444 PolarHBondContact O-N 3.15Å; T441-D444 VanDerWaalsContact O-N 3.14Å; T441-D444 PolarHBondContact OG1-N 2.82Å; T441-D444 PolarHBondContact OG1-OD2 2.93Å; T441-I445 PolarHBondContact O-N 3.19Å; T441-I445 VanDerWaalsContact O-N 3.15Å
442	S	94.8	Very high	91.7	Very high	51 Å²	51	42.3 Å²	42.3	36%	0.357	25%	0.245	S	C	.	.	H	α-helix	trans	-54.6	-39	173	-52.4	0	0	0	0	112.5	I445 I446	S442-I445 PolarHBondContact O-N 2.63Å; S442-I446 WeakPolarHBondContact O-CD1 3.47Å; S442-I446 VanDerWaalsContact O-CG1 3.32Å; S442-I446 WeakPolarHBondContact O-CG1 3.43Å; S442-I446 PolarHBondContact O-N 2.82Å; S442-I446 VanDerWaalsContact O-N 3.07Å
443	D	94.9	Very high	91.9	Very high	96 Å²	96	41.6 Å²	41.6	51%	0.513	24%	0.24	S	C	.	.	H	α-helix	trans	-69	-38.3	178.7	-66.2	-33.9	0	0	0	111.6	T441 I445 I446 N447	T441-D443 PolarHBondContact O-N 3.38Å; T441-D443 PolarHBondContact OG1-N 2.91Å; D443-I445 PolarHBondContact O-N 2.82Å; D443-I446 PolarHBondContact O-N 3.11Å; D443-N447 WeakPolarHBondContact O-CB 3.42Å; D443-N447 PolarHBondContact O-N 3.13Å; D443-N447 PolarHBondContact O-ND2 3.18Å
444	D	94.3	Very high	92.4	Very high	26 Å²	26	42.2 Å²	42.2	14%	0.139	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-46	175.5	-56.7	-62.3	0	0	0	111	Y385 W440 T441 I446 N447 I448	Y385-D444 HydrophobicContact CE1-CB 4.04Å; Y385-D444 WeakPolarHBondContact CE1-OD1 3.29Å; Y385-D444 PolarHBondContact OH-OD1 3.48Å; W440-D444 HydrophobicContact CE3-CB 3.67Å; W440-D444 HydrophobicContact CZ3-CB 4.3Å; T441-D444 WeakPolarHBondContact CA-OD2 3.26Å; T441-D444 VanDerWaalsContact CB-OD2 3.25Å; T441-D444 WeakPolarHBondContact CB-OD2 3.31Å; T441-D444 WeakPolarHBondContact CG2-OD2 3.48Å; T441-D444 PolarHBondContact N-OD2 3.07Å; T441-D444 PolarHBondContact O-N 3.15Å; T441-D444 VanDerWaalsContact O-N 3.14Å; T441-D444 PolarHBondContact OG1-N 2.82Å; T441-D444 PolarHBondContact OG1-OD2 2.93Å; D444-I446 PolarHBondContact O-N 2.88Å; D444-N447 PolarHBondContact O-N 3.47Å; D444-I448 WeakPolarHBondContact O-CD1 3.36Å; D444-I448 VanDerWaalsContact O-CG1 3.26Å; D444-I448 WeakPolarHBondContact O-CG1 3.39Å; D444-I448 PolarHBondContact O-N 3.14Å
445	I	95	Very high	92.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-41.5	-180	-61.5	-64	0	0	0	111.3	M434 F435 W440 T441 S442 D443 I448 I449 I475	M434-I445 HydrophobicContact CB-CD1 3.75Å; M434-I445 HydrophobicContact CE-CD1 4.46Å; F435-I445 HydrophobicContact CB-CD1 4.43Å; F435-I445 HydrophobicContact CB-CG1 4.18Å; F435-I445 HydrophobicContact CD2-CG1 4.21Å; W440-I445 HydrophobicContact CB-CD1 3.74Å; W440-I445 HydrophobicContact CB-CG1 4.01Å; W440-I445 HydrophobicContact CG-CD1 4.13Å; T441-I445 PolarHBondContact O-N 3.19Å; T441-I445 VanDerWaalsContact O-N 3.15Å; S442-I445 PolarHBondContact O-N 2.63Å; D443-I445 PolarHBondContact O-N 2.82Å; I445-I448 PolarHBondContact O-N 2.93Å; I445-I449 HydrophobicContact CG2-CD1 3.85Å; I445-I449 VanDerWaalsContact O-CG1 3.3Å; I445-I449 WeakPolarHBondContact O-CG1 3.4Å; I445-I449 PolarHBondContact O-N 2.92Å; I445-I475 HydrophobicContact CG2-CD1 4.12Å
446	I	96.5	Very high	92.8	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-49.7	173.8	-68.9	158.7	0	0	0	110.7	S442 D443 D444 I448 I449 D450 L478 N482	S442-I446 WeakPolarHBondContact O-CD1 3.47Å; S442-I446 VanDerWaalsContact O-CG1 3.32Å; S442-I446 WeakPolarHBondContact O-CG1 3.43Å; S442-I446 PolarHBondContact O-N 2.82Å; S442-I446 VanDerWaalsContact O-N 3.07Å; D443-I446 PolarHBondContact O-N 3.11Å; D444-I446 PolarHBondContact O-N 2.88Å; I446-I448 VanDerWaalsContact C-N 3.3Å; I446-I448 PolarHBondContact O-N 3.2Å; I446-I449 PolarHBondContact O-N 3.24Å; I446-D450 PolarHBondContact O-N 3.3Å; I446-L478 HydrophobicContact CD1-CD1 3.62Å; I446-L478 HydrophobicContact CD1-CD2 4.29Å; I446-L478 HydrophobicContact CD1-CG 3.71Å; I446-L478 HydrophobicContact CG1-CD1 4.3Å; I446-L478 HydrophobicContact CG1-CD2 4.14Å; I446-L478 HydrophobicContact CG1-CG 3.81Å; I446-N482 HydrophobicContact CD1-CB 3.6Å
447	N	96.7	Very high	93.1	Very high	62 Å²	62	42.6 Å²	42.6	33%	0.332	25%	0.25	S	C	.	.	H	α-helix	trans	-61.8	-38.1	-179.2	-76.5	-63	0	0	0	111.7	Y385 D443 D444 Q451	Y385-N447 HydrophobicContact CD1-CB 3.86Å; Y385-N447 HydrophobicContact CD2-CB 3.54Å; Y385-N447 HydrophobicContact CE1-CB 4.06Å; Y385-N447 HydrophobicContact CE2-CB 3.73Å; Y385-N447 HydrophobicContact CG-CB 3.6Å; D443-N447 WeakPolarHBondContact O-CB 3.42Å; D443-N447 PolarHBondContact O-N 3.13Å; D443-N447 PolarHBondContact O-ND2 3.18Å; D444-N447 PolarHBondContact O-N 3.47Å; N447-Q451 WeakPolarHBondContact O-CB 3.34Å; N447-Q451 WeakPolarHBondContact O-CG 3.23Å; N447-Q451 PolarHBondContact O-N 3.27Å
448	I	96.3	Very high	93.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-49.1	173.2	-71	162.5	0	0	0	110.8	Y385 Q388 L392 L431 M434 W440 D444 I445 I446 Q451 I452	Y385-I448 HydrophobicContact CD1-CG1 4.19Å; Q388-I448 HydrophobicContact CB-CG1 4.36Å; L392-I448 HydrophobicContact CD1-CG2 3.56Å; L431-I448 HydrophobicContact CD2-CG2 3.8Å; M434-I448 HydrophobicContact CE-CD1 3.77Å; W440-I448 HydrophobicContact CE3-CD1 3.71Å; W440-I448 HydrophobicContact CH2-CD1 4.25Å; W440-I448 HydrophobicContact CZ3-CD1 3.55Å; D444-I448 WeakPolarHBondContact O-CD1 3.36Å; D444-I448 VanDerWaalsContact O-CG1 3.26Å; D444-I448 WeakPolarHBondContact O-CG1 3.39Å; D444-I448 PolarHBondContact O-N 3.14Å; I445-I448 PolarHBondContact O-N 2.93Å; I446-I448 VanDerWaalsContact C-N 3.3Å; I446-I448 PolarHBondContact O-N 3.2Å; I448-Q451 PolarHBondContact O-N 3.42Å; I448-I452 HydrophobicContact CG2-CD1 3.72Å; I448-I452 HydrophobicContact CG2-CG1 4.25Å; I448-I452 WeakPolarHBondContact O-CG1 3.44Å; I448-I452 PolarHBondContact O-N 3.04Å
449	I	97	Very high	94.4	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-49.5	-179.3	-71.1	166.8	0	0	0	110.4	L431 I445 I446 Q451 I452 T453 L468 I475	L431-I449 HydrophobicContact CD1-CD1 4.43Å; L431-I449 HydrophobicContact CD1-CG1 3.94Å; L431-I449 HydrophobicContact CD2-CG1 4.23Å; I445-I449 HydrophobicContact CG2-CD1 3.85Å; I445-I449 VanDerWaalsContact O-CG1 3.3Å; I445-I449 WeakPolarHBondContact O-CG1 3.4Å; I445-I449 PolarHBondContact O-N 2.92Å; I446-I449 PolarHBondContact O-N 3.24Å; I449-Q451 PolarHBondContact O-N 2.87Å; I449-I452 PolarHBondContact O-N 2.89Å; I449-I452 VanDerWaalsContact O-N 3.12Å; I449-T453 HydrophobicContact CG2-CG2 4.39Å; I449-T453 WeakPolarHBondContact O-CG2 3.14Å; I449-T453 PolarHBondContact O-N 3.17Å; I449-T453 PolarHBondContact O-OG1 3.03Å; I449-L468 HydrophobicContact CD1-CD2 4.44Å; I449-L468 HydrophobicContact CG2-CD2 4.3Å; I449-I475 HydrophobicContact CD1-CG2 3.41Å; I449-I475 VanDerWaalsContact CD1-CG2 3.41Å
450	D	96.4	Very high	95	Very high	40 Å²	40	41.8 Å²	41.8	21%	0.214	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-31.2	178.3	-80	-18.9	0	0	0	111.9	I446 T453 I454 K483	I446-D450 PolarHBondContact O-N 3.3Å; D450-T453 PolarHBondContact O-OG1 3.38Å; D450-I454 WeakPolarHBondContact O-CG1 3.49Å; D450-I454 WeakPolarHBondContact O-CG2 3.2Å; D450-K483 WeakPolarHBondContact OD1-CE 3.48Å; D450-K483 IonicContact OD1-NZ 3.84Å; D450-K483 PolarHBondContact OD1-NZ 3.39Å
451	Q	97	Very high	95.3	Very high	49 Å²	49	43 Å²	43	23%	0.229	24%	0.237	C	C	.	.	H	α-helix	trans	-78.6	-33.7	173.7	-69.6	-63	-72.6	0	0	113.8	T386 A389 N447 I448 I449 T455	T386-Q451 PolarHBondContact OG1-OE1 3.35Å; A389-Q451 HydrophobicContact CB-CB 3.65Å; N447-Q451 WeakPolarHBondContact O-CB 3.34Å; N447-Q451 WeakPolarHBondContact O-CG 3.23Å; N447-Q451 PolarHBondContact O-N 3.27Å; I448-Q451 PolarHBondContact O-N 3.42Å; I449-Q451 PolarHBondContact O-N 2.87Å; Q451-T455 WeakPolarHBondContact O-CB 3.45Å; Q451-T455 PolarHBondContact O-OG1 3.04Å
452	I	96.4	Very high	95.5	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-48.2	173.8	-73.2	173.5	0	0	0	109.5	A389 L392 L427 L431 I448 I449 I454 T455 W459 L467	A389-I452 HydrophobicContact CB-CB 4.35Å; A389-I452 HydrophobicContact CB-CG1 3.46Å; A389-I452 VanDerWaalsContact CB-CG1 3.46Å; L392-I452 HydrophobicContact CB-CD1 4.42Å; L392-I452 HydrophobicContact CD1-CD1 4.48Å; L427-I452 HydrophobicContact CD1-CD1 4.36Å; L427-I452 HydrophobicContact CD2-CG2 4.18Å; L431-I452 HydrophobicContact CD1-CD1 4.47Å; L431-I452 HydrophobicContact CD2-CD1 4.34Å; I448-I452 HydrophobicContact CG2-CD1 3.72Å; I448-I452 HydrophobicContact CG2-CG1 4.25Å; I448-I452 WeakPolarHBondContact O-CG1 3.44Å; I448-I452 PolarHBondContact O-N 3.04Å; I449-I452 PolarHBondContact O-N 2.89Å; I449-I452 VanDerWaalsContact O-N 3.12Å; I452-I454 PolarHBondContact O-N 2.95Å; I452-T455 PolarHBondContact O-N 3.37Å; I452-T455 VanDerWaalsContact O-N 3.13Å; I452-W459 HydrophobicContact CG2-CH2 3.5Å; I452-W459 VanDerWaalsContact CG2-CH2 3.5Å; I452-W459 HydrophobicContact CG2-CZ2 3.53Å; I452-W459 HydrophobicContact CG2-CZ3 4.3Å; I452-W459 PolarHBondContact O-NE1 3.18Å; I452-L467 HydrophobicContact CG2-CD2 4.05Å
453	T	96.7	Very high	95.5	Very high	9 Å²	9	38.4 Å²	38.4	6%	0.055	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-2.3	-171	55.2	0	0	0	0	115	I449 D450 W459 V464 L467	I449-T453 HydrophobicContact CG2-CG2 4.39Å; I449-T453 WeakPolarHBondContact O-CG2 3.14Å; I449-T453 PolarHBondContact O-N 3.17Å; I449-T453 PolarHBondContact O-OG1 3.03Å; D450-T453 PolarHBondContact O-OG1 3.38Å; T453-W459 HydrophobicContact CG2-CD2 4.43Å; T453-W459 HydrophobicContact CG2-CE3 4.18Å; T453-W459 WeakPolarHBondContact O-CB 3.37Å; T453-W459 PolarHBondContact O-N 2.86Å; T453-V464 HydrophobicContact CG2-CB 4.38Å; T453-V464 HydrophobicContact CG2-CG1 4.14Å; T453-V464 HydrophobicContact CG2-CG2 3.82Å; T453-L467 HydrophobicContact CG2-CD2 4.05Å
454	I	95.6	Very high	95.6	Very high	72 Å²	72	34.7 Å²	34.7	37%	0.369	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	10	172.6	70.7	180	0	0	0	112.6	D450 I452 P456 E457 D458	D450-I454 WeakPolarHBondContact O-CG1 3.49Å; D450-I454 WeakPolarHBondContact O-CG2 3.2Å; I452-I454 PolarHBondContact O-N 2.95Å; I454-P456 CarbonylContact O-C 3.16Å; I454-E457 CarbonylContact C-O 3.6Å; I454-E457 CarbonylContact O-C 3.52Å; I454-E457 PolarHBondContact O-N 3.4Å; I454-D458 WeakPolarHBondContact CG2-OD1 3.49Å
455	T	92.9	Very high	95.8	Very high	15 Å²	15	33.5 Å²	33.5	9%	0.092	18%	0.179	C	C	.	.	S	Bend	trans	-119.4	124.3	-177	-60	0	0	0	0	110.4	P217 R390 W406 Q451 I452 E457 W459	P217-T455 HydrophobicContact CG-CG2 3.66Å; R390-T455 HydrophobicContact CG-CG2 3.9Å; W406-T455 HydrophobicContact CE3-CG2 4.43Å; W406-T455 HydrophobicContact CZ3-CG2 3.92Å; Q451-T455 WeakPolarHBondContact O-CB 3.45Å; Q451-T455 PolarHBondContact O-OG1 3.04Å; I452-T455 PolarHBondContact O-N 3.37Å; I452-T455 VanDerWaalsContact O-N 3.13Å; T455-E457 PolarHBondContact N-O 2.84Å; T455-W459 PolarHBondContact O-NE1 3.08Å
456	P	92.4	Very high	95.9	Very high	40 Å²	40	33.5 Å²	33.5	26%	0.26	18%	0.179	S	C	.	.	S	Bend	cis	-75.2	-24.7	4.4	32.3	-36.6	0	0	0	114.4	P217 W406 I454	P217-P456 HydrophobicContact CB-CB 4.17Å; P217-P456 HydrophobicContact CG-CB 3.93Å; W406-P456 HydrophobicContact CB-CG 4.1Å; W406-P456 VanDerWaalsContact O-CD 3.3Å; W406-P456 WeakPolarHBondContact O-CD 3.38Å; I454-P456 CarbonylContact O-C 3.16Å
457	E	93.7	Very high	95.9	Very high	122 Å²	122	33.3 Å²	33.3	57%	0.57	18%	0.178	S	C	*	.	S	Bend	trans	-140.5	175.3	-179.3	-66.4	170.7	-150.3	0	0	106.5	C410 I454 T455 W459	C410-E457 PolarHBondContact SG-O 3.41Å; C410-E457 VanDerWaalsContact SG-O 3.38Å; I454-E457 CarbonylContact C-O 3.6Å; I454-E457 CarbonylContact O-C 3.52Å; I454-E457 PolarHBondContact O-N 3.4Å; T455-E457 PolarHBondContact N-O 2.84Å; E457-W459 PolarHBondContact O-N 2.66Å
458	D	95.6	Very high	95.9	Very high	123 Å²	123	30.4 Å²	30.4	66%	0.658	16%	0.163	S	C	*	.	P	Polyproline II helix	trans	-57.9	129.6	178.7	-64.7	-48.9	0	0	0	111.1	C410 I454	C410-D458 PolarHBondContact SG-O 3.02Å; I454-D458 WeakPolarHBondContact CG2-OD1 3.49Å
459	W	96.7	Very high	95.9	Very high	16 Å²	16	33 Å²	33	6%	0.061	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-75.4	152.4	176	-72.1	22.1	0	0	0	110.6	F393 M409 F424 L427 I452 T453 T455 E457 A461 N463 V464 L467	F393-W459 HydrophobicContact CD2-CH2 4.04Å; F393-W459 AromaticContact CD2-CZ2 3.73Å; F393-W459 HydrophobicContact CD2-CZ2 3.73Å; F393-W459 AromaticContact CE2-CH2 3.77Å; F393-W459 HydrophobicContact CE2-CH2 3.77Å; F393-W459 AromaticContact CE2-CZ2 3.45Å; F393-W459 HydrophobicContact CE2-CZ2 3.45Å; F393-W459 VanDerWaalsContact CE2-CZ2 3.45Å; M409-W459 HydrophobicContact CB-CD2 3.6Å; M409-W459 HydrophobicContact CB-CE3 4.12Å; M409-W459 HydrophobicContact CB-CG 3.85Å; M409-W459 HydrophobicContact CB-CZ2 4.07Å; M409-W459 HydrophobicContact CE-CE3 4.08Å; M409-W459 HydrophobicContact CE-CH2 3.84Å; M409-W459 HydrophobicContact CE-CZ2 4.42Å; M409-W459 HydrophobicContact CE-CZ3 3.64Å; M409-W459 HydrophobicContact CG-CD2 4.33Å; M409-W459 HydrophobicContact CG-CH2 4.27Å; M409-W459 HydrophobicContact CG-CZ2 3.91Å; M409-W459 WeakPolarHBondContact O-CA 3.34Å; F424-W459 HydrophobicContact CD1-CZ3 4.36Å; F424-W459 HydrophobicContact CE1-CE3 4.35Å; F424-W459 AromaticContact CE1-CZ3 3.89Å; F424-W459 HydrophobicContact CE1-CZ3 3.89Å; L427-W459 HydrophobicContact CD2-CH2 4.06Å; I452-W459 HydrophobicContact CG2-CH2 3.5Å; I452-W459 VanDerWaalsContact CG2-CH2 3.5Å; I452-W459 HydrophobicContact CG2-CZ2 3.53Å; I452-W459 HydrophobicContact CG2-CZ3 4.3Å; I452-W459 PolarHBondContact O-NE1 3.18Å; T453-W459 HydrophobicContact CG2-CD2 4.43Å; T453-W459 HydrophobicContact CG2-CE3 4.18Å; T453-W459 WeakPolarHBondContact O-CB 3.37Å; T453-W459 PolarHBondContact O-N 2.86Å; T455-W459 PolarHBondContact O-NE1 3.08Å; E457-W459 PolarHBondContact O-N 2.66Å; W459-A461 PolarHBondContact O-N 3.12Å; W459-N463 HydrophobicContact CE3-CB 4.24Å; W459-V464 HydrophobicContact CB-CG2 3.93Å; W459-L467 HydrophobicContact CH2-CD2 4.42Å; W459-L467 HydrophobicContact CZ3-CB 4.44Å; W459-L467 HydrophobicContact CZ3-CD2 4.03Å
460	L	95.4	Very high	95.8	Very high	59 Å²	59	34.3 Å²	34.3	31%	0.309	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-57.6	139.5	169.3	-61.5	179.8	0	0	0	110.1	M409 C410 T413 E462 N463 V464	M409-L460 PolarHBondContact O-N 3Å; M409-L460 VanDerWaalsContact O-N 3.11Å; C410-L460 VanDerWaalsContact O-CD2 3.29Å; C410-L460 WeakPolarHBondContact O-CD2 3.47Å; C410-L460 WeakPolarHBondContact O-CG 3.21Å; T413-L460 HydrophobicContact CG2-CB 4.45Å; T413-L460 HydrophobicContact CG2-CD1 3.65Å; L460-E462 PolarHBondContact O-N 2.93Å; L460-E462 VanDerWaalsContact O-N 3.17Å; L460-N463 HydrophobicContact CB-CB 4.35Å; L460-N463 WeakPolarHBondContact O-CA 3.33Å; L460-N463 WeakPolarHBondContact O-CB 3.5Å; L460-N463 PolarHBondContact O-N 3.07Å; L460-V464 PolarHBondContact O-N 3.06Å
461	A	95.5	Very high	95.7	Very high	37 Å²	37	32.5 Å²	32.5	31%	0.306	17%	0.173	S	C	.	.	H	α-helix	trans	-58.2	-33.5	-177.6	0	0	0	0	0	112.9	W459 N463 V464 A465 V494 S498	W459-A461 PolarHBondContact O-N 3.12Å; A461-N463 VanDerWaalsContact C-N 3.35Å; A461-V464 PolarHBondContact O-N 3.44Å; A461-A465 WeakPolarHBondContact O-CB 3.32Å; A461-A465 PolarHBondContact O-N 3.41Å; A461-V494 HydrophobicContact CB-CG1 3.59Å; A461-S498 VanDerWaalsContact CB-OG 3.27Å; A461-S498 WeakPolarHBondContact CB-OG 3.35Å; A461-S498 WeakPolarHBondContact O-CB 3.43Å
462	E	94.9	Very high	95.5	Very high	28 Å²	28	31.1 Å²	31.1	13%	0.131	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-36.2	172.1	-155.4	-167.3	108.1	0	0	112.4	T413 L460 A465 C466 V502 K505	T413-E462 WeakPolarHBondContact CB-OE1 3.42Å; T413-E462 HydrophobicContact CG2-CB 3.78Å; T413-E462 HydrophobicContact CG2-CG 4.41Å; L460-E462 PolarHBondContact O-N 2.93Å; L460-E462 VanDerWaalsContact O-N 3.17Å; E462-A465 CarbonylContact O-C 3.5Å; E462-A465 WeakPolarHBondContact O-CB 3.36Å; E462-A465 PolarHBondContact O-N 2.91Å; E462-C466 PolarHBondContact O-N 2.85Å; E462-C466 PolarHBondContact O-SG 2.97Å; E462-V502 HydrophobicContact CG-CG2 3.59Å; E462-K505 VanDerWaalsContact CD-NZ 3.28Å; E462-K505 IonicContact OE1-NZ 3.03Å; E462-K505 PolarHBondContact OE1-NZ 3.15Å; E462-K505 IonicContact OE2-NZ 3.69Å; E462-K505 PolarHBondContact OE2-NZ 3.27Å; E462-K505 VanDerWaalsContact OE2-NZ 3.09Å
463	N	96.4	Very high	95.4	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.011	19%	0.194	C	C	.	.	H	α-helix	trans	-72.6	-34.7	176.6	-70	-19.2	0	0	0	112.1	M409 N412 F424 W459 L460 A461 A465 C466 L467	M409-N463 PolarHBondContact O-ND2 3.03Å; N412-N463 PolarHBondContact O-ND2 3.38Å; F424-N463 HydrophobicContact CE1-CB 3.92Å; F424-N463 WeakPolarHBondContact CE1-O 3.5Å; F424-N463 HydrophobicContact CZ-CB 3.65Å; F424-N463 WeakPolarHBondContact CZ-OD1 3.49Å; W459-N463 HydrophobicContact CE3-CB 4.24Å; L460-N463 HydrophobicContact CB-CB 4.35Å; L460-N463 WeakPolarHBondContact O-CA 3.33Å; L460-N463 WeakPolarHBondContact O-CB 3.5Å; L460-N463 PolarHBondContact O-N 3.07Å; A461-N463 VanDerWaalsContact C-N 3.35Å; N463-A465 VanDerWaalsContact C-N 3.32Å; N463-C466 PolarHBondContact O-N 3.16Å; N463-L467 PolarHBondContact O-N 3.27Å
464	V	97.2	Very high	95.3	Very high	18 Å²	18	38.7 Å²	38.7	11%	0.109	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-44.1	168.3	179.5	0	0	0	0	110.3	T453 W459 L460 A461 L467 L468	T453-V464 HydrophobicContact CG2-CB 4.38Å; T453-V464 HydrophobicContact CG2-CG1 4.14Å; T453-V464 HydrophobicContact CG2-CG2 3.82Å; W459-V464 HydrophobicContact CB-CG2 3.93Å; L460-V464 PolarHBondContact O-N 3.06Å; A461-V464 PolarHBondContact O-N 3.44Å; V464-L467 PolarHBondContact O-N 3.43Å; V464-L468 HydrophobicContact CG1-CD1 4.38Å; V464-L468 WeakPolarHBondContact O-CG 3.41Å; V464-L468 PolarHBondContact O-N 3.33Å
465	A	97.2	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-40.9	175.5	0	0	0	0	0	113	A461 E462 N463 L467 L468 H469 S498 L499 V502	A461-A465 WeakPolarHBondContact O-CB 3.32Å; A461-A465 PolarHBondContact O-N 3.41Å; E462-A465 CarbonylContact O-C 3.5Å; E462-A465 WeakPolarHBondContact O-CB 3.36Å; E462-A465 PolarHBondContact O-N 2.91Å; N463-A465 VanDerWaalsContact C-N 3.32Å; A465-L467 VanDerWaalsContact C-N 3.34Å; A465-L467 PolarHBondContact O-N 3.4Å; A465-L468 PolarHBondContact O-N 3.15Å; A465-H469 WeakPolarHBondContact O-CB 3.31Å; A465-H469 PolarHBondContact O-N 3.41Å; A465-S498 VanDerWaalsContact CB-C 3.47Å; A465-L499 HydrophobicContact CB-CB 4.38Å; A465-L499 HydrophobicContact CB-CD2 3.89Å; A465-L499 HydrophobicContact CB-CG 3.79Å; A465-L499 WeakPolarHBondContact O-CD2 3.35Å; A465-V502 HydrophobicContact CB-CG2 3.88Å
466	C	96.8	Very high	95.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-45.4	172.7	-71.4	0	0	0	0	111.6	L420 F424 E462 N463 H469 T470 V502	L420-C466 HydrophobicContact CD1-CB 4.12Å; L420-C466 VanDerWaalsContact CD1-SG 3.52Å; L420-C466 HydrophobicContact CG-CB 4.15Å; F424-C466 HydrophobicContact CB-CB 4.47Å; F424-C466 HydrophobicContact CD1-CB 3.8Å; F424-C466 HydrophobicContact CD2-CB 3.5Å; F424-C466 HydrophobicContact CE1-CB 3.76Å; F424-C466 HydrophobicContact CE2-CB 3.49Å; F424-C466 VanDerWaalsContact CE2-CB 3.49Å; F424-C466 HydrophobicContact CG-CB 3.66Å; F424-C466 HydrophobicContact CZ-CB 3.63Å; E462-C466 PolarHBondContact O-N 2.85Å; E462-C466 PolarHBondContact O-SG 2.97Å; N463-C466 PolarHBondContact O-N 3.16Å; C466-H469 PolarHBondContact O-N 3.4Å; C466-T470 PolarHBondContact O-N 2.89Å; C466-T470 PolarHBondContact O-OG1 3.38Å; C466-V502 VanDerWaalsContact SG-CG2 3.6Å
467	L	97.1	Very high	95.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-44.5	177.1	-177.4	60.8	0	0	0	112.2	F424 L427 L431 I452 T453 W459 N463 V464 A465 H469 T470 S471	F424-L467 HydrophobicContact CD1-CB 3.96Å; F424-L467 HydrophobicContact CE1-CB 4.48Å; L427-L467 HydrophobicContact CB-CD1 4.14Å; L427-L467 HydrophobicContact CD2-CD1 3.93Å; L427-L467 HydrophobicContact CG-CD1 3.84Å; L431-L467 HydrophobicContact CD1-CD1 3.9Å; L431-L467 HydrophobicContact CD1-CD2 4.29Å; L431-L467 HydrophobicContact CD1-CG 4.23Å; I452-L467 HydrophobicContact CG2-CD2 4.05Å; T453-L467 HydrophobicContact CG2-CD2 4.05Å; W459-L467 HydrophobicContact CH2-CD2 4.42Å; W459-L467 HydrophobicContact CZ3-CB 4.44Å; W459-L467 HydrophobicContact CZ3-CD2 4.03Å; N463-L467 PolarHBondContact O-N 3.27Å; V464-L467 PolarHBondContact O-N 3.43Å; A465-L467 VanDerWaalsContact C-N 3.34Å; A465-L467 PolarHBondContact O-N 3.4Å; L467-H469 VanDerWaalsContact C-N 3.33Å; L467-H469 PolarHBondContact O-N 3.26Å; L467-T470 PolarHBondContact O-N 3.46Å; L467-T470 PolarHBondContact O-OG1 2.86Å; L467-S471 WeakPolarHBondContact O-CB 3.38Å; L467-S471 PolarHBondContact O-N 3.31Å; L467-S471 PolarHBondContact O-OG 2.65Å
468	L	97.4	Very high	96	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.6	-38.7	177.2	-69.5	178.1	0	0	0	111.6	I449 V464 A465 S471 G472 I475 A476 T495 L499	I449-L468 HydrophobicContact CD1-CD2 4.44Å; I449-L468 HydrophobicContact CG2-CD2 4.3Å; V464-L468 HydrophobicContact CG1-CD1 4.38Å; V464-L468 WeakPolarHBondContact O-CG 3.41Å; V464-L468 PolarHBondContact O-N 3.33Å; A465-L468 PolarHBondContact O-N 3.15Å; L468-S471 PolarHBondContact O-N 3.33Å; L468-G472 PolarHBondContact O-N 2.97Å; L468-I475 HydrophobicContact CD2-CG2 4.4Å; L468-A476 HydrophobicContact CB-CB 4.29Å; L468-T495 HydrophobicContact CD1-CG2 3.62Å; L468-L499 HydrophobicContact CB-CD2 4.33Å
469	H	95.5	Very high	96	Very high	53 Å²	53	26 Å²	26	25%	0.245	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-49	175.6	177.4	54.4	0	0	0	112	A465 C466 L467 S471 G472 L499 V502 I506	A465-H469 WeakPolarHBondContact O-CB 3.31Å; A465-H469 PolarHBondContact O-N 3.41Å; C466-H469 PolarHBondContact O-N 3.4Å; L467-H469 VanDerWaalsContact C-N 3.33Å; L467-H469 PolarHBondContact O-N 3.26Å; H469-S471 VanDerWaalsContact C-N 3.26Å; H469-S471 PolarHBondContact O-N 3.26Å; H469-G472 PolarHBondContact O-N 3.47Å; H469-L499 HydrophobicContact CB-CD2 4.32Å; H469-V502 HydrophobicContact CB-CG1 4.42Å; H469-I506 WeakPolarHBondContact NE2-CD1 3.41Å
470	T	94.6	Very high	96	Very high	32 Å²	32	25.3 Å²	25.3	20%	0.196	15%	0.145	C	C	.	.	H	α-helix	trans	-71.9	-17.5	178.3	58.6	0	0	0	0	114	L420 F424 G428 C466 L467 G472	L420-T470 HydrophobicContact CD2-CG2 3.43Å; L420-T470 VanDerWaalsContact CD2-CG2 3.43Å; F424-T470 HydrophobicContact CB-CG2 3.8Å; F424-T470 WeakPolarHBondContact CB-OG1 3.32Å; F424-T470 PolarHBondContact O-OG1 2.8Å; G428-T470 CarbonylContact C-O 3.59Å; C466-T470 PolarHBondContact O-N 2.89Å; C466-T470 PolarHBondContact O-OG1 3.38Å; L467-T470 PolarHBondContact O-N 3.46Å; L467-T470 PolarHBondContact O-OG1 2.86Å; T470-G472 VanDerWaalsContact C-N 3.28Å
471	S	94.3	Very high	96.1	Very high	1 Å²	1	23 Å²	23	1%	0.007	13%	0.134	C	C	.	.	H	α-helix	trans	-77.3	-14.4	172.4	-56.4	0	0	0	0	113.4	G428 S432 L467 L468 H469 I475	G428-S471 WeakPolarHBondContact CA-OG 3.24Å; G428-S471 WeakPolarHBondContact O-CA 3.43Å; S432-S471 VanDerWaalsContact CB-O 3.24Å; S432-S471 WeakPolarHBondContact CB-O 3.37Å; S432-S471 PolarHBondContact OG-O 2.99Å; L467-S471 WeakPolarHBondContact O-CB 3.38Å; L467-S471 PolarHBondContact O-N 3.31Å; L467-S471 PolarHBondContact O-OG 2.65Å; L468-S471 PolarHBondContact O-N 3.33Å; H469-S471 VanDerWaalsContact C-N 3.26Å; H469-S471 PolarHBondContact O-N 3.26Å; S471-I475 WeakPolarHBondContact O-CG1 3.44Å
472	G	93.7	Very high	96.1	Very high	20 Å²	20	23.6 Å²	23.6	21%	0.206	13%	0.132	C	C	.	.			trans	92.5	164.2	179.9	0	0	0	0	0	114.3	L468 H469 T470 E474 I475 A476	L468-G472 PolarHBondContact O-N 2.97Å; H469-G472 PolarHBondContact O-N 3.47Å; T470-G472 VanDerWaalsContact C-N 3.28Å; G472-E474 VanDerWaalsContact C-N 3.31Å; G472-E474 PolarHBondContact O-N 3.45Å; G472-I475 PolarHBondContact O-N 3.5Å; G472-A476 PolarHBondContact O-N 3.02Å; G472-A476 VanDerWaalsContact O-N 3.15Å
473	P	94.1	Very high	96.1	Very high	74 Å²	74	23.2 Å²	23.2	48%	0.481	13%	0.13	S	C	.	.	H	α-helix	trans	-64.5	-30.6	-167.4	24.6	-34.9	0	0	0	113.8	L477	P473-L477 WeakPolarHBondContact O-CB 3.21Å; P473-L477 PolarHBondContact O-N 3.4Å
474	E	95.2	Very high	96.1	Very high	98 Å²	98	23.2 Å²	23.2	46%	0.458	13%	0.13	S	C	.	.	H	α-helix	trans	-67.1	-40.7	178	-60.8	-169.6	142.3	0	0	112.3	F435 H436 G472 L477 L478	F435-E474 HydrophobicContact CE1-CB 4.12Å; F435-E474 WeakPolarHBondContact CE1-OE2 3.41Å; H436-E474 IonicContact CE1-OE2 3.24Å; H436-E474 PolarHBondContact CE1-OE2 2.88Å; H436-E474 IonicContact NE2-OE2 2.66Å; H436-E474 PolarHBondContact NE2-OE2 2.97Å; G472-E474 VanDerWaalsContact C-N 3.31Å; G472-E474 PolarHBondContact O-N 3.45Å; E474-L477 PolarHBondContact O-N 3.01Å; E474-L478 VanDerWaalsContact O-CB 3.22Å; E474-L478 WeakPolarHBondContact O-CB 3.5Å; E474-L478 PolarHBondContact O-N 3.15Å
475	I	96.3	Very high	96	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-69.8	-42.3	177.1	-56.4	-53.5	0	0	0	110.7	F435 I445 I449 L468 S471 G472 L478 S479	F435-I475 HydrophobicContact CB-CD1 3.57Å; F435-I475 HydrophobicContact CD1-CD1 3.7Å; F435-I475 HydrophobicContact CD2-CD1 4.09Å; F435-I475 HydrophobicContact CE1-CD1 4.38Å; F435-I475 HydrophobicContact CG-CD1 3.52Å; I445-I475 HydrophobicContact CG2-CD1 4.12Å; I449-I475 HydrophobicContact CD1-CG2 3.41Å; I449-I475 VanDerWaalsContact CD1-CG2 3.41Å; L468-I475 HydrophobicContact CD2-CG2 4.4Å; S471-I475 WeakPolarHBondContact O-CG1 3.44Å; G472-I475 PolarHBondContact O-N 3.5Å; I475-L478 PolarHBondContact O-N 3.27Å; I475-S479 WeakPolarHBondContact O-CB 3.19Å; I475-S479 PolarHBondContact O-N 3.08Å
476	A	97.3	Very high	95.8	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-50	173.6	0	0	0	0	0	111.2	L468 G472 L478 S479 V480 L516	L468-A476 HydrophobicContact CB-CB 4.29Å; G472-A476 PolarHBondContact O-N 3.02Å; G472-A476 VanDerWaalsContact O-N 3.15Å; A476-L478 PolarHBondContact O-N 3.31Å; A476-S479 PolarHBondContact O-N 3.38Å; A476-V480 WeakPolarHBondContact O-CG2 3.47Å; A476-V480 PolarHBondContact O-N 2.82Å; A476-L516 HydrophobicContact CB-CD1 4.03Å; A476-L516 HydrophobicContact CB-CD2 4.3Å
477	L	97.4	Very high	95.7	Very high	69 Å²	69	32.1 Å²	32.1	36%	0.361	18%	0.181	S	C	.	.	H	α-helix	trans	-58.6	-44.9	177.1	178.3	66.1	0	0	0	112.2	P473 E474 T481 L516 A519	P473-L477 WeakPolarHBondContact O-CB 3.21Å; P473-L477 PolarHBondContact O-N 3.4Å; E474-L477 PolarHBondContact O-N 3.01Å; L477-T481 HydrophobicContact CD1-CG2 3.7Å; L477-T481 HydrophobicContact CG-CG2 4.39Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 VanDerWaalsContact O-CG2 3.26Å; L477-T481 WeakPolarHBondContact O-CG2 3.48Å; L477-T481 PolarHBondContact O-N 2.89Å; L477-T481 PolarHBondContact O-OG1 3.2Å; L477-L516 HydrophobicContact CB-CD2 3.62Å; L477-L516 HydrophobicContact CD1-CD2 3.98Å; L477-L516 HydrophobicContact CG-CD2 4.42Å; L477-A519 HydrophobicContact CD1-CB 3.49Å; L477-A519 VanDerWaalsContact CD1-CB 3.49Å
478	L	96.6	Very high	95.5	Very high	29 Å²	29	36.3 Å²	36.3	15%	0.152	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-49.2	178.7	174.8	59	0	0	0	111.2	F435 I446 E474 I475 A476 N482	F435-L478 HydrophobicContact CD2-CD2 4.43Å; F435-L478 HydrophobicContact CE2-CD2 4.01Å; I446-L478 HydrophobicContact CD1-CD1 3.62Å; I446-L478 HydrophobicContact CD1-CD2 4.29Å; I446-L478 HydrophobicContact CD1-CG 3.71Å; I446-L478 HydrophobicContact CG1-CD1 4.3Å; I446-L478 HydrophobicContact CG1-CD2 4.14Å; I446-L478 HydrophobicContact CG1-CG 3.81Å; E474-L478 VanDerWaalsContact O-CB 3.22Å; E474-L478 WeakPolarHBondContact O-CB 3.5Å; E474-L478 PolarHBondContact O-N 3.15Å; I475-L478 PolarHBondContact O-N 3.27Å; A476-L478 PolarHBondContact O-N 3.31Å; L478-N482 VanDerWaalsContact O-CB 3.29Å; L478-N482 WeakPolarHBondContact O-CB 3.38Å; L478-N482 PolarHBondContact O-N 3.27Å
479	S	96.3	Very high	95.4	Very high	3 Å²	3	37 Å²	37	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-52.5	-179.6	-171.4	0	0	0	0	112.3	I475 A476 T481 N482 K483	I475-S479 WeakPolarHBondContact O-CB 3.19Å; I475-S479 PolarHBondContact O-N 3.08Å; A476-S479 PolarHBondContact O-N 3.38Å; S479-T481 PolarHBondContact O-N 3.38Å; S479-N482 PolarHBondContact O-N 3.15Å; S479-K483 PolarHBondContact O-N 2.93Å; S479-K483 VanDerWaalsContact O-N 3.09Å
480	V	97	Very high	95.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-40.5	-176.9	-58.6	0	0	0	0	112.4	A476 K483 A484 V492 T495 L496 L516 T520	A476-V480 WeakPolarHBondContact O-CG2 3.47Å; A476-V480 PolarHBondContact O-N 2.82Å; V480-K483 PolarHBondContact O-N 3.02Å; V480-A484 VanDerWaalsContact O-CB 3.32Å; V480-A484 WeakPolarHBondContact O-CB 3.28Å; V480-A484 PolarHBondContact O-N 3.25Å; V480-V492 HydrophobicContact CB-CG1 4.13Å; V480-T495 HydrophobicContact CG1-CG2 4.14Å; V480-L496 HydrophobicContact CG1-CD2 4.21Å; V480-L516 HydrophobicContact CG2-CD2 4.24Å; V480-T520 VanDerWaalsContact CG2-OG1 3.29Å; V480-T520 WeakPolarHBondContact CG2-OG1 3.38Å
481	T	97.1	Very high	95.4	Very high	10 Å²	10	39.3 Å²	39.3	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-72.4	-30.9	179.7	63.4	0	0	0	0	112.5	L477 S479 R485 A519 A523	L477-T481 HydrophobicContact CD1-CG2 3.7Å; L477-T481 HydrophobicContact CG-CG2 4.39Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 VanDerWaalsContact O-CG2 3.26Å; L477-T481 WeakPolarHBondContact O-CG2 3.48Å; L477-T481 PolarHBondContact O-N 2.89Å; L477-T481 PolarHBondContact O-OG1 3.2Å; S479-T481 PolarHBondContact O-N 3.38Å; T481-R485 VanDerWaalsContact O-CG 3.29Å; T481-R485 WeakPolarHBondContact O-CG 3.47Å; T481-R485 PolarHBondContact O-N 3.46Å; T481-R485 PolarHBondContact OG1-NH1 3.27Å; T481-A519 HydrophobicContact CG2-CB 4.27Å; T481-A523 HydrophobicContact CG2-CB 4.07Å
482	N	95.8	Very high	95.5	Very high	49 Å²	49	39.3 Å²	39.3	26%	0.262	22%	0.221	S	C	.	.	H	α-helix	trans	-67.2	-49.5	172.8	-174	53.1	0	0	0	111.7	I446 L478 S479 A484 R485 S486	I446-N482 HydrophobicContact CD1-CB 3.6Å; L478-N482 VanDerWaalsContact O-CB 3.29Å; L478-N482 WeakPolarHBondContact O-CB 3.38Å; L478-N482 PolarHBondContact O-N 3.27Å; S479-N482 PolarHBondContact O-N 3.15Å; N482-A484 VanDerWaalsContact C-N 3.26Å; N482-A484 PolarHBondContact O-N 2.94Å; N482-R485 PolarHBondContact O-N 2.85Å; N482-S486 PolarHBondContact O-N 3.03Å
483	K	95.1	Very high	95.7	Very high	21 Å²	21	38.4 Å²	38.4	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-58.8	-39	176.2	-70.1	-173.8	-174.6	-168.5	0	111.2	D450 S479 V480 S486 G487 K488 V492	D450-K483 WeakPolarHBondContact OD1-CE 3.48Å; D450-K483 IonicContact OD1-NZ 3.84Å; D450-K483 PolarHBondContact OD1-NZ 3.39Å; S479-K483 PolarHBondContact O-N 2.93Å; S479-K483 VanDerWaalsContact O-N 3.09Å; V480-K483 PolarHBondContact O-N 3.02Å; K483-S486 PolarHBondContact O-N 2.99Å; K483-S486 PolarHBondContact O-OG 2.93Å; K483-G487 PolarHBondContact O-N 3.43Å; K483-K488 HydrophobicContact CB-CB 4.39Å; K483-K488 HydrophobicContact CG-CD 4.43Å; K483-K488 PolarHBondContact O-N 3.39Å; K483-K488 VanDerWaalsContact O-N 3.13Å; K483-V492 HydrophobicContact CB-CG2 3.32Å
484	A	96.1	Very high	95.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-47.9	173.7	0	0	0	0	0	113.6	V480 N482 S486 G487 T520 A523	V480-A484 VanDerWaalsContact O-CB 3.32Å; V480-A484 WeakPolarHBondContact O-CB 3.28Å; V480-A484 PolarHBondContact O-N 3.25Å; N482-A484 VanDerWaalsContact C-N 3.26Å; N482-A484 PolarHBondContact O-N 2.94Å; A484-S486 VanDerWaalsContact C-N 3.28Å; A484-S486 PolarHBondContact O-N 3.05Å; A484-G487 PolarHBondContact O-N 2.98Å; A484-T520 HydrophobicContact CB-CG2 3.89Å; A484-A523 HydrophobicContact CB-CB 4.44Å
485	R	94.9	Very high	95.9	Very high	111 Å²	111	33.6 Å²	33.6	42%	0.419	19%	0.187	S	C	.	.	H	α-helix	trans	-60	-37.6	176.3	-72.6	174.9	-167.7	108.3	4.5	112.2	T481 N482 G487 A523 K525	T481-R485 VanDerWaalsContact O-CG 3.29Å; T481-R485 WeakPolarHBondContact O-CG 3.47Å; T481-R485 PolarHBondContact O-N 3.46Å; T481-R485 PolarHBondContact OG1-NH1 3.27Å; N482-R485 PolarHBondContact O-N 2.85Å; R485-G487 PolarHBondContact O-N 3.21Å; R485-A523 HydrophobicContact CG-CB 4.22Å; R485-K525 WeakPolarHBondContact O-CE 3.49Å; R485-K525 PolarHBondContact O-NZ 3.47Å
486	S	93.7	Very high	95.9	Very high	63 Å²	63	33.6 Å²	33.6	44%	0.441	19%	0.187	S	C	.	.	H	α-helix	trans	-65.3	-24.1	176.5	79.9	0	0	0	0	113.1	N482 K483 A484 K488	N482-S486 PolarHBondContact O-N 3.03Å; K483-S486 PolarHBondContact O-N 2.99Å; K483-S486 PolarHBondContact O-OG 2.93Å; A484-S486 VanDerWaalsContact C-N 3.28Å; A484-S486 PolarHBondContact O-N 3.05Å; S486-K488 WeakPolarHBondContact OG-CD 3.48Å; S486-K488 WeakPolarHBondContact OG-CG 3.27Å
487	G	93.5	Very high	95.9	Very high	33 Å²	33	33.4 Å²	33.4	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.8	9.1	-177.1	0	0	0	0	0	114.4	K483 A484 R485 T489	K483-G487 PolarHBondContact O-N 3.43Å; A484-G487 PolarHBondContact O-N 2.98Å; R485-G487 PolarHBondContact O-N 3.21Å; G487-T489 PolarHBondContact O-N 3.32Å
488	K	94.4	Very high	95.9	Very high	88 Å²	88	30.4 Å²	30.4	38%	0.383	17%	0.17	S	C	.	.			trans	-77.1	49	175.9	-70.5	167	155.4	-94.3	0	112	K483 S486 A490 E491 V492	K483-K488 HydrophobicContact CB-CB 4.39Å; K483-K488 HydrophobicContact CG-CD 4.43Å; K483-K488 PolarHBondContact O-N 3.39Å; K483-K488 VanDerWaalsContact O-N 3.13Å; S486-K488 WeakPolarHBondContact OG-CD 3.48Å; S486-K488 WeakPolarHBondContact OG-CG 3.27Å; K488-A490 VanDerWaalsContact C-N 3.25Å; K488-A490 PolarHBondContact O-N 2.88Å; K488-E491 HydrophobicContact CB-CB 4.27Å; K488-E491 HydrophobicContact CB-CG 4.37Å; K488-E491 WeakPolarHBondContact CD-OE2 3.44Å; K488-E491 WeakPolarHBondContact CG-OE1 3.35Å; K488-E491 IonicContact NZ-OE1 2.72Å; K488-E491 PolarHBondContact NZ-OE1 3.18Å; K488-E491 IonicContact NZ-OE2 3.09Å; K488-E491 PolarHBondContact NZ-OE2 3.46Å; K488-E491 PolarHBondContact O-N 2.75Å; K488-V492 WeakPolarHBondContact O-CG2 3.37Å; K488-V492 PolarHBondContact O-N 3.32Å
489	T	93.9	Very high	95.9	Very high	15 Å²	15	29.1 Å²	29.1	9%	0.092	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-33.4	-169.9	53.8	0	0	0	0	113.4	G487 V492 A493 T524 D528 F532 Q535	G487-T489 PolarHBondContact O-N 3.32Å; T489-V492 PolarHBondContact O-N 2.92Å; T489-A493 WeakPolarHBondContact O-CB 3.16Å; T489-A493 PolarHBondContact O-N 3.31Å; T489-T524 HydrophobicContact CG2-CG2 3.95Å; T489-D528 HydrophobicContact CG2-CB 4.41Å; T489-F532 HydrophobicContact CG2-CB 4.08Å; T489-Q535 PolarHBondContact OG1-OE1 3.05Å
490	A	95.4	Very high	95.9	Very high	52 Å²	52	29 Å²	29	43%	0.43	16%	0.163	S	C	.	.	H	α-helix	trans	-70	-43.7	178.2	0	0	0	0	0	112.8	K488 V492 A493 V494	K488-A490 VanDerWaalsContact C-N 3.25Å; K488-A490 PolarHBondContact O-N 2.88Å; A490-V492 PolarHBondContact O-N 3.41Å; A490-A493 WeakPolarHBondContact O-CB 3.38Å; A490-A493 PolarHBondContact O-N 3.42Å; A490-V494 WeakPolarHBondContact O-CG2 3.36Å; A490-V494 PolarHBondContact O-N 2.95Å
491	E	95.2	Very high	95.7	Very high	83 Å²	83	29.4 Å²	29.4	39%	0.388	17%	0.165	S	C	.	.	H	α-helix	trans	-60.7	-37.4	174.4	-65.5	173.2	-140.9	0	0	111.3	K488 T495	K488-E491 HydrophobicContact CB-CB 4.27Å; K488-E491 HydrophobicContact CB-CG 4.37Å; K488-E491 WeakPolarHBondContact CD-OE2 3.44Å; K488-E491 WeakPolarHBondContact CG-OE1 3.35Å; K488-E491 IonicContact NZ-OE1 2.72Å; K488-E491 PolarHBondContact NZ-OE1 3.18Å; K488-E491 IonicContact NZ-OE2 3.09Å; K488-E491 PolarHBondContact NZ-OE2 3.46Å; K488-E491 PolarHBondContact O-N 2.75Å; E491-T495 WeakPolarHBondContact O-CB 3.22Å; E491-T495 PolarHBondContact O-N 3.01Å; E491-T495 PolarHBondContact O-OG1 2.84Å
492	V	96.4	Very high	95.6	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-70.7	-41	178.1	-178.2	0	0	0	0	111.7	V480 K483 K488 T489 A490 V494 T495 L496 T520 F532	V480-V492 HydrophobicContact CB-CG1 4.13Å; K483-V492 HydrophobicContact CB-CG2 3.32Å; K488-V492 WeakPolarHBondContact O-CG2 3.37Å; K488-V492 PolarHBondContact O-N 3.32Å; T489-V492 PolarHBondContact O-N 2.92Å; A490-V492 PolarHBondContact O-N 3.41Å; V492-V494 PolarHBondContact O-N 3.47Å; V492-T495 PolarHBondContact O-N 2.97Å; V492-L496 HydrophobicContact CG1-CD1 3.78Å; V492-L496 HydrophobicContact CG1-CG 4.23Å; V492-L496 WeakPolarHBondContact O-CB 3.49Å; V492-L496 WeakPolarHBondContact O-CG 3.26Å; V492-L496 PolarHBondContact O-N 3.26Å; V492-T520 HydrophobicContact CG1-CG2 3.47Å; V492-T520 VanDerWaalsContact CG1-CG2 3.47Å; V492-F532 HydrophobicContact CB-CE2 4.48Å; V492-F532 HydrophobicContact CG1-CE2 4.07Å
493	A	97.1	Very high	95.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.4	-49.3	173	0	0	0	0	0	111.5	T489 A490 T495 L496 T497 Q535 L536	T489-A493 WeakPolarHBondContact O-CB 3.16Å; T489-A493 PolarHBondContact O-N 3.31Å; A490-A493 WeakPolarHBondContact O-CB 3.38Å; A490-A493 PolarHBondContact O-N 3.42Å; A493-T495 VanDerWaalsContact C-N 3.34Å; A493-T495 PolarHBondContact O-N 3.12Å; A493-L496 PolarHBondContact O-N 3.14Å; A493-T497 WeakPolarHBondContact O-CB 3.47Å; A493-T497 PolarHBondContact O-N 3.18Å; A493-T497 PolarHBondContact O-OG1 2.8Å; A493-Q535 HydrophobicContact CB-CB 3.88Å; A493-L536 HydrophobicContact CB-CB 4.34Å; A493-L536 HydrophobicContact CB-CD1 4.48Å
494	V	97	Very high	95.5	Very high	58 Å²	58	26.5 Å²	26.5	35%	0.352	15%	0.15	S	C	.	.	H	α-helix	trans	-60	-41.8	175.6	172.3	0	0	0	0	112.1	A461 A490 V492 S498 S539	A461-V494 HydrophobicContact CB-CG1 3.59Å; A490-V494 WeakPolarHBondContact O-CG2 3.36Å; A490-V494 PolarHBondContact O-N 2.95Å; V492-V494 PolarHBondContact O-N 3.47Å; V494-S498 VanDerWaalsContact O-CB 3.27Å; V494-S498 WeakPolarHBondContact O-CB 3.3Å; V494-S498 PolarHBondContact O-N 3.44Å; V494-S498 PolarHBondContact O-OG 2.9Å; V494-S539 WeakPolarHBondContact CA-OG 3.31Å
495	T	96.9	Very high	95.2	Very high	14 Å²	14	28.5 Å²	28.5	9%	0.086	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-43.3	177.6	-55.1	0	0	0	0	112	L468 V480 E491 V492 A493 S498 L499	L468-T495 HydrophobicContact CD1-CG2 3.62Å; V480-T495 HydrophobicContact CG1-CG2 4.14Å; E491-T495 WeakPolarHBondContact O-CB 3.22Å; E491-T495 PolarHBondContact O-N 3.01Å; E491-T495 PolarHBondContact O-OG1 2.84Å; V492-T495 PolarHBondContact O-N 2.97Å; A493-T495 VanDerWaalsContact C-N 3.34Å; A493-T495 PolarHBondContact O-N 3.12Å; T495-S498 PolarHBondContact O-N 3.03Å; T495-L499 HydrophobicContact CG2-CD1 4.25Å; T495-L499 WeakPolarHBondContact O-CG 3.25Å; T495-L499 PolarHBondContact O-N 3.36Å
496	L	97.4	Very high	95	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-71.7	-39.7	-179.5	-71.5	169.1	0	0	0	112.4	V480 V492 A493 S498 L499 C500 L513 L516 V517 T520 F532 L536	V480-L496 HydrophobicContact CG1-CD2 4.21Å; V492-L496 HydrophobicContact CG1-CD1 3.78Å; V492-L496 HydrophobicContact CG1-CG 4.23Å; V492-L496 WeakPolarHBondContact O-CB 3.49Å; V492-L496 WeakPolarHBondContact O-CG 3.26Å; V492-L496 PolarHBondContact O-N 3.26Å; A493-L496 PolarHBondContact O-N 3.14Å; L496-S498 VanDerWaalsContact C-N 3.32Å; L496-L499 HydrophobicContact CD2-CD1 4.4Å; L496-L499 PolarHBondContact O-N 2.74Å; L496-C500 PolarHBondContact O-N 3.41Å; L496-L513 HydrophobicContact CD2-CD1 3.84Å; L496-L516 HydrophobicContact CD2-CB 4.14Å; L496-V517 HydrophobicContact CD1-CG2 4.17Å; L496-V517 HydrophobicContact CD2-CG2 4.27Å; L496-T520 HydrophobicContact CD1-CG2 4.08Å; L496-F532 HydrophobicContact CD1-CE2 4.02Å; L496-F532 HydrophobicContact CD1-CZ 3.73Å; L496-L536 HydrophobicContact CB-CD1 3.95Å
497	T	96.9	Very high	94.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.8	-45.8	170.6	-59.4	0	0	0	0	110.7	A493 L499 C500 L501 S539 F540	A493-T497 WeakPolarHBondContact O-CB 3.47Å; A493-T497 PolarHBondContact O-N 3.18Å; A493-T497 PolarHBondContact O-OG1 2.8Å; T497-L499 PolarHBondContact O-N 3.19Å; T497-C500 WeakPolarHBondContact O-CA 3.4Å; T497-C500 VanDerWaalsContact O-CB 3.25Å; T497-C500 WeakPolarHBondContact O-CB 3.43Å; T497-C500 PolarHBondContact O-N 3.04Å; T497-C500 VanDerWaalsContact O-N 3.09Å; T497-L501 WeakPolarHBondContact O-CG 3.26Å; T497-L501 PolarHBondContact O-N 2.88Å; T497-S539 VanDerWaalsContact CB-OG 3.26Å; T497-S539 WeakPolarHBondContact CB-OG 3.27Å; T497-S539 WeakPolarHBondContact OG1-CB 3.39Å; T497-S539 PolarHBondContact OG1-OG 2.95Å; T497-F540 HydrophobicContact CG2-CD1 3.81Å; T497-F540 HydrophobicContact CG2-CD2 4.02Å; T497-F540 HydrophobicContact CG2-CE1 3.93Å; T497-F540 HydrophobicContact CG2-CE2 4.13Å; T497-F540 HydrophobicContact CG2-CG 3.87Å; T497-F540 HydrophobicContact CG2-CZ 4.09Å
498	S	96.3	Very high	94.7	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-64.1	-40	177.8	-60	0	0	0	0	112.6	A461 A465 V494 T495 L496 C500 L501 V502	A461-S498 VanDerWaalsContact CB-OG 3.27Å; A461-S498 WeakPolarHBondContact CB-OG 3.35Å; A461-S498 WeakPolarHBondContact O-CB 3.43Å; A465-S498 VanDerWaalsContact CB-C 3.47Å; V494-S498 VanDerWaalsContact O-CB 3.27Å; V494-S498 WeakPolarHBondContact O-CB 3.3Å; V494-S498 PolarHBondContact O-N 3.44Å; V494-S498 PolarHBondContact O-OG 2.9Å; T495-S498 PolarHBondContact O-N 3.03Å; L496-S498 VanDerWaalsContact C-N 3.32Å; S498-C500 VanDerWaalsContact C-N 3.27Å; S498-C500 PolarHBondContact O-N 3.09Å; S498-L501 PolarHBondContact O-N 3.49Å; S498-V502 WeakPolarHBondContact O-CG2 3.46Å; S498-V502 PolarHBondContact O-N 2.99Å
499	L	96.7	Very high	94.6	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-34.2	171.8	-78.5	165	0	0	0	112.2	A465 L468 H469 T495 L496 T497 Q503 L513 L516	A465-L499 HydrophobicContact CB-CB 4.38Å; A465-L499 HydrophobicContact CB-CD2 3.89Å; A465-L499 HydrophobicContact CB-CG 3.79Å; A465-L499 WeakPolarHBondContact O-CD2 3.35Å; L468-L499 HydrophobicContact CB-CD2 4.33Å; H469-L499 HydrophobicContact CB-CD2 4.32Å; T495-L499 HydrophobicContact CG2-CD1 4.25Å; T495-L499 WeakPolarHBondContact O-CG 3.25Å; T495-L499 PolarHBondContact O-N 3.36Å; L496-L499 HydrophobicContact CD2-CD1 4.4Å; L496-L499 PolarHBondContact O-N 2.74Å; T497-L499 PolarHBondContact O-N 3.19Å; L499-Q503 WeakPolarHBondContact O-CB 3.21Å; L499-Q503 WeakPolarHBondContact O-CG 3.45Å; L499-Q503 PolarHBondContact O-N 3.43Å; L499-L513 HydrophobicContact CB-CD1 3.86Å; L499-L516 HydrophobicContact CD1-CD1 4.41Å
500	C	96.6	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-47.9	172.8	-164.4	0	0	0	0	112.1	L496 T497 S498 V502 Q503 V504 L513 F540	L496-C500 PolarHBondContact O-N 3.41Å; T497-C500 WeakPolarHBondContact O-CA 3.4Å; T497-C500 VanDerWaalsContact O-CB 3.25Å; T497-C500 WeakPolarHBondContact O-CB 3.43Å; T497-C500 PolarHBondContact O-N 3.04Å; T497-C500 VanDerWaalsContact O-N 3.09Å; S498-C500 VanDerWaalsContact C-N 3.27Å; S498-C500 PolarHBondContact O-N 3.09Å; C500-V502 VanDerWaalsContact C-N 3.33Å; C500-V502 PolarHBondContact O-N 3.38Å; C500-Q503 PolarHBondContact O-N 2.87Å; C500-V504 WeakPolarHBondContact O-CG2 3.14Å; C500-V504 PolarHBondContact O-N 3.41Å; C500-L513 HydrophobicContact CB-CD2 3.51Å; C500-F540 HydrophobicContact CB-CE1 4.47Å; C500-F540 HydrophobicContact CB-CZ 3.92Å
501	L	94.3	Very high	94.4	Very high	10 Å²	10	39 Å²	39	5%	0.052	19%	0.189	C	C	.	.	H	α-helix	trans	-57	-47.6	177.2	-66.6	169.5	0	0	0	111.1	T497 S498 V504 K505 V543 I563 A566	T497-L501 WeakPolarHBondContact O-CG 3.26Å; T497-L501 PolarHBondContact O-N 2.88Å; S498-L501 PolarHBondContact O-N 3.49Å; L501-V504 PolarHBondContact O-N 2.97Å; L501-K505 WeakPolarHBondContact O-CB 3.47Å; L501-K505 PolarHBondContact O-N 3.17Å; L501-V543 HydrophobicContact CD1-CG1 4.15Å; L501-I563 HydrophobicContact CD2-CB 4.05Å; L501-I563 HydrophobicContact CD2-CG1 3.6Å; L501-I563 HydrophobicContact CD2-CG2 4.29Å; L501-A566 HydrophobicContact CD2-CB 3.74Å
502	V	94.6	Very high	94.3	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-50.9	175.3	170.4	0	0	0	0	111.4	L420 E462 A465 C466 H469 S498 C500 V504 K505 I506	L420-V502 HydrophobicContact CD1-CG1 3.52Å; E462-V502 HydrophobicContact CG-CG2 3.59Å; A465-V502 HydrophobicContact CB-CG2 3.88Å; C466-V502 VanDerWaalsContact SG-CG2 3.6Å; H469-V502 HydrophobicContact CB-CG1 4.42Å; S498-V502 WeakPolarHBondContact O-CG2 3.46Å; S498-V502 PolarHBondContact O-N 2.99Å; C500-V502 VanDerWaalsContact C-N 3.33Å; C500-V502 PolarHBondContact O-N 3.38Å; V502-V504 VanDerWaalsContact C-N 3.33Å; V502-V504 PolarHBondContact O-N 3.07Å; V502-K505 PolarHBondContact O-N 3.49Å; V502-I506 HydrophobicContact CG1-CD1 4.36Å; V502-I506 WeakPolarHBondContact O-CG1 3.37Å; V502-I506 PolarHBondContact O-N 2.95Å
503	Q	94.3	Very high	94.2	Very high	7 Å²	7	40.1 Å²	40.1	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-39.3	-178.5	-76.1	-177	0.6	0	0	112.6	L499 C500 R507 A508 L510 L513	L499-Q503 WeakPolarHBondContact O-CB 3.21Å; L499-Q503 WeakPolarHBondContact O-CG 3.45Å; L499-Q503 PolarHBondContact O-N 3.43Å; C500-Q503 PolarHBondContact O-N 2.87Å; Q503-R507 CarbonylContact O-C 3.57Å; Q503-R507 PolarHBondContact O-N 2.83Å; Q503-A508 HydrophobicContact CB-CB 4.17Å; Q503-A508 HydrophobicContact CG-CB 4.24Å; Q503-A508 PolarHBondContact O-N 3.48Å; Q503-L510 HydrophobicContact CB-CD2 3.75Å; Q503-L510 VanDerWaalsContact OE1-CD2 3.26Å; Q503-L513 VanDerWaalsContact OE1-CB 3.27Å
504	V	93.3	Very high	94.2	Very high	10 Å²	10	40.4 Å²	40.4	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-72.8	-40.2	178.5	173.2	0	0	0	0	111.4	C500 L501 V502 I506 R507 L510 T562 R565 A566	C500-V504 WeakPolarHBondContact O-CG2 3.14Å; C500-V504 PolarHBondContact O-N 3.41Å; L501-V504 PolarHBondContact O-N 2.97Å; V502-V504 VanDerWaalsContact C-N 3.33Å; V502-V504 PolarHBondContact O-N 3.07Å; V504-I506 VanDerWaalsContact C-N 3.32Å; V504-I506 PolarHBondContact O-N 3.43Å; V504-R507 PolarHBondContact O-N 3.39Å; V504-R507 VanDerWaalsContact O-N 3.11Å; V504-L510 HydrophobicContact CG2-CD2 4.13Å; V504-T562 HydrophobicContact CG1-CG2 4.48Å; V504-R565 HydrophobicContact CG1-CB 4.33Å; V504-R565 HydrophobicContact CG1-CG 3.97Å; V504-A566 HydrophobicContact CB-CB 4.11Å; V504-A566 HydrophobicContact CG1-CB 4.32Å; V504-A566 HydrophobicContact CG2-CB 3.95Å
505	K	90.4	Very high	94	Very high	43 Å²	43	41.6 Å²	41.6	19%	0.187	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-41.8	174.9	-176.2	178.8	-77.4	-177.4	0	111.8	A414 E462 L501 V502	A414-K505 VanDerWaalsContact O-CD 3.28Å; A414-K505 WeakPolarHBondContact O-CD 3.25Å; A414-K505 PolarHBondContact O-NZ 3.46Å; E462-K505 VanDerWaalsContact CD-NZ 3.28Å; E462-K505 IonicContact OE1-NZ 3.03Å; E462-K505 PolarHBondContact OE1-NZ 3.15Å; E462-K505 IonicContact OE2-NZ 3.69Å; E462-K505 PolarHBondContact OE2-NZ 3.27Å; E462-K505 VanDerWaalsContact OE2-NZ 3.09Å; L501-K505 WeakPolarHBondContact O-CB 3.47Å; L501-K505 PolarHBondContact O-N 3.17Å; V502-K505 PolarHBondContact O-N 3.49Å
506	I	90.7	Very high	94	Very high	31 Å²	31	41.6 Å²	41.6	16%	0.159	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.3	176.3	74.3	-171.9	0	0	0	114.6	L420 H469 V502 V504 A508	L420-I506 HydrophobicContact CD1-CG2 4Å; H469-I506 WeakPolarHBondContact NE2-CD1 3.41Å; V502-I506 HydrophobicContact CG1-CD1 4.36Å; V502-I506 WeakPolarHBondContact O-CG1 3.37Å; V502-I506 PolarHBondContact O-N 2.95Å; V504-I506 VanDerWaalsContact C-N 3.32Å; V504-I506 PolarHBondContact O-N 3.43Å; I506-A508 VanDerWaalsContact C-N 3.32Å; I506-A508 HydrophobicContact CD1-CB 4.1Å; I506-A508 HydrophobicContact CG1-CB 3.84Å; I506-A508 PolarHBondContact O-N 3Å
507	R	91	Very high	93.9	Very high	232 Å²	232	41.8 Å²	41.8	88%	0.875	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	32.8	-178.6	-50	178.2	-177	173.3	1.1	114.6	Q503 V504	Q503-R507 CarbonylContact O-C 3.57Å; Q503-R507 PolarHBondContact O-N 2.83Å; V504-R507 PolarHBondContact O-N 3.39Å; V504-R507 VanDerWaalsContact O-N 3.11Å
508	A	90.8	Very high	93.9	Very high	37 Å²	37	42.8 Å²	42.8	31%	0.306	21%	0.208	S	C	.	.			trans	-77	161.9	172	0	0	0	0	0	112.3	Q503 I506	Q503-A508 HydrophobicContact CB-CB 4.17Å; Q503-A508 HydrophobicContact CG-CB 4.24Å; Q503-A508 PolarHBondContact O-N 3.48Å; I506-A508 VanDerWaalsContact C-N 3.32Å; I506-A508 HydrophobicContact CD1-CB 4.1Å; I506-A508 HydrophobicContact CG1-CB 3.84Å; I506-A508 PolarHBondContact O-N 3Å
509	K	91.8	Very high	93.9	Very high	177 Å²	177	43.8 Å²	43.8	77%	0.77	22%	0.217	S	C	*	.			trans	-80	133.3	175.8	-64.9	178.9	-178.2	175.3	0	110.7	T511	K509-T511 PolarHBondContact O-N 2.88Å; K509-T511 VanDerWaalsContact O-N 3.17Å
510	L	93.8	Very high	93.9	Very high	15 Å²	15	43.7 Å²	43.7	8%	0.079	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.4	178.7	-58.6	-172.4	0	0	0	115.2	Q503 V504 E512 L513 I514 E569 A573	Q503-L510 HydrophobicContact CB-CD2 3.75Å; Q503-L510 VanDerWaalsContact OE1-CD2 3.26Å; V504-L510 HydrophobicContact CG2-CD2 4.13Å; L510-E512 VanDerWaalsContact C-N 3.31Å; L510-E512 PolarHBondContact O-N 3.38Å; L510-L513 HydrophobicContact CD2-CD2 4.27Å; L510-L513 WeakPolarHBondContact O-CB 3.43Å; L510-L513 PolarHBondContact O-N 3.14Å; L510-I514 WeakPolarHBondContact O-CG1 3.32Å; L510-I514 PolarHBondContact O-N 3.34Å; L510-E569 HydrophobicContact CD1-CB 3.74Å; L510-A573 HydrophobicContact CB-CB 4.21Å; L510-A573 HydrophobicContact CD1-CB 4.3Å
511	T	92.1	Very high	93.9	Very high	92 Å²	92	47 Å²	47	56%	0.564	23%	0.23	S	C	*	.	H	α-helix	trans	-55.2	-43.2	-175.8	-50.1	0	0	0	0	112.8	K509 I514 N515	K509-T511 PolarHBondContact O-N 2.88Å; K509-T511 VanDerWaalsContact O-N 3.17Å; T511-I514 PolarHBondContact O-N 2.98Å; T511-N515 PolarHBondContact O-N 3.04Å; T511-N515 VanDerWaalsContact O-N 3.15Å; T511-N515 PolarHBondContact O-ND2 3.45Å
512	E	91.7	Very high	93.9	Very high	106 Å²	106	51.9 Å²	51.9	50%	0.495	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-37	177.3	-66.8	-179.6	-175.4	0	0	112	L510 N515 L516	L510-E512 VanDerWaalsContact C-N 3.31Å; L510-E512 PolarHBondContact O-N 3.38Å; E512-N515 WeakPolarHBondContact O-CB 3.33Å; E512-N515 PolarHBondContact O-N 3.22Å; E512-L516 WeakPolarHBondContact O-CG 3.39Å; E512-L516 PolarHBondContact O-N 2.86Å
513	L	95.8	Very high	94	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-40.1	176	177.9	65.5	0	0	0	112.2	L496 L499 C500 Q503 L510 N515 L516 V517 F570	L496-L513 HydrophobicContact CD2-CD1 3.84Å; L499-L513 HydrophobicContact CB-CD1 3.86Å; C500-L513 HydrophobicContact CB-CD2 3.51Å; Q503-L513 VanDerWaalsContact OE1-CB 3.27Å; L510-L513 HydrophobicContact CD2-CD2 4.27Å; L510-L513 WeakPolarHBondContact O-CB 3.43Å; L510-L513 PolarHBondContact O-N 3.14Å; L513-N515 VanDerWaalsContact C-N 3.3Å; L513-N515 PolarHBondContact O-N 3.17Å; L513-L516 WeakPolarHBondContact O-CB 3.25Å; L513-L516 PolarHBondContact O-N 3.27Å; L513-L516 VanDerWaalsContact O-N 3.15Å; L513-V517 WeakPolarHBondContact O-CG2 3.44Å; L513-V517 PolarHBondContact O-N 2.79Å; L513-F570 HydrophobicContact CD2-CD2 4.11Å; L513-F570 HydrophobicContact CD2-CE2 4.3Å
514	I	95.5	Very high	94.1	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-38.5	175.8	-60.7	-55.9	0	0	0	110.9	L510 T511 L516 V517 S518 F570 A573 L574 Y577	L510-I514 WeakPolarHBondContact O-CG1 3.32Å; L510-I514 PolarHBondContact O-N 3.34Å; T511-I514 PolarHBondContact O-N 2.98Å; I514-L516 VanDerWaalsContact C-N 3.34Å; I514-L516 PolarHBondContact O-N 2.59Å; I514-V517 PolarHBondContact O-N 3.46Å; I514-S518 WeakPolarHBondContact O-CB 3.34Å; I514-S518 PolarHBondContact O-N 3.31Å; I514-F570 HydrophobicContact CD1-CD2 4.23Å; I514-F570 HydrophobicContact CD1-CE2 3.91Å; I514-A573 HydrophobicContact CD1-CB 4Å; I514-A573 HydrophobicContact CG1-CB 3.84Å; I514-L574 HydrophobicContact CD1-CB 4.04Å; I514-Y577 HydrophobicContact CG2-CD1 4.12Å; I514-Y577 HydrophobicContact CG2-CD2 3.47Å; I514-Y577 VanDerWaalsContact CG2-CD2 3.47Å; I514-Y577 HydrophobicContact CG2-CE2 4.13Å; I514-Y577 HydrophobicContact CG2-CG 3.47Å; I514-Y577 VanDerWaalsContact CG2-CG 3.47Å
515	N	94.3	Very high	94.2	Very high	84 Å²	84	56.7 Å²	56.7	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-40.2	171.6	-67.4	-23	0	0	0	112	T511 E512 L513 S518 A519	T511-N515 PolarHBondContact O-N 3.04Å; T511-N515 VanDerWaalsContact O-N 3.15Å; T511-N515 PolarHBondContact O-ND2 3.45Å; E512-N515 WeakPolarHBondContact O-CB 3.33Å; E512-N515 PolarHBondContact O-N 3.22Å; L513-N515 VanDerWaalsContact C-N 3.3Å; L513-N515 PolarHBondContact O-N 3.17Å; N515-S518 PolarHBondContact O-N 3.18Å; N515-A519 WeakPolarHBondContact O-CB 3.35Å; N515-A519 PolarHBondContact O-N 2.86Å
516	L	96.1	Very high	94.4	Very high	13 Å²	13	62.3 Å²	62.3	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-42.7	173	-70.1	172.2	0	0	0	112	A476 L477 V480 L496 L499 E512 L513 I514 T520	A476-L516 HydrophobicContact CB-CD1 4.03Å; A476-L516 HydrophobicContact CB-CD2 4.3Å; L477-L516 HydrophobicContact CB-CD2 3.62Å; L477-L516 HydrophobicContact CD1-CD2 3.98Å; L477-L516 HydrophobicContact CG-CD2 4.42Å; V480-L516 HydrophobicContact CG2-CD2 4.24Å; L496-L516 HydrophobicContact CD2-CB 4.14Å; L499-L516 HydrophobicContact CD1-CD1 4.41Å; E512-L516 WeakPolarHBondContact O-CG 3.39Å; E512-L516 PolarHBondContact O-N 2.86Å; L513-L516 WeakPolarHBondContact O-CB 3.25Å; L513-L516 PolarHBondContact O-N 3.27Å; L513-L516 VanDerWaalsContact O-N 3.15Å; I514-L516 VanDerWaalsContact C-N 3.34Å; I514-L516 PolarHBondContact O-N 2.59Å; L516-T520 WeakPolarHBondContact O-CB 3.43Å; L516-T520 PolarHBondContact O-N 3.44Å; L516-T520 PolarHBondContact O-OG1 2.95Å
517	V	96.2	Very high	94.5	Very high	5 Å²	5	68.3 Å²	68.3	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-47.1	176.1	172.9	0	0	0	0	110.8	L496 L513 I514 T520 F521 L536 F570	L496-V517 HydrophobicContact CD1-CG2 4.17Å; L496-V517 HydrophobicContact CD2-CG2 4.27Å; L513-V517 WeakPolarHBondContact O-CG2 3.44Å; L513-V517 PolarHBondContact O-N 2.79Å; I514-V517 PolarHBondContact O-N 3.46Å; V517-T520 WeakPolarHBondContact O-CB 3.37Å; V517-T520 PolarHBondContact O-N 3.15Å; V517-F521 WeakPolarHBondContact O-CB 3.22Å; V517-F521 PolarHBondContact O-N 2.9Å; V517-L536 HydrophobicContact CG1-CD2 4.23Å; V517-F570 HydrophobicContact CG2-CE2 3.91Å; V517-F570 HydrophobicContact CG2-CZ 4.01Å
518	S	95.5	Very high	94.7	Very high	21 Å²	21	59 Å²	59	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-50.5	177.6	-178.6	0	0	0	0	111.4	I514 N515 T520 F521 Q522 Y577	I514-S518 WeakPolarHBondContact O-CB 3.34Å; I514-S518 PolarHBondContact O-N 3.31Å; N515-S518 PolarHBondContact O-N 3.18Å; S518-T520 VanDerWaalsContact C-N 3.31Å; S518-T520 PolarHBondContact O-N 3.34Å; S518-F521 PolarHBondContact O-N 2.95Å; S518-Q522 WeakPolarHBondContact O-CG 3.36Å; S518-Q522 PolarHBondContact O-N 3.5Å; S518-Q522 PolarHBondContact OG-NE2 2.99Å; S518-Y577 PolarHBondContact OG-OH 2.96Å; S518-Y577 VanDerWaalsContact OG-OH 3.06Å
519	A	96.3	Very high	94.9	Very high	27 Å²	27	60.7 Å²	60.7	22%	0.223	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-36	176.7	0	0	0	0	0	113	L477 T481 N515 A523	L477-A519 HydrophobicContact CD1-CB 3.49Å; L477-A519 VanDerWaalsContact CD1-CB 3.49Å; T481-A519 HydrophobicContact CG2-CB 4.27Å; N515-A519 WeakPolarHBondContact O-CB 3.35Å; N515-A519 PolarHBondContact O-N 2.86Å; A519-A523 VanDerWaalsContact O-CB 3.25Å; A519-A523 WeakPolarHBondContact O-CB 3.48Å; A519-A523 PolarHBondContact O-N 3.06Å
520	T	96.8	Very high	95	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-45.7	174.9	-62.9	0	0	0	0	111.7	V480 A484 V492 L496 L516 V517 S518 Q522 A523 T524 F532	V480-T520 VanDerWaalsContact CG2-OG1 3.29Å; V480-T520 WeakPolarHBondContact CG2-OG1 3.38Å; A484-T520 HydrophobicContact CB-CG2 3.89Å; V492-T520 HydrophobicContact CG1-CG2 3.47Å; V492-T520 VanDerWaalsContact CG1-CG2 3.47Å; L496-T520 HydrophobicContact CD1-CG2 4.08Å; L516-T520 WeakPolarHBondContact O-CB 3.43Å; L516-T520 PolarHBondContact O-N 3.44Å; L516-T520 PolarHBondContact O-OG1 2.95Å; V517-T520 WeakPolarHBondContact O-CB 3.37Å; V517-T520 PolarHBondContact O-N 3.15Å; S518-T520 VanDerWaalsContact C-N 3.31Å; S518-T520 PolarHBondContact O-N 3.34Å; T520-Q522 VanDerWaalsContact C-N 3.34Å; T520-Q522 PolarHBondContact O-N 2.88Å; T520-A523 PolarHBondContact O-N 3.46Å; T520-T524 WeakPolarHBondContact O-CB 3.28Å; T520-T524 PolarHBondContact O-N 3.44Å; T520-T524 PolarHBondContact O-OG1 2.66Å; T520-F532 HydrophobicContact CG2-CE1 4.06Å; T520-F532 HydrophobicContact CG2-CE2 3.79Å; T520-F532 HydrophobicContact CG2-CZ 3.47Å; T520-F532 VanDerWaalsContact CG2-CZ 3.47Å
521	F	96.1	Very high	95.1	Very high	69 Å²	69	58.1 Å²	58.1	30%	0.303	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-43	176.7	179.2	-94.5	0	0	0	111.4	V517 S518 T524 R529 F532 L533	V517-F521 WeakPolarHBondContact O-CB 3.22Å; V517-F521 PolarHBondContact O-N 2.9Å; S518-F521 PolarHBondContact O-N 2.95Å; F521-T524 PolarHBondContact O-N 3.08Å; F521-R529 HydrophobicContact CD2-CB 4.26Å; F521-R529 HydrophobicContact CD2-CG 4.29Å; F521-R529 HydrophobicContact CE2-CB 3.69Å; F521-R529 HydrophobicContact CE2-CG 4.04Å; F521-R529 HydrophobicContact CZ-CB 4.11Å; F521-R529 HydrophobicContact CZ-CG 4.27Å; F521-R529 PolarHBondContact O-NE 3.45Å; F521-F532 HydrophobicContact CB-CE1 4.23Å; F521-F532 HydrophobicContact CD2-CD1 4.23Å; F521-L533 HydrophobicContact CD2-CD1 4.26Å; F521-L533 HydrophobicContact CD2-CD2 4.08Å; F521-L533 HydrophobicContact CD2-CG 4.12Å; F521-L533 HydrophobicContact CE2-CD1 3.74Å; F521-L533 HydrophobicContact CE2-CD2 4.4Å; F521-L533 HydrophobicContact CE2-CG 4.03Å
522	Q	95.5	Very high	95.3	Very high	113 Å²	113	53.8 Å²	53.8	53%	0.528	27%	0.272	S	S	.	.	H	α-helix	trans	-62.5	-44.3	174.6	-68.9	176.9	25.2	0	0	112	S518 T520 T524 R529	S518-Q522 WeakPolarHBondContact O-CG 3.36Å; S518-Q522 PolarHBondContact O-N 3.5Å; S518-Q522 PolarHBondContact OG-NE2 2.99Å; T520-Q522 VanDerWaalsContact C-N 3.34Å; T520-Q522 PolarHBondContact O-N 2.88Å; Q522-T524 VanDerWaalsContact C-N 3.31Å; Q522-T524 PolarHBondContact O-N 3.13Å; Q522-R529 PolarHBondContact O-NH2 3.46Å
523	A	96.3	Very high	95.4	Very high	20 Å²	20	52.2 Å²	52.2	17%	0.165	27%	0.267	C	S	.	.	H	α-helix	trans	-71.1	-20.8	178.2	0	0	0	0	0	114.3	T481 A484 R485 A519 T520	T481-A523 HydrophobicContact CG2-CB 4.07Å; A484-A523 HydrophobicContact CB-CB 4.44Å; R485-A523 HydrophobicContact CG-CB 4.22Å; A519-A523 VanDerWaalsContact O-CB 3.25Å; A519-A523 WeakPolarHBondContact O-CB 3.48Å; A519-A523 PolarHBondContact O-N 3.06Å; T520-A523 PolarHBondContact O-N 3.46Å
524	T	96.9	Very high	95.3	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.018	29%	0.289	C	S	.	.	S	Bend	trans	-71.1	135	175.1	-59.6	0	0	0	0	110.2	T489 T520 F521 Q522 E526 D528 R529 F532	T489-T524 HydrophobicContact CG2-CG2 3.95Å; T520-T524 WeakPolarHBondContact O-CB 3.28Å; T520-T524 PolarHBondContact O-N 3.44Å; T520-T524 PolarHBondContact O-OG1 2.66Å; F521-T524 PolarHBondContact O-N 3.08Å; Q522-T524 VanDerWaalsContact C-N 3.31Å; Q522-T524 PolarHBondContact O-N 3.13Å; T524-E526 PolarHBondContact O-N 3.38Å; T524-D528 HydrophobicContact CG2-CB 4.07Å; T524-R529 HydrophobicContact CG2-CG 4.06Å; T524-R529 PolarHBondContact O-NE 2.86Å; T524-R529 VanDerWaalsContact O-NE 3.13Å; T524-F532 HydrophobicContact CG2-CB 4.23Å
525	K	94.6	Very high	95.4	Very high	96 Å²	96	58.8 Å²	58.8	42%	0.417	30%	0.3	S	S	.	.			trans	-55.1	134.3	175.9	-67.9	164	-176	152.4	0	109.6	R485 K527 D528 R529	R485-K525 WeakPolarHBondContact O-CE 3.49Å; R485-K525 PolarHBondContact O-NZ 3.47Å; K525-K527 VanDerWaalsContact C-N 3.28Å; K525-K527 HydrophobicContact CB-CG 4.38Å; K525-K527 PolarHBondContact O-N 3.11Å; K525-K527 VanDerWaalsContact O-N 3.12Å; K525-D528 WeakPolarHBondContact CB-OD2 3.44Å; K525-D528 WeakPolarHBondContact O-CA 3.37Å; K525-D528 PolarHBondContact O-N 2.88Å; K525-R529 PolarHBondContact O-N 2.77Å
526	E	94	Very high	95.4	Very high	162 Å²	162	55 Å²	55	76%	0.757	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-49.6	-45.9	-171.4	-173.1	178	-176.5	0	0	113.7	T524 D528 R529	T524-E526 PolarHBondContact O-N 3.38Å; E526-D528 PolarHBondContact O-N 3.39Å; E526-R529 WeakPolarHBondContact O-CB 3.46Å; E526-R529 PolarHBondContact O-N 2.85Å
527	K	94.6	Very high	95.3	Very high	157 Å²	157	57.4 Å²	57.4	68%	0.683	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-61	-20.9	176.8	57.9	158.6	-169.8	100.7	0	115.7	K525	K525-K527 VanDerWaalsContact C-N 3.28Å; K525-K527 HydrophobicContact CB-CG 4.38Å; K525-K527 PolarHBondContact O-N 3.11Å; K525-K527 VanDerWaalsContact O-N 3.12Å
528	D	94.7	Very high	95.2	Very high	35 Å²	35	63.9 Å²	63.9	19%	0.187	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-106.4	-3.5	-174.1	-54.2	-39.8	0	0	0	111.6	T489 T524 K525 E526 A531 F532	T489-D528 HydrophobicContact CG2-CB 4.41Å; T524-D528 HydrophobicContact CG2-CB 4.07Å; K525-D528 WeakPolarHBondContact CB-OD2 3.44Å; K525-D528 WeakPolarHBondContact O-CA 3.37Å; K525-D528 PolarHBondContact O-N 2.88Å; E526-D528 PolarHBondContact O-N 3.39Å; D528-A531 PolarHBondContact O-N 3.35Å; D528-F532 PolarHBondContact O-N 3.19Å
529	R	94.9	Very high	95.2	Very high	74 Å²	74	63 Å²	63	28%	0.279	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-40	-174.7	-78.2	-179.1	178.2	165	-2.1	114.4	F521 Q522 T524 K525 E526 F532 L533	F521-R529 HydrophobicContact CD2-CB 4.26Å; F521-R529 HydrophobicContact CD2-CG 4.29Å; F521-R529 HydrophobicContact CE2-CB 3.69Å; F521-R529 HydrophobicContact CE2-CG 4.04Å; F521-R529 HydrophobicContact CZ-CB 4.11Å; F521-R529 HydrophobicContact CZ-CG 4.27Å; F521-R529 PolarHBondContact O-NE 3.45Å; Q522-R529 PolarHBondContact O-NH2 3.46Å; T524-R529 HydrophobicContact CG2-CG 4.06Å; T524-R529 PolarHBondContact O-NE 2.86Å; T524-R529 VanDerWaalsContact O-NE 3.13Å; K525-R529 PolarHBondContact O-N 2.77Å; E526-R529 WeakPolarHBondContact O-CB 3.46Å; E526-R529 PolarHBondContact O-N 2.85Å; R529-F532 PolarHBondContact O-N 3.43Å; R529-L533 PolarHBondContact O-N 2.84Å
530	T	94.1	Very high	95.1	Very high	100 Å²	100	62 Å²	62	61%	0.613	31%	0.31	S	S	*	.	H	α-helix	trans	-66.3	-45.1	175.5	47.2	0	0	0	0	110.8	F532 L533 D534	T530-F532 VanDerWaalsContact C-N 3.29Å; T530-F532 PolarHBondContact O-N 2.91Å; T530-L533 PolarHBondContact O-N 3.48Å; T530-L533 VanDerWaalsContact O-N 3.16Å; T530-D534 PolarHBondContact O-N 2.99Å
531	A	94.6	Very high	94.9	Very high	37 Å²	37	67.5 Å²	67.5	31%	0.306	34%	0.335	S	S	.	.	H	α-helix	trans	-61.1	-35.6	175.8	0	0	0	0	0	112.6	D528 Q535	D528-A531 PolarHBondContact O-N 3.35Å; A531-Q535 VanDerWaalsContact O-CB 3.3Å; A531-Q535 WeakPolarHBondContact O-CB 3.35Å; A531-Q535 VanDerWaalsContact O-CD 3.31Å; A531-Q535 WeakPolarHBondContact O-CG 3.46Å; A531-Q535 PolarHBondContact O-N 3.42Å
532	F	95.9	Very high	94.8	Very high	1 Å²	1	68.2 Å²	68.2	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-63.3	-46	172.4	166.3	-111.9	0	0	0	112.5	T489 V492 L496 T520 F521 T524 D528 R529 T530 Q535 L536	T489-F532 HydrophobicContact CG2-CB 4.08Å; V492-F532 HydrophobicContact CB-CE2 4.48Å; V492-F532 HydrophobicContact CG1-CE2 4.07Å; L496-F532 HydrophobicContact CD1-CE2 4.02Å; L496-F532 HydrophobicContact CD1-CZ 3.73Å; T520-F532 HydrophobicContact CG2-CE1 4.06Å; T520-F532 HydrophobicContact CG2-CE2 3.79Å; T520-F532 HydrophobicContact CG2-CZ 3.47Å; T520-F532 VanDerWaalsContact CG2-CZ 3.47Å; F521-F532 HydrophobicContact CB-CE1 4.23Å; F521-F532 HydrophobicContact CD2-CD1 4.23Å; T524-F532 HydrophobicContact CG2-CB 4.23Å; D528-F532 PolarHBondContact O-N 3.19Å; R529-F532 PolarHBondContact O-N 3.43Å; T530-F532 VanDerWaalsContact C-N 3.29Å; T530-F532 PolarHBondContact O-N 2.91Å; F532-Q535 PolarHBondContact O-N 3.23Å; F532-L536 HydrophobicContact CZ-CD2 4.42Å; F532-L536 WeakPolarHBondContact O-CB 3.34Å; F532-L536 PolarHBondContact O-N 3.5Å
533	L	94.1	Very high	94.6	Very high	74 Å²	74	64.8 Å²	64.8	39%	0.387	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-41.5	177	-66.3	179.2	0	0	0	111.9	F521 R529 T530 Q535 L536 A537	F521-L533 HydrophobicContact CD2-CD1 4.26Å; F521-L533 HydrophobicContact CD2-CD2 4.08Å; F521-L533 HydrophobicContact CD2-CG 4.12Å; F521-L533 HydrophobicContact CE2-CD1 3.74Å; F521-L533 HydrophobicContact CE2-CD2 4.4Å; F521-L533 HydrophobicContact CE2-CG 4.03Å; R529-L533 PolarHBondContact O-N 2.84Å; T530-L533 PolarHBondContact O-N 3.48Å; T530-L533 VanDerWaalsContact O-N 3.16Å; L533-Q535 VanDerWaalsContact C-N 3.33Å; L533-Q535 PolarHBondContact O-N 2.96Å; L533-L536 PolarHBondContact O-N 2.94Å; L533-A537 PolarHBondContact O-N 3.29Å
534	D	94.8	Very high	94.3	Very high	88 Å²	88	65.2 Å²	65.2	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-41.9	173.6	-75.5	-14.2	0	0	0	111.6	T530 A537 R538	T530-D534 PolarHBondContact O-N 2.99Å; D534-A537 PolarHBondContact O-N 2.72Å; D534-R538 WeakPolarHBondContact O-CB 3.28Å; D534-R538 VanDerWaalsContact O-CG 3.23Å; D534-R538 WeakPolarHBondContact O-CG 3.32Å; D534-R538 PolarHBondContact O-N 3.35Å
535	Q	96.4	Very high	94.1	Very high	55 Å²	55	67.6 Å²	67.6	26%	0.257	34%	0.343	S	S	.	.	H	α-helix	trans	-69.4	-33.8	178	-75.6	164.3	0.1	0	0	112.5	T489 A493 A531 F532 L533 R538 S539	T489-Q535 PolarHBondContact OG1-OE1 3.05Å; A493-Q535 HydrophobicContact CB-CB 3.88Å; A531-Q535 VanDerWaalsContact O-CB 3.3Å; A531-Q535 WeakPolarHBondContact O-CB 3.35Å; A531-Q535 VanDerWaalsContact O-CD 3.31Å; A531-Q535 WeakPolarHBondContact O-CG 3.46Å; A531-Q535 PolarHBondContact O-N 3.42Å; F532-Q535 PolarHBondContact O-N 3.23Å; L533-Q535 VanDerWaalsContact C-N 3.33Å; L533-Q535 PolarHBondContact O-N 2.96Å; Q535-R538 PolarHBondContact O-N 3.42Å; Q535-S539 VanDerWaalsContact O-CB 3.31Å; Q535-S539 WeakPolarHBondContact O-CB 3.36Å; Q535-S539 PolarHBondContact O-N 2.76Å
536	L	95.3	Very high	93.7	Very high	5 Å²	5	68.3 Å²	68.3	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-65.5	-43.4	174.1	-173.1	61.4	0	0	0	111.3	A493 L496 V517 F532 L533 S539 F570	A493-L536 HydrophobicContact CB-CB 4.34Å; A493-L536 HydrophobicContact CB-CD1 4.48Å; L496-L536 HydrophobicContact CB-CD1 3.95Å; V517-L536 HydrophobicContact CG1-CD2 4.23Å; F532-L536 HydrophobicContact CZ-CD2 4.42Å; F532-L536 WeakPolarHBondContact O-CB 3.34Å; F532-L536 PolarHBondContact O-N 3.5Å; L533-L536 PolarHBondContact O-N 2.94Å; L536-S539 PolarHBondContact O-N 2.93Å; L536-F570 HydrophobicContact CD2-CE1 4.12Å; L536-F570 HydrophobicContact CD2-CZ 3.81Å; L536-F570 HydrophobicContact CG-CE1 4.43Å; L536-F570 HydrophobicContact CG-CZ 4.42Å
537	A	92.9	Very high	93.3	Very high	63 Å²	63	61.3 Å²	61.3	52%	0.521	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-43.2	173.8	0	0	0	0	0	112.3	L533 D534 F540 Q541	L533-A537 PolarHBondContact O-N 3.29Å; D534-A537 PolarHBondContact O-N 2.72Å; A537-F540 PolarHBondContact O-N 3.18Å; A537-Q541 PolarHBondContact O-N 3.4Å
538	R	95.2	Very high	92.9	Very high	141 Å²	141	61.3 Å²	61.3	53%	0.532	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-41.4	175.9	-72.5	171.8	-160.5	-163	6.6	112.3	D534 Q535 F540 Q541 D542	D534-R538 WeakPolarHBondContact O-CB 3.28Å; D534-R538 VanDerWaalsContact O-CG 3.23Å; D534-R538 WeakPolarHBondContact O-CG 3.32Å; D534-R538 PolarHBondContact O-N 3.35Å; Q535-R538 PolarHBondContact O-N 3.42Å; R538-F540 PolarHBondContact O-N 2.73Å; R538-Q541 CarbonylContact O-C 3.49Å; R538-Q541 VanDerWaalsContact O-CA 3.32Å; R538-Q541 WeakPolarHBondContact O-CA 3.46Å; R538-Q541 VanDerWaalsContact O-CB 3.28Å; R538-Q541 WeakPolarHBondContact O-CB 3.04Å; R538-Q541 PolarHBondContact O-N 3.03Å; R538-D542 PolarHBondContact O-N 2.94Å
539	S	95.5	Very high	92.6	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.028	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-32	-179.7	171.9	0	0	0	0	113.3	V494 T497 Q535 L536 V543	V494-S539 WeakPolarHBondContact CA-OG 3.31Å; T497-S539 VanDerWaalsContact CB-OG 3.26Å; T497-S539 WeakPolarHBondContact CB-OG 3.27Å; T497-S539 WeakPolarHBondContact OG1-CB 3.39Å; T497-S539 PolarHBondContact OG1-OG 2.95Å; Q535-S539 VanDerWaalsContact O-CB 3.31Å; Q535-S539 WeakPolarHBondContact O-CB 3.36Å; Q535-S539 PolarHBondContact O-N 2.76Å; L536-S539 PolarHBondContact O-N 2.93Å; S539-V543 WeakPolarHBondContact O-CG2 3.43Å; S539-V543 PolarHBondContact O-N 3.5Å
540	F	93.9	Very high	92	Very high	5 Å²	5	65.3 Å²	65.3	2%	0.022	34%	0.34	C	S	.	.	H	α-helix	trans	-69.5	-40.4	168.8	-84.7	-79.6	0	0	0	112.2	T497 C500 A537 R538 I544 A566 Q567 F570	T497-F540 HydrophobicContact CG2-CD1 3.81Å; T497-F540 HydrophobicContact CG2-CD2 4.02Å; T497-F540 HydrophobicContact CG2-CE1 3.93Å; T497-F540 HydrophobicContact CG2-CE2 4.13Å; T497-F540 HydrophobicContact CG2-CG 3.87Å; T497-F540 HydrophobicContact CG2-CZ 4.09Å; C500-F540 HydrophobicContact CB-CE1 4.47Å; C500-F540 HydrophobicContact CB-CZ 3.92Å; A537-F540 PolarHBondContact O-N 3.18Å; R538-F540 PolarHBondContact O-N 2.73Å; F540-I544 WeakPolarHBondContact O-CD1 3.47Å; F540-I544 WeakPolarHBondContact O-CG1 3.37Å; F540-I544 PolarHBondContact O-N 3.49Å; F540-A566 HydrophobicContact CE1-CB 4.36Å; F540-Q567 HydrophobicContact CB-CG 4.19Å; F540-Q567 HydrophobicContact CD1-CB 3.73Å; F540-Q567 HydrophobicContact CD1-CG 3.99Å; F540-Q567 HydrophobicContact CE1-CB 4.08Å; F540-Q567 HydrophobicContact CG-CB 4.36Å; F540-Q567 HydrophobicContact CG-CG 4.1Å; F540-F570 HydrophobicContact CE2-CB 4.32Å; F540-F570 AromaticContact CE2-CD1 3.68Å; F540-F570 HydrophobicContact CE2-CD1 3.68Å; F540-F570 HydrophobicContact CE2-CE1 4.18Å; F540-F570 AromaticContact CE2-CG 3.89Å; F540-F570 HydrophobicContact CE2-CG 3.89Å; F540-F570 HydrophobicContact CZ-CB 3.85Å; F540-F570 HydrophobicContact CZ-CD1 4.09Å; F540-F570 HydrophobicContact CZ-CD2 4.41Å; F540-F570 AromaticContact CZ-CG 3.84Å; F540-F570 HydrophobicContact CZ-CG 3.84Å
541	Q	93.4	Very high	91.2	Very high	115 Å²	115	69 Å²	69	54%	0.537	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.3	179.7	-177.7	-14.7	0	0	111.6	A537 R538 V543 I544 V545	A537-Q541 PolarHBondContact O-N 3.4Å; R538-Q541 CarbonylContact O-C 3.49Å; R538-Q541 VanDerWaalsContact O-CA 3.32Å; R538-Q541 WeakPolarHBondContact O-CA 3.46Å; R538-Q541 VanDerWaalsContact O-CB 3.28Å; R538-Q541 WeakPolarHBondContact O-CB 3.04Å; R538-Q541 PolarHBondContact O-N 3.03Å; Q541-V543 PolarHBondContact O-N 3.09Å; Q541-I544 PolarHBondContact O-N 3.48Å; Q541-I544 VanDerWaalsContact O-N 3.14Å; Q541-V545 HydrophobicContact CG-CG2 4.26Å; Q541-V545 WeakPolarHBondContact O-CG2 3.32Å; Q541-V545 PolarHBondContact O-N 3.25Å
542	D	93.8	Very high	90.6	Very high	84 Å²	84	71.6 Å²	71.6	45%	0.449	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-49.2	-178.4	-58	-29	0	0	0	110.1	R538 I544 V545 D546	R538-D542 PolarHBondContact O-N 2.94Å; D542-I544 VanDerWaalsContact C-N 3.31Å; D542-I544 PolarHBondContact O-N 2.86Å; D542-V545 PolarHBondContact O-N 3.23Å; D542-V545 VanDerWaalsContact O-N 3.11Å; D542-D546 VanDerWaalsContact O-CG 3.29Å; D542-D546 PolarHBondContact O-N 2.65Å
543	V	91.2	Very high	89.7	Confident	41 Å²	41	73.7 Å²	73.7	25%	0.248	37%	0.372	C	S	.	.	H	α-helix	trans	-62.9	-33.2	176.6	176.1	0	0	0	0	113	L501 S539 Q541 L547 I563	L501-V543 HydrophobicContact CD1-CG1 4.15Å; S539-V543 WeakPolarHBondContact O-CG2 3.43Å; S539-V543 PolarHBondContact O-N 3.5Å; Q541-V543 PolarHBondContact O-N 3.09Å; V543-L547 PolarHBondContact O-N 2.88Å; V543-I563 HydrophobicContact CG1-CD1 3.82Å; V543-I563 HydrophobicContact CG1-CG1 4.01Å; V543-I563 HydrophobicContact CG1-CG2 4.07Å
544	I	90.4	Very high	89.1	Confident	30 Å²	30	79 Å²	79	15%	0.154	40%	0.395	C	S	.	.	H	α-helix	trans	-70.5	-39.6	174.8	-69.7	165.1	0	0	0	110.9	F540 Q541 D542 Y548 F560 I563 L564	F540-I544 WeakPolarHBondContact O-CD1 3.47Å; F540-I544 WeakPolarHBondContact O-CG1 3.37Å; F540-I544 PolarHBondContact O-N 3.49Å; Q541-I544 PolarHBondContact O-N 3.48Å; Q541-I544 VanDerWaalsContact O-N 3.14Å; D542-I544 VanDerWaalsContact C-N 3.31Å; D542-I544 PolarHBondContact O-N 2.86Å; I544-Y548 VanDerWaalsContact O-CB 3.28Å; I544-Y548 WeakPolarHBondContact O-CB 3.29Å; I544-Y548 PolarHBondContact O-N 3.04Å; I544-F560 HydrophobicContact CG2-CE2 4.02Å; I544-F560 HydrophobicContact CG2-CZ 4.45Å; I544-I563 HydrophobicContact CD1-CG2 4.24Å; I544-I563 HydrophobicContact CG1-CG2 3.43Å; I544-I563 VanDerWaalsContact CG1-CG2 3.43Å; I544-L564 HydrophobicContact CD1-CD2 4.01Å; I544-L564 HydrophobicContact CG1-CD2 4.47Å
545	V	91.3	Very high	88.5	Confident	53 Å²	53	82.6 Å²	82.6	32%	0.321	41%	0.409	S	S	.	.	H	α-helix	trans	-69.4	-48.4	179.2	171	0	0	0	0	110.4	Q541 D542 L547 Y548 E549	Q541-V545 HydrophobicContact CG-CG2 4.26Å; Q541-V545 WeakPolarHBondContact O-CG2 3.32Å; Q541-V545 PolarHBondContact O-N 3.25Å; D542-V545 PolarHBondContact O-N 3.23Å; D542-V545 VanDerWaalsContact O-N 3.11Å; V545-L547 PolarHBondContact O-N 3.36Å; V545-Y548 PolarHBondContact O-N 3.02Å; V545-E549 HydrophobicContact CG1-CG 4.09Å; V545-E549 WeakPolarHBondContact O-CG 3.44Å; V545-E549 PolarHBondContact O-N 3.04Å
546	D	87.5	Confident	87.9	Confident	110 Å²	110	84.5 Å²	84.5	59%	0.588	41%	0.414	S	S	*	.	H	α-helix	trans	-54.6	-39.9	178.6	-70.4	-18.3	0	0	0	112.1	D542 T550	D542-D546 VanDerWaalsContact O-CG 3.29Å; D542-D546 PolarHBondContact O-N 2.65Å; D546-T550 PolarHBondContact O-OG1 3.42Å
547	L	85.7	Confident	87.4	Confident	15 Å²	15	88.2 Å²	88.2	8%	0.079	44%	0.437	C	S	.	.	H	α-helix	trans	-79.1	-28.9	177.2	-169.8	61.2	0	0	0	113.4	V543 V545 T550 R556 D559 F560 I563	V543-L547 PolarHBondContact O-N 2.88Å; V545-L547 PolarHBondContact O-N 3.36Å; L547-T550 WeakPolarHBondContact CA-OG1 3.44Å; L547-T550 PolarHBondContact O-OG1 2.76Å; L547-T550 VanDerWaalsContact O-OG1 3.05Å; L547-R556 HydrophobicContact CD1-CB 3.88Å; L547-R556 HydrophobicContact CD1-CG 4.42Å; L547-D559 HydrophobicContact CD2-CB 3.81Å; L547-F560 HydrophobicContact CD2-CB 3.77Å; L547-F560 HydrophobicContact CD2-CD2 4.11Å; L547-F560 HydrophobicContact CD2-CG 4.47Å; L547-F560 HydrophobicContact CG-CD2 4.35Å; L547-I563 HydrophobicContact CB-CD1 4.4Å; L547-I563 HydrophobicContact CD2-CD1 3.43Å; L547-I563 VanDerWaalsContact CD2-CD1 3.43Å
548	Y	85.8	Confident	87	Confident	157 Å²	157	92.9 Å²	92.9	62%	0.616	45%	0.448	S	S	*	.	H	α-helix	trans	-74.8	-32.2	175.7	-177.3	-96.1	0	0	0	112.4	I544 V545 T550 L553	I544-Y548 VanDerWaalsContact O-CB 3.28Å; I544-Y548 WeakPolarHBondContact O-CB 3.29Å; I544-Y548 PolarHBondContact O-N 3.04Å; V545-Y548 PolarHBondContact O-N 3.02Å; Y548-T550 VanDerWaalsContact C-N 3.29Å; Y548-L553 HydrophobicContact CD2-CD2 3.77Å; Y548-L553 HydrophobicContact CE2-CD2 4.08Å
549	E	87	Confident	86.5	Confident	148 Å²	148	89.6 Å²	89.6	69%	0.692	44%	0.441	S	S	*	.	S	Bend	trans	-81.7	-2.2	178	-67.8	-171.6	174.8	0	0	113.5	V545	V545-E549 HydrophobicContact CG1-CG 4.09Å; V545-E549 WeakPolarHBondContact O-CG 3.44Å; V545-E549 PolarHBondContact O-N 3.04Å
550	T	83.8	Confident	86.2	Confident	46 Å²	46	91.8 Å²	91.8	28%	0.282	45%	0.45	S	S	.	.	S	Bend	trans	-81.7	130.6	175.2	-5.7	0	0	0	0	111.5	D546 L547 Y548 E552 L553	D546-T550 PolarHBondContact O-OG1 3.42Å; L547-T550 WeakPolarHBondContact CA-OG1 3.44Å; L547-T550 PolarHBondContact O-OG1 2.76Å; L547-T550 VanDerWaalsContact O-OG1 3.05Å; Y548-T550 VanDerWaalsContact C-N 3.29Å; T550-E552 PolarHBondContact O-N 3.06Å; T550-L553 PolarHBondContact O-N 3.03Å; T550-L553 VanDerWaalsContact O-N 3.15Å
551	D	76.6	Confident	86	Confident	177 Å²	177	93.6 Å²	93.6	95%	0.947	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-17.9	178.7	-68.6	-43.1	0	0	0	113.9
552	E	81.2	Confident	85.8	Confident	91 Å²	91	89.3 Å²	89.3	43%	0.425	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	16	-178.2	-62.1	174.8	177	0	0	113.8	T550 E554 E555 R556	T550-E552 PolarHBondContact O-N 3.06Å; E552-E554 PolarHBondContact O-N 3.5Å; E552-E554 VanDerWaalsContact O-N 3.07Å; E552-E555 PolarHBondContact O-N 2.93Å; E552-R556 PolarHBondContact O-N 2.98Å; E552-R556 VanDerWaalsContact O-N 3.13Å; E552-R556 IonicContact OE2-CZ 3.83Å; E552-R556 VanDerWaalsContact OE2-CZ 3.3Å; E552-R556 IonicContact OE2-NE 3.8Å; E552-R556 PolarHBondContact OE2-NE 3.15Å; E552-R556 VanDerWaalsContact OE2-NE 3.12Å; E552-R556 IonicContact OE2-NH2 2.73Å; E552-R556 PolarHBondContact OE2-NH2 2.59Å
553	L	78.6	Confident	85.7	Confident	45 Å²	45	86 Å²	86	24%	0.236	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-33.3	-175	179.4	61.8	0	0	0	113.9	Y548 T550 E555 R556 V557 F560	Y548-L553 HydrophobicContact CD2-CD2 3.77Å; Y548-L553 HydrophobicContact CE2-CD2 4.08Å; T550-L553 PolarHBondContact O-N 3.03Å; T550-L553 VanDerWaalsContact O-N 3.15Å; L553-E555 VanDerWaalsContact C-N 3.31Å; L553-E555 PolarHBondContact O-N 3.31Å; L553-R556 CarbonylContact O-C 3.59Å; L553-R556 PolarHBondContact O-N 3.24Å; L553-V557 VanDerWaalsContact O-CG2 3.26Å; L553-V557 WeakPolarHBondContact O-CG2 3.21Å; L553-V557 PolarHBondContact O-N 3.11Å; L553-V557 VanDerWaalsContact O-N 3.16Å; L553-F560 HydrophobicContact CD1-CB 4.27Å; L553-F560 HydrophobicContact CD1-CD2 4.08Å; L553-F560 HydrophobicContact CD1-CG 4.2Å
554	E	80.3	Confident	85.7	Confident	185 Å²	185	87.5 Å²	87.5	86%	0.864	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.2	175.4	-66.8	-168.1	171.4	0	0	113.3	E552 V557	E552-E554 PolarHBondContact O-N 3.5Å; E552-E554 VanDerWaalsContact O-N 3.07Å; E554-V557 WeakPolarHBondContact O-CG2 3.26Å
555	E	82.2	Confident	85.9	Confident	164 Å²	164	91.2 Å²	91.2	77%	0.766	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-24.9	175.3	-57.5	-168	172.2	0	0	111.6	E552 L553	E552-E555 PolarHBondContact O-N 2.93Å; L553-E555 VanDerWaalsContact C-N 3.31Å; L553-E555 PolarHBondContact O-N 3.31Å
556	R	83.6	Confident	86	Confident	95 Å²	95	88.7 Å²	88.7	36%	0.358	43%	0.43	S	S	.	.			trans	-103.5	19.7	-176.3	-54.2	-174.4	-173.3	-157.6	2.3	114.6	L547 E552 L553 E558 D559 F560	L547-R556 HydrophobicContact CD1-CB 3.88Å; L547-R556 HydrophobicContact CD1-CG 4.42Å; E552-R556 PolarHBondContact O-N 2.98Å; E552-R556 VanDerWaalsContact O-N 3.13Å; E552-R556 IonicContact OE2-CZ 3.83Å; E552-R556 VanDerWaalsContact OE2-CZ 3.3Å; E552-R556 IonicContact OE2-NE 3.8Å; E552-R556 PolarHBondContact OE2-NE 3.15Å; E552-R556 VanDerWaalsContact OE2-NE 3.12Å; E552-R556 IonicContact OE2-NH2 2.73Å; E552-R556 PolarHBondContact OE2-NH2 2.59Å; L553-R556 CarbonylContact O-C 3.59Å; L553-R556 PolarHBondContact O-N 3.24Å; R556-E558 PolarHBondContact O-N 3.45Å; R556-D559 PolarHBondContact O-N 2.95Å; R556-D559 VanDerWaalsContact O-N 3.17Å; R556-F560 PolarHBondContact O-N 3.18Å
557	V	85.1	Confident	86.3	Confident	84 Å²	84	86.5 Å²	86.5	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-57.5	-33.2	178.2	177	0	0	0	0	112.2	L553 E554 F560 S561	L553-V557 VanDerWaalsContact O-CG2 3.26Å; L553-V557 WeakPolarHBondContact O-CG2 3.21Å; L553-V557 PolarHBondContact O-N 3.11Å; L553-V557 VanDerWaalsContact O-N 3.16Å; E554-V557 WeakPolarHBondContact O-CG2 3.26Å; V557-F560 PolarHBondContact O-N 2.65Å; V557-S561 WeakPolarHBondContact O-CB 3.29Å; V557-S561 PolarHBondContact O-N 2.72Å
558	E	85.4	Confident	86.8	Confident	161 Å²	161	88.4 Å²	88.4	75%	0.752	43%	0.434	S	S	*	.	H	α-helix	trans	-67.1	-42.9	177.9	-63.9	-163.6	167.2	0	0	112.4	R556 S561 T562	R556-E558 PolarHBondContact O-N 3.45Å; E558-S561 PolarHBondContact O-N 2.94Å; E558-S561 PolarHBondContact O-OG 3.28Å; E558-T562 PolarHBondContact O-N 3.2Å; E558-T562 PolarHBondContact O-OG1 3.18Å
559	D	85	Confident	87.2	Confident	72 Å²	72	83.5 Å²	83.5	39%	0.385	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-45.9	173.9	-69.3	-36.2	0	0	0	110.7	L547 R556 S561 T562 I563	L547-D559 HydrophobicContact CD2-CB 3.81Å; R556-D559 PolarHBondContact O-N 2.95Å; R556-D559 VanDerWaalsContact O-N 3.17Å; D559-S561 VanDerWaalsContact C-N 3.31Å; D559-S561 PolarHBondContact O-N 2.65Å; D559-T562 CarbonylContact O-C 3.59Å; D559-T562 WeakPolarHBondContact O-CA 3.33Å; D559-T562 WeakPolarHBondContact O-CB 3.28Å; D559-T562 PolarHBondContact O-N 3.46Å; D559-I563 WeakPolarHBondContact O-CG1 3.34Å; D559-I563 PolarHBondContact O-N 3.06Å
560	F	87.9	Confident	87.6	Confident	49 Å²	49	76.7 Å²	76.7	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-60	-42	177.1	-169.3	-100.3	0	0	0	111.6	I544 L547 L553 R556 V557 T562 I563 L564	I544-F560 HydrophobicContact CG2-CE2 4.02Å; I544-F560 HydrophobicContact CG2-CZ 4.45Å; L547-F560 HydrophobicContact CD2-CB 3.77Å; L547-F560 HydrophobicContact CD2-CD2 4.11Å; L547-F560 HydrophobicContact CD2-CG 4.47Å; L547-F560 HydrophobicContact CG-CD2 4.35Å; L553-F560 HydrophobicContact CD1-CB 4.27Å; L553-F560 HydrophobicContact CD1-CD2 4.08Å; L553-F560 HydrophobicContact CD1-CG 4.2Å; R556-F560 PolarHBondContact O-N 3.18Å; V557-F560 PolarHBondContact O-N 2.65Å; F560-T562 PolarHBondContact O-N 3.29Å; F560-I563 PolarHBondContact O-N 2.9Å; F560-L564 HydrophobicContact CD1-CD1 3.87Å; F560-L564 HydrophobicContact CD1-CG 4.42Å; F560-L564 HydrophobicContact CE1-CD1 3.47Å; F560-L564 VanDerWaalsContact CE1-CD1 3.47Å; F560-L564 HydrophobicContact CE1-CG 4.18Å; F560-L564 HydrophobicContact CZ-CD1 4.11Å; F560-L564 HydrophobicContact CZ-CG 4.48Å; F560-L564 WeakPolarHBondContact O-CG 3.16Å; F560-L564 PolarHBondContact O-N 3.46Å
561	S	89.3	Confident	88	Confident	43 Å²	43	79.2 Å²	79.2	30%	0.301	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-32.3	173.5	91.5	0	0	0	0	112.7	V557 E558 D559 R565	V557-S561 WeakPolarHBondContact O-CB 3.29Å; V557-S561 PolarHBondContact O-N 2.72Å; E558-S561 PolarHBondContact O-N 2.94Å; E558-S561 PolarHBondContact O-OG 3.28Å; D559-S561 VanDerWaalsContact C-N 3.31Å; D559-S561 PolarHBondContact O-N 2.65Å; S561-R565 WeakPolarHBondContact O-CB 3.35Å; S561-R565 PolarHBondContact OG-NH2 3.27Å; S561-R565 PolarHBondContact O-N 2.93Å
562	T	90.1	Very high	88.8	Confident	25 Å²	25	77.5 Å²	77.5	15%	0.153	38%	0.375	C	S	.	.	H	α-helix	trans	-77.6	-39.8	-178.2	-61.6	0	0	0	0	111.3	V504 E558 D559 F560 R565 A566	V504-T562 HydrophobicContact CG1-CG2 4.48Å; E558-T562 PolarHBondContact O-N 3.2Å; E558-T562 PolarHBondContact O-OG1 3.18Å; D559-T562 CarbonylContact O-C 3.59Å; D559-T562 WeakPolarHBondContact O-CA 3.33Å; D559-T562 WeakPolarHBondContact O-CB 3.28Å; D559-T562 PolarHBondContact O-N 3.46Å; F560-T562 PolarHBondContact O-N 3.29Å; T562-R565 PolarHBondContact O-N 3.35Å; T562-R565 PolarHBondContact OG1-NH1 3.18Å; T562-A566 WeakPolarHBondContact O-CB 3.31Å; T562-A566 PolarHBondContact O-N 3.35Å
563	I	91.5	Very high	89.4	Confident	16 Å²	16	74.5 Å²	74.5	8%	0.082	37%	0.366	C	S	.	.	H	α-helix	trans	-65.1	-47.2	174	-65	152.3	0	0	0	110.9	L501 V543 I544 L547 D559 F560 R565 A566 Q567	L501-I563 HydrophobicContact CD2-CB 4.05Å; L501-I563 HydrophobicContact CD2-CG1 3.6Å; L501-I563 HydrophobicContact CD2-CG2 4.29Å; V543-I563 HydrophobicContact CG1-CD1 3.82Å; V543-I563 HydrophobicContact CG1-CG1 4.01Å; V543-I563 HydrophobicContact CG1-CG2 4.07Å; I544-I563 HydrophobicContact CD1-CG2 4.24Å; I544-I563 HydrophobicContact CG1-CG2 3.43Å; I544-I563 VanDerWaalsContact CG1-CG2 3.43Å; L547-I563 HydrophobicContact CB-CD1 4.4Å; L547-I563 HydrophobicContact CD2-CD1 3.43Å; L547-I563 VanDerWaalsContact CD2-CD1 3.43Å; D559-I563 WeakPolarHBondContact O-CG1 3.34Å; D559-I563 PolarHBondContact O-N 3.06Å; F560-I563 PolarHBondContact O-N 2.9Å; I563-R565 VanDerWaalsContact C-N 3.32Å; I563-R565 PolarHBondContact O-N 2.99Å; I563-A566 VanDerWaalsContact O-N 3.15Å; I563-A566 PolarHBondContact O-N 3.18Å; I563-Q567 PolarHBondContact O-N 3.02Å
564	L	92.3	Very high	90	Very high	71 Å²	71	74.1 Å²	74.1	37%	0.372	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-39.5	175.7	-71.3	-178.4	0	0	0	112.2	I544 F560 A568	I544-L564 HydrophobicContact CD1-CD2 4.01Å; I544-L564 HydrophobicContact CG1-CD2 4.47Å; F560-L564 HydrophobicContact CD1-CD1 3.87Å; F560-L564 HydrophobicContact CD1-CG 4.42Å; F560-L564 HydrophobicContact CE1-CD1 3.47Å; F560-L564 VanDerWaalsContact CE1-CD1 3.47Å; F560-L564 HydrophobicContact CE1-CG 4.18Å; F560-L564 HydrophobicContact CZ-CD1 4.11Å; F560-L564 HydrophobicContact CZ-CG 4.48Å; F560-L564 WeakPolarHBondContact O-CG 3.16Å; F560-L564 PolarHBondContact O-N 3.46Å; L564-A568 WeakPolarHBondContact O-CB 3.43Å; L564-A568 PolarHBondContact O-N 3.04Å
565	R	93.1	Very high	90.5	Very high	108 Å²	108	70.2 Å²	70.2	41%	0.408	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-44.1	173.5	-173.9	-179.5	-54.3	102.5	10.7	111	V504 S561 T562 I563 A568 E569	V504-R565 HydrophobicContact CG1-CB 4.33Å; V504-R565 HydrophobicContact CG1-CG 3.97Å; S561-R565 WeakPolarHBondContact O-CB 3.35Å; S561-R565 PolarHBondContact OG-NH2 3.27Å; S561-R565 PolarHBondContact O-N 2.93Å; T562-R565 PolarHBondContact O-N 3.35Å; T562-R565 PolarHBondContact OG1-NH1 3.18Å; I563-R565 VanDerWaalsContact C-N 3.32Å; I563-R565 PolarHBondContact O-N 2.99Å; R565-A568 PolarHBondContact O-N 3.31Å; R565-E569 PolarHBondContact O-N 3.28Å; R565-E569 WeakPolarHBondContact O-CG 3.23Å; R565-E569 VanDerWaalsContact O-CG 3.31Å; R565-E569 WeakPolarHBondContact O-CB 3.44Å; R565-E569 WeakPolarHBondContact CG-OE1 3.45Å; R565-E569 VanDerWaalsContact CG-OE1 3.25Å; R565-E569 HydrophobicContact CG-CG 4.26Å
566	A	94.3	Very high	91	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-45.2	178.9	0	0	0	0	0	112.7	L501 V504 F540 T562 I563 A568 E569 F570	L501-A566 HydrophobicContact CD2-CB 3.74Å; V504-A566 HydrophobicContact CB-CB 4.11Å; V504-A566 HydrophobicContact CG1-CB 4.32Å; V504-A566 HydrophobicContact CG2-CB 3.95Å; F540-A566 HydrophobicContact CE1-CB 4.36Å; T562-A566 WeakPolarHBondContact O-CB 3.31Å; T562-A566 PolarHBondContact O-N 3.35Å; I563-A566 VanDerWaalsContact O-N 3.15Å; I563-A566 PolarHBondContact O-N 3.18Å; A566-A568 VanDerWaalsContact C-N 3.35Å; A566-A568 PolarHBondContact O-N 3.46Å; A566-E569 PolarHBondContact O-N 3.16Å; A566-F570 WeakPolarHBondContact O-CB 3.3Å; A566-F570 PolarHBondContact O-N 2.74Å
567	Q	94.6	Very high	91.2	Very high	65 Å²	65	62.5 Å²	62.5	30%	0.304	32%	0.321	S	S	.	.	H	α-helix	trans	-58.2	-46.6	173.7	-168.5	-172.4	34.6	0	0	111.5	F540 I563 M571	F540-Q567 HydrophobicContact CB-CG 4.19Å; F540-Q567 HydrophobicContact CD1-CB 3.73Å; F540-Q567 HydrophobicContact CD1-CG 3.99Å; F540-Q567 HydrophobicContact CE1-CB 4.08Å; F540-Q567 HydrophobicContact CG-CB 4.36Å; F540-Q567 HydrophobicContact CG-CG 4.1Å; I563-Q567 PolarHBondContact O-N 3.02Å; Q567-M571 WeakPolarHBondContact O-CB 3.49Å; Q567-M571 WeakPolarHBondContact O-CG 3.49Å; Q567-M571 PolarHBondContact O-N 2.87Å
568	A	94.4	Very high	91.4	Very high	55 Å²	55	63.4 Å²	63.4	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-37.6	-179.3	0	0	0	0	0	113.3	L564 R565 A566 R572	L564-A568 WeakPolarHBondContact O-CB 3.43Å; L564-A568 PolarHBondContact O-N 3.04Å; R565-A568 PolarHBondContact O-N 3.31Å; A566-A568 VanDerWaalsContact C-N 3.35Å; A566-A568 PolarHBondContact O-N 3.46Å; A568-R572 WeakPolarHBondContact O-CB 3.4Å; A568-R572 PolarHBondContact O-N 2.98Å
569	E	94.4	Very high	91.5	Very high	53 Å²	53	65.2 Å²	65.2	25%	0.248	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-42.4	175.4	-72.7	-174.4	-165.8	0	0	111.8	L510 R565 A566 R572 A573	L510-E569 HydrophobicContact CD1-CB 3.74Å; R565-E569 PolarHBondContact O-N 3.28Å; R565-E569 WeakPolarHBondContact O-CG 3.23Å; R565-E569 VanDerWaalsContact O-CG 3.31Å; R565-E569 WeakPolarHBondContact O-CB 3.44Å; R565-E569 WeakPolarHBondContact CG-OE1 3.45Å; R565-E569 VanDerWaalsContact CG-OE1 3.25Å; R565-E569 HydrophobicContact CG-CG 4.26Å; A566-E569 PolarHBondContact O-N 3.16Å; E569-R572 VanDerWaalsContact CG-NH2 3.33Å; E569-R572 PolarHBondContact O-N 3.35Å; E569-A573 WeakPolarHBondContact O-CB 3.38Å; E569-A573 PolarHBondContact O-N 3.26Å
570	F	95.1	Very high	91.2	Very high	5 Å²	5	70 Å²	70	2%	0.022	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-54.9	175.3	-177.3	-101.3	0	0	0	111.8	L513 I514 V517 L536 F540 A566 R572 A573 L574	L513-F570 HydrophobicContact CD2-CD2 4.11Å; L513-F570 HydrophobicContact CD2-CE2 4.3Å; I514-F570 HydrophobicContact CD1-CD2 4.23Å; I514-F570 HydrophobicContact CD1-CE2 3.91Å; V517-F570 HydrophobicContact CG2-CE2 3.91Å; V517-F570 HydrophobicContact CG2-CZ 4.01Å; L536-F570 HydrophobicContact CD2-CE1 4.12Å; L536-F570 HydrophobicContact CD2-CZ 3.81Å; L536-F570 HydrophobicContact CG-CE1 4.43Å; L536-F570 HydrophobicContact CG-CZ 4.42Å; F540-F570 HydrophobicContact CE2-CB 4.32Å; F540-F570 AromaticContact CE2-CD1 3.68Å; F540-F570 HydrophobicContact CE2-CD1 3.68Å; F540-F570 HydrophobicContact CE2-CE1 4.18Å; F540-F570 AromaticContact CE2-CG 3.89Å; F540-F570 HydrophobicContact CE2-CG 3.89Å; F540-F570 HydrophobicContact CZ-CB 3.85Å; F540-F570 HydrophobicContact CZ-CD1 4.09Å; F540-F570 HydrophobicContact CZ-CD2 4.41Å; F540-F570 AromaticContact CZ-CG 3.84Å; F540-F570 HydrophobicContact CZ-CG 3.84Å; A566-F570 WeakPolarHBondContact O-CB 3.3Å; A566-F570 PolarHBondContact O-N 2.74Å; F570-R572 VanDerWaalsContact C-N 3.27Å; F570-R572 PolarHBondContact O-N 2.59Å; F570-A573 PolarHBondContact O-N 3.26Å; F570-L574 HydrophobicContact CE1-CD2 3.87Å; F570-L574 HydrophobicContact CZ-CD2 4.18Å; F570-L574 WeakPolarHBondContact O-CB 3.39Å; F570-L574 PolarHBondContact O-N 3.48Å
571	M	93.2	Very high	89.9	Confident	99 Å²	99	76.2 Å²	76.2	49%	0.488	37%	0.372	S	S	.	.	H	α-helix	trans	-61.4	-37.4	-178.7	-67	-66.6	-82.4	0	0	111.5	Q567 M575	Q567-M571 WeakPolarHBondContact O-CB 3.49Å; Q567-M571 WeakPolarHBondContact O-CG 3.49Å; Q567-M571 PolarHBondContact O-N 2.87Å; M571-M575 VanDerWaalsContact O-CG 3.28Å; M571-M575 PolarHBondContact O-N 2.95Å; M571-M575 WeakPolarHBondContact O-CG 3.46Å; M571-M575 WeakPolarHBondContact O-CE 3.14Å; M571-M575 WeakPolarHBondContact O-CB 3.49Å
572	R	93.4	Very high	89.9	Confident	142 Å²	142	77.9 Å²	77.9	54%	0.536	38%	0.376	S	S	.	.	H	α-helix	trans	-65.4	-46	175.3	-165.5	-161.9	-41.1	113.5	6.7	112.3	A568 E569 F570 A576	A568-R572 WeakPolarHBondContact O-CB 3.4Å; A568-R572 PolarHBondContact O-N 2.98Å; E569-R572 VanDerWaalsContact CG-NH2 3.33Å; E569-R572 PolarHBondContact O-N 3.35Å; F570-R572 VanDerWaalsContact C-N 3.27Å; F570-R572 PolarHBondContact O-N 2.59Å; R572-A576 WeakPolarHBondContact O-CB 3.25Å; R572-A576 PolarHBondContact O-N 3.13Å
573	A	93.2	Very high	89.9	Confident	28 Å²	28	80.6 Å²	80.6	23%	0.231	39%	0.388	C	S	.	.	H	α-helix	trans	-67.5	-39.6	-179.8	0	0	0	0	0	111.8	L510 I514 E569 F570 A576 Y577	L510-A573 HydrophobicContact CB-CB 4.21Å; L510-A573 HydrophobicContact CD1-CB 4.3Å; I514-A573 HydrophobicContact CD1-CB 4Å; I514-A573 HydrophobicContact CG1-CB 3.84Å; E569-A573 WeakPolarHBondContact O-CB 3.38Å; E569-A573 PolarHBondContact O-N 3.26Å; F570-A573 PolarHBondContact O-N 3.26Å; A573-A576 PolarHBondContact O-N 2.95Å; A573-Y577 PolarHBondContact O-N 2.94Å
574	L	91.6	Very high	89.8	Confident	37 Å²	37	84.2 Å²	84.2	19%	0.194	41%	0.405	C	S	.	.	H	α-helix	trans	-65.3	-45.3	175.2	-177.3	62.2	0	0	0	111.8	I514 F570 Y577 I578	I514-L574 HydrophobicContact CD1-CB 4.04Å; F570-L574 HydrophobicContact CE1-CD2 3.87Å; F570-L574 HydrophobicContact CZ-CD2 4.18Å; F570-L574 WeakPolarHBondContact O-CB 3.39Å; F570-L574 PolarHBondContact O-N 3.48Å; L574-Y577 PolarHBondContact O-N 3.44Å; L574-I578 PolarHBondContact O-N 3.35Å; L574-I578 WeakPolarHBondContact O-CG1 3.29Å; L574-I578 VanDerWaalsContact O-CG1 3.28Å; L574-I578 HydrophobicContact CD1-CD1 4.02Å; L574-I578 HydrophobicContact CG-CD1 3.9Å
575	M	91.7	Very high	89.6	Confident	102 Å²	102	85 Å²	85	50%	0.502	41%	0.407	S	S	.	.	H	α-helix	trans	-61.1	-44.4	174.5	-76.3	-174.4	-66.8	0	0	111.8	M571 Y577 I578 Y579	M571-M575 VanDerWaalsContact O-CG 3.28Å; M571-M575 PolarHBondContact O-N 2.95Å; M571-M575 WeakPolarHBondContact O-CG 3.46Å; M571-M575 WeakPolarHBondContact O-CE 3.14Å; M571-M575 WeakPolarHBondContact O-CB 3.49Å; M575-Y577 PolarHBondContact O-N 3.34Å; M575-I578 PolarHBondContact O-N 3.36Å; M575-Y579 WeakPolarHBondContact O-CD2 3.48Å; M575-Y579 PolarHBondContact O-N 3.44Å
576	A	91.5	Very high	89.4	Confident	45 Å²	45	83.6 Å²	83.6	37%	0.372	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-47.2	178.2	0	0	0	0	0	111.7	R572 A573 I578 Y579 E580	R572-A576 WeakPolarHBondContact O-CB 3.25Å; R572-A576 PolarHBondContact O-N 3.13Å; A573-A576 PolarHBondContact O-N 2.95Å; A576-I578 PolarHBondContact O-N 3.04Å; A576-Y579 PolarHBondContact O-N 3.32Å; A576-Y579 VanDerWaalsContact O-N 3.13Å; A576-E580 VanDerWaalsContact O-N 3.08Å; A576-E580 PolarHBondContact O-N 3.3Å; A576-E580 WeakPolarHBondContact O-CG 3.17Å
577	Y	89.3	Confident	89.1	Confident	53 Å²	53	89.1 Å²	89.1	21%	0.208	43%	0.434	C	S	.	.	H	α-helix	trans	-58.5	-44.5	175.6	-178.5	-82	0	0	0	112.4	I514 S518 A573 L574 M575 Y579 E580 E581	I514-Y577 HydrophobicContact CG2-CD1 4.12Å; I514-Y577 HydrophobicContact CG2-CD2 3.47Å; I514-Y577 VanDerWaalsContact CG2-CD2 3.47Å; I514-Y577 HydrophobicContact CG2-CE2 4.13Å; I514-Y577 HydrophobicContact CG2-CG 3.47Å; I514-Y577 VanDerWaalsContact CG2-CG 3.47Å; S518-Y577 PolarHBondContact OG-OH 2.96Å; S518-Y577 VanDerWaalsContact OG-OH 3.06Å; A573-Y577 PolarHBondContact O-N 2.94Å; L574-Y577 PolarHBondContact O-N 3.44Å; M575-Y577 PolarHBondContact O-N 3.34Å; Y577-Y579 PolarHBondContact O-N 3.13Å; Y577-E580 PolarHBondContact O-N 2.83Å; Y577-E580 VanDerWaalsContact O-N 3.15Å; Y577-E581 HydrophobicContact CD1-CG 4.5Å; Y577-E581 HydrophobicContact CE1-CG 4.03Å; Y577-E581 VanDerWaalsContact CE1-OE1 3.31Å; Y577-E581 WeakPolarHBondContact CE1-OE1 3.48Å; Y577-E581 WeakPolarHBondContact CE1-OE2 3.45Å; Y577-E581 PolarHBondContact O-N 3.12Å; Y577-E581 PolarHBondContact OH-OE1 3.19Å
578	I	87.5	Confident	88.7	Confident	102 Å²	102	90.9 Å²	90.9	52%	0.523	44%	0.443	S	S	.	.	H	α-helix	trans	-67.3	-21.8	178.2	-66.9	166.4	0	0	0	112.8	L574 M575 A576	L574-I578 PolarHBondContact O-N 3.35Å; L574-I578 WeakPolarHBondContact O-CG1 3.29Å; L574-I578 VanDerWaalsContact O-CG1 3.28Å; L574-I578 HydrophobicContact CD1-CD1 4.02Å; L574-I578 HydrophobicContact CG-CD1 3.9Å; M575-I578 PolarHBondContact O-N 3.36Å; A576-I578 PolarHBondContact O-N 3.04Å
579	Y	87.7	Confident	88.3	Confident	200 Å²	200	93.6 Å²	93.6	78%	0.784	44%	0.442	S	S	*	.	H	α-helix	trans	-90.2	-13.7	173.8	-80.6	-64	0	0	0	113.8	M575 A576 Y577	M575-Y579 WeakPolarHBondContact O-CD2 3.48Å; M575-Y579 PolarHBondContact O-N 3.44Å; A576-Y579 PolarHBondContact O-N 3.32Å; A576-Y579 VanDerWaalsContact O-N 3.13Å; Y577-Y579 PolarHBondContact O-N 3.13Å
580	E	80.3	Confident	87.8	Confident	173 Å²	173	97 Å²	97	81%	0.808	46%	0.458	S	S	*	.	H	α-helix	trans	-94.7	-19.7	177.6	-73.4	177.8	-173.4	0	0	112.9	A576 Y577	A576-E580 VanDerWaalsContact O-N 3.08Å; A576-E580 PolarHBondContact O-N 3.3Å; A576-E580 WeakPolarHBondContact O-CG 3.17Å; Y577-E580 PolarHBondContact O-N 2.83Å; Y577-E580 VanDerWaalsContact O-N 3.15Å
581	E	58.8	Low	87.1	Confident	178 Å²	178	105.4 Å²	105.4	83%	0.832	50%	0.498	S	S	*	.			trans	-84.9	0	167.2	-69.8	-168.4	154.3	0	0	113.6	Y577	Y577-E581 HydrophobicContact CD1-CG 4.5Å; Y577-E581 HydrophobicContact CE1-CG 4.03Å; Y577-E581 VanDerWaalsContact CE1-OE1 3.31Å; Y577-E581 WeakPolarHBondContact CE1-OE1 3.48Å; Y577-E581 WeakPolarHBondContact CE1-OE2 3.45Å; Y577-E581 PolarHBondContact O-N 3.12Å; Y577-E581 PolarHBondContact OH-OE1 3.19Å

Retrieved 581 of 581 residues in 479.3 ms (Link to these results)

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