A0A5K4FFU4_SCHMA Loading...

Transmembrane protein 39A

AlphaFold DB , UniProt , Accession A0A5K4FFU4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 532 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	34.3	Very low	32.9	Very low	241 Å²	241	163 Å²	163	100%	1.187	88%	0.875	S	S	*	*				0	100.8	0	-75.7	174.8	161.8	0	0	108.9
2	P	35.1	Very low	33.1	Very low	132 Å²	132	160.2 Å²	160.2	86%	0.857	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-93.9	137.7	178.3	24.7	-11.1	0	0	0	111.7
3	I	37.2	Very low	33	Very low	166 Å²	166	161.2 Å²	161.2	85%	0.851	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-69.5	123.2	-175.2	-68.4	161.3	0	0	0	110.2	R5	I3-R5 PolarHBondContact O-N 3.21Å
4	K	34.4	Very low	32.7	Very low	203 Å²	203	154.6 Å²	154.6	88%	0.883	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-62.7	119.1	175	-82.6	177.9	172.8	177.6	0	110.9	S6	K4-S6 PolarHBondContact O-N 3.26Å
5	R	29.9	Very low	32.6	Very low	252 Å²	252	148.7 Å²	148.7	95%	0.951	85%	0.849	S	S	*	*			trans	-79.6	105.4	159.1	-74.6	-178.2	178.7	177.4	-0.2	108.3	I3	I3-R5 PolarHBondContact O-N 3.21Å
6	S	37.1	Very low	32.9	Very low	115 Å²	115	143.8 Å²	143.8	80%	0.804	84%	0.842	S	S	*	*			trans	-92.6	114.4	165.1	-174	0	0	0	0	108.1	K4 G8	K4-S6 PolarHBondContact O-N 3.26Å; S6-G8 PolarHBondContact O-N 3.47Å
7	S	33.9	Very low	33.6	Very low	121 Å²	121	140.3 Å²	140.3	85%	0.846	82%	0.822	S	S	*	*			trans	-64.8	92.6	172.4	-76	0	0	0	0	110.1	R9	S7-R9 PolarHBondContact O-N 3.45Å; S7-R9 VanDerWaalsContact O-N 3.16Å
8	G	33.4	Very low	34.3	Very low	62 Å²	62	137.8 Å²	137.8	64%	0.639	81%	0.805	S	S	*	*			trans	-70	101.2	166.1	0	0	0	0	0	110	S6 L10	S6-G8 PolarHBondContact O-N 3.47Å; G8-L10 VanDerWaalsContact C-N 3.33Å; G8-L10 PolarHBondContact O-N 3.01Å
9	R	29.7	Very low	35.1	Very low	253 Å²	253	136.2 Å²	136.2	96%	0.955	79%	0.793	S	S	*	*			trans	-65.7	93.9	164.9	-119.4	-178.9	-168.3	-169.4	3.4	107.8	S7	S7-R9 PolarHBondContact O-N 3.45Å; S7-R9 VanDerWaalsContact O-N 3.16Å
10	L	30.1	Very low	35.8	Very low	179 Å²	179	134.7 Å²	134.7	94%	0.937	78%	0.782	S	S	*	*			trans	-83	110.3	167.5	-81.7	158.8	0	0	0	108.5	G8	G8-L10 VanDerWaalsContact C-N 3.33Å; G8-L10 PolarHBondContact O-N 3.01Å
11	G	27	Very low	36.5	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	76%	0.762	S	S	*	*			trans	-170.7	149.4	166.4	0	0	0	0	0	111.1
12	P	35.1	Very low	37.2	Very low	129 Å²	129	126.9 Å²	126.9	84%	0.838	73%	0.733	S	S	*	*				-104.8	153.6	-56.3	33.5	-23.5	0	0	0	110	G14	P12-G14 VanDerWaalsContact C-N 3.29Å; P12-G14 PolarHBondContact O-N 3.2Å
13	I	31.6	Very low	38.1	Very low	173 Å²	173	128.4 Å²	128.4	89%	0.887	72%	0.721	S	S	*	*			trans	-65	89.4	174.9	-60.3	169.4	0	0	0	108.3	G15	I13-G15 VanDerWaalsContact C-N 3.34Å; I13-G15 PolarHBondContact O-N 2.64Å; I13-G15 VanDerWaalsContact O-N 3.08Å
14	G	28.7	Very low	38.9	Very low	70 Å²	70	122.9 Å²	122.9	72%	0.722	70%	0.7	S	S	*	*			trans	-70.7	93.5	163.4	0	0	0	0	0	107.6	P12 G16	P12-G14 VanDerWaalsContact C-N 3.29Å; P12-G14 PolarHBondContact O-N 3.2Å; G14-G16 PolarHBondContact O-N 3.16Å
15	G	31.4	Very low	39.7	Very low	65 Å²	65	114.6 Å²	114.6	67%	0.67	67%	0.668	S	S	*	*			trans	-56.9	101.9	168.2	0	0	0	0	0	108.6	I13 V17	I13-G15 VanDerWaalsContact C-N 3.34Å; I13-G15 PolarHBondContact O-N 2.64Å; I13-G15 VanDerWaalsContact O-N 3.08Å; G15-V17 PolarHBondContact O-N 3.31Å
16	G	38.1	Very low	40.8	Very low	71 Å²	71	107.1 Å²	107.1	73%	0.732	64%	0.643	S	S	*	*			trans	-59.9	108.5	174.1	0	0	0	0	0	109	G14 N18	G14-G16 PolarHBondContact O-N 3.16Å; G16-N18 PolarHBondContact O-N 3.12Å; G16-N18 VanDerWaalsContact O-N 3.14Å
17	V	43.7	Very low	41.7	Very low	84 Å²	84	108.4 Å²	108.4	51%	0.509	64%	0.637	S	S	.	*			trans	-58.3	117.8	168.6	176.2	0	0	0	0	106.8	G15 N19	G15-V17 PolarHBondContact O-N 3.31Å; V17-N19 PolarHBondContact O-N 3.05Å
18	N	46.5	Very low	42.8	Very low	95 Å²	95	105.7 Å²	105.7	51%	0.508	62%	0.615	S	S	.	*			trans	-64.2	109.8	-175.4	-152.1	-6.6	0	0	0	108.6	G16 N20 T21	G16-N18 PolarHBondContact O-N 3.12Å; G16-N18 VanDerWaalsContact O-N 3.14Å; N18-N20 PolarHBondContact O-N 2.91Å; N18-T21 PolarHBondContact O-N 3.01Å; N18-T21 PolarHBondContact O-OG1 2.63Å
19	N	49.5	Very low	44	Very low	107 Å²	107	104.5 Å²	104.5	57%	0.572	60%	0.595	S	S	*	*	H	α-helix	trans	-50.9	-27.2	-177.7	-84.8	-19.1	0	0	0	113.2	V17 R22 R23	V17-N19 PolarHBondContact O-N 3.05Å; N19-R22 PolarHBondContact O-N 3.21Å; N19-R23 WeakPolarHBondContact O-CG 3.46Å; N19-R23 PolarHBondContact O-N 2.96Å
20	N	48.5	Very low	45.2	Very low	107 Å²	107	97.5 Å²	97.5	57%	0.572	59%	0.585	S	S	*	*	H	α-helix	trans	-63.9	-37.4	175.9	-66.1	-7.4	0	0	0	112.8	N18 A24	N18-N20 PolarHBondContact O-N 2.91Å; N20-A24 WeakPolarHBondContact O-CB 3.39Å; N20-A24 PolarHBondContact O-N 2.75Å
21	T	51.3	Low	46.7	Very low	59 Å²	59	92.9 Å²	92.9	36%	0.362	57%	0.567	S	S	.	*	H	α-helix	trans	-71.4	-35.8	176.1	47.7	0	0	0	0	112.6	N18 C25 N392	N18-T21 PolarHBondContact O-N 3.01Å; N18-T21 PolarHBondContact O-OG1 2.63Å; T21-C25 WeakPolarHBondContact O-CB 3.41Å; T21-C25 PolarHBondContact O-N 2.78Å; T21-C25 VanDerWaalsContact O-N 3.07Å; T21-N392 PolarHBondContact OG1-ND2 3.36Å
22	R	48.2	Very low	48.4	Very low	153 Å²	153	91.9 Å²	91.9	58%	0.577	55%	0.548	S	S	*	.	H	α-helix	trans	-64.3	-47.9	174.6	-176.5	177.2	173.5	167.8	4.2	111.1	N19 A24 C25 E26	N19-R22 PolarHBondContact O-N 3.21Å; R22-A24 PolarHBondContact O-N 3.05Å; R22-C25 PolarHBondContact O-N 3.08Å; R22-E26 HydrophobicContact CG-CG 4.44Å; R22-E26 WeakPolarHBondContact CG-OE1 3.4Å; R22-E26 IonicContact CZ-OE1 3.71Å; R22-E26 IonicContact NE-OE1 2.86Å; R22-E26 PolarHBondContact NE-OE1 2.93Å; R22-E26 IonicContact NH2-OE1 3.7Å; R22-E26 WeakPolarHBondContact O-CB 3.49Å; R22-E26 WeakPolarHBondContact O-CG 3.34Å; R22-E26 PolarHBondContact O-N 3.44Å
23	R	54.3	Low	49.9	Very low	164 Å²	164	88.6 Å²	88.6	62%	0.619	53%	0.526	S	S	*	.	H	α-helix	trans	-62.2	-42.2	176.7	-72.5	-179	-178.2	173.3	0.2	112.9	N19 C25 E26 Q27	N19-R23 WeakPolarHBondContact O-CG 3.46Å; N19-R23 PolarHBondContact O-N 2.96Å; R23-C25 VanDerWaalsContact C-N 3.28Å; R23-C25 PolarHBondContact O-N 3.03Å; R23-E26 PolarHBondContact O-N 3.41Å; R23-Q27 WeakPolarHBondContact O-CG 3.37Å; R23-Q27 PolarHBondContact O-N 3.17Å
24	A	53.9	Low	51.6	Low	49 Å²	49	86.4 Å²	86.4	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-39.5	176.8	0	0	0	0	0	111.5	N20 R22 Q27 V28	N20-A24 WeakPolarHBondContact O-CB 3.39Å; N20-A24 PolarHBondContact O-N 2.75Å; R22-A24 PolarHBondContact O-N 3.05Å; A24-Q27 PolarHBondContact O-N 2.87Å; A24-V28 VanDerWaalsContact O-CG2 3.31Å; A24-V28 WeakPolarHBondContact O-CG2 3.24Å; A24-V28 PolarHBondContact O-N 2.97Å; A24-V28 VanDerWaalsContact O-N 3.08Å
25	C	51.2	Low	53.5	Low	30 Å²	30	83.6 Å²	83.6	20%	0.203	48%	0.484	C	S	.	.	H	α-helix	trans	-78.3	-33.3	179	-151.2	0	0	0	0	112.9	T21 R22 R23 Q27 V28 V29 I394	T21-C25 WeakPolarHBondContact O-CB 3.41Å; T21-C25 PolarHBondContact O-N 2.78Å; T21-C25 VanDerWaalsContact O-N 3.07Å; R22-C25 PolarHBondContact O-N 3.08Å; R23-C25 VanDerWaalsContact C-N 3.28Å; R23-C25 PolarHBondContact O-N 3.03Å; C25-Q27 VanDerWaalsContact C-N 3.31Å; C25-Q27 PolarHBondContact O-N 3.48Å; C25-V28 WeakPolarHBondContact O-CB 3.17Å; C25-V28 PolarHBondContact O-N 3.37Å; C25-V28 VanDerWaalsContact O-N 3.15Å; C25-V29 WeakPolarHBondContact O-CG2 3.27Å; C25-V29 PolarHBondContact O-N 3.29Å; C25-I394 HydrophobicContact CB-CD1 3.6Å; C25-I394 HydrophobicContact CB-CG1 4.4Å; C25-I394 WeakPolarHBondContact SG-CD1 3.34Å
26	E	54.6	Low	55.2	Low	95 Å²	95	87.3 Å²	87.3	44%	0.444	48%	0.482	S	S	.	.	H	α-helix	trans	-61.2	-37.9	168.3	-75	168.7	180	0	0	111.4	R22 R23 V29 S30	R22-E26 HydrophobicContact CG-CG 4.44Å; R22-E26 WeakPolarHBondContact CG-OE1 3.4Å; R22-E26 IonicContact CZ-OE1 3.71Å; R22-E26 IonicContact NE-OE1 2.86Å; R22-E26 PolarHBondContact NE-OE1 2.93Å; R22-E26 IonicContact NH2-OE1 3.7Å; R22-E26 WeakPolarHBondContact O-CB 3.49Å; R22-E26 WeakPolarHBondContact O-CG 3.34Å; R22-E26 PolarHBondContact O-N 3.44Å; R23-E26 PolarHBondContact O-N 3.41Å; E26-V29 PolarHBondContact O-N 3.31Å; E26-S30 WeakPolarHBondContact O-CB 3.3Å; E26-S30 PolarHBondContact O-N 3.07Å
27	Q	55.4	Low	56.9	Low	142 Å²	142	86.1 Å²	86.1	66%	0.664	46%	0.457	S	S	*	.	H	α-helix	trans	-65.2	-37.6	171	-80.2	-177.6	-41.2	0	0	112.8	R23 A24 C25 S30 S31	R23-Q27 WeakPolarHBondContact O-CG 3.37Å; R23-Q27 PolarHBondContact O-N 3.17Å; A24-Q27 PolarHBondContact O-N 2.87Å; C25-Q27 VanDerWaalsContact C-N 3.31Å; C25-Q27 PolarHBondContact O-N 3.48Å; Q27-S30 PolarHBondContact O-N 3.28Å; Q27-S31 PolarHBondContact O-N 3.46Å; Q27-S31 PolarHBondContact O-OG 3.25Å
28	V	57.4	Low	58	Low	63 Å²	63	82.8 Å²	82.8	38%	0.382	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-43.8	175	170.2	0	0	0	0	110.6	A24 C25 S30 S31 P403 V406	A24-V28 VanDerWaalsContact O-CG2 3.31Å; A24-V28 WeakPolarHBondContact O-CG2 3.24Å; A24-V28 PolarHBondContact O-N 2.97Å; A24-V28 VanDerWaalsContact O-N 3.08Å; C25-V28 WeakPolarHBondContact O-CB 3.17Å; C25-V28 PolarHBondContact O-N 3.37Å; C25-V28 VanDerWaalsContact O-N 3.15Å; V28-S30 VanDerWaalsContact C-N 3.29Å; V28-S30 PolarHBondContact O-N 3.31Å; V28-S31 PolarHBondContact O-N 3.02Å; V28-S31 VanDerWaalsContact O-N 3.16Å; V28-S31 PolarHBondContact O-OG 3.48Å; V28-S31 VanDerWaalsContact O-OG 3.1Å; V28-P403 HydrophobicContact CG1-CG 3.51Å; V28-V406 HydrophobicContact CG1-CG2 3.85Å
29	V	57.6	Low	59.3	Low	38 Å²	38	84.4 Å²	84.4	23%	0.23	45%	0.451	C	S	.	.	H	α-helix	trans	-65.9	-30.8	173.7	175.2	0	0	0	0	111.9	C25 E26 S31 V32 T400	C25-V29 WeakPolarHBondContact O-CG2 3.27Å; C25-V29 PolarHBondContact O-N 3.29Å; E26-V29 PolarHBondContact O-N 3.31Å; V29-S31 PolarHBondContact O-N 3.29Å; V29-V32 VanDerWaalsContact O-CG2 3.27Å; V29-V32 WeakPolarHBondContact O-CG2 3.27Å; V29-T400 HydrophobicContact CG1-CG2 3.49Å; V29-T400 VanDerWaalsContact CG1-CG2 3.49Å; V29-T400 HydrophobicContact CG2-CG2 4.48Å
30	S	55.9	Low	60.5	Low	106 Å²	106	81 Å²	81	74%	0.741	43%	0.432	S	S	*	.	H	α-helix	trans	-71	-15.3	175.1	-175.1	0	0	0	0	113.6	E26 Q27 V28	E26-S30 WeakPolarHBondContact O-CB 3.3Å; E26-S30 PolarHBondContact O-N 3.07Å; Q27-S30 PolarHBondContact O-N 3.28Å; V28-S30 VanDerWaalsContact C-N 3.29Å; V28-S30 PolarHBondContact O-N 3.31Å
31	S	60.4	Low	61.9	Low	81 Å²	81	78.8 Å²	78.8	57%	0.566	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	39.2	-176.7	52.2	0	0	0	0	112.5	Q27 V28 V29 P33	Q27-S31 PolarHBondContact O-N 3.46Å; Q27-S31 PolarHBondContact O-OG 3.25Å; V28-S31 PolarHBondContact O-N 3.02Å; V28-S31 VanDerWaalsContact O-N 3.16Å; V28-S31 PolarHBondContact O-OG 3.48Å; V28-S31 VanDerWaalsContact O-OG 3.1Å; V29-S31 PolarHBondContact O-N 3.29Å; S31-P33 WeakPolarHBondContact O-CD 3.23Å
32	V	63.2	Low	63	Low	49 Å²	49	82.2 Å²	82.2	30%	0.297	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-57.4	119.4	175	171.7	0	0	0	0	109.6	V29 I401 N421	V29-V32 VanDerWaalsContact O-CG2 3.27Å; V29-V32 WeakPolarHBondContact O-CG2 3.27Å; V32-I401 HydrophobicContact CG1-CG2 3.85Å; V32-I401 HydrophobicContact CG2-CB 4.28Å; V32-I401 HydrophobicContact CG2-CG2 4.18Å; V32-N421 WeakPolarHBondContact CG1-ND2 3.43Å; V32-N421 WeakPolarHBondContact CG1-OD1 3.49Å
33	P	65.8	Low	64.3	Low	60 Å²	60	75.7 Å²	75.7	39%	0.39	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.5	140.8	178.3	26.6	-32.3	0	0	0	111.1	S31 V35 I420 N421	S31-P33 WeakPolarHBondContact O-CD 3.23Å; P33-V35 PolarHBondContact O-N 3.01Å; P33-I420 HydrophobicContact CB-CG2 4.29Å; P33-I420 HydrophobicContact CG-CG2 3.73Å; P33-N421 PolarHBondContact O-ND2 3.01Å; P33-N421 PolarHBondContact O-OD1 3.37Å; P33-N421 VanDerWaalsContact O-OD1 3.13Å
34	L	69.1	Low	65.5	Low	127 Å²	127	72 Å²	72	67%	0.665	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-70.4	126.3	173.6	-169.5	76.2	0	0	0	109.7	K36 L287	L34-K36 PolarHBondContact O-N 3.48Å; L34-K36 VanDerWaalsContact O-N 3.12Å; L34-L287 HydrophobicContact CD1-CD2 4.26Å
35	V	68.6	Low	66.7	Low	10 Å²	10	74.8 Å²	74.8	6%	0.061	42%	0.421	C	S	.	.			trans	-67	110.9	172.5	-175.5	0	0	0	0	108.4	P33 M376 I420 N421	P33-V35 PolarHBondContact O-N 3.01Å; V35-M376 HydrophobicContact CG1-CB 4.01Å; V35-I420 HydrophobicContact CG2-CG2 4.3Å; V35-N421 HydrophobicContact CG2-CB 4.37Å; V35-N421 WeakPolarHBondContact CG2-ND2 3.32Å
36	K	67.2	Low	68.1	Low	143 Å²	143	75.3 Å²	75.3	62%	0.622	42%	0.421	S	S	*	.			trans	-84.8	131.7	172.6	-67.3	-176.7	-179.3	-179.1	0	108.6	L34	L34-K36 PolarHBondContact O-N 3.48Å; L34-K36 VanDerWaalsContact O-N 3.12Å
37	H	71.7	Confident	69.4	Low	46 Å²	46	73.6 Å²	73.6	21%	0.213	42%	0.42	C	S	.	.			trans	-109.2	139.9	176.1	-55.8	-82.3	0	0	0	110.9	C286 R373 H377	H37-C286 VanDerWaalsContact CD2-SG 3.55Å; H37-C286 PolarHBondContact NE2-SG 3.36Å; H37-C286 VanDerWaalsContact NE2-SG 3.39Å; H37-R373 WeakPolarHBondContact ND1-CG 3.33Å; H37-H377 AromaticContact CE1-CD2 3.93Å; H37-H377 AromaticContact CE1-NE2 3.43Å; H37-H377 PolarHBondContact CE1-NE2 2.87Å; H37-H377 AromaticContact NE2-CE1 3.86Å; H37-H377 AromaticContact NE2-NE2 3.16Å; H37-H377 PolarHBondContact NE2-NE2 3.17Å; H37-H377 VanDerWaalsContact NE2-NE2 3.16Å
38	C	68.8	Low	70.4	Confident	15 Å²	15	72.3 Å²	72.3	10%	0.101	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-68	151.6	167.2	-63.9	0	0	0	0	109.9	R373 V499	C38-R373 PolarHBondContact O-NH1 2.96Å; C38-R373 PolarHBondContact O-NH2 3.42Å; C38-V499 HydrophobicContact CB-CG1 3.94Å
39	T	73.4	Confident	71.4	Confident	129 Å²	129	73.7 Å²	73.7	79%	0.791	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-83.3	123.8	171.4	45.1	0	0	0	0	109.4
40	F	74.2	Confident	72.7	Confident	36 Å²	36	74.3 Å²	74.3	16%	0.158	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-87.2	128.4	176.6	-154.3	-94.6	0	0	0	109.7	V43 C365 D366 D369 L495 V496 V499 Y500	F40-V43 HydrophobicContact CD1-CG2 4.41Å; F40-V43 HydrophobicContact CE1-CG2 3.64Å; F40-C365 HydrophobicContact CE1-CB 4.46Å; F40-C365 HydrophobicContact CZ-CB 4.08Å; F40-D366 WeakPolarHBondContact CD1-OD1 3.32Å; F40-D366 WeakPolarHBondContact CE1-OD1 3.28Å; F40-D369 WeakPolarHBondContact CB-OD2 3.25Å; F40-D369 HydrophobicContact CD2-CB 3.91Å; F40-D369 HydrophobicContact CE2-CB 4.28Å; F40-D369 HydrophobicContact CG-CB 4.21Å; F40-L495 HydrophobicContact CE1-CD2 3.86Å; F40-L495 HydrophobicContact CZ-CD2 3.74Å; F40-L495 HydrophobicContact CZ-CG 4.17Å; F40-V496 HydrophobicContact CZ-CG2 4.45Å; F40-V499 HydrophobicContact CD2-CG1 4.15Å; F40-V499 HydrophobicContact CD2-CG2 4.31Å; F40-V499 HydrophobicContact CE2-CG2 4.28Å; F40-Y500 HydrophobicContact CE2-CE2 4.44Å
41	P	77	Confident	74.2	Confident	59 Å²	59	69.3 Å²	69.3	38%	0.383	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-70.2	154.2	177.6	30.2	-35	0	0	0	111.1	V43 L495 V499	P41-V43 PolarHBondContact O-N 3.15Å; P41-L495 HydrophobicContact CG-CD1 3.6Å; P41-L495 HydrophobicContact CG-CD2 4.33Å; P41-L495 HydrophobicContact CG-CG 4.33Å; P41-V499 HydrophobicContact CG-CG2 4.49Å
42	V	75.3	Confident	75.4	Confident	131 Å²	131	66.4 Å²	66.4	79%	0.794	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-69.5	119.8	176.8	-178.5	0	0	0	0	109.5
43	V	75.9	Confident	76.5	Confident	16 Å²	16	70.2 Å²	70.2	10%	0.097	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-95	135.6	179.6	-175.4	0	0	0	0	110.3	F40 P41 K45 D366 L495	F40-V43 HydrophobicContact CD1-CG2 4.41Å; F40-V43 HydrophobicContact CE1-CG2 3.64Å; P41-V43 PolarHBondContact O-N 3.15Å; V43-K45 PolarHBondContact O-N 2.99Å; V43-K45 VanDerWaalsContact O-N 3.12Å; V43-D366 WeakPolarHBondContact CG2-OD1 3.49Å; V43-L495 HydrophobicContact CG2-CD2 3.21Å
44	P	78.7	Confident	77.8	Confident	87 Å²	87	68.8 Å²	68.8	57%	0.565	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-62.1	116.6	172	25.2	-33.8	0	0	0	110.4	R491	P44-R491 PolarHBondContact O-NH2 3.16Å; P44-R491 VanDerWaalsContact O-NH2 3.15Å
45	K	79.2	Confident	78.8	Confident	108 Å²	108	63 Å²	63	47%	0.47	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-89	142.5	178.1	-62.5	-179.5	-176.6	177.9	0	110.1	V43 S47 D366	V43-K45 PolarHBondContact O-N 2.99Å; V43-K45 VanDerWaalsContact O-N 3.12Å; K45-S47 PolarHBondContact O-N 3.47Å; K45-D366 WeakPolarHBondContact CE-OD2 3.14Å; K45-D366 IonicContact NZ-OD2 3.75Å; K45-D366 PolarHBondContact NZ-OD2 3.26Å
46	L	81.2	Confident	79.8	Confident	40 Å²	40	63.9 Å²	63.9	21%	0.209	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.1	125.4	171.7	-169.8	60.8	0	0	0	108.7	S50 F51 L357 Y361	L46-S50 VanDerWaalsContact CD1-OG 3.32Å; L46-S50 WeakPolarHBondContact CD1-OG 3.46Å; L46-F51 HydrophobicContact CD2-CB 3.66Å; L46-F51 HydrophobicContact CD2-CD2 4.06Å; L46-F51 HydrophobicContact CD2-CG 4.37Å; L46-F51 HydrophobicContact CG-CB 3.94Å; L46-L357 HydrophobicContact CD2-CD1 4.27Å; L46-Y361 HydrophobicContact CB-CD2 4.4Å
47	S	80.7	Confident	81.1	Confident	60 Å²	60	60 Å²	60	42%	0.42	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-63.6	148.6	177.6	69.9	0	0	0	0	109.9	K45 T49 S50 F51	K45-S47 PolarHBondContact O-N 3.47Å; S47-T49 PolarHBondContact O-N 3.45Å; S47-T49 PolarHBondContact OG-OG1 3.38Å; S47-S50 PolarHBondContact O-N 2.94Å; S47-S50 VanDerWaalsContact O-N 3.08Å; S47-S50 WeakPolarHBondContact OG-CB 3.38Å; S47-S50 PolarHBondContact OG-N 3.24Å; S47-S50 VanDerWaalsContact OG-N 3.12Å; S47-F51 PolarHBondContact O-N 3.45Å
48	R	77.6	Confident	82.2	Confident	114 Å²	114	58 Å²	58	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-51.8	-43	176.8	-179.9	174.3	68.9	170.8	0	111.6	L52 P248 Y361	R48-L52 HydrophobicContact CG-CD1 3.84Å; R48-L52 HydrophobicContact CG-CG 4.5Å; R48-L52 WeakPolarHBondContact O-CB 3.41Å; R48-L52 WeakPolarHBondContact O-CD1 3.3Å; R48-L52 WeakPolarHBondContact O-CG 3.23Å; R48-L52 PolarHBondContact O-N 2.88Å; R48-P248 HydrophobicContact CB-CG 4.5Å; R48-Y361 WeakPolarHBondContact CA-OH 2.99Å; R48-Y361 WeakPolarHBondContact CB-OH 3.4Å; R48-Y361 WeakPolarHBondContact CG-OH 3.35Å
49	T	77.8	Confident	83.3	Confident	93 Å²	93	57.6 Å²	57.6	57%	0.571	32%	0.316	S	S	*	.	H	α-helix	trans	-66.5	-42.8	178.7	50.5	0	0	0	0	112.5	S47 L52 F53	S47-T49 PolarHBondContact O-N 3.45Å; S47-T49 PolarHBondContact OG-OG1 3.38Å; T49-L52 PolarHBondContact O-N 2.86Å; T49-F53 WeakPolarHBondContact O-CB 3.39Å; T49-F53 PolarHBondContact O-N 3.4Å
50	S	84.7	Confident	84.3	Confident	50 Å²	50	53.9 Å²	53.9	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-67.5	-40	178.7	-173.4	0	0	0	0	112	L46 S47 F53 L54	L46-S50 VanDerWaalsContact CD1-OG 3.32Å; L46-S50 WeakPolarHBondContact CD1-OG 3.46Å; S47-S50 PolarHBondContact O-N 2.94Å; S47-S50 VanDerWaalsContact O-N 3.08Å; S47-S50 WeakPolarHBondContact OG-CB 3.38Å; S47-S50 PolarHBondContact OG-N 3.24Å; S47-S50 VanDerWaalsContact OG-N 3.12Å; S50-F53 PolarHBondContact O-N 3.21Å; S50-L54 VanDerWaalsContact O-CB 3.26Å; S50-L54 WeakPolarHBondContact O-CB 3.44Å; S50-L54 PolarHBondContact O-N 2.75Å
51	F	88.1	Confident	85.3	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-47	174.9	168.6	-105.2	0	0	0	111.6	L46 S47 L54 S55 P246 L357 R358 Y361 F362	L46-F51 HydrophobicContact CD2-CB 3.66Å; L46-F51 HydrophobicContact CD2-CD2 4.06Å; L46-F51 HydrophobicContact CD2-CG 4.37Å; L46-F51 HydrophobicContact CG-CB 3.94Å; S47-F51 PolarHBondContact O-N 3.45Å; F51-L54 PolarHBondContact O-N 3.02Å; F51-S55 WeakPolarHBondContact CE2-OG 3.45Å; F51-S55 VanDerWaalsContact O-CB 3.28Å; F51-S55 WeakPolarHBondContact O-CB 3.42Å; F51-S55 PolarHBondContact O-N 3.29Å; F51-S55 PolarHBondContact O-OG 3.29Å; F51-P246 HydrophobicContact CD1-CG 4.23Å; F51-P246 HydrophobicContact CE1-CB 4.04Å; F51-P246 HydrophobicContact CE1-CG 3.71Å; F51-L357 HydrophobicContact CD2-CD1 4.42Å; F51-L357 HydrophobicContact CD2-CG 4.34Å; F51-L357 HydrophobicContact CE2-CG 4.13Å; F51-R358 HydrophobicContact CE2-CG 4.31Å; F51-R358 HydrophobicContact CZ-CG 4.05Å; F51-Y361 HydrophobicContact CB-CD2 3.43Å; F51-Y361 VanDerWaalsContact CB-CD2 3.43Å; F51-Y361 HydrophobicContact CB-CE2 3.48Å; F51-Y361 VanDerWaalsContact CB-CE2 3.48Å; F51-Y361 HydrophobicContact CB-CG 4.12Å; F51-Y361 AromaticContact CD1-CD1 3.8Å; F51-Y361 HydrophobicContact CD1-CD1 3.8Å; F51-Y361 AromaticContact CD1-CD2 3.9Å; F51-Y361 HydrophobicContact CD1-CD2 3.9Å; F51-Y361 AromaticContact CD1-CE1 3.81Å; F51-Y361 HydrophobicContact CD1-CE1 3.81Å; F51-Y361 AromaticContact CD1-CE2 3.88Å; F51-Y361 HydrophobicContact CD1-CE2 3.88Å; F51-Y361 AromaticContact CD1-CG 3.82Å; F51-Y361 HydrophobicContact CD1-CG 3.82Å; F51-Y361 AromaticContact CD1-CZ 3.79Å; F51-Y361 HydrophobicContact CD2-CD1 4.23Å; F51-Y361 AromaticContact CD2-CD2 3.73Å; F51-Y361 HydrophobicContact CD2-CD2 3.73Å; F51-Y361 HydrophobicContact CD2-CE2 4.47Å; F51-Y361 AromaticContact CD2-CG 3.54Å; F51-Y361 HydrophobicContact CD2-CG 3.54Å; F51-Y361 AromaticContact CE1-CD1 3.82Å; F51-Y361 HydrophobicContact CE1-CD1 3.82Å; F51-Y361 HydrophobicContact CE1-CE1 4.04Å; F51-Y361 HydrophobicContact CE1-CG 4.11Å; F51-Y361 HydrophobicContact CE2-CD1 4.23Å; F51-Y361 HydrophobicContact CE2-CD2 4.48Å; F51-Y361 AromaticContact CE2-CG 3.85Å; F51-Y361 HydrophobicContact CE2-CG 3.85Å; F51-Y361 HydrophobicContact CG-CD1 4.01Å; F51-Y361 AromaticContact CG-CD2 3.37Å; F51-Y361 HydrophobicContact CG-CD2 3.37Å; F51-Y361 HydrophobicContact CG-CE1 4.3Å; F51-Y361 AromaticContact CG-CE2 3.68Å; F51-Y361 HydrophobicContact CG-CE2 3.68Å; F51-Y361 AromaticContact CG-CG 3.51Å; F51-Y361 HydrophobicContact CG-CG 3.51Å; F51-Y361 HydrophobicContact CZ-CD1 4.03Å; F51-Y361 HydrophobicContact CZ-CG 4.12Å; F51-F362 HydrophobicContact CZ-CE2 4.44Å
52	L	84.6	Confident	86.1	Confident	21 Å²	21	50.9 Å²	50.9	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-46.7	178.7	-73.2	168	0	0	0	111.3	R48 T49 L54 S55 L56 Y107 L110 P246	R48-L52 HydrophobicContact CG-CD1 3.84Å; R48-L52 HydrophobicContact CG-CG 4.5Å; R48-L52 WeakPolarHBondContact O-CB 3.41Å; R48-L52 WeakPolarHBondContact O-CD1 3.3Å; R48-L52 WeakPolarHBondContact O-CG 3.23Å; R48-L52 PolarHBondContact O-N 2.88Å; T49-L52 PolarHBondContact O-N 2.86Å; L52-L54 PolarHBondContact O-N 3.36Å; L52-S55 PolarHBondContact O-N 2.87Å; L52-L56 WeakPolarHBondContact O-CB 3.45Å; L52-L56 PolarHBondContact O-N 2.98Å; L52-Y107 HydrophobicContact CB-CD1 3.84Å; L52-Y107 HydrophobicContact CB-CE1 3.73Å; L52-Y107 HydrophobicContact CD2-CD1 3.78Å; L52-Y107 HydrophobicContact CD2-CE1 3.52Å; L52-Y107 HydrophobicContact CG-CD1 4.33Å; L52-Y107 HydrophobicContact CG-CE1 4.22Å; L52-Y107 WeakPolarHBondContact O-CE1 3.29Å; L52-L110 HydrophobicContact CD1-CD1 3.36Å; L52-L110 HydrophobicContact CD2-CD1 3.96Å; L52-L110 HydrophobicContact CG-CD1 4.32Å; L52-P246 HydrophobicContact CD2-CG 3.96Å
53	F	87.9	Confident	86.9	Confident	129 Å²	129	44.9 Å²	44.9	57%	0.566	24%	0.238	S	C	*	.	H	α-helix	trans	-57.9	-48.6	176.7	176.3	-101.5	0	0	0	111.6	T49 S50 S55 L56 M57	T49-F53 WeakPolarHBondContact O-CB 3.39Å; T49-F53 PolarHBondContact O-N 3.4Å; S50-F53 PolarHBondContact O-N 3.21Å; F53-S55 PolarHBondContact O-N 3.45Å; F53-L56 PolarHBondContact O-N 3.33Å; F53-M57 HydrophobicContact CD1-CG 4.24Å; F53-M57 HydrophobicContact CD2-CE 4.37Å; F53-M57 HydrophobicContact CD2-CG 4.37Å; F53-M57 HydrophobicContact CE1-CG 3.81Å; F53-M57 HydrophobicContact CE2-CE 3.84Å; F53-M57 HydrophobicContact CE2-CG 3.97Å; F53-M57 HydrophobicContact CE2-SD 4.17Å; F53-M57 HydrophobicContact CZ-CE 4.32Å; F53-M57 HydrophobicContact CZ-CG 3.66Å; F53-M57 HydrophobicContact CZ-SD 4.03Å; F53-M57 VanDerWaalsContact O-CG 3.29Å; F53-M57 WeakPolarHBondContact O-CG 3.41Å; F53-M57 PolarHBondContact O-N 2.93Å
54	L	92.3	Very high	87.8	Confident	29 Å²	29	48.9 Å²	48.9	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-39.6	-179.8	-175.6	70.9	0	0	0	112.3	S50 F51 L52 M57 L58 L357 F481 L484	S50-L54 VanDerWaalsContact O-CB 3.26Å; S50-L54 WeakPolarHBondContact O-CB 3.44Å; S50-L54 PolarHBondContact O-N 2.75Å; F51-L54 PolarHBondContact O-N 3.02Å; L52-L54 PolarHBondContact O-N 3.36Å; L54-M57 PolarHBondContact O-N 3.47Å; L54-L58 VanDerWaalsContact O-CB 3.27Å; L54-L58 WeakPolarHBondContact O-CB 3.36Å; L54-L58 PolarHBondContact O-N 3.23Å; L54-L357 HydrophobicContact CB-CD2 4.41Å; L54-L357 HydrophobicContact CD2-CD1 3.44Å; L54-L357 VanDerWaalsContact CD2-CD1 3.44Å; L54-L357 HydrophobicContact CD2-CD2 3.62Å; L54-L357 HydrophobicContact CD2-CG 4.18Å; L54-L357 HydrophobicContact CG-CD2 3.8Å; L54-F481 HydrophobicContact CD1-CD1 3.86Å; L54-F481 HydrophobicContact CD1-CE1 3.6Å; L54-F481 HydrophobicContact CG-CD1 4.44Å; L54-F481 HydrophobicContact CG-CE1 4.32Å; L54-L484 HydrophobicContact CD1-CD2 3.53Å; L54-L484 HydrophobicContact CD2-CD2 3.36Å; L54-L484 HydrophobicContact CG-CD2 4.06Å
55	S	90.3	Very high	88.5	Confident	5 Å²	5	44.9 Å²	44.9	4%	0.035	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-39.9	176.3	-61.8	0	0	0	0	111.5	F51 L52 F53 C59 Y107	F51-S55 WeakPolarHBondContact CE2-OG 3.45Å; F51-S55 VanDerWaalsContact O-CB 3.28Å; F51-S55 WeakPolarHBondContact O-CB 3.42Å; F51-S55 PolarHBondContact O-N 3.29Å; F51-S55 PolarHBondContact O-OG 3.29Å; L52-S55 PolarHBondContact O-N 2.87Å; F53-S55 PolarHBondContact O-N 3.45Å; S55-C59 PolarHBondContact O-N 3.36Å; S55-C59 PolarHBondContact O-SG 2.9Å; S55-Y107 VanDerWaalsContact CB-OH 3.24Å; S55-Y107 WeakPolarHBondContact CB-OH 3.45Å
56	L	90.3	Very high	89.2	Confident	30 Å²	30	39.8 Å²	39.8	16%	0.157	21%	0.21	C	C	.	.	H	α-helix	trans	-65.9	-48	175	178.7	61.8	0	0	0	110.9	L52 F53 L58 C59 L60 Y107	L52-L56 WeakPolarHBondContact O-CB 3.45Å; L52-L56 PolarHBondContact O-N 2.98Å; F53-L56 PolarHBondContact O-N 3.33Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.82Å; L56-C59 PolarHBondContact O-N 3.39Å; L56-L60 HydrophobicContact CD1-CD1 3.97Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CG-CD1 3.89Å; L56-L60 HydrophobicContact CG-CG 4.31Å; L56-L60 WeakPolarHBondContact O-CB 3.21Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.32Å; L56-L60 PolarHBondContact O-N 3.03Å; L56-Y107 HydrophobicContact CB-CD1 4.4Å; L56-Y107 HydrophobicContact CB-CD2 4.31Å; L56-Y107 HydrophobicContact CB-CE1 4.04Å; L56-Y107 HydrophobicContact CB-CE2 3.9Å; L56-Y107 HydrophobicContact CD1-CD2 3.82Å; L56-Y107 HydrophobicContact CD1-CE2 3.72Å; L56-Y107 HydrophobicContact CD2-CD2 4.46Å; L56-Y107 HydrophobicContact CD2-CG 4.45Å; L56-Y107 HydrophobicContact CG-CD2 4.42Å; L56-Y107 HydrophobicContact CG-CE2 4.33Å; L56-Y107 PolarHBondContact N-OH 3.02Å
57	M	93.4	Very high	89.7	Confident	62 Å²	62	38.8 Å²	38.8	31%	0.305	20%	0.204	S	C	.	.	H	α-helix	trans	-57.2	-48.3	177.3	-71.2	-60.5	111.3	0	0	110.7	F53 L54 C59 L60 T61 F481	F53-M57 HydrophobicContact CD1-CG 4.24Å; F53-M57 HydrophobicContact CD2-CE 4.37Å; F53-M57 HydrophobicContact CD2-CG 4.37Å; F53-M57 HydrophobicContact CE1-CG 3.81Å; F53-M57 HydrophobicContact CE2-CE 3.84Å; F53-M57 HydrophobicContact CE2-CG 3.97Å; F53-M57 HydrophobicContact CE2-SD 4.17Å; F53-M57 HydrophobicContact CZ-CE 4.32Å; F53-M57 HydrophobicContact CZ-CG 3.66Å; F53-M57 HydrophobicContact CZ-SD 4.03Å; F53-M57 VanDerWaalsContact O-CG 3.29Å; F53-M57 WeakPolarHBondContact O-CG 3.41Å; F53-M57 PolarHBondContact O-N 2.93Å; L54-M57 PolarHBondContact O-N 3.47Å; M57-C59 PolarHBondContact O-N 3.31Å; M57-L60 HydrophobicContact CE-CD1 4.11Å; M57-L60 PolarHBondContact O-N 3.37Å; M57-T61 WeakPolarHBondContact O-CB 3.31Å; M57-T61 WeakPolarHBondContact O-CG2 3.46Å; M57-T61 PolarHBondContact O-N 3Å; M57-T61 PolarHBondContact O-OG1 3.49Å; M57-F481 HydrophobicContact CB-CE1 4.44Å; M57-F481 HydrophobicContact CB-CZ 4.2Å
58	L	94.5	Very high	90.2	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-56	-49.9	176.4	176.6	59.6	0	0	0	111.7	L54 L56 L60 T61 S62 V353 V354 L357 F481	L54-L58 VanDerWaalsContact O-CB 3.27Å; L54-L58 WeakPolarHBondContact O-CB 3.36Å; L54-L58 PolarHBondContact O-N 3.23Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.82Å; L58-L60 PolarHBondContact O-N 3.5Å; L58-T61 WeakPolarHBondContact CA-OG1 3.42Å; L58-T61 PolarHBondContact O-N 2.96Å; L58-T61 PolarHBondContact O-OG1 3.46Å; L58-S62 WeakPolarHBondContact O-CB 3.39Å; L58-S62 PolarHBondContact O-N 3.18Å; L58-S62 PolarHBondContact O-OG 3.44Å; L58-V353 HydrophobicContact CD1-CG1 3.79Å; L58-V353 HydrophobicContact CD2-CG1 3.85Å; L58-V354 HydrophobicContact CD2-CB 4.27Å; L58-V354 HydrophobicContact CD2-CG2 3.48Å; L58-V354 VanDerWaalsContact CD2-CG2 3.48Å; L58-V354 HydrophobicContact CG-CG2 4.05Å; L58-L357 HydrophobicContact CD2-CD2 4.22Å; L58-F481 HydrophobicContact CB-CD1 4.01Å; L58-F481 HydrophobicContact CB-CE1 3.72Å; L58-F481 HydrophobicContact CB-CZ 4.03Å; L58-F481 HydrophobicContact CD1-CB 4.03Å; L58-F481 HydrophobicContact CD1-CD1 3.98Å; L58-F481 HydrophobicContact CD1-CD2 3.72Å; L58-F481 HydrophobicContact CD1-CE1 4.34Å; L58-F481 HydrophobicContact CD1-CE2 4.12Å; L58-F481 HydrophobicContact CD1-CG 3.65Å; L58-F481 HydrophobicContact CD1-CZ 4.41Å; L58-F481 HydrophobicContact CG-CD1 4.44Å
59	C	93	Very high	90.8	Very high	8 Å²	8	32.1 Å²	32.1	5%	0.054	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-42.8	179.6	-69.8	0	0	0	0	112.5	S55 L56 M57 S62 T63 L103	S55-C59 PolarHBondContact O-N 3.36Å; S55-C59 PolarHBondContact O-SG 2.9Å; L56-C59 PolarHBondContact O-N 3.39Å; M57-C59 PolarHBondContact O-N 3.31Å; C59-S62 PolarHBondContact O-N 2.86Å; C59-T63 WeakPolarHBondContact O-CB 3.36Å; C59-T63 PolarHBondContact O-N 2.86Å; C59-T63 PolarHBondContact O-OG1 3.4Å; C59-L103 HydrophobicContact CB-CD1 4.02Å; C59-L103 HydrophobicContact CB-CD2 3.88Å; C59-L103 HydrophobicContact CB-CG 4.43Å
60	L	93.6	Very high	91.4	Very high	50 Å²	50	27.8 Å²	27.8	26%	0.262	15%	0.145	S	C	.	.	H	α-helix	trans	-65.6	-43.5	179.3	-70.8	175.9	0	0	0	111.4	L56 M57 L58 T63 L64 I100	L56-L60 HydrophobicContact CD1-CD1 3.97Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CG-CD1 3.89Å; L56-L60 HydrophobicContact CG-CG 4.31Å; L56-L60 WeakPolarHBondContact O-CB 3.21Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.32Å; L56-L60 PolarHBondContact O-N 3.03Å; M57-L60 HydrophobicContact CE-CD1 4.11Å; M57-L60 PolarHBondContact O-N 3.37Å; L58-L60 PolarHBondContact O-N 3.5Å; L60-T63 PolarHBondContact O-N 3.36Å; L60-L64 WeakPolarHBondContact O-CB 3.18Å; L60-L64 PolarHBondContact O-N 3.47Å; L60-I100 HydrophobicContact CD2-CG1 4.3Å; L60-I100 HydrophobicContact CD2-CG2 4.27Å
61	T	94.7	Very high	91.6	Very high	33 Å²	33	25.7 Å²	25.7	20%	0.202	13%	0.13	C	C	.	.	H	α-helix	trans	-66.9	-42.2	176.9	52.6	0	0	0	0	111.9	M57 L58 T63 L64 T65 I477 F481	M57-T61 WeakPolarHBondContact O-CB 3.31Å; M57-T61 WeakPolarHBondContact O-CG2 3.46Å; M57-T61 PolarHBondContact O-N 3Å; M57-T61 PolarHBondContact O-OG1 3.49Å; L58-T61 WeakPolarHBondContact CA-OG1 3.42Å; L58-T61 PolarHBondContact O-N 2.96Å; L58-T61 PolarHBondContact O-OG1 3.46Å; T61-T63 VanDerWaalsContact C-N 3.27Å; T61-T63 PolarHBondContact O-N 3.3Å; T61-L64 WeakPolarHBondContact O-CB 3.19Å; T61-L64 PolarHBondContact O-N 2.95Å; T61-T65 WeakPolarHBondContact O-CG2 3.35Å; T61-T65 PolarHBondContact O-N 3.44Å; T61-T65 PolarHBondContact O-OG1 3Å; T61-T65 VanDerWaalsContact O-OG1 3.1Å; T61-I477 HydrophobicContact CG2-CG2 3.97Å; T61-F481 HydrophobicContact CG2-CE2 4.45Å; T61-F481 WeakPolarHBondContact OG1-CE2 3.36Å
62	S	94.2	Very high	91.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-34.1	174.9	-62	0	0	0	0	112	L58 C59 T65 Q66 H346 T350	L58-S62 WeakPolarHBondContact O-CB 3.39Å; L58-S62 PolarHBondContact O-N 3.18Å; L58-S62 PolarHBondContact O-OG 3.44Å; C59-S62 PolarHBondContact O-N 2.86Å; S62-T65 VanDerWaalsContact CA-OG1 3.29Å; S62-T65 WeakPolarHBondContact CA-OG1 3.48Å; S62-T65 PolarHBondContact O-OG1 3.14Å; S62-Q66 WeakPolarHBondContact O-CB 3.1Å; S62-Q66 PolarHBondContact O-N 3.22Å; S62-H346 PolarHBondContact O-CE1 3.02Å; S62-H346 VanDerWaalsContact O-CE1 3.22Å; S62-T350 WeakPolarHBondContact OG-CG2 3.3Å; S62-T350 PolarHBondContact OG-OG1 2.8Å
63	T	93.3	Very high	91.5	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-47.3	173.8	-56.2	0	0	0	0	110.1	C59 L60 T61 Q66 H67 I99 L103 G323	C59-T63 WeakPolarHBondContact O-CB 3.36Å; C59-T63 PolarHBondContact O-N 2.86Å; C59-T63 PolarHBondContact O-OG1 3.4Å; L60-T63 PolarHBondContact O-N 3.36Å; T61-T63 VanDerWaalsContact C-N 3.27Å; T61-T63 PolarHBondContact O-N 3.3Å; T63-Q66 PolarHBondContact O-N 3.42Å; T63-H67 PolarHBondContact O-N 3.43Å; T63-H67 PolarHBondContact O-ND1 3.04Å; T63-I99 HydrophobicContact CG2-CG2 3.71Å; T63-L103 WeakPolarHBondContact OG1-CD1 3.48Å; T63-G323 WeakPolarHBondContact CA-O 3.26Å; T63-G323 WeakPolarHBondContact OG1-CA 3.44Å
64	L	93.3	Very high	91.3	Very high	99 Å²	99	25.2 Å²	25.2	52%	0.518	13%	0.132	S	C	.	.	H	α-helix	trans	-59.5	-49.6	178.2	177.5	63.9	0	0	0	111.7	L60 T61 Q66 H67 M68	L60-L64 WeakPolarHBondContact O-CB 3.18Å; L60-L64 PolarHBondContact O-N 3.47Å; T61-L64 WeakPolarHBondContact O-CB 3.19Å; T61-L64 PolarHBondContact O-N 2.95Å; L64-Q66 VanDerWaalsContact C-N 3.28Å; L64-Q66 PolarHBondContact O-N 3.13Å; L64-H67 PolarHBondContact O-N 3.42Å; L64-H67 VanDerWaalsContact O-N 3.17Å; L64-M68 VanDerWaalsContact O-CG 3.3Å; L64-M68 WeakPolarHBondContact O-CG 3.44Å; L64-M68 PolarHBondContact O-N 3.49Å
65	T	93.8	Very high	90.7	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-62.5	-35.6	179.2	52.7	0	0	0	0	111.9	T61 S62 M68 N69 H346 I477	T61-T65 WeakPolarHBondContact O-CG2 3.35Å; T61-T65 PolarHBondContact O-N 3.44Å; T61-T65 PolarHBondContact O-OG1 3Å; T61-T65 VanDerWaalsContact O-OG1 3.1Å; S62-T65 VanDerWaalsContact CA-OG1 3.29Å; S62-T65 WeakPolarHBondContact CA-OG1 3.48Å; S62-T65 PolarHBondContact O-OG1 3.14Å; T65-M68 WeakPolarHBondContact O-CB 3.43Å; T65-M68 PolarHBondContact O-N 2.95Å; T65-N69 PolarHBondContact O-N 3.3Å; T65-N69 PolarHBondContact O-ND2 3.22Å; T65-H346 PolarHBondContact OG1-CE1 3.47Å; T65-H346 VanDerWaalsContact OG1-CE1 3.22Å; T65-H346 PolarHBondContact OG1-NE2 2.93Å; T65-I477 HydrophobicContact CG2-CB 4.25Å; T65-I477 HydrophobicContact CG2-CD1 3.94Å; T65-I477 HydrophobicContact CG2-CG2 4.22Å
66	Q	94	Very high	90.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.2	-165.1	75.6	-32.5	0	0	112.3	S62 T63 L64 M68 N69 L70 C324 P327 I328 C343 H346	S62-Q66 WeakPolarHBondContact O-CB 3.1Å; S62-Q66 PolarHBondContact O-N 3.22Å; T63-Q66 PolarHBondContact O-N 3.42Å; L64-Q66 VanDerWaalsContact C-N 3.28Å; L64-Q66 PolarHBondContact O-N 3.13Å; Q66-M68 VanDerWaalsContact C-N 3.31Å; Q66-M68 PolarHBondContact O-N 2.65Å; Q66-N69 WeakPolarHBondContact O-CB 3.45Å; Q66-N69 PolarHBondContact O-N 3Å; Q66-N69 VanDerWaalsContact O-N 3.15Å; Q66-N69 PolarHBondContact OE1-ND2 3.41Å; Q66-L70 HydrophobicContact CG-CD1 4.28Å; Q66-L70 VanDerWaalsContact O-CG 3.3Å; Q66-L70 WeakPolarHBondContact O-CG 3.14Å; Q66-L70 PolarHBondContact O-N 3.39Å; Q66-L70 VanDerWaalsContact O-N 3.1Å; Q66-C324 PolarHBondContact NE2-O 3.46Å; Q66-P327 HydrophobicContact CG-CB 4.07Å; Q66-P327 HydrophobicContact CG-CG 4.28Å; Q66-I328 VanDerWaalsContact NE2-CD1 3.34Å; Q66-C343 PolarHBondContact NE2-O 3.47Å; Q66-H346 PolarHBondContact OE1-ND1 3.38Å
67	H	91.2	Very high	89.9	Confident	19 Å²	19	39.3 Å²	39.3	9%	0.088	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-39.2	175.1	-73.9	77.6	0	0	0	111.5	T63 L64 N69 L70 Y71 T96	T63-H67 PolarHBondContact O-N 3.43Å; T63-H67 PolarHBondContact O-ND1 3.04Å; L64-H67 PolarHBondContact O-N 3.42Å; L64-H67 VanDerWaalsContact O-N 3.17Å; H67-N69 VanDerWaalsContact C-N 3.3Å; H67-N69 PolarHBondContact O-N 2.96Å; H67-L70 PolarHBondContact O-N 2.96Å; H67-Y71 HydrophobicContact CB-CD2 4.44Å; H67-Y71 AromaticContact CD2-CE2 3.99Å; H67-Y71 WeakPolarHBondContact O-CD2 3.01Å; H67-Y71 PolarHBondContact O-N 3.43Å; H67-T96 PolarHBondContact NE2-OG1 2.85Å
68	M	91.2	Very high	89.1	Confident	32 Å²	32	41.3 Å²	41.3	16%	0.158	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-40	172.8	-65.2	-67.5	-59	0	0	112.1	L64 T65 Q66 L70 V86 W469	L64-M68 VanDerWaalsContact O-CG 3.3Å; L64-M68 WeakPolarHBondContact O-CG 3.44Å; L64-M68 PolarHBondContact O-N 3.49Å; T65-M68 WeakPolarHBondContact O-CB 3.43Å; T65-M68 PolarHBondContact O-N 2.95Å; Q66-M68 VanDerWaalsContact C-N 3.31Å; Q66-M68 PolarHBondContact O-N 2.65Å; M68-L70 VanDerWaalsContact C-N 3.31Å; M68-L70 PolarHBondContact O-N 2.85Å; M68-V86 HydrophobicContact CE-CG2 3.76Å; M68-V86 HydrophobicContact SD-CG2 3.27Å; M68-V86 WeakPolarHBondContact SD-CG2 3.33Å; M68-W469 HydrophobicContact CE-CH2 3.42Å; M68-W469 VanDerWaalsContact CE-CH2 3.42Å; M68-W469 HydrophobicContact CE-CZ3 3.46Å; M68-W469 VanDerWaalsContact CE-CZ3 3.46Å
69	N	91.3	Very high	88.4	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-33.9	178.4	-68.8	-33.1	0	0	0	112.5	T65 Q66 H67 R72 W342 Y470	T65-N69 PolarHBondContact O-N 3.3Å; T65-N69 PolarHBondContact O-ND2 3.22Å; Q66-N69 WeakPolarHBondContact O-CB 3.45Å; Q66-N69 PolarHBondContact O-N 3Å; Q66-N69 VanDerWaalsContact O-N 3.15Å; Q66-N69 PolarHBondContact OE1-ND2 3.41Å; H67-N69 VanDerWaalsContact C-N 3.3Å; H67-N69 PolarHBondContact O-N 2.96Å; N69-R72 PolarHBondContact O-NH1 3.28Å; N69-W342 PolarHBondContact OD1-NE1 2.85Å; N69-Y470 HydrophobicContact CB-CE2 4.46Å; N69-Y470 WeakPolarHBondContact OD1-CD2 3.41Å
70	L	90.8	Very high	87.8	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-82.8	-46.4	-176.6	-66.2	171.6	0	0	0	112.9	Q66 H67 M68 P327 I328 V331 I338	Q66-L70 HydrophobicContact CG-CD1 4.28Å; Q66-L70 VanDerWaalsContact O-CG 3.3Å; Q66-L70 WeakPolarHBondContact O-CG 3.14Å; Q66-L70 PolarHBondContact O-N 3.39Å; Q66-L70 VanDerWaalsContact O-N 3.1Å; H67-L70 PolarHBondContact O-N 2.96Å; M68-L70 VanDerWaalsContact C-N 3.31Å; M68-L70 PolarHBondContact O-N 2.85Å; L70-P327 HydrophobicContact CD1-CB 3.56Å; L70-P327 WeakPolarHBondContact CD1-O 3.11Å; L70-I328 HydrophobicContact CD2-CG1 4.44Å; L70-V331 HydrophobicContact CD1-CG2 4.1Å; L70-V331 HydrophobicContact CD2-CG2 3.89Å; L70-V331 HydrophobicContact CG-CG2 4.43Å; L70-I338 HydrophobicContact CD2-CD1 4.16Å; L70-I338 HydrophobicContact CD2-CG2 3.79Å
71	Y	89	Confident	87.1	Confident	6 Å²	6	54.3 Å²	54.3	2%	0.024	29%	0.287	C	S	.	.	S	Bend	trans	-110.1	27.3	-166.3	-59.4	-76.8	0	0	0	114	H67 V86 E87 S90 V91 L336	H67-Y71 HydrophobicContact CB-CD2 4.44Å; H67-Y71 AromaticContact CD2-CE2 3.99Å; H67-Y71 WeakPolarHBondContact O-CD2 3.01Å; H67-Y71 PolarHBondContact O-N 3.43Å; Y71-V86 WeakPolarHBondContact O-CA 3.46Å; Y71-E87 PolarHBondContact O-N 3.33Å; Y71-S90 WeakPolarHBondContact CE1-O 3.45Å; Y71-V91 HydrophobicContact CD1-CG2 4.07Å; Y71-V91 HydrophobicContact CD2-CG2 3.62Å; Y71-V91 HydrophobicContact CE1-CG2 4.36Å; Y71-V91 HydrophobicContact CE2-CG2 3.95Å; Y71-V91 HydrophobicContact CG-CG2 3.68Å; Y71-L336 HydrophobicContact CD1-CD1 4Å; Y71-L336 HydrophobicContact CE1-CD1 4.13Å
72	R	86.8	Confident	86.4	Confident	53 Å²	53	55.8 Å²	55.8	20%	0.2	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-62.5	146.8	179	70.6	-172.6	-172.2	-77.5	1.1	112.4	N69 Y337 Y470	N69-R72 PolarHBondContact O-NH1 3.28Å; R72-Y337 VanDerWaalsContact CZ-O 3.25Å; R72-Y337 PolarHBondContact NH1-O 3.01Å; R72-Y337 PolarHBondContact NH2-O 3.32Å; R72-Y470 HydrophobicContact CB-CD1 4.45Å; R72-Y470 VanDerWaalsContact CD-OH 3.23Å; R72-Y470 WeakPolarHBondContact CD-OH 3.29Å; R72-Y470 HydrophobicContact CG-CE1 4.46Å; R72-Y470 PolarHBondContact NE-OH 2.95Å
73	T	83.2	Confident	85.7	Confident	10 Å²	10	63 Å²	63	6%	0.061	33%	0.327	C	S	.	.			trans	-127.3	160.9	174.6	64.4	0	0	0	0	112.2	W75 I82 Y84 P85 E87	T73-W75 VanDerWaalsContact C-N 3.31Å; T73-W75 PolarHBondContact O-N 2.91Å; T73-I82 HydrophobicContact CG2-CD1 4.42Å; T73-I82 HydrophobicContact CG2-CG2 3.96Å; T73-Y84 PolarHBondContact OG1-O 3.06Å; T73-P85 PolarHBondContact N-O 2.89Å; T73-P85 WeakPolarHBondContact OG1-CA 3.47Å; T73-P85 PolarHBondContact OG1-O 3.49Å; T73-P85 VanDerWaalsContact OG1-O 3.12Å; T73-E87 HydrophobicContact CG2-CB 3.55Å; T73-E87 HydrophobicContact CG2-CG 4.37Å
74	V	82.3	Confident	85.4	Confident	78 Å²	78	69.1 Å²	69.1	47%	0.473	35%	0.351	S	S	.	.			trans	-92.6	68.5	170.1	-170.5	0	0	0	0	108.7	W76 L77	V74-W76 VanDerWaalsContact C-N 3.31Å; V74-W76 HydrophobicContact CG1-CD2 4.23Å; V74-W76 HydrophobicContact CG1-CH2 4.23Å; V74-W76 HydrophobicContact CG1-CZ2 3.82Å; V74-W76 PolarHBondContact O-N 3.3Å; V74-L77 HydrophobicContact CG1-CB 4.19Å
75	W	80.3	Confident	84.9	Confident	118 Å²	118	66.5 Å²	66.5	45%	0.447	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20	-175.1	67.5	-83.1	0	0	0	114.4	T73 L77 Y84 P85	T73-W75 VanDerWaalsContact C-N 3.31Å; T73-W75 PolarHBondContact O-N 2.91Å; W75-L77 VanDerWaalsContact C-N 3.3Å; W75-L77 PolarHBondContact O-N 3.18Å; W75-Y84 WeakPolarHBondContact CB-O 3.29Å; W75-P85 HydrophobicContact CG-CB 4.09Å
76	W	81.7	Confident	84.6	Confident	141 Å²	141	66.9 Å²	66.9	53%	0.534	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	0.6	-177.8	63.9	85.1	0	0	0	113.7	V74 W469	V74-W76 VanDerWaalsContact C-N 3.31Å; V74-W76 HydrophobicContact CG1-CD2 4.23Å; V74-W76 HydrophobicContact CG1-CH2 4.23Å; V74-W76 HydrophobicContact CG1-CZ2 3.82Å; V74-W76 PolarHBondContact O-N 3.3Å; W76-W469 AromaticContact CH2-CD1 3.96Å; W76-W469 AromaticContact CH2-NE1 3.57Å; W76-W469 AromaticContact CZ3-CD1 3.87Å; W76-W469 AromaticContact CZ3-NE1 3.24Å
77	L	81.3	Confident	84	Confident	100 Å²	100	69.6 Å²	69.6	52%	0.524	35%	0.354	S	S	.	.	S	Bend	trans	-72.9	125.1	-179.6	-166.3	77	0	0	0	109.7	V74 W75 N79 S80	V74-L77 HydrophobicContact CG1-CB 4.19Å; W75-L77 VanDerWaalsContact C-N 3.3Å; W75-L77 PolarHBondContact O-N 3.18Å; L77-N79 PolarHBondContact O-N 3.04Å; L77-S80 PolarHBondContact O-N 3.48Å; L77-S80 PolarHBondContact O-OG 2.87Å
78	P	78.3	Confident	83.7	Confident	104 Å²	104	73.1 Å²	73.1	68%	0.675	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	128.7	174.3	23.1	-29.9	0	0	0	109.8
79	N	80	Confident	83.3	Confident	173 Å²	173	78.8 Å²	78.8	93%	0.925	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	10.9	-175.5	-47.4	-44.9	0	0	0	117.4	L77	L77-N79 PolarHBondContact O-N 3.04Å
80	S	79.5	Confident	82.8	Confident	38 Å²	38	79.2 Å²	79.2	27%	0.266	40%	0.404	S	S	.	.			trans	-72.2	142.9	167.2	56.2	0	0	0	0	111.3	L77 I82	L77-S80 PolarHBondContact O-N 3.48Å; L77-S80 PolarHBondContact O-OG 2.87Å; S80-I82 PolarHBondContact O-N 3.46Å
81	S	79.1	Confident	82.6	Confident	123 Å²	123	79.8 Å²	79.8	86%	0.86	41%	0.407	S	S	*	.	S	Bend	trans	-71.7	-1.7	172.4	56.8	0	0	0	0	113.9
82	I	79.2	Confident	82.4	Confident	64 Å²	64	80.1 Å²	80.1	33%	0.328	41%	0.41	S	S	.	.			trans	-97.9	115.3	-174.1	-55.2	172.4	0	0	0	109	T73 S80 Y84	T73-I82 HydrophobicContact CG2-CD1 4.42Å; T73-I82 HydrophobicContact CG2-CG2 3.96Å; S80-I82 PolarHBondContact O-N 3.46Å; I82-Y84 WeakPolarHBondContact CG2-O 3.28Å
83	E	81.1	Confident	82.5	Confident	152 Å²	152	84.2 Å²	84.2	71%	0.71	43%	0.426	S	S	*	.			trans	-86.3	-26.5	-179.7	-64.4	-177.1	171.6	0	0	113.4
84	Y	85.6	Confident	82.7	Confident	133 Å²	133	86.7 Å²	86.7	52%	0.522	44%	0.436	S	S	.	.	S	Bend	trans	-111.6	148.7	-168.9	-62.6	-75.4	0	0	0	112.8	T73 W75 I82 V86 F88	T73-Y84 PolarHBondContact OG1-O 3.06Å; W75-Y84 WeakPolarHBondContact CB-O 3.29Å; I82-Y84 WeakPolarHBondContact CG2-O 3.28Å; Y84-V86 PolarHBondContact O-N 3.24Å; Y84-V86 VanDerWaalsContact O-N 3.16Å; Y84-F88 AromaticContact CD1-CE2 3.96Å; Y84-F88 HydrophobicContact CD1-CE2 3.96Å; Y84-F88 HydrophobicContact CD2-CD2 4.16Å; Y84-F88 HydrophobicContact CD2-CE2 4.39Å; Y84-F88 AromaticContact CG-CD2 3.93Å; Y84-F88 HydrophobicContact CG-CD2 3.93Å; Y84-F88 AromaticContact CG-CE2 3.74Å; Y84-F88 HydrophobicContact CG-CE2 3.74Å
85	P	83.6	Confident	82.9	Confident	43 Å²	43	83.3 Å²	83.3	28%	0.279	42%	0.416	S	S	.	.	S	Bend	trans	-66.1	-13.4	178.2	27.5	-36.6	0	0	0	115.3	T73 W75 W469	T73-P85 PolarHBondContact N-O 2.89Å; T73-P85 WeakPolarHBondContact OG1-CA 3.47Å; T73-P85 PolarHBondContact OG1-O 3.49Å; T73-P85 VanDerWaalsContact OG1-O 3.12Å; W75-P85 HydrophobicContact CG-CB 4.09Å; P85-W469 HydrophobicContact CB-CH2 3.63Å; P85-W469 HydrophobicContact CB-CZ2 4.05Å; P85-W469 HydrophobicContact CB-CZ3 4.42Å
86	V	86.4	Confident	83.3	Confident	12 Å²	12	79.1 Å²	79.1	7%	0.073	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-127	137.3	178.7	-178.2	0	0	0	0	107.7	M68 Y71 Y84 F88	M68-V86 HydrophobicContact CE-CG2 3.76Å; M68-V86 HydrophobicContact SD-CG2 3.27Å; M68-V86 WeakPolarHBondContact SD-CG2 3.33Å; Y71-V86 WeakPolarHBondContact O-CA 3.46Å; Y84-V86 PolarHBondContact O-N 3.24Å; Y84-V86 VanDerWaalsContact O-N 3.16Å; V86-F88 VanDerWaalsContact C-N 3.32Å; V86-F88 HydrophobicContact CB-CE1 4.15Å; V86-F88 HydrophobicContact CB-CE2 4.49Å; V86-F88 HydrophobicContact CB-CZ 4.13Å; V86-F88 HydrophobicContact CG1-CD1 4.32Å; V86-F88 HydrophobicContact CG1-CE1 4.24Å; V86-F88 WeakPolarHBondContact O-CD2 3.22Å; V86-F88 PolarHBondContact O-N 2.96Å
87	E	82.8	Confident	83.6	Confident	58 Å²	58	74.3 Å²	74.3	27%	0.271	39%	0.393	S	S	.	.			trans	-79	82.1	176.2	-161.7	179.8	151.6	0	0	110	Y71 T73 D89 S90	Y71-E87 PolarHBondContact O-N 3.33Å; T73-E87 HydrophobicContact CG2-CB 3.55Å; T73-E87 HydrophobicContact CG2-CG 4.37Å; E87-D89 PolarHBondContact O-N 3.35Å; E87-S90 VanDerWaalsContact CD-OG 3.25Å; E87-S90 PolarHBondContact O-N 3.37Å; E87-S90 PolarHBondContact OE1-OG 2.93Å
88	F	84.5	Confident	83.9	Confident	92 Å²	92	69.8 Å²	69.8	40%	0.404	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-60.9	-26.3	-177.9	-66.3	-64.5	0	0	0	113.5	Y84 V86 S90 V91 Y93	Y84-F88 AromaticContact CD1-CE2 3.96Å; Y84-F88 HydrophobicContact CD1-CE2 3.96Å; Y84-F88 HydrophobicContact CD2-CD2 4.16Å; Y84-F88 HydrophobicContact CD2-CE2 4.39Å; Y84-F88 AromaticContact CG-CD2 3.93Å; Y84-F88 HydrophobicContact CG-CD2 3.93Å; Y84-F88 AromaticContact CG-CE2 3.74Å; Y84-F88 HydrophobicContact CG-CE2 3.74Å; V86-F88 VanDerWaalsContact C-N 3.32Å; V86-F88 HydrophobicContact CB-CE1 4.15Å; V86-F88 HydrophobicContact CB-CE2 4.49Å; V86-F88 HydrophobicContact CB-CZ 4.13Å; V86-F88 HydrophobicContact CG1-CD1 4.32Å; V86-F88 HydrophobicContact CG1-CE1 4.24Å; V86-F88 WeakPolarHBondContact O-CD2 3.22Å; V86-F88 PolarHBondContact O-N 2.96Å; F88-S90 VanDerWaalsContact C-N 3.26Å; F88-S90 PolarHBondContact O-N 3.44Å; F88-V91 PolarHBondContact O-N 2.99Å; F88-Y93 PolarHBondContact O-OH 3.44Å
89	D	81.9	Confident	84.3	Confident	151 Å²	151	64.9 Å²	64.9	81%	0.807	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-68.7	-27.7	179.7	-61.6	-30.1	0	0	0	112.6	E87	E87-D89 PolarHBondContact O-N 3.35Å
90	S	81.9	Confident	84.8	Confident	12 Å²	12	60 Å²	60	8%	0.084	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-91.1	-7.2	-179.5	-75	0	0	0	0	113.4	Y71 E87 F88 N333	Y71-S90 WeakPolarHBondContact CE1-O 3.45Å; E87-S90 VanDerWaalsContact CD-OG 3.25Å; E87-S90 PolarHBondContact O-N 3.37Å; E87-S90 PolarHBondContact OE1-OG 2.93Å; F88-S90 VanDerWaalsContact C-N 3.26Å; F88-S90 PolarHBondContact O-N 3.44Å; S90-N333 WeakPolarHBondContact CB-ND2 3.26Å; S90-N333 PolarHBondContact OG-ND2 3.29Å
91	V	85.2	Confident	85.1	Confident	15 Å²	15	60.8 Å²	60.8	9%	0.091	31%	0.309	C	S	.	.	S	Bend	trans	-84.3	120.2	176.7	178.9	0	0	0	0	109.2	Y71 F88 Y93 T96	Y71-V91 HydrophobicContact CD1-CG2 4.07Å; Y71-V91 HydrophobicContact CD2-CG2 3.62Å; Y71-V91 HydrophobicContact CE1-CG2 4.36Å; Y71-V91 HydrophobicContact CE2-CG2 3.95Å; Y71-V91 HydrophobicContact CG-CG2 3.68Å; F88-V91 PolarHBondContact O-N 2.99Å; V91-Y93 WeakPolarHBondContact O-CD2 3.38Å; V91-Y93 PolarHBondContact O-N 2.97Å; V91-T96 WeakPolarHBondContact CG1-OG1 3.5Å
92	D	85.7	Confident	85.3	Confident	13 Å²	13	55.1 Å²	55.1	7%	0.07	27%	0.269	C	S	.	.			trans	-70.7	106.1	169.2	-170.9	-35.9	0	0	0	109.9	F94 V95 T96 I149 E150 Q332	D92-F94 VanDerWaalsContact C-N 3.26Å; D92-F94 PolarHBondContact O-N 2.85Å; D92-F94 WeakPolarHBondContact OD1-CA 3.29Å; D92-F94 VanDerWaalsContact OD1-CB 3.3Å; D92-F94 WeakPolarHBondContact OD1-CB 3.49Å; D92-F94 PolarHBondContact OD1-N 2.87Å; D92-V95 HydrophobicContact CB-CB 4Å; D92-V95 HydrophobicContact CB-CG2 3.71Å; D92-V95 VanDerWaalsContact CG-CG2 3.48Å; D92-V95 PolarHBondContact O-N 3.34Å; D92-V95 PolarHBondContact OD1-N 3.49Å; D92-T96 PolarHBondContact O-N 2.97Å; D92-T96 PolarHBondContact O-OG1 3.3Å; D92-I149 WeakPolarHBondContact OD2-CG2 3.23Å; D92-E150 PolarHBondContact OD2-N 3.47Å; D92-E150 VanDerWaalsContact OD2-N 3.13Å; D92-Q332 PolarHBondContact OD2-NE2 2.97Å
93	Y	89.4	Confident	85.5	Confident	138 Å²	138	52.3 Å²	52.3	54%	0.541	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-31.5	178.3	-62.6	-84.8	0	0	0	112.8	F88 V91 A97	F88-Y93 PolarHBondContact O-OH 3.44Å; V91-Y93 WeakPolarHBondContact O-CD2 3.38Å; V91-Y93 PolarHBondContact O-N 2.97Å; Y93-A97 WeakPolarHBondContact O-CB 3.23Å; Y93-A97 PolarHBondContact O-N 2.73Å
94	F	87.9	Confident	85.6	Confident	62 Å²	62	46.2 Å²	46.2	27%	0.272	23%	0.229	S	C	.	.	H	α-helix	trans	-73.1	-39	178.2	-62.6	-71.8	0	0	0	111.1	D92 A97 H98 W144 I145 R148 I149	D92-F94 VanDerWaalsContact C-N 3.26Å; D92-F94 PolarHBondContact O-N 2.85Å; D92-F94 WeakPolarHBondContact OD1-CA 3.29Å; D92-F94 VanDerWaalsContact OD1-CB 3.3Å; D92-F94 WeakPolarHBondContact OD1-CB 3.49Å; D92-F94 PolarHBondContact OD1-N 2.87Å; F94-A97 PolarHBondContact O-N 2.95Å; F94-H98 WeakPolarHBondContact O-CB 3.27Å; F94-H98 PolarHBondContact O-N 2.98Å; F94-W144 HydrophobicContact CE1-CH2 4.13Å; F94-W144 HydrophobicContact CE1-CZ3 4.27Å; F94-I145 HydrophobicContact CB-CG2 4.01Å; F94-I145 WeakPolarHBondContact O-CG2 3.2Å; F94-R148 HydrophobicContact CD1-CB 3.74Å; F94-R148 HydrophobicContact CD2-CB 3.89Å; F94-R148 VanDerWaalsContact CD2-O 3.24Å; F94-R148 WeakPolarHBondContact CD2-O 3.45Å; F94-R148 HydrophobicContact CE1-CB 3.71Å; F94-R148 HydrophobicContact CE1-CG 4.28Å; F94-R148 HydrophobicContact CE2-CB 3.84Å; F94-R148 HydrophobicContact CG-CB 3.84Å; F94-R148 HydrophobicContact CZ-CB 3.77Å; F94-R148 HydrophobicContact CZ-CG 4.34Å; F94-I149 HydrophobicContact CB-CG1 3.77Å
95	V	85.1	Confident	85.3	Confident	8 Å²	8	40.4 Å²	40.4	5%	0.048	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-47.8	172.5	176.3	0	0	0	0	110.4	D92 A97 H98 I99 I149 F330	D92-V95 HydrophobicContact CB-CB 4Å; D92-V95 HydrophobicContact CB-CG2 3.71Å; D92-V95 VanDerWaalsContact CG-CG2 3.48Å; D92-V95 PolarHBondContact O-N 3.34Å; D92-V95 PolarHBondContact OD1-N 3.49Å; V95-A97 VanDerWaalsContact C-N 3.34Å; V95-A97 PolarHBondContact O-N 3.22Å; V95-H98 WeakPolarHBondContact O-CB 3.49Å; V95-H98 PolarHBondContact O-N 3.47Å; V95-I99 HydrophobicContact CG1-CD1 4.06Å; V95-I99 WeakPolarHBondContact O-CG1 3.48Å; V95-I99 PolarHBondContact O-N 3.49Å; V95-I149 HydrophobicContact CG2-CB 4.5Å; V95-I149 HydrophobicContact CG2-CD1 3.97Å; V95-I149 HydrophobicContact CG2-CG1 3.97Å; V95-I149 HydrophobicContact CG2-CG2 3.8Å; V95-F330 HydrophobicContact CB-CD1 4.39Å; V95-F330 HydrophobicContact CG1-CB 3.82Å; V95-F330 HydrophobicContact CG1-CD1 4.08Å; V95-F330 HydrophobicContact CG1-CD2 4.41Å; V95-F330 HydrophobicContact CG1-CG 3.85Å; V95-F330 HydrophobicContact CG2-CB 4.11Å; V95-F330 HydrophobicContact CG2-CD1 3.36Å; V95-F330 HydrophobicContact CG2-CE1 4.11Å; V95-F330 HydrophobicContact CG2-CG 3.95Å
96	T	88.4	Confident	84.7	Confident	29 Å²	29	39.3 Å²	39.3	18%	0.178	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-43.8	178.6	-54.2	0	0	0	0	111.2	H67 V91 D92 H98 I99 I100	H67-T96 PolarHBondContact NE2-OG1 2.85Å; V91-T96 WeakPolarHBondContact CG1-OG1 3.5Å; D92-T96 PolarHBondContact O-N 2.97Å; D92-T96 PolarHBondContact O-OG1 3.3Å; T96-H98 VanDerWaalsContact C-N 3.34Å; T96-H98 PolarHBondContact O-N 2.83Å; T96-I99 PolarHBondContact O-N 3.42Å; T96-I100 HydrophobicContact CG2-CD1 3.98Å; T96-I100 WeakPolarHBondContact O-CG1 3.32Å; T96-I100 PolarHBondContact O-N 2.82Å
97	A	89.1	Confident	83.9	Confident	40 Å²	40	40 Å²	40	33%	0.331	20%	0.202	S	C	.	.	H	α-helix	trans	-62.1	-40.3	175.5	0	0	0	0	0	112	Y93 F94 V95 I100 F101	Y93-A97 WeakPolarHBondContact O-CB 3.23Å; Y93-A97 PolarHBondContact O-N 2.73Å; F94-A97 PolarHBondContact O-N 2.95Å; V95-A97 VanDerWaalsContact C-N 3.34Å; V95-A97 PolarHBondContact O-N 3.22Å; A97-I100 PolarHBondContact O-N 2.86Å; A97-F101 WeakPolarHBondContact O-CB 3.16Å; A97-F101 PolarHBondContact O-N 3.44Å
98	H	86.3	Confident	83.5	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.028	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-46.8	174.9	-178.5	72.9	0	0	0	111.5	F94 V95 T96 F101 M102 M142 I145	F94-H98 WeakPolarHBondContact O-CB 3.27Å; F94-H98 PolarHBondContact O-N 2.98Å; V95-H98 WeakPolarHBondContact O-CB 3.49Å; V95-H98 PolarHBondContact O-N 3.47Å; T96-H98 VanDerWaalsContact C-N 3.34Å; T96-H98 PolarHBondContact O-N 2.83Å; H98-F101 PolarHBondContact O-N 3.34Å; H98-M102 WeakPolarHBondContact O-CB 3.02Å; H98-M102 WeakPolarHBondContact O-CG 3.27Å; H98-M102 PolarHBondContact O-N 2.99Å; H98-M142 PolarHBondContact ND1-SD 3.26Å; H98-I145 HydrophobicContact CB-CG2 3.91Å
99	I	87.8	Confident	82.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-53.1	177.3	-69.2	166.6	0	0	0	110.4	T63 V95 T96 F101 M102 L103 Y322 L326 P327	T63-I99 HydrophobicContact CG2-CG2 3.71Å; V95-I99 HydrophobicContact CG1-CD1 4.06Å; V95-I99 WeakPolarHBondContact O-CG1 3.48Å; V95-I99 PolarHBondContact O-N 3.49Å; T96-I99 PolarHBondContact O-N 3.42Å; I99-F101 VanDerWaalsContact C-N 3.32Å; I99-F101 PolarHBondContact O-N 3.07Å; I99-M102 PolarHBondContact O-N 3.47Å; I99-L103 HydrophobicContact CG2-CD1 3.68Å; I99-L103 HydrophobicContact CG2-CG 4.31Å; I99-L103 WeakPolarHBondContact O-CB 3.43Å; I99-L103 VanDerWaalsContact O-CG 3.24Å; I99-L103 WeakPolarHBondContact O-CG 3.11Å; I99-L103 PolarHBondContact O-N 2.92Å; I99-Y322 VanDerWaalsContact CG2-O 3.25Å; I99-Y322 WeakPolarHBondContact CG2-O 3.33Å; I99-L326 HydrophobicContact CD1-CB 4.27Å; I99-L326 HydrophobicContact CD1-CD2 4.15Å; I99-L326 HydrophobicContact CD1-CG 4.44Å; I99-L326 HydrophobicContact CG1-CB 4.42Å; I99-L326 HydrophobicContact CG1-CD2 3.6Å; I99-L326 HydrophobicContact CG1-CG 4.39Å; I99-P327 HydrophobicContact CD1-CG 3.78Å
100	I	89.5	Confident	82	Confident	71 Å²	71	30.8 Å²	30.8	36%	0.364	16%	0.16	S	C	.	.	H	α-helix	trans	-60.9	-44	-178.8	-67.8	170.9	0	0	0	110.2	L60 T96 A97 L103 C104	L60-I100 HydrophobicContact CD2-CG1 4.3Å; L60-I100 HydrophobicContact CD2-CG2 4.27Å; T96-I100 HydrophobicContact CG2-CD1 3.98Å; T96-I100 WeakPolarHBondContact O-CG1 3.32Å; T96-I100 PolarHBondContact O-N 2.82Å; A97-I100 PolarHBondContact O-N 2.86Å; I100-L103 PolarHBondContact O-N 3.1Å; I100-C104 WeakPolarHBondContact O-CB 3.48Å; I100-C104 PolarHBondContact O-N 3.38Å; I100-C104 PolarHBondContact O-SG 3Å
101	F	86.3	Confident	81.5	Confident	54 Å²	54	35.2 Å²	35.2	24%	0.237	18%	0.182	C	C	.	.	H	α-helix	trans	-67.6	-39.8	-178.8	-166.5	-126.3	0	0	0	111.8	A97 H98 I99 C104 T105 W138 I141 M142	A97-F101 WeakPolarHBondContact O-CB 3.16Å; A97-F101 PolarHBondContact O-N 3.44Å; H98-F101 PolarHBondContact O-N 3.34Å; I99-F101 VanDerWaalsContact C-N 3.32Å; I99-F101 PolarHBondContact O-N 3.07Å; F101-C104 PolarHBondContact O-N 3.34Å; F101-T105 WeakPolarHBondContact O-CB 3.29Å; F101-T105 PolarHBondContact O-N 3.17Å; F101-T105 PolarHBondContact O-OG1 3.02Å; F101-W138 AromaticContact CE1-CD1 3.43Å; F101-W138 VanDerWaalsContact CE1-CD1 3.43Å; F101-W138 HydrophobicContact CE1-CG 4.23Å; F101-W138 AromaticContact CE1-NE1 3.63Å; F101-W138 AromaticContact CZ-CD1 3.47Å; F101-W138 VanDerWaalsContact CZ-CD1 3.47Å; F101-W138 HydrophobicContact CZ-CG 4.39Å; F101-I141 HydrophobicContact CD1-CG2 4.24Å; F101-I141 HydrophobicContact CE1-CB 4.31Å; F101-I141 HydrophobicContact CE1-CG2 3.86Å; F101-I141 HydrophobicContact CZ-CG2 4.25Å; F101-M142 HydrophobicContact CB-CE 4.32Å; F101-M142 HydrophobicContact CD1-CE 3.04Å; F101-M142 HydrophobicContact CD1-CG 4.29Å; F101-M142 HydrophobicContact CD1-SD 3.55Å; F101-M142 VanDerWaalsContact CD1-SD 3.55Å; F101-M142 HydrophobicContact CE1-CE 3.49Å; F101-M142 VanDerWaalsContact CE1-CE 3.49Å; F101-M142 HydrophobicContact CE1-CG 4.19Å; F101-M142 HydrophobicContact CE1-SD 4.05Å; F101-M142 HydrophobicContact CG-CE 3.97Å
102	M	83.2	Confident	80.9	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-44.1	173.3	-78.1	-59.1	-73.4	0	0	112.4	H98 I99 C104 T105 W138 M142 F169 Y322	H98-M102 WeakPolarHBondContact O-CB 3.02Å; H98-M102 WeakPolarHBondContact O-CG 3.27Å; H98-M102 PolarHBondContact O-N 2.99Å; I99-M102 PolarHBondContact O-N 3.47Å; M102-C104 VanDerWaalsContact C-N 3.34Å; M102-C104 PolarHBondContact O-N 3.37Å; M102-T105 PolarHBondContact O-N 3.39Å; M102-W138 HydrophobicContact SD-CH2 4.45Å; M102-W138 HydrophobicContact SD-CZ2 3.84Å; M102-M142 HydrophobicContact CG-CE 3.79Å; M102-M142 HydrophobicContact CG-SD 4.47Å; M102-M142 HydrophobicContact SD-CE 3.25Å; M102-M142 WeakPolarHBondContact SD-CE 3.4Å; M102-M142 HydrophobicContact SD-SD 4.23Å; M102-F169 HydrophobicContact CE-CB 4.28Å; M102-F169 HydrophobicContact CE-CD2 4.15Å; M102-Y322 HydrophobicContact CB-CD1 3.86Å; M102-Y322 HydrophobicContact CB-CE1 3.73Å; M102-Y322 HydrophobicContact CB-CE2 4.44Å; M102-Y322 HydrophobicContact CB-CG 4.3Å; M102-Y322 HydrophobicContact CE-CE1 4.23Å; M102-Y322 HydrophobicContact CE-CE2 3.99Å; M102-Y322 WeakPolarHBondContact CE-OH 3.37Å; M102-Y322 HydrophobicContact CG-CD1 4.28Å; M102-Y322 HydrophobicContact CG-CE1 3.68Å
103	L	83.5	Confident	80.1	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-42.2	175.1	-70.7	172.9	0	0	0	111.1	C59 T63 I99 I100 Y107	C59-L103 HydrophobicContact CB-CD1 4.02Å; C59-L103 HydrophobicContact CB-CD2 3.88Å; C59-L103 HydrophobicContact CB-CG 4.43Å; T63-L103 WeakPolarHBondContact OG1-CD1 3.48Å; I99-L103 HydrophobicContact CG2-CD1 3.68Å; I99-L103 HydrophobicContact CG2-CG 4.31Å; I99-L103 WeakPolarHBondContact O-CB 3.43Å; I99-L103 VanDerWaalsContact O-CG 3.24Å; I99-L103 WeakPolarHBondContact O-CG 3.11Å; I99-L103 PolarHBondContact O-N 2.92Å; I100-L103 PolarHBondContact O-N 3.1Å; L103-Y107 WeakPolarHBondContact O-CD2 3.39Å; L103-Y107 WeakPolarHBondContact O-CE2 3.29Å
104	C	83.8	Confident	79.2	Confident	25 Å²	25	39.7 Å²	39.7	17%	0.169	21%	0.207	C	C	.	.	H	α-helix	trans	-74.1	-24.9	179.9	-73.9	0	0	0	0	114	I100 F101 M102 Y107 V108	I100-C104 WeakPolarHBondContact O-CB 3.48Å; I100-C104 PolarHBondContact O-N 3.38Å; I100-C104 PolarHBondContact O-SG 3Å; F101-C104 PolarHBondContact O-N 3.34Å; M102-C104 VanDerWaalsContact C-N 3.34Å; M102-C104 PolarHBondContact O-N 3.37Å; C104-Y107 WeakPolarHBondContact O-CA 3.5Å; C104-Y107 WeakPolarHBondContact O-CB 3.33Å; C104-Y107 PolarHBondContact O-N 3.49Å; C104-V108 HydrophobicContact CB-CG2 4.16Å; C104-V108 WeakPolarHBondContact O-CG2 3.46Å; C104-V108 PolarHBondContact O-N 2.67Å
105	T	78.3	Confident	78.7	Confident	10 Å²	10	43 Å²	43	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-48.7	-54.6	-173.6	-69.5	0	0	0	0	114.4	F101 M102 Y107 V108 Y109 W138 F169	F101-T105 WeakPolarHBondContact O-CB 3.29Å; F101-T105 PolarHBondContact O-N 3.17Å; F101-T105 PolarHBondContact O-OG1 3.02Å; M102-T105 PolarHBondContact O-N 3.39Å; T105-Y107 PolarHBondContact O-N 3.42Å; T105-V108 PolarHBondContact O-N 3.38Å; T105-Y109 VanDerWaalsContact O-CB 3.23Å; T105-Y109 WeakPolarHBondContact O-CB 3.15Å; T105-Y109 PolarHBondContact O-N 3.46Å; T105-W138 HydrophobicContact CG2-CZ2 4.15Å; T105-W138 PolarHBondContact OG1-NE1 3.02Å; T105-F169 HydrophobicContact CG2-CE2 4.24Å
106	P	70.8	Confident	78.3	Confident	20 Å²	20	43.7 Å²	43.7	13%	0.13	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-29.5	179.2	23.3	-33.9	0	0	0	112.9	L110 F244	P106-L110 WeakPolarHBondContact O-CG 3.27Å; P106-L110 PolarHBondContact O-N 3.4Å; P106-F244 HydrophobicContact CB-CB 4.47Å; P106-F244 HydrophobicContact CB-CD1 4.42Å
107	Y	71.5	Confident	77.8	Confident	27 Å²	27	45.1 Å²	45.1	11%	0.106	24%	0.24	C	C	.	.	H	α-helix	trans	-79.2	-47.7	179.9	-53.3	-79.8	0	0	0	112.5	L52 S55 L56 L103 C104 T105 Y109 L110 I111	L52-Y107 HydrophobicContact CB-CD1 3.84Å; L52-Y107 HydrophobicContact CB-CE1 3.73Å; L52-Y107 HydrophobicContact CD2-CD1 3.78Å; L52-Y107 HydrophobicContact CD2-CE1 3.52Å; L52-Y107 HydrophobicContact CG-CD1 4.33Å; L52-Y107 HydrophobicContact CG-CE1 4.22Å; L52-Y107 WeakPolarHBondContact O-CE1 3.29Å; S55-Y107 VanDerWaalsContact CB-OH 3.24Å; S55-Y107 WeakPolarHBondContact CB-OH 3.45Å; L56-Y107 HydrophobicContact CB-CD1 4.4Å; L56-Y107 HydrophobicContact CB-CD2 4.31Å; L56-Y107 HydrophobicContact CB-CE1 4.04Å; L56-Y107 HydrophobicContact CB-CE2 3.9Å; L56-Y107 HydrophobicContact CD1-CD2 3.82Å; L56-Y107 HydrophobicContact CD1-CE2 3.72Å; L56-Y107 HydrophobicContact CD2-CD2 4.46Å; L56-Y107 HydrophobicContact CD2-CG 4.45Å; L56-Y107 HydrophobicContact CG-CD2 4.42Å; L56-Y107 HydrophobicContact CG-CE2 4.33Å; L56-Y107 PolarHBondContact N-OH 3.02Å; L103-Y107 WeakPolarHBondContact O-CD2 3.39Å; L103-Y107 WeakPolarHBondContact O-CE2 3.29Å; C104-Y107 WeakPolarHBondContact O-CA 3.5Å; C104-Y107 WeakPolarHBondContact O-CB 3.33Å; C104-Y107 PolarHBondContact O-N 3.49Å; T105-Y107 PolarHBondContact O-N 3.42Å; Y107-Y109 PolarHBondContact O-N 2.95Å; Y107-L110 PolarHBondContact O-N 3.28Å; Y107-L110 VanDerWaalsContact O-N 3.14Å; Y107-I111 WeakPolarHBondContact O-CG1 3.34Å; Y107-I111 PolarHBondContact O-N 2.96Å
108	V	73.7	Confident	77.2	Confident	71 Å²	71	47.9 Å²	47.9	43%	0.43	26%	0.257	S	S	.	.	H	α-helix	trans	-56.7	-45	174.9	172	0	0	0	0	109.1	C104 T105 L110 I111 V112	C104-V108 HydrophobicContact CB-CG2 4.16Å; C104-V108 WeakPolarHBondContact O-CG2 3.46Å; C104-V108 PolarHBondContact O-N 2.67Å; T105-V108 PolarHBondContact O-N 3.38Å; V108-L110 PolarHBondContact O-N 3.01Å; V108-I111 PolarHBondContact O-N 3.32Å; V108-V112 HydrophobicContact CG1-CG2 4.38Å; V108-V112 VanDerWaalsContact O-CG2 3.28Å; V108-V112 WeakPolarHBondContact O-CG2 3.37Å; V108-V112 PolarHBondContact O-N 2.82Å
109	Y	69.6	Low	76.7	Confident	12 Å²	12	54.1 Å²	54.1	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-43.8	177.3	178.2	-85.7	0	0	0	112.6	T105 Y107 I111 V112 L113 W235 P236 C237 L238 F245	T105-Y109 VanDerWaalsContact O-CB 3.23Å; T105-Y109 WeakPolarHBondContact O-CB 3.15Å; T105-Y109 PolarHBondContact O-N 3.46Å; Y107-Y109 PolarHBondContact O-N 2.95Å; Y109-I111 VanDerWaalsContact C-N 3.34Å; Y109-I111 PolarHBondContact O-N 3.12Å; Y109-V112 WeakPolarHBondContact O-CB 3.34Å; Y109-V112 PolarHBondContact O-N 2.94Å; Y109-L113 HydrophobicContact CD1-CD1 3.99Å; Y109-L113 HydrophobicContact CD1-CG 4.01Å; Y109-L113 HydrophobicContact CE1-CD1 3.21Å; Y109-L113 HydrophobicContact CE1-CD2 4.04Å; Y109-L113 HydrophobicContact CE1-CG 3.48Å; Y109-L113 VanDerWaalsContact CE1-CG 3.48Å; Y109-L113 HydrophobicContact CE2-CD2 4.3Å; Y109-L113 HydrophobicContact CE2-CG 4.41Å; Y109-L113 WeakPolarHBondContact O-CG 3.3Å; Y109-L113 PolarHBondContact O-N 3.42Å; Y109-W235 AromaticContact CD2-CD1 3.86Å; Y109-W235 AromaticContact CD2-NE1 3.63Å; Y109-W235 AromaticContact CE2-CD1 3.6Å; Y109-W235 HydrophobicContact CE2-CG 4.44Å; Y109-W235 AromaticContact CE2-NE1 3.83Å; Y109-W235 WeakPolarHBondContact CE2-O 3.26Å; Y109-W235 PolarHBondContact OH-O 3.01Å; Y109-P236 VanDerWaalsContact OH-C 3.23Å; Y109-P236 WeakPolarHBondContact OH-CA 3.45Å; Y109-C237 PolarHBondContact OH-N 2.68Å; Y109-L238 PolarHBondContact OH-N 3.39Å; Y109-F245 HydrophobicContact CD1-CD1 4.2Å; Y109-F245 AromaticContact CD1-CE1 3.07Å; Y109-F245 HydrophobicContact CD1-CE1 3.07Å; Y109-F245 AromaticContact CD1-CE2 3.99Å; Y109-F245 HydrophobicContact CD1-CE2 3.99Å; Y109-F245 AromaticContact CD1-CZ 2.96Å; Y109-F245 HydrophobicContact CD1-CZ 2.96Å; Y109-F245 HydrophobicContact CE1-CD1 4.29Å; Y109-F245 HydrophobicContact CE1-CD2 4.37Å; Y109-F245 AromaticContact CE1-CE1 3.37Å; Y109-F245 HydrophobicContact CE1-CE1 3.37Å; Y109-F245 AromaticContact CE1-CE2 3.43Å; Y109-F245 HydrophobicContact CE1-CE2 3.43Å; Y109-F245 VanDerWaalsContact CE1-CE2 3.43Å; Y109-F245 AromaticContact CE1-CZ 2.87Å; Y109-F245 HydrophobicContact CE1-CZ 2.87Å; Y109-F245 HydrophobicContact CG-CE1 4.17Å; Y109-F245 AromaticContact CG-CZ 3.95Å; Y109-F245 HydrophobicContact CG-CZ 3.95Å; Y109-F245 AromaticContact CZ-CZ 3.91Å
110	L	65.9	Low	76.1	Confident	25 Å²	25	55.5 Å²	55.5	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-38.2	176	-82.3	173.4	0	0	0	113.4	L52 P106 Y107 V108 L113 K114 F245	L52-L110 HydrophobicContact CD1-CD1 3.36Å; L52-L110 HydrophobicContact CD2-CD1 3.96Å; L52-L110 HydrophobicContact CG-CD1 4.32Å; P106-L110 WeakPolarHBondContact O-CG 3.27Å; P106-L110 PolarHBondContact O-N 3.4Å; Y107-L110 PolarHBondContact O-N 3.28Å; Y107-L110 VanDerWaalsContact O-N 3.14Å; V108-L110 PolarHBondContact O-N 3.01Å; L110-L113 PolarHBondContact O-N 3.35Å; L110-K114 PolarHBondContact O-N 3.19Å; L110-F245 HydrophobicContact CD1-CD1 4.04Å; L110-F245 HydrophobicContact CD2-CD1 3.29Å; L110-F245 HydrophobicContact CD2-CE1 3.94Å; L110-F245 HydrophobicContact CD2-CG 4.15Å; L110-F245 HydrophobicContact CG-CD1 3.5Å; L110-F245 HydrophobicContact CG-CE1 3.79Å
111	I	70.2	Confident	75.1	Confident	105 Å²	105	55.3 Å²	55.3	54%	0.538	29%	0.29	S	S	.	.	H	α-helix	trans	-64.4	-45.1	175	-68.3	167.7	0	0	0	109.5	Y107 V108 Y109 L113 K114 L115	Y107-I111 WeakPolarHBondContact O-CG1 3.34Å; Y107-I111 PolarHBondContact O-N 2.96Å; V108-I111 PolarHBondContact O-N 3.32Å; Y109-I111 VanDerWaalsContact C-N 3.34Å; Y109-I111 PolarHBondContact O-N 3.12Å; I111-L113 PolarHBondContact O-N 3.29Å; I111-K114 PolarHBondContact O-N 3.32Å; I111-L115 HydrophobicContact CG2-CD1 3.79Å; I111-L115 HydrophobicContact CG2-CG 4.44Å; I111-L115 VanDerWaalsContact O-CG 3.3Å; I111-L115 WeakPolarHBondContact O-CG 3.37Å; I111-L115 PolarHBondContact O-N 3.31Å
112	V	72.6	Confident	74.4	Confident	45 Å²	45	58.5 Å²	58.5	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-57.8	-48.8	175.5	170.9	0	0	0	0	110.5	V108 Y109 K114 L115 I116 I134	V108-V112 HydrophobicContact CG1-CG2 4.38Å; V108-V112 VanDerWaalsContact O-CG2 3.28Å; V108-V112 WeakPolarHBondContact O-CG2 3.37Å; V108-V112 PolarHBondContact O-N 2.82Å; Y109-V112 WeakPolarHBondContact O-CB 3.34Å; Y109-V112 PolarHBondContact O-N 2.94Å; V112-K114 VanDerWaalsContact C-N 3.29Å; V112-K114 PolarHBondContact O-N 2.85Å; V112-L115 PolarHBondContact O-N 3.34Å; V112-L115 VanDerWaalsContact O-N 3.08Å; V112-I116 HydrophobicContact CG1-CD1 3.93Å; V112-I116 HydrophobicContact CG1-CG1 4.41Å; V112-I116 VanDerWaalsContact O-CG1 3.29Å; V112-I116 WeakPolarHBondContact O-CG1 3.39Å; V112-I116 PolarHBondContact O-N 2.79Å; V112-I134 HydrophobicContact CG1-CD1 3.8Å
113	L	70.3	Confident	74	Confident	38 Å²	38	60.4 Å²	60.4	20%	0.199	33%	0.328	C	S	.	.	H	α-helix	trans	-56.6	-41	176	-73.2	-167.9	0	0	0	113.6	Y109 L110 I111 L115 I116 P236	Y109-L113 HydrophobicContact CD1-CD1 3.99Å; Y109-L113 HydrophobicContact CD1-CG 4.01Å; Y109-L113 HydrophobicContact CE1-CD1 3.21Å; Y109-L113 HydrophobicContact CE1-CD2 4.04Å; Y109-L113 HydrophobicContact CE1-CG 3.48Å; Y109-L113 VanDerWaalsContact CE1-CG 3.48Å; Y109-L113 HydrophobicContact CE2-CD2 4.3Å; Y109-L113 HydrophobicContact CE2-CG 4.41Å; Y109-L113 WeakPolarHBondContact O-CG 3.3Å; Y109-L113 PolarHBondContact O-N 3.42Å; L110-L113 PolarHBondContact O-N 3.35Å; I111-L113 PolarHBondContact O-N 3.29Å; L113-L115 VanDerWaalsContact C-N 3.29Å; L113-L115 PolarHBondContact O-N 2.87Å; L113-I116 HydrophobicContact CD2-CD1 4.3Å; L113-I116 PolarHBondContact O-N 3.28Å; L113-P236 HydrophobicContact CD2-CB 4.48Å; L113-P236 WeakPolarHBondContact CD2-O 2.97Å
114	K	70.5	Confident	73.5	Confident	176 Å²	176	65.7 Å²	65.7	77%	0.765	36%	0.355	S	S	*	.	H	α-helix	trans	-69.6	-29	179.6	-170.8	177.9	178.5	-172.9	0	112.5	L110 I111 V112	L110-K114 PolarHBondContact O-N 3.19Å; I111-K114 PolarHBondContact O-N 3.32Å; V112-K114 VanDerWaalsContact C-N 3.29Å; V112-K114 PolarHBondContact O-N 2.85Å
115	L	76.5	Confident	73.2	Confident	131 Å²	131	70.4 Å²	70.4	69%	0.686	38%	0.377	S	S	*	.	H	α-helix	trans	-82.1	-22.1	178.8	-70.2	168.3	0	0	0	112.8	I111 V112 L113 P117	I111-L115 HydrophobicContact CG2-CD1 3.79Å; I111-L115 HydrophobicContact CG2-CG 4.44Å; I111-L115 VanDerWaalsContact O-CG 3.3Å; I111-L115 WeakPolarHBondContact O-CG 3.37Å; I111-L115 PolarHBondContact O-N 3.31Å; V112-L115 PolarHBondContact O-N 3.34Å; V112-L115 VanDerWaalsContact O-N 3.08Å; L113-L115 VanDerWaalsContact C-N 3.29Å; L113-L115 PolarHBondContact O-N 2.87Å; L115-P117 WeakPolarHBondContact O-CD 3.42Å
116	I	77.4	Confident	73.2	Confident	24 Å²	24	74.6 Å²	74.6	12%	0.123	40%	0.398	C	S	.	.	S	Bend	trans	-68.8	122.9	179.3	-69	164.4	0	0	0	109.9	V112 L113 I120 M121 L130 P236	V112-I116 HydrophobicContact CG1-CD1 3.93Å; V112-I116 HydrophobicContact CG1-CG1 4.41Å; V112-I116 VanDerWaalsContact O-CG1 3.29Å; V112-I116 WeakPolarHBondContact O-CG1 3.39Å; V112-I116 PolarHBondContact O-N 2.79Å; L113-I116 HydrophobicContact CD2-CD1 4.3Å; L113-I116 PolarHBondContact O-N 3.28Å; I116-I120 HydrophobicContact CG2-CB 3.72Å; I116-I120 HydrophobicContact CG2-CD1 4.46Å; I116-I120 HydrophobicContact CG2-CG2 3.79Å; I116-M121 HydrophobicContact CG2-CG 3.82Å; I116-M121 HydrophobicContact CG2-SD 3.95Å; I116-L130 HydrophobicContact CD1-CD2 3.55Å; I116-L130 HydrophobicContact CG1-CD2 3.87Å; I116-L130 HydrophobicContact CG2-CD2 4.36Å; I116-P236 HydrophobicContact CD1-CB 4.34Å
117	P	77.7	Confident	73.3	Confident	58 Å²	58	76 Å²	76	38%	0.377	40%	0.401	S	S	.	.			trans	-61	148.5	174.8	-25.2	35.3	0	0	0	113.3	L115 F119 I120 M121	L115-P117 WeakPolarHBondContact O-CD 3.42Å; P117-F119 HydrophobicContact CB-CD1 3.4Å; P117-F119 HydrophobicContact CB-CE1 3.28Å; P117-F119 HydrophobicContact CB-CG 4.4Å; P117-F119 HydrophobicContact CB-CZ 4.22Å; P117-F119 HydrophobicContact CG-CD1 4.3Å; P117-F119 HydrophobicContact CG-CE1 3.67Å; P117-F119 HydrophobicContact CG-CZ 4.32Å; P117-F119 PolarHBondContact O-N 2.97Å; P117-F119 VanDerWaalsContact O-N 3.17Å; P117-I120 HydrophobicContact CG-CD1 4.41Å; P117-I120 PolarHBondContact O-N 2.95Å; P117-M121 PolarHBondContact O-N 2.92Å
118	S	75.7	Confident	73.4	Confident	99 Å²	99	76.3 Å²	76.3	69%	0.692	41%	0.406	S	S	*	.	H	α-helix	trans	-55.7	-35.4	179.7	54.7	0	0	0	0	113.5	I120 M121 T122	S118-I120 VanDerWaalsContact C-N 3.29Å; S118-I120 PolarHBondContact O-N 3.22Å; S118-M121 WeakPolarHBondContact O-CB 3.46Å; S118-M121 PolarHBondContact O-N 3.08Å; S118-M121 VanDerWaalsContact O-N 3.1Å; S118-T122 PolarHBondContact O-N 3.03Å; S118-T122 PolarHBondContact O-OG1 3.29Å
119	F	76.2	Confident	73.7	Confident	136 Å²	136	76.7 Å²	76.7	60%	0.596	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-33.5	179.3	77.4	-97.9	0	0	0	113.2	P117 M121 S123	P117-F119 HydrophobicContact CB-CD1 3.4Å; P117-F119 HydrophobicContact CB-CE1 3.28Å; P117-F119 HydrophobicContact CB-CG 4.4Å; P117-F119 HydrophobicContact CB-CZ 4.22Å; P117-F119 HydrophobicContact CG-CD1 4.3Å; P117-F119 HydrophobicContact CG-CE1 3.67Å; P117-F119 HydrophobicContact CG-CZ 4.32Å; P117-F119 PolarHBondContact O-N 2.97Å; P117-F119 VanDerWaalsContact O-N 3.17Å; F119-M121 VanDerWaalsContact C-N 3.34Å; F119-S123 PolarHBondContact O-N 3.41Å
120	I	74.8	Confident	74.3	Confident	29 Å²	29	78.4 Å²	78.4	15%	0.149	42%	0.418	C	S	.	.	H	α-helix	trans	-69.4	-39.5	176.1	-61.5	-171.8	0	0	0	109.4	I116 P117 S118 T122 S123 M126 L130	I116-I120 HydrophobicContact CG2-CB 3.72Å; I116-I120 HydrophobicContact CG2-CD1 4.46Å; I116-I120 HydrophobicContact CG2-CG2 3.79Å; P117-I120 HydrophobicContact CG-CD1 4.41Å; P117-I120 PolarHBondContact O-N 2.95Å; S118-I120 VanDerWaalsContact C-N 3.29Å; S118-I120 PolarHBondContact O-N 3.22Å; I120-T122 VanDerWaalsContact C-N 3.32Å; I120-T122 PolarHBondContact O-N 2.86Å; I120-S123 PolarHBondContact O-N 3.43Å; I120-M126 HydrophobicContact CG2-CB 4.19Å; I120-L130 HydrophobicContact CG2-CD2 3.9Å
121	M	68.6	Low	74.7	Confident	67 Å²	67	77.2 Å²	77.2	33%	0.33	41%	0.412	S	S	.	.	H	α-helix	trans	-67.6	-31.5	179	-64.5	-67.6	-87	0	0	112.6	I116 P117 S118 F119 C237	I116-M121 HydrophobicContact CG2-CG 3.82Å; I116-M121 HydrophobicContact CG2-SD 3.95Å; P117-M121 PolarHBondContact O-N 2.92Å; S118-M121 WeakPolarHBondContact O-CB 3.46Å; S118-M121 PolarHBondContact O-N 3.08Å; S118-M121 VanDerWaalsContact O-N 3.1Å; F119-M121 VanDerWaalsContact C-N 3.34Å; M121-C237 WeakPolarHBondContact CE-SG 3.17Å
122	T	71.1	Confident	75.1	Confident	121 Å²	121	76 Å²	76	74%	0.742	41%	0.406	S	S	*	.	H	α-helix	trans	-71.5	-32.3	177.6	-46.1	0	0	0	0	112.8	S118 I120	S118-T122 PolarHBondContact O-N 3.03Å; S118-T122 PolarHBondContact O-OG1 3.29Å; I120-T122 VanDerWaalsContact C-N 3.32Å; I120-T122 PolarHBondContact O-N 2.86Å
123	S	75.6	Confident	75.6	Confident	44 Å²	44	78.8 Å²	78.8	31%	0.308	42%	0.419	S	S	.	.			trans	-87.4	112.9	-178.1	174.8	0	0	0	0	111.9	F119 I120 I125 M126 R127	F119-S123 PolarHBondContact O-N 3.41Å; I120-S123 PolarHBondContact O-N 3.43Å; S123-I125 PolarHBondContact O-N 3.3Å; S123-M126 PolarHBondContact O-N 3.22Å; S123-M126 WeakPolarHBondContact OG-CG 3.09Å; S123-M126 PolarHBondContact OG-N 3.04Å; S123-R127 WeakPolarHBondContact O-CB 3.28Å; S123-R127 PolarHBondContact O-N 3.3Å
124	L	73.4	Confident	76.1	Confident	116 Å²	116	78.6 Å²	78.6	61%	0.607	42%	0.418	S	S	*	.	H	α-helix	trans	-54.6	-38.2	178.4	-175	68.1	0	0	0	112.9	S128	L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 3.14Å; L124-S128 PolarHBondContact O-OG 3.44Å; L124-S128 VanDerWaalsContact O-OG 3.14Å
125	I	77.8	Confident	76.4	Confident	124 Å²	124	72.4 Å²	72.4	64%	0.636	39%	0.391	S	S	*	.	H	α-helix	trans	-73.3	-47.8	-178.2	-61.2	168.5	0	0	0	110.7	S123 R127 S128 V129	S123-I125 PolarHBondContact O-N 3.3Å; I125-R127 VanDerWaalsContact C-N 3.26Å; I125-R127 PolarHBondContact O-N 2.97Å; I125-S128 PolarHBondContact O-N 2.82Å; I125-S128 PolarHBondContact O-OG 3.22Å; I125-V129 HydrophobicContact CG2-CG2 4.42Å; I125-V129 WeakPolarHBondContact O-CB 3.24Å; I125-V129 VanDerWaalsContact O-CG2 3.27Å; I125-V129 WeakPolarHBondContact O-CG2 3.24Å; I125-V129 PolarHBondContact O-N 3.18Å
126	M	77.1	Confident	76.5	Confident	98 Å²	98	69.4 Å²	69.4	48%	0.483	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-39.8	179	-67.3	-65.2	-69.5	0	0	110.9	I120 S123 L130	I120-M126 HydrophobicContact CG2-CB 4.19Å; S123-M126 PolarHBondContact O-N 3.22Å; S123-M126 WeakPolarHBondContact OG-CG 3.09Å; S123-M126 PolarHBondContact OG-N 3.04Å; M126-L130 VanDerWaalsContact O-CB 3.23Å; M126-L130 WeakPolarHBondContact O-CB 3.42Å; M126-L130 PolarHBondContact O-N 3.47Å
127	R	72.2	Confident	76.9	Confident	51 Å²	51	71.1 Å²	71.1	19%	0.192	39%	0.393	C	S	.	.	H	α-helix	trans	-61.2	-49.6	174.7	-173.4	175	76.9	130.1	12.3	112.4	S123 I125 L130 G131 D234 P236 C237	S123-R127 WeakPolarHBondContact O-CB 3.28Å; S123-R127 PolarHBondContact O-N 3.3Å; I125-R127 VanDerWaalsContact C-N 3.26Å; I125-R127 PolarHBondContact O-N 2.97Å; R127-L130 PolarHBondContact O-N 2.88Å; R127-G131 PolarHBondContact O-N 3.2Å; R127-D234 IonicContact CZ-OD1 3.61Å; R127-D234 VanDerWaalsContact CZ-OD1 3.23Å; R127-D234 IonicContact NE-OD1 3.3Å; R127-D234 IonicContact NH1-OD1 3.23Å; R127-D234 IonicContact NH2-OD1 3.89Å; R127-D234 PolarHBondContact NH2-OD1 3.1Å; R127-P236 HydrophobicContact CG-CG 3.96Å; R127-P236 WeakPolarHBondContact O-CG 3.33Å; R127-C237 WeakPolarHBondContact CD-SG 3.38Å; R127-C237 HydrophobicContact CG-CB 4.29Å
128	S	74.8	Confident	77.1	Confident	33 Å²	33	69.8 Å²	69.8	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-65.9	-40.2	-179	62.7	0	0	0	0	113	L124 I125 G131 L132 T233	L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 3.14Å; L124-S128 PolarHBondContact O-OG 3.44Å; L124-S128 VanDerWaalsContact O-OG 3.14Å; I125-S128 PolarHBondContact O-N 2.82Å; I125-S128 PolarHBondContact O-OG 3.22Å; S128-G131 PolarHBondContact O-N 2.89Å; S128-L132 WeakPolarHBondContact O-CB 3.39Å; S128-L132 PolarHBondContact O-N 3.45Å; S128-T233 WeakPolarHBondContact CA-O 3.43Å
129	V	80.6	Confident	77.2	Confident	78 Å²	78	65.8 Å²	65.8	47%	0.473	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-48.8	177.1	172.9	0	0	0	0	110.8	I125 G131 L132 L133	I125-V129 HydrophobicContact CG2-CG2 4.42Å; I125-V129 WeakPolarHBondContact O-CB 3.24Å; I125-V129 VanDerWaalsContact O-CG2 3.27Å; I125-V129 WeakPolarHBondContact O-CG2 3.24Å; I125-V129 PolarHBondContact O-N 3.18Å; V129-G131 PolarHBondContact O-N 3.44Å; V129-L132 PolarHBondContact O-N 3.1Å; V129-L133 HydrophobicContact CG1-CD1 4.16Å; V129-L133 WeakPolarHBondContact O-CG 3.38Å; V129-L133 PolarHBondContact O-N 3.49Å
130	L	80.6	Confident	77.6	Confident	48 Å²	48	67 Å²	67	25%	0.251	36%	0.356	S	S	.	.	H	α-helix	trans	-59.5	-39.2	176.6	179.7	59.6	0	0	0	111.4	I116 I120 M126 R127 L133 I134	I116-L130 HydrophobicContact CD1-CD2 3.55Å; I116-L130 HydrophobicContact CG1-CD2 3.87Å; I116-L130 HydrophobicContact CG2-CD2 4.36Å; I120-L130 HydrophobicContact CG2-CD2 3.9Å; M126-L130 VanDerWaalsContact O-CB 3.23Å; M126-L130 WeakPolarHBondContact O-CB 3.42Å; M126-L130 PolarHBondContact O-N 3.47Å; R127-L130 PolarHBondContact O-N 2.88Å; L130-L133 PolarHBondContact O-N 3.28Å; L130-I134 HydrophobicContact CD1-CD1 3.86Å; L130-I134 HydrophobicContact CD1-CG1 4.21Å; L130-I134 HydrophobicContact CG-CD1 3.78Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.4Å; L130-I134 PolarHBondContact O-N 3.02Å
131	G	75.8	Confident	78.1	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-52.7	177.5	0	0	0	0	0	113.8	R127 S128 V129 L133 I134 F135	R127-G131 PolarHBondContact O-N 3.2Å; S128-G131 PolarHBondContact O-N 2.89Å; V129-G131 PolarHBondContact O-N 3.44Å; G131-L133 VanDerWaalsContact C-N 3.31Å; G131-L133 PolarHBondContact O-N 2.88Å; G131-I134 PolarHBondContact O-N 3.25Å; G131-F135 WeakPolarHBondContact O-CB 3.15Å; G131-F135 PolarHBondContact O-N 3.3Å
132	L	77.6	Confident	78.7	Confident	79 Å²	79	65.9 Å²	65.9	41%	0.414	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-42.7	176.3	-174.7	67.3	0	0	0	111.2	S128 V129 F135 T136 I232	S128-L132 WeakPolarHBondContact O-CB 3.39Å; S128-L132 PolarHBondContact O-N 3.45Å; V129-L132 PolarHBondContact O-N 3.1Å; L132-F135 PolarHBondContact O-N 3.45Å; L132-T136 HydrophobicContact CD1-CG2 3.96Å; L132-T136 HydrophobicContact CG-CG2 4.21Å; L132-T136 VanDerWaalsContact O-CB 3.27Å; L132-T136 WeakPolarHBondContact O-CB 3.25Å; L132-T136 WeakPolarHBondContact O-CG2 3.43Å; L132-T136 PolarHBondContact O-N 3.23Å; L132-T136 PolarHBondContact O-OG1 2.97Å; L132-I232 HydrophobicContact CD1-CG2 3.44Å; L132-I232 VanDerWaalsContact CD1-CG2 3.44Å
133	L	83.8	Confident	79.1	Confident	104 Å²	104	63.8 Å²	63.8	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-44.7	177.2	-70.5	173.6	0	0	0	112.6	V129 L130 G131 T136 S137	V129-L133 HydrophobicContact CG1-CD1 4.16Å; V129-L133 WeakPolarHBondContact O-CG 3.38Å; V129-L133 PolarHBondContact O-N 3.49Å; L130-L133 PolarHBondContact O-N 3.28Å; G131-L133 VanDerWaalsContact C-N 3.31Å; G131-L133 PolarHBondContact O-N 2.88Å; L133-T136 PolarHBondContact O-OG1 2.71Å; L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.26Å; L133-S137 PolarHBondContact O-N 2.9Å; L133-S137 PolarHBondContact O-OG 2.9Å
134	I	80.7	Confident	79.5	Confident	35 Å²	35	66.7 Å²	66.7	18%	0.179	34%	0.339	C	S	.	.	H	α-helix	trans	-65.6	-45.4	177.7	-67.2	163.7	0	0	0	110.4	V112 L130 G131 S137 W138	V112-I134 HydrophobicContact CG1-CD1 3.8Å; L130-I134 HydrophobicContact CD1-CD1 3.86Å; L130-I134 HydrophobicContact CD1-CG1 4.21Å; L130-I134 HydrophobicContact CG-CD1 3.78Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.4Å; L130-I134 PolarHBondContact O-N 3.02Å; G131-I134 PolarHBondContact O-N 3.25Å; I134-S137 WeakPolarHBondContact CA-OG 2.73Å; I134-S137 PolarHBondContact O-OG 3.08Å; I134-W138 WeakPolarHBondContact O-CB 3.38Å; I134-W138 PolarHBondContact O-N 3.47Å
135	F	77.2	Confident	80	Confident	46 Å²	46	61.6 Å²	61.6	20%	0.202	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-46.1	-179.7	179.6	-110.3	0	0	0	112.2	G131 L132 W138 G139 I232 W235	G131-F135 WeakPolarHBondContact O-CB 3.15Å; G131-F135 PolarHBondContact O-N 3.3Å; L132-F135 PolarHBondContact O-N 3.45Å; F135-W138 HydrophobicContact CD2-CE3 4.49Å; F135-W138 HydrophobicContact CE2-CE3 4.45Å; F135-W138 HydrophobicContact CE2-CZ3 4.44Å; F135-W138 PolarHBondContact O-N 3.2Å; F135-G139 PolarHBondContact O-N 3.44Å; F135-I232 HydrophobicContact CD1-CB 4.43Å; F135-I232 HydrophobicContact CD1-CG1 4.22Å; F135-I232 HydrophobicContact CD1-CG2 3.71Å; F135-I232 HydrophobicContact CE1-CD1 4.44Å; F135-I232 HydrophobicContact CE1-CG1 3.9Å; F135-I232 HydrophobicContact CE1-CG2 4.21Å; F135-I232 HydrophobicContact CG-CG2 4.43Å; F135-I232 HydrophobicContact CZ-CG1 4.48Å; F135-W235 HydrophobicContact CB-CB 4.19Å; F135-W235 HydrophobicContact CB-CD2 4.06Å; F135-W235 HydrophobicContact CB-CE3 4.31Å; F135-W235 HydrophobicContact CB-CG 4.03Å; F135-W235 AromaticContact CD2-CD2 3.66Å; F135-W235 HydrophobicContact CD2-CD2 3.66Å; F135-W235 AromaticContact CD2-CE2 3.96Å; F135-W235 AromaticContact CD2-CE3 3.26Å; F135-W235 HydrophobicContact CD2-CE3 3.26Å; F135-W235 HydrophobicContact CD2-CG 4.49Å; F135-W235 AromaticContact CD2-CH2 3.32Å; F135-W235 HydrophobicContact CD2-CH2 3.32Å; F135-W235 AromaticContact CD2-CZ2 3.83Å; F135-W235 HydrophobicContact CD2-CZ2 3.83Å; F135-W235 AromaticContact CD2-CZ3 3.08Å; F135-W235 HydrophobicContact CD2-CZ3 3.08Å; F135-W235 AromaticContact CE2-CE3 3.78Å; F135-W235 HydrophobicContact CE2-CE3 3.78Å; F135-W235 AromaticContact CE2-CH2 3.46Å; F135-W235 HydrophobicContact CE2-CH2 3.46Å; F135-W235 VanDerWaalsContact CE2-CH2 3.46Å; F135-W235 HydrophobicContact CE2-CZ2 4.38Å; F135-W235 AromaticContact CE2-CZ3 3.17Å; F135-W235 HydrophobicContact CE2-CZ3 3.17Å; F135-W235 HydrophobicContact CG-CD2 4.26Å; F135-W235 HydrophobicContact CG-CE3 4.04Å; F135-W235 HydrophobicContact CG-CZ3 4.24Å; F135-W235 HydrophobicContact CZ-CZ3 4.38Å
136	T	79	Confident	80.1	Confident	68 Å²	68	56.3 Å²	56.3	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-67.9	-39.7	-179.9	53.1	0	0	0	0	111.9	L132 L133 G139 Y140	L132-T136 HydrophobicContact CD1-CG2 3.96Å; L132-T136 HydrophobicContact CG-CG2 4.21Å; L132-T136 VanDerWaalsContact O-CB 3.27Å; L132-T136 WeakPolarHBondContact O-CB 3.25Å; L132-T136 WeakPolarHBondContact O-CG2 3.43Å; L132-T136 PolarHBondContact O-N 3.23Å; L132-T136 PolarHBondContact O-OG1 2.97Å; L133-T136 PolarHBondContact O-OG1 2.71Å; T136-G139 PolarHBondContact O-N 2.93Å; T136-Y140 WeakPolarHBondContact O-CB 3.34Å; T136-Y140 PolarHBondContact O-N 3.12Å
137	S	84.3	Confident	80.3	Confident	60 Å²	60	57.7 Å²	57.7	42%	0.42	29%	0.294	S	S	.	.	H	α-helix	trans	-65.5	-45	175.4	57.1	0	0	0	0	112	L133 I134 Y140 I141	L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.26Å; L133-S137 PolarHBondContact O-N 2.9Å; L133-S137 PolarHBondContact O-OG 2.9Å; I134-S137 WeakPolarHBondContact CA-OG 2.73Å; I134-S137 PolarHBondContact O-OG 3.08Å; S137-Y140 PolarHBondContact O-N 3.32Å; S137-I141 VanDerWaalsContact O-CG1 3.27Å; S137-I141 WeakPolarHBondContact O-CG1 3.39Å; S137-I141 PolarHBondContact O-N 2.89Å
138	W	82.2	Confident	80.8	Confident	30 Å²	30	61.9 Å²	61.9	11%	0.114	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-48.1	173.9	177.3	90	0	0	0	111.7	F101 M102 T105 I134 F135 Y140 I141 M142 F169 W235	F101-W138 AromaticContact CE1-CD1 3.43Å; F101-W138 VanDerWaalsContact CE1-CD1 3.43Å; F101-W138 HydrophobicContact CE1-CG 4.23Å; F101-W138 AromaticContact CE1-NE1 3.63Å; F101-W138 AromaticContact CZ-CD1 3.47Å; F101-W138 VanDerWaalsContact CZ-CD1 3.47Å; F101-W138 HydrophobicContact CZ-CG 4.39Å; M102-W138 HydrophobicContact SD-CH2 4.45Å; M102-W138 HydrophobicContact SD-CZ2 3.84Å; T105-W138 HydrophobicContact CG2-CZ2 4.15Å; T105-W138 PolarHBondContact OG1-NE1 3.02Å; I134-W138 WeakPolarHBondContact O-CB 3.38Å; I134-W138 PolarHBondContact O-N 3.47Å; F135-W138 HydrophobicContact CD2-CE3 4.49Å; F135-W138 HydrophobicContact CE2-CE3 4.45Å; F135-W138 HydrophobicContact CE2-CZ3 4.44Å; F135-W138 PolarHBondContact O-N 3.2Å; W138-Y140 PolarHBondContact O-N 3.33Å; W138-I141 PolarHBondContact O-N 2.88Å; W138-M142 HydrophobicContact CD2-CE 4.48Å; W138-M142 HydrophobicContact CD2-CG 4.18Å; W138-M142 VanDerWaalsContact CE2-CE 3.49Å; W138-M142 HydrophobicContact CE3-CG 4.4Å; W138-M142 HydrophobicContact CH2-CE 4.36Å; W138-M142 HydrophobicContact CH2-CG 4.24Å; W138-M142 HydrophobicContact CZ2-CE 3.43Å; W138-M142 VanDerWaalsContact CZ2-CE 3.43Å; W138-M142 HydrophobicContact CZ2-CG 4.05Å; W138-M142 HydrophobicContact CZ3-CG 4.42Å; W138-M142 WeakPolarHBondContact O-CG 3.32Å; W138-M142 PolarHBondContact O-N 3.46Å; W138-F169 HydrophobicContact CH2-CB 3.84Å; W138-F169 HydrophobicContact CH2-CD1 4.02Å; W138-F169 HydrophobicContact CH2-CD2 4.09Å; W138-F169 AromaticContact CH2-CG 3.69Å; W138-F169 HydrophobicContact CH2-CG 3.69Å; W138-F169 HydrophobicContact CZ2-CD2 4.18Å; W138-F169 HydrophobicContact CZ2-CG 4.26Å; W138-F169 HydrophobicContact CZ3-CD1 4.4Å; W138-F169 HydrophobicContact CZ3-CG 4.49Å; W138-W235 HydrophobicContact CD2-CZ2 4.47Å; W138-W235 HydrophobicContact CE3-CH2 4.32Å; W138-W235 HydrophobicContact CE3-CZ2 4.38Å; W138-W235 HydrophobicContact CZ3-CH2 4.32Å
139	G	78.6	Confident	81.1	Confident	15 Å²	15	60.7 Å²	60.7	16%	0.155	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-39.8	178.6	0	0	0	0	0	112.9	F135 T136 M142 I143	F135-G139 PolarHBondContact O-N 3.44Å; T136-G139 PolarHBondContact O-N 2.93Å; G139-M142 PolarHBondContact O-N 3.05Å; G139-I143 WeakPolarHBondContact O-CB 3.13Å; G139-I143 VanDerWaalsContact O-CG1 3.26Å; G139-I143 WeakPolarHBondContact O-CG1 3.36Å; G139-I143 PolarHBondContact O-N 3.27Å
140	Y	84	Confident	80.6	Confident	160 Å²	160	63 Å²	63	63%	0.627	31%	0.307	S	S	*	.	H	α-helix	trans	-62.2	-46.8	174.5	176.1	-97	0	0	0	111.6	T136 S137 W138 M142 I143 W144	T136-Y140 WeakPolarHBondContact O-CB 3.34Å; T136-Y140 PolarHBondContact O-N 3.12Å; S137-Y140 PolarHBondContact O-N 3.32Å; W138-Y140 PolarHBondContact O-N 3.33Å; Y140-M142 VanDerWaalsContact C-N 3.31Å; Y140-M142 PolarHBondContact O-N 3.43Å; Y140-I143 PolarHBondContact O-N 3.29Å; Y140-W144 VanDerWaalsContact O-CB 3.23Å; Y140-W144 WeakPolarHBondContact O-CB 3.08Å; Y140-W144 PolarHBondContact O-N 3.49Å
141	I	85	Confident	80.1	Confident	71 Å²	71	63 Å²	63	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-44.3	176.3	-68.6	165.7	0	0	0	110.1	F101 S137 W138 W144 I145	F101-I141 HydrophobicContact CD1-CG2 4.24Å; F101-I141 HydrophobicContact CE1-CB 4.31Å; F101-I141 HydrophobicContact CE1-CG2 3.86Å; F101-I141 HydrophobicContact CZ-CG2 4.25Å; S137-I141 VanDerWaalsContact O-CG1 3.27Å; S137-I141 WeakPolarHBondContact O-CG1 3.39Å; S137-I141 PolarHBondContact O-N 2.89Å; W138-I141 PolarHBondContact O-N 2.88Å; I141-W144 PolarHBondContact O-N 2.88Å; I141-I145 HydrophobicContact CG2-CD1 3.89Å; I141-I145 HydrophobicContact CG2-CG1 4.4Å; I141-I145 VanDerWaalsContact O-CG1 3.29Å; I141-I145 WeakPolarHBondContact O-CG1 3.38Å; I141-I145 PolarHBondContact O-N 3.12Å
142	M	80.8	Confident	79.4	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-48.7	177.9	-72.9	-62.5	-171.4	0	0	112.6	H98 F101 M102 W138 G139 Y140 W144 I145 L146	H98-M142 PolarHBondContact ND1-SD 3.26Å; F101-M142 HydrophobicContact CB-CE 4.32Å; F101-M142 HydrophobicContact CD1-CE 3.04Å; F101-M142 HydrophobicContact CD1-CG 4.29Å; F101-M142 HydrophobicContact CD1-SD 3.55Å; F101-M142 VanDerWaalsContact CD1-SD 3.55Å; F101-M142 HydrophobicContact CE1-CE 3.49Å; F101-M142 VanDerWaalsContact CE1-CE 3.49Å; F101-M142 HydrophobicContact CE1-CG 4.19Å; F101-M142 HydrophobicContact CE1-SD 4.05Å; F101-M142 HydrophobicContact CG-CE 3.97Å; M102-M142 HydrophobicContact CG-CE 3.79Å; M102-M142 HydrophobicContact CG-SD 4.47Å; M102-M142 HydrophobicContact SD-CE 3.25Å; M102-M142 WeakPolarHBondContact SD-CE 3.4Å; M102-M142 HydrophobicContact SD-SD 4.23Å; W138-M142 HydrophobicContact CD2-CE 4.48Å; W138-M142 HydrophobicContact CD2-CG 4.18Å; W138-M142 VanDerWaalsContact CE2-CE 3.49Å; W138-M142 HydrophobicContact CE3-CG 4.4Å; W138-M142 HydrophobicContact CH2-CE 4.36Å; W138-M142 HydrophobicContact CH2-CG 4.24Å; W138-M142 HydrophobicContact CZ2-CE 3.43Å; W138-M142 VanDerWaalsContact CZ2-CE 3.43Å; W138-M142 HydrophobicContact CZ2-CG 4.05Å; W138-M142 HydrophobicContact CZ3-CG 4.42Å; W138-M142 WeakPolarHBondContact O-CG 3.32Å; W138-M142 PolarHBondContact O-N 3.46Å; G139-M142 PolarHBondContact O-N 3.05Å; Y140-M142 VanDerWaalsContact C-N 3.31Å; Y140-M142 PolarHBondContact O-N 3.43Å; M142-W144 VanDerWaalsContact C-N 3.29Å; M142-W144 PolarHBondContact O-N 2.8Å; M142-I145 PolarHBondContact O-N 3.04Å; M142-L146 WeakPolarHBondContact O-CB 3.35Å; M142-L146 VanDerWaalsContact O-CG 3.25Å; M142-L146 WeakPolarHBondContact O-CG 3.37Å; M142-L146 PolarHBondContact O-N 3.32Å
143	I	80.5	Confident	78.5	Confident	77 Å²	77	66.8 Å²	66.8	40%	0.395	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-40.2	177.6	-67.9	166	0	0	0	110.4	G139 Y140 L146 N147 L166	G139-I143 WeakPolarHBondContact O-CB 3.13Å; G139-I143 VanDerWaalsContact O-CG1 3.26Å; G139-I143 WeakPolarHBondContact O-CG1 3.36Å; G139-I143 PolarHBondContact O-N 3.27Å; Y140-I143 PolarHBondContact O-N 3.29Å; I143-L146 PolarHBondContact O-N 2.85Å; I143-N147 WeakPolarHBondContact O-CB 3.01Å; I143-N147 PolarHBondContact O-N 3.2Å; I143-N147 PolarHBondContact O-ND2 3.5Å; I143-L166 HydrophobicContact CG1-CD1 3.93Å; I143-L166 HydrophobicContact CG1-CD2 4.32Å
144	W	83.7	Confident	77.3	Confident	105 Å²	105	63.9 Å²	63.9	40%	0.398	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.2	179	90.1	0	0	0	112.3	F94 Y140 I141 M142 R148	F94-W144 HydrophobicContact CE1-CH2 4.13Å; F94-W144 HydrophobicContact CE1-CZ3 4.27Å; Y140-W144 VanDerWaalsContact O-CB 3.23Å; Y140-W144 WeakPolarHBondContact O-CB 3.08Å; Y140-W144 PolarHBondContact O-N 3.49Å; I141-W144 PolarHBondContact O-N 2.88Å; M142-W144 VanDerWaalsContact C-N 3.29Å; M142-W144 PolarHBondContact O-N 2.8Å; W144-R148 VanDerWaalsContact CZ2-NE 3.34Å
145	I	84.9	Confident	76.4	Confident	10 Å²	10	66.8 Å²	66.8	5%	0.051	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-50.1	175.4	-66.4	170.9	0	0	0	109.9	F94 H98 I141 M142 N147 R148 I149	F94-I145 HydrophobicContact CB-CG2 4.01Å; F94-I145 WeakPolarHBondContact O-CG2 3.2Å; H98-I145 HydrophobicContact CB-CG2 3.91Å; I141-I145 HydrophobicContact CG2-CD1 3.89Å; I141-I145 HydrophobicContact CG2-CG1 4.4Å; I141-I145 VanDerWaalsContact O-CG1 3.29Å; I141-I145 WeakPolarHBondContact O-CG1 3.38Å; I141-I145 PolarHBondContact O-N 3.12Å; M142-I145 PolarHBondContact O-N 3.04Å; I145-N147 VanDerWaalsContact C-N 3.3Å; I145-N147 PolarHBondContact O-N 2.94Å; I145-R148 PolarHBondContact O-N 2.87Å; I145-I149 PolarHBondContact O-N 3.42Å
146	L	79.5	Confident	75.7	Confident	12 Å²	12	71.2 Å²	71.2	6%	0.063	38%	0.381	C	S	.	.	H	α-helix	trans	-61.4	-35.2	-176.3	-73	167.1	0	0	0	113.6	M142 I143 R148 I149 Y151 L166	M142-L146 WeakPolarHBondContact O-CB 3.35Å; M142-L146 VanDerWaalsContact O-CG 3.25Å; M142-L146 WeakPolarHBondContact O-CG 3.37Å; M142-L146 PolarHBondContact O-N 3.32Å; I143-L146 PolarHBondContact O-N 2.85Å; L146-R148 PolarHBondContact O-N 2.94Å; L146-I149 HydrophobicContact CD2-CD1 3.87Å; L146-Y151 PolarHBondContact O-OH 3.11Å; L146-L166 HydrophobicContact CD1-CB 3.9Å; L146-L166 HydrophobicContact CD1-CD1 3.75Å; L146-L166 HydrophobicContact CD1-CG 4.3Å
147	N	80.6	Confident	74.7	Confident	127 Å²	127	74 Å²	74	68%	0.679	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-14.1	177.3	-73.9	-17.9	0	0	0	113.4	I143 I145	I143-N147 WeakPolarHBondContact O-CB 3.01Å; I143-N147 PolarHBondContact O-N 3.2Å; I143-N147 PolarHBondContact O-ND2 3.5Å; I145-N147 VanDerWaalsContact C-N 3.3Å; I145-N147 PolarHBondContact O-N 2.94Å
148	R	83.8	Confident	73.5	Confident	140 Å²	140	72 Å²	72	53%	0.528	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-9.2	179.1	-73	-171	173.8	-126.7	0	114.1	F94 W144 I145 L146 E150	F94-R148 HydrophobicContact CD1-CB 3.74Å; F94-R148 HydrophobicContact CD2-CB 3.89Å; F94-R148 VanDerWaalsContact CD2-O 3.24Å; F94-R148 WeakPolarHBondContact CD2-O 3.45Å; F94-R148 HydrophobicContact CE1-CB 3.71Å; F94-R148 HydrophobicContact CE1-CG 4.28Å; F94-R148 HydrophobicContact CE2-CB 3.84Å; F94-R148 HydrophobicContact CG-CB 3.84Å; F94-R148 HydrophobicContact CZ-CB 3.77Å; F94-R148 HydrophobicContact CZ-CG 4.34Å; W144-R148 VanDerWaalsContact CZ2-NE 3.34Å; I145-R148 PolarHBondContact O-N 2.87Å; L146-R148 PolarHBondContact O-N 2.94Å; R148-E150 PolarHBondContact O-N 3.5Å
149	I	79.2	Confident	72.5	Confident	8 Å²	8	74.8 Å²	74.8	4%	0.041	39%	0.39	C	S	.	.	S	Bend	trans	-57.9	133.3	171.5	-68	173.8	0	0	0	108.3	D92 F94 V95 I145 L146 Y151 F330	D92-I149 WeakPolarHBondContact OD2-CG2 3.23Å; F94-I149 HydrophobicContact CB-CG1 3.77Å; V95-I149 HydrophobicContact CG2-CB 4.5Å; V95-I149 HydrophobicContact CG2-CD1 3.97Å; V95-I149 HydrophobicContact CG2-CG1 3.97Å; V95-I149 HydrophobicContact CG2-CG2 3.8Å; I145-I149 PolarHBondContact O-N 3.42Å; L146-I149 HydrophobicContact CD2-CD1 3.87Å; I149-Y151 HydrophobicContact CB-CE2 3.87Å; I149-Y151 HydrophobicContact CG2-CD1 4.4Å; I149-Y151 HydrophobicContact CG2-CD2 4.49Å; I149-Y151 HydrophobicContact CG2-CE1 3.97Å; I149-Y151 HydrophobicContact CG2-CE2 4.06Å; I149-Y151 WeakPolarHBondContact O-CD2 3.38Å; I149-Y151 WeakPolarHBondContact O-CE2 3.38Å; I149-Y151 PolarHBondContact O-N 2.84Å; I149-F330 HydrophobicContact CD1-CE1 4.39Å; I149-F330 HydrophobicContact CG2-CD1 4.2Å; I149-F330 HydrophobicContact CG2-CE1 4.09Å
150	E	71.7	Confident	71.8	Confident	127 Å²	127	78.2 Å²	78.2	59%	0.593	40%	0.404	S	S	*	.			trans	-84.8	116.9	179.4	-168	163.3	-172.3	0	0	109.4	D92 R148 Q332	D92-E150 PolarHBondContact OD2-N 3.47Å; D92-E150 VanDerWaalsContact OD2-N 3.13Å; R148-E150 PolarHBondContact O-N 3.5Å; E150-Q332 PolarHBondContact O-NE2 3.4Å
151	Y	68.6	Low	70.7	Confident	48 Å²	48	72.1 Å²	72.1	19%	0.188	39%	0.385	C	S	.	.			trans	-97.4	14.5	-173.5	-67.2	-80.8	0	0	0	113.3	L146 I149 G153 T154 Y158 H159	L146-Y151 PolarHBondContact O-OH 3.11Å; I149-Y151 HydrophobicContact CB-CE2 3.87Å; I149-Y151 HydrophobicContact CG2-CD1 4.4Å; I149-Y151 HydrophobicContact CG2-CD2 4.49Å; I149-Y151 HydrophobicContact CG2-CE1 3.97Å; I149-Y151 HydrophobicContact CG2-CE2 4.06Å; I149-Y151 WeakPolarHBondContact O-CD2 3.38Å; I149-Y151 WeakPolarHBondContact O-CE2 3.38Å; I149-Y151 PolarHBondContact O-N 2.84Å; Y151-G153 PolarHBondContact O-N 2.59Å; Y151-T154 PolarHBondContact O-N 3.21Å; Y151-T154 VanDerWaalsContact O-N 3.11Å; Y151-T154 PolarHBondContact O-OG1 3.46Å; Y151-Y158 AromaticContact CD1-CD1 3.36Å; Y151-Y158 HydrophobicContact CD1-CD1 3.36Å; Y151-Y158 AromaticContact CD1-CE1 3.28Å; Y151-Y158 HydrophobicContact CD1-CE1 3.28Å; Y151-Y158 AromaticContact CE1-CD1 3.58Å; Y151-Y158 HydrophobicContact CE1-CD1 3.58Å; Y151-Y158 AromaticContact CE1-CE1 3.44Å; Y151-Y158 HydrophobicContact CE1-CE1 3.44Å; Y151-Y158 VanDerWaalsContact CE1-CE1 3.44Å; Y151-H159 AromaticContact CD1-CE1 3.7Å; Y151-H159 AromaticContact CD1-ND1 3.76Å; Y151-H159 AromaticContact CD2-CE1 3.57Å; Y151-H159 AromaticContact CE1-ND1 3.96Å; Y151-H159 AromaticContact CG-CE1 3.32Å; Y151-H159 AromaticContact CG-ND1 3.8Å
152	S	62.2	Low	69.7	Low	69 Å²	69	69 Å²	69	48%	0.483	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	112	-173.5	55.5	0	0	0	0	111.4
153	G	59.1	Low	68.8	Low	88 Å²	88	74 Å²	74	91%	0.907	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	1	176.3	0	0	0	0	0	116.6	Y151	Y151-G153 PolarHBondContact O-N 2.59Å
154	T	58.2	Low	68	Low	44 Å²	44	74.4 Å²	74.4	27%	0.27	40%	0.402	S	S	.	.			trans	-98.2	143.7	-174.1	63.5	0	0	0	0	113.9	Y151 Y158	Y151-T154 PolarHBondContact O-N 3.21Å; Y151-T154 VanDerWaalsContact O-N 3.11Å; Y151-T154 PolarHBondContact O-OG1 3.46Å; T154-Y158 HydrophobicContact CG2-CD1 4.07Å; T154-Y158 HydrophobicContact CG2-CD2 3.96Å; T154-Y158 HydrophobicContact CG2-CE1 4.04Å; T154-Y158 HydrophobicContact CG2-CE2 3.94Å; T154-Y158 HydrophobicContact CG2-CG 3.96Å; T154-Y158 WeakPolarHBondContact OG1-CD1 3.25Å
155	T	60.9	Low	66.9	Low	96 Å²	96	69.5 Å²	69.5	59%	0.589	38%	0.384	S	S	*	.			trans	-66.1	160.1	-179.9	58.8	0	0	0	0	112	L157 Y158	T155-L157 PolarHBondContact O-N 3.43Å; T155-L157 WeakPolarHBondContact OG1-CB 3.44Å; T155-Y158 WeakPolarHBondContact O-CA 3.38Å; T155-Y158 WeakPolarHBondContact O-CB 2.93Å; T155-Y158 PolarHBondContact O-N 2.99Å
156	I	63.4	Low	65.7	Low	139 Å²	139	72.5 Å²	72.5	71%	0.713	40%	0.4	S	S	*	.	H	α-helix	trans	-49.9	-30.7	171.9	-65.7	166.5	0	0	0	112	Y158 H159 L160	I156-Y158 PolarHBondContact O-N 3.21Å; I156-H159 PolarHBondContact O-N 3.13Å; I156-L160 HydrophobicContact CG2-CD1 4.34Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 3.26Å
157	L	56.8	Low	64.8	Low	125 Å²	125	73.3 Å²	73.3	65%	0.654	41%	0.408	S	S	*	.	H	α-helix	trans	-59.5	-26.2	175.3	-172	63	0	0	0	113.1	T155 L160 S161	T155-L157 PolarHBondContact O-N 3.43Å; T155-L157 WeakPolarHBondContact OG1-CB 3.44Å; L157-L160 CarbonylContact O-C 3.53Å; L157-L160 WeakPolarHBondContact O-CB 2.83Å; L157-S161 PolarHBondContact O-N 3.35Å
158	Y	59.4	Low	64.1	Low	19 Å²	19	69.8 Å²	69.8	8%	0.075	39%	0.386	C	S	.	.	H	α-helix	trans	-83	-36.1	177.7	-168.9	-83.8	0	0	0	112.7	Y151 T154 T155 I156 L160 S161 G162 I329 F330	Y151-Y158 AromaticContact CD1-CD1 3.36Å; Y151-Y158 HydrophobicContact CD1-CD1 3.36Å; Y151-Y158 AromaticContact CD1-CE1 3.28Å; Y151-Y158 HydrophobicContact CD1-CE1 3.28Å; Y151-Y158 AromaticContact CE1-CD1 3.58Å; Y151-Y158 HydrophobicContact CE1-CD1 3.58Å; Y151-Y158 AromaticContact CE1-CE1 3.44Å; Y151-Y158 HydrophobicContact CE1-CE1 3.44Å; Y151-Y158 VanDerWaalsContact CE1-CE1 3.44Å; T154-Y158 HydrophobicContact CG2-CD1 4.07Å; T154-Y158 HydrophobicContact CG2-CD2 3.96Å; T154-Y158 HydrophobicContact CG2-CE1 4.04Å; T154-Y158 HydrophobicContact CG2-CE2 3.94Å; T154-Y158 HydrophobicContact CG2-CG 3.96Å; T154-Y158 WeakPolarHBondContact OG1-CD1 3.25Å; T155-Y158 WeakPolarHBondContact O-CA 3.38Å; T155-Y158 WeakPolarHBondContact O-CB 2.93Å; T155-Y158 PolarHBondContact O-N 2.99Å; I156-Y158 PolarHBondContact O-N 3.21Å; Y158-L160 VanDerWaalsContact C-N 3.25Å; Y158-L160 PolarHBondContact O-N 3.14Å; Y158-S161 WeakPolarHBondContact CA-OG 3.4Å; Y158-S161 PolarHBondContact O-N 2.97Å; Y158-S161 VanDerWaalsContact O-N 3.09Å; Y158-S161 PolarHBondContact O-OG 3.32Å; Y158-G162 PolarHBondContact O-N 3.14Å; Y158-I329 HydrophobicContact CD2-CG2 4.16Å; Y158-I329 HydrophobicContact CE2-CG2 3.79Å; Y158-F330 AromaticContact CE1-CD1 3.88Å; Y158-F330 HydrophobicContact CE1-CD1 3.88Å; Y158-F330 AromaticContact CE1-CE1 3.47Å; Y158-F330 HydrophobicContact CE1-CE1 3.47Å; Y158-F330 VanDerWaalsContact CE1-CE1 3.47Å; Y158-F330 HydrophobicContact CE1-CZ 4.04Å; Y158-F330 HydrophobicContact CE2-CD1 4.24Å; Y158-F330 HydrophobicContact CE2-CD2 4.42Å; Y158-F330 HydrophobicContact CE2-CE1 4.24Å; Y158-F330 HydrophobicContact CE2-CE2 4.46Å; Y158-F330 HydrophobicContact CE2-CG 4.29Å; Y158-F330 HydrophobicContact CE2-CZ 4.35Å; Y158-F330 AromaticContact CZ-CD1 3.35Å; Y158-F330 AromaticContact CZ-CE1 3.36Å; Y158-F330 AromaticContact CZ-CG 3.8Å; Y158-F330 AromaticContact CZ-CZ 3.87Å; Y158-F330 WeakPolarHBondContact OH-CA 3.12Å; Y158-F330 WeakPolarHBondContact OH-CD1 3.17Å; Y158-F330 VanDerWaalsContact OH-CE1 3.26Å; Y158-F330 WeakPolarHBondContact OH-CE1 3.39Å; Y158-F330 WeakPolarHBondContact OH-CG 3.4Å
159	H	62.1	Low	62.8	Low	88 Å²	88	63.6 Å²	63.6	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-39.5	165.3	-72.8	-63.3	0	0	0	110.8	Y151 I156 S161 G162 I163	Y151-H159 AromaticContact CD1-CE1 3.7Å; Y151-H159 AromaticContact CD1-ND1 3.76Å; Y151-H159 AromaticContact CD2-CE1 3.57Å; Y151-H159 AromaticContact CE1-ND1 3.96Å; Y151-H159 AromaticContact CG-CE1 3.32Å; Y151-H159 AromaticContact CG-ND1 3.8Å; I156-H159 PolarHBondContact O-N 3.13Å; H159-S161 VanDerWaalsContact C-N 3.3Å; H159-S161 PolarHBondContact O-N 3.39Å; H159-G162 PolarHBondContact O-N 3.28Å; H159-I163 WeakPolarHBondContact O-CG1 3.09Å; H159-I163 PolarHBondContact O-N 3.47Å
160	L	64	Low	61.7	Low	87 Å²	87	65.6 Å²	65.6	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-62.1	-37	170.7	-70.7	171	0	0	0	111.6	I156 L157 Y158 I163 V164	I156-L160 HydrophobicContact CG2-CD1 4.34Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 3.26Å; L157-L160 CarbonylContact O-C 3.53Å; L157-L160 WeakPolarHBondContact O-CB 2.83Å; Y158-L160 VanDerWaalsContact C-N 3.25Å; Y158-L160 PolarHBondContact O-N 3.14Å; L160-I163 CarbonylContact O-C 3.52Å; L160-I163 PolarHBondContact O-N 2.9Å; L160-V164 WeakPolarHBondContact O-CB 3.44Å; L160-V164 WeakPolarHBondContact O-CG2 3.16Å; L160-V164 PolarHBondContact O-N 3.41Å
161	S	60.5	Low	61	Low	33 Å²	33	63.9 Å²	63.9	23%	0.231	37%	0.37	C	S	.	.	H	α-helix	trans	-67	-37.7	175	81.8	0	0	0	0	112	L157 Y158 H159 V164 L165	L157-S161 PolarHBondContact O-N 3.35Å; Y158-S161 WeakPolarHBondContact CA-OG 3.4Å; Y158-S161 PolarHBondContact O-N 2.97Å; Y158-S161 VanDerWaalsContact O-N 3.09Å; Y158-S161 PolarHBondContact O-OG 3.32Å; H159-S161 VanDerWaalsContact C-N 3.3Å; H159-S161 PolarHBondContact O-N 3.39Å; S161-V164 CarbonylContact O-C 3.54Å; S161-V164 PolarHBondContact O-N 2.99Å; S161-L165 WeakPolarHBondContact O-CB 3.19Å; S161-L165 WeakPolarHBondContact O-CD1 3.47Å; S161-L165 VanDerWaalsContact O-CG 3.27Å; S161-L165 WeakPolarHBondContact O-CG 3.49Å; S161-L165 PolarHBondContact O-N 3.36Å
162	G	63.3	Low	60.4	Low	6 Å²	6	62.1 Å²	62.1	6%	0.062	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-40.4	169.8	0	0	0	0	0	113.3	Y158 H159 L165 L166	Y158-G162 PolarHBondContact O-N 3.14Å; H159-G162 PolarHBondContact O-N 3.28Å; G162-L165 WeakPolarHBondContact O-CB 3.06Å; G162-L165 PolarHBondContact O-N 2.91Å; G162-L166 PolarHBondContact O-N 3.39Å
163	I	63	Low	60.1	Low	105 Å²	105	59.8 Å²	59.8	54%	0.538	35%	0.347	S	S	.	.	H	α-helix	trans	-71.3	-38.3	173.5	-65.6	166.7	0	0	0	111.1	H159 L160 L165 L166 A167	H159-I163 WeakPolarHBondContact O-CG1 3.09Å; H159-I163 PolarHBondContact O-N 3.47Å; L160-I163 CarbonylContact O-C 3.52Å; L160-I163 PolarHBondContact O-N 2.9Å; I163-L165 VanDerWaalsContact C-N 3.29Å; I163-L165 PolarHBondContact O-N 3.39Å; I163-L166 PolarHBondContact O-N 3.21Å; I163-A167 WeakPolarHBondContact O-CB 3.35Å; I163-A167 PolarHBondContact O-N 2.82Å
164	V	63.2	Low	59.9	Low	86 Å²	86	59.5 Å²	59.5	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-65.4	-34.2	173.8	168.5	0	0	0	0	110.6	L160 S161 A167 Y168	L160-V164 WeakPolarHBondContact O-CB 3.44Å; L160-V164 WeakPolarHBondContact O-CG2 3.16Å; L160-V164 PolarHBondContact O-N 3.41Å; S161-V164 CarbonylContact O-C 3.54Å; S161-V164 PolarHBondContact O-N 2.99Å; V164-A167 CarbonylContact O-C 3.59Å; V164-A167 PolarHBondContact O-N 3.18Å; V164-Y168 WeakPolarHBondContact O-CA 3.35Å; V164-Y168 VanDerWaalsContact O-CB 3.28Å; V164-Y168 WeakPolarHBondContact O-CB 3.45Å; V164-Y168 PolarHBondContact O-N 3.34Å
165	L	61.4	Low	59.7	Low	3 Å²	3	62.5 Å²	62.5	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-66	-42.5	171.9	-83	156.3	0	0	0	112	S161 G162 I163 Y168 Y321 Y322 L326 F330	S161-L165 WeakPolarHBondContact O-CB 3.19Å; S161-L165 WeakPolarHBondContact O-CD1 3.47Å; S161-L165 VanDerWaalsContact O-CG 3.27Å; S161-L165 WeakPolarHBondContact O-CG 3.49Å; S161-L165 PolarHBondContact O-N 3.36Å; G162-L165 WeakPolarHBondContact O-CB 3.06Å; G162-L165 PolarHBondContact O-N 2.91Å; I163-L165 VanDerWaalsContact C-N 3.29Å; I163-L165 PolarHBondContact O-N 3.39Å; L165-Y168 WeakPolarHBondContact O-CB 3.18Å; L165-Y168 PolarHBondContact O-N 2.86Å; L165-Y321 HydrophobicContact CD2-CE1 3.65Å; L165-Y321 WeakPolarHBondContact CD2-OH 3.45Å; L165-Y322 HydrophobicContact CD2-CE1 4.15Å; L165-L326 HydrophobicContact CD1-CD1 3.83Å; L165-L326 HydrophobicContact CD2-CD1 3.69Å; L165-L326 HydrophobicContact CD2-CD2 4.07Å; L165-L326 HydrophobicContact CG-CD1 4.32Å; L165-F330 HydrophobicContact CD1-CE2 3.83Å; L165-F330 HydrophobicContact CD1-CZ 3.68Å
166	L	59	Low	59.4	Low	72 Å²	72	58.5 Å²	58.5	38%	0.377	31%	0.313	S	S	.	.	H	α-helix	trans	-66.6	-41.1	173.2	-177	68.7	0	0	0	111.6	I143 L146 G162 I163 Y168 P170	I143-L166 HydrophobicContact CG1-CD1 3.93Å; I143-L166 HydrophobicContact CG1-CD2 4.32Å; L146-L166 HydrophobicContact CD1-CB 3.9Å; L146-L166 HydrophobicContact CD1-CD1 3.75Å; L146-L166 HydrophobicContact CD1-CG 4.3Å; G162-L166 PolarHBondContact O-N 3.39Å; I163-L166 PolarHBondContact O-N 3.21Å; L166-Y168 VanDerWaalsContact C-N 3.27Å; L166-Y168 PolarHBondContact O-N 3.05Å; L166-P170 WeakPolarHBondContact O-CD 3.48Å
167	A	60.8	Low	58.8	Low	30 Å²	30	54.5 Å²	54.5	25%	0.248	30%	0.297	C	S	.	.	H	α-helix	trans	-75.2	-17.1	177.2	0	0	0	0	0	111.8	I163 V164 F169 P170 I171	I163-A167 WeakPolarHBondContact O-CB 3.35Å; I163-A167 PolarHBondContact O-N 2.82Å; V164-A167 CarbonylContact O-C 3.59Å; V164-A167 PolarHBondContact O-N 3.18Å; A167-F169 PolarHBondContact O-N 3.25Å; A167-P170 WeakPolarHBondContact O-CD 3.44Å; A167-I171 HydrophobicContact CB-CD1 3.59Å; A167-I171 HydrophobicContact CB-CG1 4.21Å; A167-I171 WeakPolarHBondContact O-CA 3.44Å; A167-I171 WeakPolarHBondContact O-CB 3.32Å; A167-I171 WeakPolarHBondContact O-CD1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.47Å; A167-I171 PolarHBondContact O-N 2.84Å
168	Y	64.6	Low	58.5	Low	53 Å²	53	54 Å²	54	21%	0.208	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-45.2	-176.3	177.9	-96.2	0	0	0	111.6	V164 L165 L166 L172 H318 Y322	V164-Y168 WeakPolarHBondContact O-CA 3.35Å; V164-Y168 VanDerWaalsContact O-CB 3.28Å; V164-Y168 WeakPolarHBondContact O-CB 3.45Å; V164-Y168 PolarHBondContact O-N 3.34Å; L165-Y168 WeakPolarHBondContact O-CB 3.18Å; L165-Y168 PolarHBondContact O-N 2.86Å; L166-Y168 VanDerWaalsContact C-N 3.27Å; L166-Y168 PolarHBondContact O-N 3.05Å; Y168-L172 HydrophobicContact CE1-CD2 4.07Å; Y168-L172 WeakPolarHBondContact O-CB 3.31Å; Y168-L172 PolarHBondContact O-N 3.16Å; Y168-H318 AromaticContact CE1-CD2 3.7Å; Y168-Y322 HydrophobicContact CD1-CE2 4.11Å; Y168-Y322 WeakPolarHBondContact CD1-OH 3.22Å; Y168-Y322 AromaticContact CE1-CE2 3.77Å; Y168-Y322 HydrophobicContact CE1-CE2 3.77Å
169	F	57.1	Low	58.2	Low	9 Å²	9	56.1 Å²	56.1	4%	0.039	31%	0.309	C	S	.	.	H	α-helix	trans	-68.9	-48.7	178.9	-168.1	-75	0	0	0	112.3	M102 T105 W138 A167 I171 L172 T173 W235 F244	M102-F169 HydrophobicContact CE-CB 4.28Å; M102-F169 HydrophobicContact CE-CD2 4.15Å; T105-F169 HydrophobicContact CG2-CE2 4.24Å; W138-F169 HydrophobicContact CH2-CB 3.84Å; W138-F169 HydrophobicContact CH2-CD1 4.02Å; W138-F169 HydrophobicContact CH2-CD2 4.09Å; W138-F169 AromaticContact CH2-CG 3.69Å; W138-F169 HydrophobicContact CH2-CG 3.69Å; W138-F169 HydrophobicContact CZ2-CD2 4.18Å; W138-F169 HydrophobicContact CZ2-CG 4.26Å; W138-F169 HydrophobicContact CZ3-CD1 4.4Å; W138-F169 HydrophobicContact CZ3-CG 4.49Å; A167-F169 PolarHBondContact O-N 3.25Å; F169-I171 PolarHBondContact O-N 2.9Å; F169-L172 PolarHBondContact O-N 3.46Å; F169-T173 HydrophobicContact CD1-CG2 3.79Å; F169-T173 HydrophobicContact CE1-CG2 3.35Å; F169-T173 HydrophobicContact CZ-CG2 4.13Å; F169-T173 WeakPolarHBondContact O-CG2 3.48Å; F169-T173 PolarHBondContact O-N 3.3Å; F169-T173 PolarHBondContact O-OG1 3.36Å; F169-W235 AromaticContact CD1-CH2 3.66Å; F169-W235 HydrophobicContact CD1-CH2 3.66Å; F169-W235 HydrophobicContact CD1-CZ3 4.18Å; F169-W235 AromaticContact CE1-CH2 2.95Å; F169-W235 HydrophobicContact CE1-CH2 2.95Å; F169-W235 AromaticContact CE1-CZ2 3.84Å; F169-W235 HydrophobicContact CE1-CZ2 3.84Å; F169-W235 AromaticContact CE1-CZ3 3.43Å; F169-W235 HydrophobicContact CE1-CZ3 3.43Å; F169-W235 VanDerWaalsContact CE1-CZ3 3.43Å; F169-W235 AromaticContact CZ-CH2 3.49Å; F169-W235 HydrophobicContact CZ-CH2 3.49Å; F169-W235 VanDerWaalsContact CZ-CH2 3.49Å; F169-W235 AromaticContact CZ-CZ2 3.9Å; F169-W235 HydrophobicContact CZ-CZ2 3.9Å; F169-W235 HydrophobicContact CZ-CZ3 4.22Å; F169-F244 HydrophobicContact CD2-CE1 4.02Å; F169-F244 AromaticContact CD2-CZ 3.72Å; F169-F244 HydrophobicContact CD2-CZ 3.72Å; F169-F244 HydrophobicContact CE1-CE2 4.21Å; F169-F244 HydrophobicContact CE1-CZ 4.16Å; F169-F244 HydrophobicContact CE2-CD1 4.18Å; F169-F244 AromaticContact CE2-CE1 3.39Å; F169-F244 HydrophobicContact CE2-CE1 3.39Å; F169-F244 AromaticContact CE2-CE2 3.88Å; F169-F244 HydrophobicContact CE2-CE2 3.88Å; F169-F244 AromaticContact CE2-CZ 3.18Å; F169-F244 HydrophobicContact CE2-CZ 3.18Å; F169-F244 HydrophobicContact CG-CZ 4.45Å; F169-F244 HydrophobicContact CZ-CD2 4.26Å; F169-F244 AromaticContact CZ-CE1 3.99Å; F169-F244 HydrophobicContact CZ-CE1 3.99Å; F169-F244 AromaticContact CZ-CE2 3.62Å; F169-F244 HydrophobicContact CZ-CE2 3.62Å; F169-F244 AromaticContact CZ-CZ 3.44Å; F169-F244 HydrophobicContact CZ-CZ 3.44Å; F169-F244 VanDerWaalsContact CZ-CZ 3.44Å
170	P	55.5	Low	57.6	Low	50 Å²	50	54.2 Å²	54.2	33%	0.325	30%	0.298	S	S	.	.	H	α-helix	trans	-55.9	-46.7	169.9	-26.6	34.5	0	0	0	113.3	L166 A167 L172 T173 L174	L166-P170 WeakPolarHBondContact O-CD 3.48Å; A167-P170 WeakPolarHBondContact O-CD 3.44Å; P170-L172 VanDerWaalsContact C-N 3.33Å; P170-L172 PolarHBondContact O-N 3.47Å; P170-T173 VanDerWaalsContact CA-OG1 3.31Å; P170-T173 WeakPolarHBondContact CA-OG1 3.32Å; P170-T173 PolarHBondContact O-N 2.93Å; P170-T173 PolarHBondContact O-OG1 3.44Å; P170-L174 VanDerWaalsContact O-CB 3.23Å; P170-L174 WeakPolarHBondContact O-CB 3.28Å; P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 2.91Å
171	I	58.3	Low	57	Low	91 Å²	91	55.5 Å²	55.5	47%	0.467	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-41.6	177.8	-69.6	165.2	0	0	0	110	A167 F169 L174 L175	A167-I171 HydrophobicContact CB-CD1 3.59Å; A167-I171 HydrophobicContact CB-CG1 4.21Å; A167-I171 WeakPolarHBondContact O-CA 3.44Å; A167-I171 WeakPolarHBondContact O-CB 3.32Å; A167-I171 WeakPolarHBondContact O-CD1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.47Å; A167-I171 PolarHBondContact O-N 2.84Å; F169-I171 PolarHBondContact O-N 2.9Å; I171-L174 CarbonylContact O-C 2.9Å; I171-L174 PolarHBondContact O-N 3.01Å; I171-L175 WeakPolarHBondContact O-CA 3.46Å; I171-L175 WeakPolarHBondContact O-CB 3.47Å; I171-L175 PolarHBondContact O-N 3.27Å
172	L	56.5	Low	56.4	Low	12 Å²	12	57.9 Å²	57.9	6%	0.063	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-45.5	177	-166.6	68.4	0	0	0	110.5	Y168 F169 P170 L174 L175 V176 M243 F244 I314	Y168-L172 HydrophobicContact CE1-CD2 4.07Å; Y168-L172 WeakPolarHBondContact O-CB 3.31Å; Y168-L172 PolarHBondContact O-N 3.16Å; F169-L172 PolarHBondContact O-N 3.46Å; P170-L172 VanDerWaalsContact C-N 3.33Å; P170-L172 PolarHBondContact O-N 3.47Å; L172-L174 VanDerWaalsContact C-N 3.32Å; L172-L174 PolarHBondContact O-N 3.29Å; L172-L175 PolarHBondContact O-N 3.18Å; L172-V176 HydrophobicContact CG-CG2 4.4Å; L172-V176 WeakPolarHBondContact O-CB 3.49Å; L172-V176 WeakPolarHBondContact O-CG2 3.25Å; L172-V176 PolarHBondContact O-N 3.12Å; L172-M243 HydrophobicContact CD1-CE 3.67Å; L172-M243 HydrophobicContact CD2-CE 3.69Å; L172-M243 HydrophobicContact CG-CE 3.66Å; L172-F244 HydrophobicContact CD2-CE1 4Å; L172-F244 HydrophobicContact CD2-CZ 3.68Å; L172-F244 HydrophobicContact CG-CZ 4.36Å; L172-I314 HydrophobicContact CD1-CG2 4.07Å
173	T	55	Low	55.9	Low	20 Å²	20	60.8 Å²	60.8	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-40.1	173.9	55.8	0	0	0	0	112.1	F169 P170 C177 F244	F169-T173 HydrophobicContact CD1-CG2 3.79Å; F169-T173 HydrophobicContact CE1-CG2 3.35Å; F169-T173 HydrophobicContact CZ-CG2 4.13Å; F169-T173 WeakPolarHBondContact O-CG2 3.48Å; F169-T173 PolarHBondContact O-N 3.3Å; F169-T173 PolarHBondContact O-OG1 3.36Å; P170-T173 VanDerWaalsContact CA-OG1 3.31Å; P170-T173 WeakPolarHBondContact CA-OG1 3.32Å; P170-T173 PolarHBondContact O-N 2.93Å; P170-T173 PolarHBondContact O-OG1 3.44Å; T173-C177 WeakPolarHBondContact O-CA 3.49Å; T173-C177 WeakPolarHBondContact O-CB 3.43Å; T173-C177 PolarHBondContact O-N 3.32Å; T173-F244 HydrophobicContact CG2-CE2 3.84Å; T173-F244 HydrophobicContact CG2-CZ 4.47Å
174	L	54.9	Low	55.2	Low	82 Å²	82	60.4 Å²	60.4	43%	0.429	31%	0.313	S	S	.	.	H	α-helix	trans	-70	-41.2	177.7	-74.9	169.8	0	0	0	111.2	P170 I171 L172 C177 H178 I231	P170-L174 VanDerWaalsContact O-CB 3.23Å; P170-L174 WeakPolarHBondContact O-CB 3.28Å; P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 2.91Å; I171-L174 CarbonylContact O-C 2.9Å; I171-L174 PolarHBondContact O-N 3.01Å; L172-L174 VanDerWaalsContact C-N 3.32Å; L172-L174 PolarHBondContact O-N 3.29Å; L174-C177 PolarHBondContact O-N 3.32Å; L174-H178 WeakPolarHBondContact O-CA 3.32Å; L174-H178 WeakPolarHBondContact O-CB 3.42Å; L174-H178 PolarHBondContact O-N 3.1Å; L174-I231 HydrophobicContact CD2-CD1 4.13Å
175	L	54.6	Low	54.6	Low	106 Å²	106	57.9 Å²	57.9	56%	0.555	30%	0.298	S	S	*	.	H	α-helix	trans	-69.3	-42.1	178.7	-174.7	74.6	0	0	0	110.7	I171 L172 H178 S179	I171-L175 WeakPolarHBondContact O-CA 3.46Å; I171-L175 WeakPolarHBondContact O-CB 3.47Å; I171-L175 PolarHBondContact O-N 3.27Å; L172-L175 PolarHBondContact O-N 3.18Å; L175-H178 PolarHBondContact O-N 3.18Å; L175-S179 VanDerWaalsContact O-CB 3.27Å; L175-S179 WeakPolarHBondContact O-CB 3.27Å; L175-S179 PolarHBondContact O-N 3.29Å; L175-S179 PolarHBondContact O-OG 2.97Å
176	V	53.3	Low	54.1	Low	12 Å²	12	61.4 Å²	61.4	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-42.4	174	172.9	0	0	0	0	110.3	L172 S179 R180 M243	L172-V176 HydrophobicContact CG-CG2 4.4Å; L172-V176 WeakPolarHBondContact O-CB 3.49Å; L172-V176 WeakPolarHBondContact O-CG2 3.25Å; L172-V176 PolarHBondContact O-N 3.12Å; V176-S179 WeakPolarHBondContact CA-OG 3.49Å; V176-S179 PolarHBondContact O-OG 3.27Å; V176-R180 WeakPolarHBondContact O-CB 3.44Å; V176-R180 VanDerWaalsContact O-CG 3.25Å; V176-R180 WeakPolarHBondContact O-CG 3.4Å; V176-R180 PolarHBondContact O-N 3.49Å; V176-M243 HydrophobicContact CG1-CB 4.32Å; V176-M243 HydrophobicContact CG2-CB 4.36Å; V176-M243 HydrophobicContact CG2-CE 3.54Å; V176-M243 HydrophobicContact CG2-SD 3.94Å
177	C	51.1	Low	53.7	Low	55 Å²	55	58.7 Å²	58.7	37%	0.372	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-42.1	175	-174.1	0	0	0	0	111.5	T173 L174 R180 Y181 I231	T173-C177 WeakPolarHBondContact O-CA 3.49Å; T173-C177 WeakPolarHBondContact O-CB 3.43Å; T173-C177 PolarHBondContact O-N 3.32Å; L174-C177 PolarHBondContact O-N 3.32Å; C177-R180 PolarHBondContact O-N 3.2Å; C177-Y181 VanDerWaalsContact O-CB 3.25Å; C177-Y181 WeakPolarHBondContact O-CB 3.46Å; C177-Y181 PolarHBondContact O-N 3.24Å; C177-I231 HydrophobicContact CB-CD1 4.32Å
178	H	51.4	Low	53	Low	116 Å²	116	61.9 Å²	61.9	54%	0.537	32%	0.316	S	S	.	.	H	α-helix	trans	-69.4	-40.9	-179.7	-172.9	-87.3	0	0	0	111	L174 L175 L182	L174-H178 WeakPolarHBondContact O-CA 3.32Å; L174-H178 WeakPolarHBondContact O-CB 3.42Å; L174-H178 PolarHBondContact O-N 3.1Å; L175-H178 PolarHBondContact O-N 3.18Å; H178-L182 WeakPolarHBondContact CE1-CD1 3.08Å; H178-L182 VanDerWaalsContact ND1-CD1 3.26Å; H178-L182 WeakPolarHBondContact ND1-CD1 3.32Å; H178-L182 WeakPolarHBondContact O-CB 3.41Å; H178-L182 WeakPolarHBondContact O-CG 3.41Å; H178-L182 PolarHBondContact O-N 3.1Å
179	S	53	Low	52	Low	62 Å²	62	63.2 Å²	63.2	43%	0.434	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-42.6	174.2	52.6	0	0	0	0	111.9	L175 V176 E183	L175-S179 VanDerWaalsContact O-CB 3.27Å; L175-S179 WeakPolarHBondContact O-CB 3.27Å; L175-S179 PolarHBondContact O-N 3.29Å; L175-S179 PolarHBondContact O-OG 2.97Å; V176-S179 WeakPolarHBondContact CA-OG 3.49Å; V176-S179 PolarHBondContact O-OG 3.27Å; S179-E183 WeakPolarHBondContact O-CB 3.32Å; S179-E183 PolarHBondContact O-N 3.03Å
180	R	50	Low	51.4	Low	49 Å²	49	66.9 Å²	66.9	19%	0.185	35%	0.346	C	S	.	.	H	α-helix	trans	-71	-36.4	176.8	-72.4	177.2	-177.4	-149.2	-7.2	114.1	V176 C177 E183 K184 E241 N242	V176-R180 WeakPolarHBondContact O-CB 3.44Å; V176-R180 VanDerWaalsContact O-CG 3.25Å; V176-R180 WeakPolarHBondContact O-CG 3.4Å; V176-R180 PolarHBondContact O-N 3.49Å; C177-R180 PolarHBondContact O-N 3.2Å; R180-E183 WeakPolarHBondContact O-CB 3.4Å; R180-E183 PolarHBondContact O-N 2.95Å; R180-K184 WeakPolarHBondContact O-CG 3.35Å; R180-K184 PolarHBondContact O-N 2.92Å; R180-E241 VanDerWaalsContact NH1-CB 3.31Å; R180-E241 PolarHBondContact NH1-O 2.89Å; R180-E241 PolarHBondContact NH2-O 3.01Å; R180-N242 PolarHBondContact NH1-OD1 3.24Å
181	Y	50.9	Low	50.4	Low	114 Å²	114	70.3 Å²	70.3	45%	0.447	35%	0.353	S	S	.	.	H	α-helix	trans	-73.9	-39.5	174.7	-175.4	-99.9	0	0	0	111	C177 E183 K184 V185	C177-Y181 VanDerWaalsContact O-CB 3.25Å; C177-Y181 WeakPolarHBondContact O-CB 3.46Å; C177-Y181 PolarHBondContact O-N 3.24Å; Y181-E183 PolarHBondContact O-N 3.47Å; Y181-K184 CarbonylContact O-C 3.6Å; Y181-K184 PolarHBondContact O-N 2.88Å; Y181-K184 VanDerWaalsContact O-N 3.12Å; Y181-V185 HydrophobicContact CD1-CG2 3.62Å; Y181-V185 HydrophobicContact CD2-CG2 4.37Å; Y181-V185 HydrophobicContact CE1-CB 4.45Å; Y181-V185 HydrophobicContact CE1-CG2 3.09Å; Y181-V185 HydrophobicContact CE2-CG2 3.93Å; Y181-V185 HydrophobicContact CG-CG2 4.23Å; Y181-V185 WeakPolarHBondContact O-CB 3.46Å; Y181-V185 WeakPolarHBondContact O-CG2 3.42Å; Y181-V185 PolarHBondContact O-N 3.49Å
182	L	48.7	Very low	49.3	Very low	83 Å²	83	72.9 Å²	72.9	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-54.2	-43.6	167.6	-89.6	169.6	0	0	0	110.2	H178 V185 V186	H178-L182 WeakPolarHBondContact CE1-CD1 3.08Å; H178-L182 VanDerWaalsContact ND1-CD1 3.26Å; H178-L182 WeakPolarHBondContact ND1-CD1 3.32Å; H178-L182 WeakPolarHBondContact O-CB 3.41Å; H178-L182 WeakPolarHBondContact O-CG 3.41Å; H178-L182 PolarHBondContact O-N 3.1Å; L182-V185 PolarHBondContact O-N 3.23Å; L182-V186 WeakPolarHBondContact O-CB 3.27Å; L182-V186 WeakPolarHBondContact O-CG2 3.49Å; L182-V186 PolarHBondContact O-N 3.01Å
183	E	50.7	Low	48.6	Very low	67 Å²	67	78.7 Å²	78.7	31%	0.313	39%	0.389	S	S	.	.	H	α-helix	trans	-61	-47.5	174.9	-169.7	-179.8	178.2	0	0	111.7	S179 R180 Y181 C187	S179-E183 WeakPolarHBondContact O-CB 3.32Å; S179-E183 PolarHBondContact O-N 3.03Å; R180-E183 WeakPolarHBondContact O-CB 3.4Å; R180-E183 PolarHBondContact O-N 2.95Å; Y181-E183 PolarHBondContact O-N 3.47Å; E183-C187 WeakPolarHBondContact O-CB 3.19Å; E183-C187 PolarHBondContact O-N 3.46Å; E183-C187 PolarHBondContact O-SG 3.15Å
184	K	49.4	Very low	47.3	Very low	96 Å²	96	85.5 Å²	85.5	42%	0.417	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-44	176.2	-74.8	-177.9	-178.8	179.5	0	113	R180 Y181 C187 Q188	R180-K184 WeakPolarHBondContact O-CG 3.35Å; R180-K184 PolarHBondContact O-N 2.92Å; Y181-K184 CarbonylContact O-C 3.6Å; Y181-K184 PolarHBondContact O-N 2.88Å; Y181-K184 VanDerWaalsContact O-N 3.12Å; K184-C187 CarbonylContact O-C 3.58Å; K184-C187 PolarHBondContact O-N 3.49Å; K184-Q188 VanDerWaalsContact O-CB 3.31Å; K184-Q188 WeakPolarHBondContact O-CB 3.37Å; K184-Q188 VanDerWaalsContact O-CG 3.29Å; K184-Q188 WeakPolarHBondContact O-CG 3.33Å; K184-Q188 PolarHBondContact O-N 3.42Å
185	V	50.1	Low	46.3	Very low	34 Å²	34	86 Å²	86	21%	0.206	43%	0.428	C	S	.	.	H	α-helix	trans	-67.1	-48.6	178.6	171.3	0	0	0	0	110.3	Y181 L182 C187 Q188 D189	Y181-V185 HydrophobicContact CD1-CG2 3.62Å; Y181-V185 HydrophobicContact CD2-CG2 4.37Å; Y181-V185 HydrophobicContact CE1-CB 4.45Å; Y181-V185 HydrophobicContact CE1-CG2 3.09Å; Y181-V185 HydrophobicContact CE2-CG2 3.93Å; Y181-V185 HydrophobicContact CG-CG2 4.23Å; Y181-V185 WeakPolarHBondContact O-CB 3.46Å; Y181-V185 WeakPolarHBondContact O-CG2 3.42Å; Y181-V185 PolarHBondContact O-N 3.49Å; L182-V185 PolarHBondContact O-N 3.23Å; V185-C187 PolarHBondContact O-N 3.4Å; V185-Q188 CarbonylContact O-C 3.55Å; V185-Q188 PolarHBondContact O-N 3.41Å; V185-Q188 VanDerWaalsContact O-N 3.08Å; V185-D189 WeakPolarHBondContact O-CB 3.18Å; V185-D189 PolarHBondContact O-N 3.4Å
186	V	51.9	Low	45.2	Very low	76 Å²	76	88.4 Å²	88.4	46%	0.461	44%	0.441	S	S	.	.	H	α-helix	trans	-59.3	-40.5	175.7	171.5	0	0	0	0	109.8	L182 I190	L182-V186 WeakPolarHBondContact O-CB 3.27Å; L182-V186 WeakPolarHBondContact O-CG2 3.49Å; L182-V186 PolarHBondContact O-N 3.01Å; V186-I190 HydrophobicContact CG1-CD1 3.91Å; V186-I190 WeakPolarHBondContact O-CB 3.37Å; V186-I190 VanDerWaalsContact O-CD1 3.31Å; V186-I190 WeakPolarHBondContact O-CD1 3.21Å; V186-I190 WeakPolarHBondContact O-CG1 3.42Å; V186-I190 PolarHBondContact O-N 3.46Å
187	C	49.4	Very low	44.3	Very low	15 Å²	15	93.4 Å²	93.4	10%	0.101	48%	0.477	C	S	.	.	H	α-helix	trans	-72.4	-26.2	175.5	-75.1	0	0	0	0	114.7	E183 K184 V185 R191 Y270	E183-C187 WeakPolarHBondContact O-CB 3.19Å; E183-C187 PolarHBondContact O-N 3.46Å; E183-C187 PolarHBondContact O-SG 3.15Å; K184-C187 CarbonylContact O-C 3.58Å; K184-C187 PolarHBondContact O-N 3.49Å; V185-C187 PolarHBondContact O-N 3.4Å; C187-R191 PolarHBondContact O-N 2.93Å; C187-Y270 PolarHBondContact SG-OH 2.87Å; C187-Y270 VanDerWaalsContact SG-OH 3.32Å
188	Q	47.5	Very low	43.3	Very low	97 Å²	97	96.3 Å²	96.3	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-80.2	-40.4	173	-80.4	178.8	-17.1	0	0	111.3	K184 V185 R191 H192	K184-Q188 VanDerWaalsContact O-CB 3.31Å; K184-Q188 WeakPolarHBondContact O-CB 3.37Å; K184-Q188 VanDerWaalsContact O-CG 3.29Å; K184-Q188 WeakPolarHBondContact O-CG 3.33Å; K184-Q188 PolarHBondContact O-N 3.42Å; V185-Q188 CarbonylContact O-C 3.55Å; V185-Q188 PolarHBondContact O-N 3.41Å; V185-Q188 VanDerWaalsContact O-N 3.08Å; Q188-R191 CarbonylContact O-C 3.58Å; Q188-R191 WeakPolarHBondContact O-CA 3.21Å; Q188-R191 WeakPolarHBondContact O-CB 3.08Å; Q188-R191 PolarHBondContact O-N 3.15Å; Q188-H192 PolarHBondContact O-CD2 3.13Å; Q188-H192 VanDerWaalsContact O-CD2 3.25Å; Q188-H192 PolarHBondContact O-N 2.9Å
189	D	43.4	Very low	42.3	Very low	82 Å²	82	98.5 Å²	98.5	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-41.7	174.7	-81.6	-15.5	0	0	0	110.9	V185 R191 H192 H193	V185-D189 WeakPolarHBondContact O-CB 3.18Å; V185-D189 PolarHBondContact O-N 3.4Å; D189-R191 PolarHBondContact O-N 2.93Å; D189-H192 PolarHBondContact O-N 3.12Å; D189-H193 PolarHBondContact O-N 3.29Å; D189-H193 PolarHBondContact O-ND1 2.95Å
190	I	43.5	Very low	41.2	Very low	86 Å²	86	101.1 Å²	101.1	44%	0.441	53%	0.527	S	S	.	.	H	α-helix	trans	-58	-35.5	171	-70.5	163.6	0	0	0	110.8	V186 H193 H194	V186-I190 HydrophobicContact CG1-CD1 3.91Å; V186-I190 WeakPolarHBondContact O-CB 3.37Å; V186-I190 VanDerWaalsContact O-CD1 3.31Å; V186-I190 WeakPolarHBondContact O-CD1 3.21Å; V186-I190 WeakPolarHBondContact O-CG1 3.42Å; V186-I190 PolarHBondContact O-N 3.46Å; I190-H193 PolarHBondContact O-N 3.28Å; I190-H194 PolarHBondContact O-N 2.99Å
191	R	33.9	Very low	40.5	Very low	122 Å²	122	104.2 Å²	104.2	46%	0.46	56%	0.555	S	S	.	*	H	α-helix	trans	-70.2	-41.4	176.6	-120	179.5	-69.1	-156	-3	112.4	C187 Q188 D189 H193 H194	C187-R191 PolarHBondContact O-N 2.93Å; Q188-R191 CarbonylContact O-C 3.58Å; Q188-R191 WeakPolarHBondContact O-CA 3.21Å; Q188-R191 WeakPolarHBondContact O-CB 3.08Å; Q188-R191 PolarHBondContact O-N 3.15Å; D189-R191 PolarHBondContact O-N 2.93Å; R191-H193 VanDerWaalsContact C-N 3.26Å; R191-H193 PolarHBondContact O-N 3.23Å; R191-H194 CarbonylContact O-C 3.48Å; R191-H194 PolarHBondContact O-N 3.17Å
192	H	36.9	Very low	39.4	Very low	145 Å²	145	107.3 Å²	107.3	67%	0.671	58%	0.58	S	S	*	*	H	α-helix	trans	-70.2	-22.2	176.2	-71.6	-58	0	0	0	113.3	Q188 D189	Q188-H192 PolarHBondContact O-CD2 3.13Å; Q188-H192 VanDerWaalsContact O-CD2 3.25Å; Q188-H192 PolarHBondContact O-N 2.9Å; D189-H192 PolarHBondContact O-N 3.12Å
193	H	40.4	Very low	38.5	Very low	134 Å²	134	108 Å²	108	62%	0.62	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-9.3	172.1	-72.2	78	0	0	0	113.9	D189 I190 R191 P195	D189-H193 PolarHBondContact O-N 3.29Å; D189-H193 PolarHBondContact O-ND1 2.95Å; I190-H193 PolarHBondContact O-N 3.28Å; R191-H193 VanDerWaalsContact C-N 3.26Å; R191-H193 PolarHBondContact O-N 3.23Å; H193-P195 WeakPolarHBondContact O-CD 3.28Å
194	H	28.5	Very low	37.3	Very low	162 Å²	162	116.4 Å²	116.4	75%	0.75	62%	0.62	S	S	*	*	S	Bend	trans	-107.7	67.7	165.8	-106.3	-73.2	0	0	0	109.9	I190 R191 D196	I190-H194 PolarHBondContact O-N 2.99Å; R191-H194 CarbonylContact O-C 3.48Å; R191-H194 PolarHBondContact O-N 3.17Å; H194-D196 PolarHBondContact O-N 3.32Å
195	P	34.1	Very low	36.3	Very low	94 Å²	94	119.8 Å²	119.8	61%	0.61	64%	0.64	S	S	*	*			trans	-67.5	133	165.3	30.5	-30.1	0	0	0	107.9	H193 S197	H193-P195 WeakPolarHBondContact O-CD 3.28Å; P195-S197 PolarHBondContact O-N 3.45Å
196	D	31.2	Very low	35.3	Very low	155 Å²	155	124 Å²	124	83%	0.829	67%	0.665	S	S	*	*			trans	-42.6	113.8	163.9	-73.3	-45.5	0	0	0	108.4	H194 T198	H194-D196 PolarHBondContact O-N 3.32Å; D196-T198 PolarHBondContact O-N 3.01Å
197	S	34.4	Very low	34.1	Very low	118 Å²	118	130.2 Å²	130.2	83%	0.825	68%	0.682	S	S	*	*	S	Bend	trans	-76.8	69.3	-175.2	62.3	0	0	0	0	109.9	P195	P195-S197 PolarHBondContact O-N 3.45Å
198	T	30.7	Very low	32.9	Very low	115 Å²	115	137.8 Å²	137.8	71%	0.706	72%	0.716	S	S	*	*			trans	-140.1	75	158.4	53.1	0	0	0	0	106.8	D196	D196-T198 PolarHBondContact O-N 3.01Å
199	D	30.9	Very low	32.1	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	73%	0.731	S	S	*	*			trans	-159.1	109.1	141.4	-93.4	-25.2	0	0	0	110.9	S201	D199-S201 PolarHBondContact O-N 3.21Å
200	S	29.7	Very low	31.6	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	74%	0.743	S	S	*	*			trans	-70.8	109.6	168.1	50.3	0	0	0	0	109.8
201	S	34	Very low	31.2	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	76%	0.761	S	S	*	*			trans	-178.2	136.5	133.9	51.1	0	0	0	0	111.6	D199 S203	D199-S201 PolarHBondContact O-N 3.21Å; S201-S203 PolarHBondContact O-N 3.27Å; S201-S203 VanDerWaalsContact O-N 3.09Å
202	N	28.2	Very low	31.3	Very low	179 Å²	179	147.4 Å²	147.4	96%	0.957	78%	0.783	S	S	*	*			trans	-51.5	106.7	179.9	-71.4	-43.5	0	0	0	113.3
203	S	30	Very low	31.9	Very low	97 Å²	97	143.3 Å²	143.3	68%	0.678	77%	0.771	S	S	*	*			trans	-129.5	102.3	148.4	60.6	0	0	0	0	109.7	S201 M205	S201-S203 PolarHBondContact O-N 3.27Å; S201-S203 VanDerWaalsContact O-N 3.09Å; S203-M205 VanDerWaalsContact C-N 3.27Å; S203-M205 PolarHBondContact O-N 3.48Å
204	R	26.3	Very low	32.5	Very low	244 Å²	244	143.5 Å²	143.5	92%	0.921	78%	0.775	S	S	*	*			trans	-63	90.7	163.2	-96.6	177.7	-90.7	-179.3	-7.3	107.2	V206	R204-V206 PolarHBondContact O-N 3.14Å; R204-V206 VanDerWaalsContact O-N 3.16Å
205	M	28.2	Very low	33.9	Very low	167 Å²	167	140.2 Å²	140.2	82%	0.823	77%	0.767	S	S	*	*			trans	-74.7	100.1	162.2	-74.3	-142.4	-155.7	0	0	108	S203 Y207	S203-M205 VanDerWaalsContact C-N 3.27Å; S203-M205 PolarHBondContact O-N 3.48Å; M205-Y207 PolarHBondContact O-N 2.85Å
206	V	27.3	Very low	35.2	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	76%	0.758	S	S	*	*			trans	-66.9	116.3	165.3	172.8	0	0	0	0	107.1	R204 Q208	R204-V206 PolarHBondContact O-N 3.14Å; R204-V206 VanDerWaalsContact O-N 3.16Å; V206-Q208 PolarHBondContact O-N 3.5Å
207	Y	28.3	Very low	36.2	Very low	208 Å²	208	136.1 Å²	136.1	82%	0.816	75%	0.746	S	S	*	*			trans	-61.6	100.8	168.8	-88.3	-94.8	0	0	0	109.1	M205	M205-Y207 PolarHBondContact O-N 2.85Å
208	Q	23.7	Very low	37.7	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	73%	0.734	S	S	*	*			trans	-89.4	121.1	159.4	-103.3	-178.7	-31.2	0	0	108	V206 S210	V206-Q208 PolarHBondContact O-N 3.5Å; Q208-S210 PolarHBondContact O-N 2.82Å
209	P	29.9	Very low	39.3	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	73%	0.729	S	S	*	*			trans	-68.3	108.2	172	27.6	-28.8	0	0	0	107.4	I211	P209-I211 PolarHBondContact O-N 2.86Å
210	S	32.7	Very low	40.9	Very low	98 Å²	98	134.1 Å²	134.1	69%	0.685	72%	0.716	S	S	*	*			trans	-61.1	120.6	178.7	55.5	0	0	0	0	109.9	Q208 F212	Q208-S210 PolarHBondContact O-N 2.82Å; S210-F212 PolarHBondContact O-N 3.29Å
211	I	35	Very low	42.5	Very low	160 Å²	160	135 Å²	135	82%	0.821	71%	0.705	S	S	*	*			trans	-48.3	129.7	172.4	-66.3	164.7	0	0	0	109.7	P209 S213	P209-I211 PolarHBondContact O-N 2.86Å; I211-S213 PolarHBondContact O-N 2.69Å
212	F	37	Very low	44.1	Very low	213 Å²	213	132.8 Å²	132.8	93%	0.934	69%	0.69	S	S	*	*			trans	-51.6	103.8	-179.8	-96.6	-104.7	0	0	0	111.8	S210	S210-F212 PolarHBondContact O-N 3.29Å
213	S	48.6	Very low	45.8	Very low	58 Å²	58	126.1 Å²	126.1	41%	0.406	66%	0.658	S	S	.	*			trans	-97.1	141.4	172.7	175.8	0	0	0	0	111.3	I211 T215 N216	I211-S213 PolarHBondContact O-N 2.69Å; S213-T215 PolarHBondContact O-N 2.77Å; S213-T215 VanDerWaalsContact O-N 3.1Å; S213-T215 PolarHBondContact OG-OG1 2.8Å; S213-N216 PolarHBondContact O-N 2.99Å
214	L	53.5	Low	47.3	Very low	138 Å²	138	124 Å²	124	72%	0.723	64%	0.642	S	S	*	*	H	α-helix	trans	-50.8	-31.9	177.5	-169	75.4	0	0	0	113.3	N216 C217 L218	L214-N216 VanDerWaalsContact C-N 3.35Å; L214-N216 PolarHBondContact O-N 3.09Å; L214-C217 WeakPolarHBondContact O-CB 3.37Å; L214-C217 PolarHBondContact O-N 3.45Å; L214-C217 VanDerWaalsContact O-N 3.12Å; L214-L218 PolarHBondContact O-N 2.72Å
215	T	58.2	Low	49	Very low	93 Å²	93	115.2 Å²	115.2	57%	0.571	62%	0.618	S	S	*	*	H	α-helix	trans	-61.1	-39.2	176.4	12.5	0	0	0	0	112.9	S213 C217 L218 Q219	S213-T215 PolarHBondContact O-N 2.77Å; S213-T215 VanDerWaalsContact O-N 3.1Å; S213-T215 PolarHBondContact OG-OG1 2.8Å; T215-C217 VanDerWaalsContact C-N 3.29Å; T215-C217 PolarHBondContact O-N 2.88Å; T215-L218 PolarHBondContact O-N 3.22Å; T215-Q219 WeakPolarHBondContact O-CB 3.32Å; T215-Q219 PolarHBondContact O-N 2.72Å
216	N	60.3	Low	50.7	Low	78 Å²	78	115.9 Å²	115.9	42%	0.417	61%	0.611	S	S	.	*	H	α-helix	trans	-69.6	-31.3	175.8	-71.2	-2.6	0	0	0	111.1	S213 L214 Q219 L220	S213-N216 PolarHBondContact O-N 2.99Å; L214-N216 VanDerWaalsContact C-N 3.35Å; L214-N216 PolarHBondContact O-N 3.09Å; N216-Q219 PolarHBondContact O-N 2.99Å; N216-L220 WeakPolarHBondContact O-CB 3.4Å; N216-L220 WeakPolarHBondContact O-CD1 3.45Å; N216-L220 PolarHBondContact O-N 2.75Å
217	C	53.5	Low	52.2	Low	85 Å²	85	115.4 Å²	115.4	57%	0.574	60%	0.596	S	S	*	*	H	α-helix	trans	-69.5	-43.5	177	-151.5	0	0	0	0	111.4	L214 T215 Q219 L220 F221	L214-C217 WeakPolarHBondContact O-CB 3.37Å; L214-C217 PolarHBondContact O-N 3.45Å; L214-C217 VanDerWaalsContact O-N 3.12Å; T215-C217 VanDerWaalsContact C-N 3.29Å; T215-C217 PolarHBondContact O-N 2.88Å; C217-Q219 VanDerWaalsContact C-N 3.34Å; C217-Q219 PolarHBondContact O-N 3.33Å; C217-L220 PolarHBondContact O-N 3.5Å; C217-F221 VanDerWaalsContact O-CB 3.28Å; C217-F221 WeakPolarHBondContact O-CB 3.08Å; C217-F221 PolarHBondContact O-N 3.28Å
218	L	65.5	Low	53.8	Low	111 Å²	111	108.1 Å²	108.1	58%	0.581	58%	0.575	S	S	*	*	H	α-helix	trans	-63.5	-38.1	172.6	-81.4	165.9	0	0	0	112.2	L214 T215 F221 S222	L214-L218 PolarHBondContact O-N 2.72Å; T215-L218 PolarHBondContact O-N 3.22Å; L218-F221 PolarHBondContact O-N 2.97Å; L218-S222 VanDerWaalsContact O-CB 3.28Å; L218-S222 WeakPolarHBondContact O-CB 3.42Å; L218-S222 PolarHBondContact O-N 3.49Å; L218-S222 PolarHBondContact O-OG 3.42Å
219	Q	64.1	Low	55.6	Low	128 Å²	128	104.2 Å²	104.2	60%	0.598	56%	0.559	S	S	*	*	H	α-helix	trans	-71	-38	175.8	-168.4	175.5	-3.4	0	0	112.1	T215 N216 C217 S222 S223	T215-Q219 WeakPolarHBondContact O-CB 3.32Å; T215-Q219 PolarHBondContact O-N 2.72Å; N216-Q219 PolarHBondContact O-N 2.99Å; C217-Q219 VanDerWaalsContact C-N 3.34Å; C217-Q219 PolarHBondContact O-N 3.33Å; Q219-S222 PolarHBondContact O-OG 2.75Å; Q219-S223 WeakPolarHBondContact O-CB 3.35Å; Q219-S223 PolarHBondContact O-N 3.24Å
220	L	64	Low	57.1	Low	116 Å²	116	100.5 Å²	100.5	61%	0.607	54%	0.535	S	S	*	.	H	α-helix	trans	-63.9	-42.9	171.1	-104.8	96.2	0	0	0	111	N216 C217 S224	N216-L220 WeakPolarHBondContact O-CB 3.4Å; N216-L220 WeakPolarHBondContact O-CD1 3.45Å; N216-L220 PolarHBondContact O-N 2.75Å; C217-L220 PolarHBondContact O-N 3.5Å; L220-S224 VanDerWaalsContact O-CB 3.26Å; L220-S224 WeakPolarHBondContact O-CB 3.07Å; L220-S224 PolarHBondContact O-N 2.97Å; L220-S224 PolarHBondContact O-OG 2.96Å
221	F	63.5	Low	58.4	Low	135 Å²	135	97.7 Å²	97.7	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-67.5	-48.4	179.7	-175.9	-100.4	0	0	0	111.1	C217 L218 S223 S224 C225	C217-F221 VanDerWaalsContact O-CB 3.28Å; C217-F221 WeakPolarHBondContact O-CB 3.08Å; C217-F221 PolarHBondContact O-N 3.28Å; L218-F221 PolarHBondContact O-N 2.97Å; F221-S223 VanDerWaalsContact C-N 3.32Å; F221-S223 PolarHBondContact O-N 2.76Å; F221-S224 CarbonylContact O-C 3.43Å; F221-S224 PolarHBondContact O-N 3.27Å; F221-S224 VanDerWaalsContact O-N 3.12Å; F221-C225 VanDerWaalsContact CE1-SG 3.51Å; F221-C225 VanDerWaalsContact CZ-SG 3.56Å; F221-C225 PolarHBondContact O-N 3.23Å; F221-C225 PolarHBondContact O-SG 3.35Å; F221-C225 VanDerWaalsContact O-SG 3.4Å
222	S	67.5	Low	59.6	Low	67 Å²	67	92.5 Å²	92.5	47%	0.469	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-40.7	176.4	71.4	0	0	0	0	111.4	L218 Q219 C225 W226	L218-S222 VanDerWaalsContact O-CB 3.28Å; L218-S222 WeakPolarHBondContact O-CB 3.42Å; L218-S222 PolarHBondContact O-N 3.49Å; L218-S222 PolarHBondContact O-OG 3.42Å; Q219-S222 PolarHBondContact O-OG 2.75Å; S222-C225 PolarHBondContact O-N 3.42Å; S222-W226 WeakPolarHBondContact O-CB 3.43Å; S222-W226 PolarHBondContact O-N 2.79Å
223	S	65	Low	60.5	Low	39 Å²	39	83.7 Å²	83.7	27%	0.273	45%	0.449	S	S	.	.	H	α-helix	trans	-63.5	-41.4	173.5	-164.6	0	0	0	0	111.2	Q219 F221 W226 R227	Q219-S223 WeakPolarHBondContact O-CB 3.35Å; Q219-S223 PolarHBondContact O-N 3.24Å; F221-S223 VanDerWaalsContact C-N 3.32Å; F221-S223 PolarHBondContact O-N 2.76Å; S223-W226 PolarHBondContact O-N 2.84Å; S223-R227 VanDerWaalsContact O-CB 3.31Å; S223-R227 WeakPolarHBondContact O-CB 3.47Å; S223-R227 VanDerWaalsContact O-CD 3.24Å; S223-R227 WeakPolarHBondContact O-CD 3.47Å; S223-R227 WeakPolarHBondContact O-CG 3.16Å; S223-R227 PolarHBondContact O-N 3.27Å; S223-R227 PolarHBondContact O-NE 3.18Å; S223-R227 VanDerWaalsContact OG-CZ 3.24Å; S223-R227 PolarHBondContact OG-NE 2.83Å; S223-R227 PolarHBondContact OG-NH2 3.28Å
224	S	61.3	Low	61	Low	51 Å²	51	83.1 Å²	83.1	36%	0.357	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-42.6	176.8	-59.2	0	0	0	0	112.3	L220 F221 R227 C228	L220-S224 VanDerWaalsContact O-CB 3.26Å; L220-S224 WeakPolarHBondContact O-CB 3.07Å; L220-S224 PolarHBondContact O-N 2.97Å; L220-S224 PolarHBondContact O-OG 2.96Å; F221-S224 CarbonylContact O-C 3.43Å; F221-S224 PolarHBondContact O-N 3.27Å; F221-S224 VanDerWaalsContact O-N 3.12Å; S224-R227 WeakPolarHBondContact O-CB 3.21Å; S224-R227 PolarHBondContact O-N 3.47Å; S224-C228 PolarHBondContact O-N 3.4Å; S224-C228 PolarHBondContact O-SG 2.83Å
225	C	61.7	Low	61.1	Low	60 Å²	60	77 Å²	77	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-64.1	-44.2	175.1	-71.9	0	0	0	0	111.9	F221 S222 R227 C228 L229	F221-C225 VanDerWaalsContact CE1-SG 3.51Å; F221-C225 VanDerWaalsContact CZ-SG 3.56Å; F221-C225 PolarHBondContact O-N 3.23Å; F221-C225 PolarHBondContact O-SG 3.35Å; F221-C225 VanDerWaalsContact O-SG 3.4Å; S222-C225 PolarHBondContact O-N 3.42Å; C225-R227 VanDerWaalsContact C-N 3.29Å; C225-R227 PolarHBondContact O-N 3.47Å; C225-C228 PolarHBondContact O-N 2.76Å; C225-L229 WeakPolarHBondContact O-CB 3.37Å; C225-L229 PolarHBondContact O-N 2.76Å
226	W	63.2	Low	60.7	Low	181 Å²	181	72.7 Å²	72.7	69%	0.686	38%	0.382	S	S	*	.	H	α-helix	trans	-64.4	-36.3	176.3	-150.6	81.7	0	0	0	111.2	S222 S223 L229 T230	S222-W226 WeakPolarHBondContact O-CB 3.43Å; S222-W226 PolarHBondContact O-N 2.79Å; S223-W226 PolarHBondContact O-N 2.84Å; W226-L229 WeakPolarHBondContact O-CB 3.48Å; W226-L229 PolarHBondContact O-N 2.75Å; W226-T230 HydrophobicContact CE3-CG2 3.99Å; W226-T230 HydrophobicContact CZ3-CG2 3.96Å; W226-T230 WeakPolarHBondContact O-CG2 3.5Å; W226-T230 PolarHBondContact O-N 3.48Å; W226-T230 PolarHBondContact O-OG1 3.4Å
227	R	60	Low	60.2	Low	112 Å²	112	70.1 Å²	70.1	42%	0.423	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-45	173	-71.3	163.1	-158.4	-164.5	1.8	112.6	S223 S224 C225 L229 T230 I231	S223-R227 VanDerWaalsContact O-CB 3.31Å; S223-R227 WeakPolarHBondContact O-CB 3.47Å; S223-R227 VanDerWaalsContact O-CD 3.24Å; S223-R227 WeakPolarHBondContact O-CD 3.47Å; S223-R227 WeakPolarHBondContact O-CG 3.16Å; S223-R227 PolarHBondContact O-N 3.27Å; S223-R227 PolarHBondContact O-NE 3.18Å; S223-R227 VanDerWaalsContact OG-CZ 3.24Å; S223-R227 PolarHBondContact OG-NE 2.83Å; S223-R227 PolarHBondContact OG-NH2 3.28Å; S224-R227 WeakPolarHBondContact O-CB 3.21Å; S224-R227 PolarHBondContact O-N 3.47Å; C225-R227 VanDerWaalsContact C-N 3.29Å; C225-R227 PolarHBondContact O-N 3.47Å; R227-L229 VanDerWaalsContact C-N 3.29Å; R227-L229 PolarHBondContact O-N 2.81Å; R227-T230 WeakPolarHBondContact CA-OG1 3.37Å; R227-T230 PolarHBondContact O-N 3.47Å; R227-T230 PolarHBondContact O-OG1 3.28Å; R227-I231 WeakPolarHBondContact O-CG1 3.3Å; R227-I231 PolarHBondContact O-N 3.07Å; R227-I231 VanDerWaalsContact O-N 3.07Å
228	C	61.4	Low	60.1	Low	56 Å²	56	67 Å²	67	38%	0.378	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-41.3	173.7	-69.9	0	0	0	0	110.9	S224 C225 I231 I232	S224-C228 PolarHBondContact O-N 3.4Å; S224-C228 PolarHBondContact O-SG 2.83Å; C225-C228 PolarHBondContact O-N 2.76Å; C228-I231 PolarHBondContact O-N 3.3Å; C228-I232 WeakPolarHBondContact O-CD1 3.49Å; C228-I232 VanDerWaalsContact O-CG1 3.27Å; C228-I232 WeakPolarHBondContact O-CG1 3.46Å; C228-I232 PolarHBondContact O-N 2.94Å
229	L	62.5	Low	59.3	Low	90 Å²	90	64.7 Å²	64.7	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-45.5	176	-175.5	65.1	0	0	0	111.3	C225 W226 R227 I231 I232 T233	C225-L229 WeakPolarHBondContact O-CB 3.37Å; C225-L229 PolarHBondContact O-N 2.76Å; W226-L229 WeakPolarHBondContact O-CB 3.48Å; W226-L229 PolarHBondContact O-N 2.75Å; R227-L229 VanDerWaalsContact C-N 3.29Å; R227-L229 PolarHBondContact O-N 2.81Å; L229-I231 VanDerWaalsContact C-N 3.32Å; L229-I231 PolarHBondContact O-N 2.93Å; L229-I232 PolarHBondContact O-N 3.35Å; L229-T233 HydrophobicContact CD1-CG2 3.96Å; L229-T233 HydrophobicContact CG-CG2 4.22Å; L229-T233 WeakPolarHBondContact O-CB 3.27Å; L229-T233 WeakPolarHBondContact O-CG2 3.47Å; L229-T233 PolarHBondContact O-N 3.49Å; L229-T233 PolarHBondContact O-OG1 3.39Å
230	T	61.4	Low	58.4	Low	42 Å²	42	60.6 Å²	60.6	26%	0.258	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-38	176.4	51.4	0	0	0	0	112.7	W226 R227 I232 T233 D234	W226-T230 HydrophobicContact CE3-CG2 3.99Å; W226-T230 HydrophobicContact CZ3-CG2 3.96Å; W226-T230 WeakPolarHBondContact O-CG2 3.5Å; W226-T230 PolarHBondContact O-N 3.48Å; W226-T230 PolarHBondContact O-OG1 3.4Å; R227-T230 WeakPolarHBondContact CA-OG1 3.37Å; R227-T230 PolarHBondContact O-N 3.47Å; R227-T230 PolarHBondContact O-OG1 3.28Å; T230-I232 VanDerWaalsContact C-N 3.33Å; T230-I232 PolarHBondContact O-N 2.86Å; T230-T233 WeakPolarHBondContact CA-OG1 3.4Å; T230-T233 PolarHBondContact O-N 3.21Å; T230-T233 PolarHBondContact O-OG1 3.07Å; T230-D234 WeakPolarHBondContact O-CA 3.27Å; T230-D234 WeakPolarHBondContact O-CB 3.18Å; T230-D234 PolarHBondContact O-N 2.93Å
231	I	58.3	Low	57.4	Low	39 Å²	39	56.7 Å²	56.7	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-40.1	177.3	-66.9	164.3	0	0	0	110.9	L174 C177 R227 C228 L229 W235	L174-I231 HydrophobicContact CD2-CD1 4.13Å; C177-I231 HydrophobicContact CB-CD1 4.32Å; R227-I231 WeakPolarHBondContact O-CG1 3.3Å; R227-I231 PolarHBondContact O-N 3.07Å; R227-I231 VanDerWaalsContact O-N 3.07Å; C228-I231 PolarHBondContact O-N 3.3Å; L229-I231 VanDerWaalsContact C-N 3.32Å; L229-I231 PolarHBondContact O-N 2.93Å; I231-W235 PolarHBondContact O-N 2.85Å
232	I	61.8	Low	56.5	Low	50 Å²	50	51.5 Å²	51.5	26%	0.256	28%	0.282	S	S	.	.	H	α-helix	trans	-70.7	-42.8	179.2	-66.8	165.2	0	0	0	111.1	L132 F135 C228 L229 T230 W235	L132-I232 HydrophobicContact CD1-CG2 3.44Å; L132-I232 VanDerWaalsContact CD1-CG2 3.44Å; F135-I232 HydrophobicContact CD1-CB 4.43Å; F135-I232 HydrophobicContact CD1-CG1 4.22Å; F135-I232 HydrophobicContact CD1-CG2 3.71Å; F135-I232 HydrophobicContact CE1-CD1 4.44Å; F135-I232 HydrophobicContact CE1-CG1 3.9Å; F135-I232 HydrophobicContact CE1-CG2 4.21Å; F135-I232 HydrophobicContact CG-CG2 4.43Å; F135-I232 HydrophobicContact CZ-CG1 4.48Å; C228-I232 WeakPolarHBondContact O-CD1 3.49Å; C228-I232 VanDerWaalsContact O-CG1 3.27Å; C228-I232 WeakPolarHBondContact O-CG1 3.46Å; C228-I232 PolarHBondContact O-N 2.94Å; L229-I232 PolarHBondContact O-N 3.35Å; T230-I232 VanDerWaalsContact C-N 3.33Å; T230-I232 PolarHBondContact O-N 2.86Å; I232-W235 WeakPolarHBondContact O-CB 3.11Å; I232-W235 PolarHBondContact O-N 3.42Å
233	T	55.9	Low	55.5	Low	29 Å²	29	49.2 Å²	49.2	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-80.4	-35.6	-176.2	56	0	0	0	0	112.7	S128 L229 T230 W235 P236	S128-T233 WeakPolarHBondContact CA-O 3.43Å; L229-T233 HydrophobicContact CD1-CG2 3.96Å; L229-T233 HydrophobicContact CG-CG2 4.22Å; L229-T233 WeakPolarHBondContact O-CB 3.27Å; L229-T233 WeakPolarHBondContact O-CG2 3.47Å; L229-T233 PolarHBondContact O-N 3.49Å; L229-T233 PolarHBondContact O-OG1 3.39Å; T230-T233 WeakPolarHBondContact CA-OG1 3.4Å; T230-T233 PolarHBondContact O-N 3.21Å; T230-T233 PolarHBondContact O-OG1 3.07Å; T233-W235 PolarHBondContact O-N 3.45Å; T233-P236 WeakPolarHBondContact O-CD 3.18Å
234	D	57.5	Low	54.5	Low	46 Å²	46	48.4 Å²	48.4	25%	0.246	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	15.5	171.7	-68.9	-43.1	0	0	0	111.5	R127 T230 P236 C237 L238	R127-D234 IonicContact CZ-OD1 3.61Å; R127-D234 VanDerWaalsContact CZ-OD1 3.23Å; R127-D234 IonicContact NE-OD1 3.3Å; R127-D234 IonicContact NH1-OD1 3.23Å; R127-D234 IonicContact NH2-OD1 3.89Å; R127-D234 PolarHBondContact NH2-OD1 3.1Å; T230-D234 WeakPolarHBondContact O-CA 3.27Å; T230-D234 WeakPolarHBondContact O-CB 3.18Å; T230-D234 PolarHBondContact O-N 2.93Å; D234-P236 VanDerWaalsContact C-N 3.28Å; D234-P236 WeakPolarHBondContact O-CD 3.27Å; D234-P236 VanDerWaalsContact O-N 3.16Å; D234-C237 CarbonylContact O-C 3.58Å; D234-C237 WeakPolarHBondContact O-CA 3.36Å; D234-C237 PolarHBondContact O-N 2.87Å; D234-L238 PolarHBondContact O-N 3.37Å
235	W	56	Low	53.9	Low	10 Å²	10	46.5 Å²	46.5	4%	0.038	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-48.2	-41.5	171.6	-162.4	-91.1	0	0	0	114	Y109 F135 W138 F169 I231 I232 T233 C237 L238	Y109-W235 AromaticContact CD2-CD1 3.86Å; Y109-W235 AromaticContact CD2-NE1 3.63Å; Y109-W235 AromaticContact CE2-CD1 3.6Å; Y109-W235 HydrophobicContact CE2-CG 4.44Å; Y109-W235 AromaticContact CE2-NE1 3.83Å; Y109-W235 WeakPolarHBondContact CE2-O 3.26Å; Y109-W235 PolarHBondContact OH-O 3.01Å; F135-W235 HydrophobicContact CB-CB 4.19Å; F135-W235 HydrophobicContact CB-CD2 4.06Å; F135-W235 HydrophobicContact CB-CE3 4.31Å; F135-W235 HydrophobicContact CB-CG 4.03Å; F135-W235 AromaticContact CD2-CD2 3.66Å; F135-W235 HydrophobicContact CD2-CD2 3.66Å; F135-W235 AromaticContact CD2-CE2 3.96Å; F135-W235 AromaticContact CD2-CE3 3.26Å; F135-W235 HydrophobicContact CD2-CE3 3.26Å; F135-W235 HydrophobicContact CD2-CG 4.49Å; F135-W235 AromaticContact CD2-CH2 3.32Å; F135-W235 HydrophobicContact CD2-CH2 3.32Å; F135-W235 AromaticContact CD2-CZ2 3.83Å; F135-W235 HydrophobicContact CD2-CZ2 3.83Å; F135-W235 AromaticContact CD2-CZ3 3.08Å; F135-W235 HydrophobicContact CD2-CZ3 3.08Å; F135-W235 AromaticContact CE2-CE3 3.78Å; F135-W235 HydrophobicContact CE2-CE3 3.78Å; F135-W235 AromaticContact CE2-CH2 3.46Å; F135-W235 HydrophobicContact CE2-CH2 3.46Å; F135-W235 VanDerWaalsContact CE2-CH2 3.46Å; F135-W235 HydrophobicContact CE2-CZ2 4.38Å; F135-W235 AromaticContact CE2-CZ3 3.17Å; F135-W235 HydrophobicContact CE2-CZ3 3.17Å; F135-W235 HydrophobicContact CG-CD2 4.26Å; F135-W235 HydrophobicContact CG-CE3 4.04Å; F135-W235 HydrophobicContact CG-CZ3 4.24Å; F135-W235 HydrophobicContact CZ-CZ3 4.38Å; W138-W235 HydrophobicContact CD2-CZ2 4.47Å; W138-W235 HydrophobicContact CE3-CH2 4.32Å; W138-W235 HydrophobicContact CE3-CZ2 4.38Å; W138-W235 HydrophobicContact CZ3-CH2 4.32Å; F169-W235 AromaticContact CD1-CH2 3.66Å; F169-W235 HydrophobicContact CD1-CH2 3.66Å; F169-W235 HydrophobicContact CD1-CZ3 4.18Å; F169-W235 AromaticContact CE1-CH2 2.95Å; F169-W235 HydrophobicContact CE1-CH2 2.95Å; F169-W235 AromaticContact CE1-CZ2 3.84Å; F169-W235 HydrophobicContact CE1-CZ2 3.84Å; F169-W235 AromaticContact CE1-CZ3 3.43Å; F169-W235 HydrophobicContact CE1-CZ3 3.43Å; F169-W235 VanDerWaalsContact CE1-CZ3 3.43Å; F169-W235 AromaticContact CZ-CH2 3.49Å; F169-W235 HydrophobicContact CZ-CH2 3.49Å; F169-W235 VanDerWaalsContact CZ-CH2 3.49Å; F169-W235 AromaticContact CZ-CZ2 3.9Å; F169-W235 HydrophobicContact CZ-CZ2 3.9Å; F169-W235 HydrophobicContact CZ-CZ3 4.22Å; I231-W235 PolarHBondContact O-N 2.85Å; I232-W235 WeakPolarHBondContact O-CB 3.11Å; I232-W235 PolarHBondContact O-N 3.42Å; T233-W235 PolarHBondContact O-N 3.45Å; W235-C237 VanDerWaalsContact C-N 3.27Å; W235-C237 PolarHBondContact O-N 3.17Å; W235-L238 HydrophobicContact CB-CD1 4.49Å; W235-L238 HydrophobicContact CD2-CD1 4.26Å; W235-L238 HydrophobicContact CE3-CD1 4.31Å; W235-L238 HydrophobicContact CG-CD1 4.34Å; W235-L238 WeakPolarHBondContact O-CD1 3.4Å
236	P	51.3	Low	53.2	Low	1 Å²	1	44 Å²	44	1%	0.006	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-87.7	4.4	178.5	34.6	-22.3	0	0	0	112.3	Y109 L113 I116 R127 T233 D234	Y109-P236 VanDerWaalsContact OH-C 3.23Å; Y109-P236 WeakPolarHBondContact OH-CA 3.45Å; L113-P236 HydrophobicContact CD2-CB 4.48Å; L113-P236 WeakPolarHBondContact CD2-O 2.97Å; I116-P236 HydrophobicContact CD1-CB 4.34Å; R127-P236 HydrophobicContact CG-CG 3.96Å; R127-P236 WeakPolarHBondContact O-CG 3.33Å; T233-P236 WeakPolarHBondContact O-CD 3.18Å; D234-P236 VanDerWaalsContact C-N 3.28Å; D234-P236 WeakPolarHBondContact O-CD 3.27Å; D234-P236 VanDerWaalsContact O-N 3.16Å
237	C	49.3	Very low	52.3	Low	25 Å²	25	36.2 Å²	36.2	17%	0.169	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-140.4	44.3	172.1	-92.8	0	0	0	0	109.7	Y109 M121 R127 D234 W235 P239	Y109-C237 PolarHBondContact OH-N 2.68Å; M121-C237 WeakPolarHBondContact CE-SG 3.17Å; R127-C237 WeakPolarHBondContact CD-SG 3.38Å; R127-C237 HydrophobicContact CG-CB 4.29Å; D234-C237 CarbonylContact O-C 3.58Å; D234-C237 WeakPolarHBondContact O-CA 3.36Å; D234-C237 PolarHBondContact O-N 2.87Å; W235-C237 VanDerWaalsContact C-N 3.27Å; W235-C237 PolarHBondContact O-N 3.17Å; C237-P239 WeakPolarHBondContact O-CD 3.41Å
238	L	50.4	Low	51.5	Low	19 Å²	19	33 Å²	33	10%	0.099	19%	0.189	C	C	.	.			trans	-51.4	124.1	157.2	-95.9	79.6	0	0	0	104.1	Y109 D234 W235 S240 N242 F244 F245	Y109-L238 PolarHBondContact OH-N 3.39Å; D234-L238 PolarHBondContact O-N 3.37Å; W235-L238 HydrophobicContact CB-CD1 4.49Å; W235-L238 HydrophobicContact CD2-CD1 4.26Å; W235-L238 HydrophobicContact CE3-CD1 4.31Å; W235-L238 HydrophobicContact CG-CD1 4.34Å; W235-L238 WeakPolarHBondContact O-CD1 3.4Å; L238-S240 PolarHBondContact O-N 3.38Å; L238-N242 HydrophobicContact CB-CB 4.29Å; L238-N242 VanDerWaalsContact CB-ND2 3.28Å; L238-N242 WeakPolarHBondContact CB-ND2 3.48Å; L238-N242 HydrophobicContact CD2-CB 4.07Å; L238-N242 WeakPolarHBondContact CD2-ND2 3.43Å; L238-N242 WeakPolarHBondContact CG-ND2 3.46Å; L238-F244 HydrophobicContact CD2-CD2 4.12Å; L238-F245 HydrophobicContact CB-CD2 4.22Å; L238-F245 HydrophobicContact CB-CE2 3.51Å; L238-F245 HydrophobicContact CB-CZ 4.49Å; L238-F245 HydrophobicContact CD2-CE2 3.8Å; L238-F245 HydrophobicContact CD2-CZ 4.36Å; L238-F245 HydrophobicContact CG-CE2 4.25Å
239	P	49.6	Very low	51	Low	63 Å²	63	32 Å²	32	41%	0.409	18%	0.178	S	C	.	.			trans	-50.2	143	-177.7	17.3	-30.3	0	0	0	108.3	C237 E241 N242	C237-P239 WeakPolarHBondContact O-CD 3.41Å; P239-E241 HydrophobicContact CB-CB 4.15Å; P239-E241 HydrophobicContact CB-CG 4.32Å; P239-E241 PolarHBondContact O-N 2.84Å; P239-N242 PolarHBondContact O-N 2.74Å
240	S	44.5	Very low	49.6	Very low	42 Å²	42	32.9 Å²	32.9	29%	0.294	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-12.5	176.5	64.4	0	0	0	0	113.2	L238 T247	L238-S240 PolarHBondContact O-N 3.38Å; S240-T247 PolarHBondContact O-OG1 3.49Å; S240-T247 VanDerWaalsContact O-OG1 3.1Å
241	E	44.4	Very low	48.7	Very low	33 Å²	33	32.8 Å²	32.8	15%	0.154	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.7	170.1	-57.1	178.2	164.4	0	0	113.7	R180 P239 Y271	R180-E241 VanDerWaalsContact NH1-CB 3.31Å; R180-E241 PolarHBondContact NH1-O 2.89Å; R180-E241 PolarHBondContact NH2-O 3.01Å; P239-E241 HydrophobicContact CB-CB 4.15Å; P239-E241 HydrophobicContact CB-CG 4.32Å; P239-E241 PolarHBondContact O-N 2.84Å; E241-Y271 WeakPolarHBondContact CG-O 3.49Å; E241-Y271 PolarHBondContact OE1-N 2.91Å; E241-Y271 VanDerWaalsContact OE1-O 3.05Å
242	N	43.8	Very low	47.2	Very low	27 Å²	27	33.8 Å²	33.8	14%	0.144	19%	0.188	C	C	.	.	S	Bend	trans	-61.1	144.7	-167.3	-86	-5.9	0	0	0	113.7	R180 L238 P239 F244 F245	R180-N242 PolarHBondContact NH1-OD1 3.24Å; L238-N242 HydrophobicContact CB-CB 4.29Å; L238-N242 VanDerWaalsContact CB-ND2 3.28Å; L238-N242 WeakPolarHBondContact CB-ND2 3.48Å; L238-N242 HydrophobicContact CD2-CB 4.07Å; L238-N242 WeakPolarHBondContact CD2-ND2 3.43Å; L238-N242 WeakPolarHBondContact CG-ND2 3.46Å; P239-N242 PolarHBondContact O-N 2.74Å; N242-F244 PolarHBondContact O-N 2.9Å; N242-F245 HydrophobicContact CB-CD2 3.97Å; N242-F245 HydrophobicContact CB-CE2 4.21Å; N242-F245 CarbonylContact O-C 3.58Å; N242-F245 WeakPolarHBondContact O-CA 3.33Å; N242-F245 PolarHBondContact O-N 3.22Å; N242-F245 VanDerWaalsContact O-O 3.14Å
243	M	46.5	Very low	45.7	Very low	19 Å²	19	35.8 Å²	35.8	9%	0.094	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.2	-178.5	-174.8	176.9	74.9	0	0	113.6	L172 V176 F245 D311 I314	L172-M243 HydrophobicContact CD1-CE 3.67Å; L172-M243 HydrophobicContact CD2-CE 3.69Å; L172-M243 HydrophobicContact CG-CE 3.66Å; V176-M243 HydrophobicContact CG1-CB 4.32Å; V176-M243 HydrophobicContact CG2-CB 4.36Å; V176-M243 HydrophobicContact CG2-CE 3.54Å; V176-M243 HydrophobicContact CG2-SD 3.94Å; M243-F245 VanDerWaalsContact C-N 3.29Å; M243-D311 HydrophobicContact CG-CB 4.49Å; M243-D311 WeakPolarHBondContact CG-OD1 3.47Å; M243-I314 HydrophobicContact CE-CB 4.17Å; M243-I314 HydrophobicContact CE-CD1 4.4Å; M243-I314 HydrophobicContact CE-CG2 3.3Å; M243-I314 HydrophobicContact SD-CB 3.56Å; M243-I314 VanDerWaalsContact SD-CB 3.56Å; M243-I314 HydrophobicContact SD-CD1 3.52Å; M243-I314 VanDerWaalsContact SD-CD1 3.52Å; M243-I314 HydrophobicContact SD-CG1 4.14Å; M243-I314 HydrophobicContact SD-CG2 3.41Å; M243-I314 WeakPolarHBondContact SD-CG2 3.47Å
244	F	43.2	Very low	44.7	Very low	22 Å²	22	39.3 Å²	39.3	10%	0.096	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.9	172.5	-65.4	-69.4	0	0	0	113.8	P106 F169 L172 T173 L238 N242 P246	P106-F244 HydrophobicContact CB-CB 4.47Å; P106-F244 HydrophobicContact CB-CD1 4.42Å; F169-F244 HydrophobicContact CD2-CE1 4.02Å; F169-F244 AromaticContact CD2-CZ 3.72Å; F169-F244 HydrophobicContact CD2-CZ 3.72Å; F169-F244 HydrophobicContact CE1-CE2 4.21Å; F169-F244 HydrophobicContact CE1-CZ 4.16Å; F169-F244 HydrophobicContact CE2-CD1 4.18Å; F169-F244 AromaticContact CE2-CE1 3.39Å; F169-F244 HydrophobicContact CE2-CE1 3.39Å; F169-F244 AromaticContact CE2-CE2 3.88Å; F169-F244 HydrophobicContact CE2-CE2 3.88Å; F169-F244 AromaticContact CE2-CZ 3.18Å; F169-F244 HydrophobicContact CE2-CZ 3.18Å; F169-F244 HydrophobicContact CG-CZ 4.45Å; F169-F244 HydrophobicContact CZ-CD2 4.26Å; F169-F244 AromaticContact CZ-CE1 3.99Å; F169-F244 HydrophobicContact CZ-CE1 3.99Å; F169-F244 AromaticContact CZ-CE2 3.62Å; F169-F244 HydrophobicContact CZ-CE2 3.62Å; F169-F244 AromaticContact CZ-CZ 3.44Å; F169-F244 HydrophobicContact CZ-CZ 3.44Å; F169-F244 VanDerWaalsContact CZ-CZ 3.44Å; L172-F244 HydrophobicContact CD2-CE1 4Å; L172-F244 HydrophobicContact CD2-CZ 3.68Å; L172-F244 HydrophobicContact CG-CZ 4.36Å; T173-F244 HydrophobicContact CG2-CE2 3.84Å; T173-F244 HydrophobicContact CG2-CZ 4.47Å; L238-F244 HydrophobicContact CD2-CD2 4.12Å; N242-F244 PolarHBondContact O-N 2.9Å; F244-P246 WeakPolarHBondContact O-CD 3.36Å
245	F	48.5	Very low	43.4	Very low	11 Å²	11	48.2 Å²	48.2	5%	0.048	26%	0.261	C	S	.	.	S	Bend	trans	-111.8	87.9	178.2	-51.4	-50.1	0	0	0	109.8	Y109 L110 L238 N242 M243 T247	Y109-F245 HydrophobicContact CD1-CD1 4.2Å; Y109-F245 AromaticContact CD1-CE1 3.07Å; Y109-F245 HydrophobicContact CD1-CE1 3.07Å; Y109-F245 AromaticContact CD1-CE2 3.99Å; Y109-F245 HydrophobicContact CD1-CE2 3.99Å; Y109-F245 AromaticContact CD1-CZ 2.96Å; Y109-F245 HydrophobicContact CD1-CZ 2.96Å; Y109-F245 HydrophobicContact CE1-CD1 4.29Å; Y109-F245 HydrophobicContact CE1-CD2 4.37Å; Y109-F245 AromaticContact CE1-CE1 3.37Å; Y109-F245 HydrophobicContact CE1-CE1 3.37Å; Y109-F245 AromaticContact CE1-CE2 3.43Å; Y109-F245 HydrophobicContact CE1-CE2 3.43Å; Y109-F245 VanDerWaalsContact CE1-CE2 3.43Å; Y109-F245 AromaticContact CE1-CZ 2.87Å; Y109-F245 HydrophobicContact CE1-CZ 2.87Å; Y109-F245 HydrophobicContact CG-CE1 4.17Å; Y109-F245 AromaticContact CG-CZ 3.95Å; Y109-F245 HydrophobicContact CG-CZ 3.95Å; Y109-F245 AromaticContact CZ-CZ 3.91Å; L110-F245 HydrophobicContact CD1-CD1 4.04Å; L110-F245 HydrophobicContact CD2-CD1 3.29Å; L110-F245 HydrophobicContact CD2-CE1 3.94Å; L110-F245 HydrophobicContact CD2-CG 4.15Å; L110-F245 HydrophobicContact CG-CD1 3.5Å; L110-F245 HydrophobicContact CG-CE1 3.79Å; L238-F245 HydrophobicContact CB-CD2 4.22Å; L238-F245 HydrophobicContact CB-CE2 3.51Å; L238-F245 HydrophobicContact CB-CZ 4.49Å; L238-F245 HydrophobicContact CD2-CE2 3.8Å; L238-F245 HydrophobicContact CD2-CZ 4.36Å; L238-F245 HydrophobicContact CG-CE2 4.25Å; N242-F245 HydrophobicContact CB-CD2 3.97Å; N242-F245 HydrophobicContact CB-CE2 4.21Å; N242-F245 CarbonylContact O-C 3.58Å; N242-F245 WeakPolarHBondContact O-CA 3.33Å; N242-F245 PolarHBondContact O-N 3.22Å; N242-F245 VanDerWaalsContact O-O 3.14Å; M243-F245 VanDerWaalsContact C-N 3.29Å; F245-T247 PolarHBondContact O-N 3.38Å
246	P	47.6	Very low	42	Very low	8 Å²	8	55.4 Å²	55.4	5%	0.052	30%	0.295	C	S	.	.			trans	-69.4	80.8	171.3	33.3	-37.2	0	0	0	107.9	F51 L52 F244 Y361 F362	F51-P246 HydrophobicContact CD1-CG 4.23Å; F51-P246 HydrophobicContact CE1-CB 4.04Å; F51-P246 HydrophobicContact CE1-CG 3.71Å; L52-P246 HydrophobicContact CD2-CG 3.96Å; F244-P246 WeakPolarHBondContact O-CD 3.36Å; P246-Y361 HydrophobicContact CB-CD1 4.35Å; P246-Y361 HydrophobicContact CB-CE1 3.77Å; P246-Y361 HydrophobicContact CG-CE1 4.47Å; P246-Y361 WeakPolarHBondContact O-CE1 3.07Å; P246-Y361 PolarHBondContact O-OH 3.46Å; P246-F362 HydrophobicContact CB-CE1 3.58Å; P246-F362 HydrophobicContact CB-CE2 3.98Å; P246-F362 HydrophobicContact CB-CZ 3.23Å; P246-F362 HydrophobicContact CG-CZ 4.49Å
247	T	44.7	Very low	41	Very low	16 Å²	16	61.3 Å²	61.3	10%	0.098	33%	0.326	C	S	.	.			trans	-71.4	124.2	164.3	46.9	0	0	0	0	106.2	S240 F245 Y249	S240-T247 PolarHBondContact O-OG1 3.49Å; S240-T247 VanDerWaalsContact O-OG1 3.1Å; F245-T247 PolarHBondContact O-N 3.38Å; T247-Y249 PolarHBondContact O-N 2.93Å
248	P	43.4	Very low	39.9	Very low	44 Å²	44	69.3 Å²	69.3	29%	0.286	36%	0.36	S	S	.	.			trans	-68.1	111.8	170.4	25.1	-15.5	0	0	0	104.5	R48 T250 Y361	R48-P248 HydrophobicContact CB-CG 4.5Å; P248-T250 PolarHBondContact O-N 2.94Å; P248-Y361 HydrophobicContact CB-CE1 4.21Å; P248-Y361 HydrophobicContact CB-CE2 4.18Å; P248-Y361 WeakPolarHBondContact CD-OH 3.28Å; P248-Y361 HydrophobicContact CG-CE2 4.2Å; P248-Y361 VanDerWaalsContact CG-OH 3.32Å; P248-Y361 WeakPolarHBondContact CG-OH 3.26Å
249	Y	49.8	Very low	38.9	Very low	37 Å²	37	73.1 Å²	73.1	15%	0.145	39%	0.388	C	S	.	.			trans	-52.9	108.9	174.2	-61.1	-80.9	0	0	0	107.7	T247 F251 Y271 R308	T247-Y249 PolarHBondContact O-N 2.93Å; Y249-F251 WeakPolarHBondContact O-CD2 3.38Å; Y249-Y271 AromaticContact CD1-CD1 3.41Å; Y249-Y271 HydrophobicContact CD1-CD1 3.41Å; Y249-Y271 VanDerWaalsContact CD1-CD1 3.41Å; Y249-Y271 HydrophobicContact CD1-CD2 4.11Å; Y249-Y271 AromaticContact CD1-CE1 3.82Å; Y249-Y271 HydrophobicContact CD1-CE1 3.82Å; Y249-Y271 HydrophobicContact CD1-CE2 4.43Å; Y249-Y271 AromaticContact CD1-CG 3.57Å; Y249-Y271 HydrophobicContact CD1-CG 3.57Å; Y249-Y271 AromaticContact CE1-CD1 3.69Å; Y249-Y271 HydrophobicContact CE1-CD1 3.69Å; Y249-Y271 AromaticContact CE1-CD2 3.46Å; Y249-Y271 HydrophobicContact CE1-CD2 3.46Å; Y249-Y271 VanDerWaalsContact CE1-CD2 3.46Å; Y249-Y271 HydrophobicContact CE1-CE1 4.12Å; Y249-Y271 AromaticContact CE1-CE2 3.9Å; Y249-Y271 HydrophobicContact CE1-CE2 3.9Å; Y249-Y271 AromaticContact CE1-CG 3.32Å; Y249-Y271 HydrophobicContact CE1-CG 3.32Å; Y249-R308 HydrophobicContact CD2-CG 4.28Å; Y249-R308 HydrophobicContact CE2-CG 3.9Å
250	T	34.3	Very low	38	Very low	107 Å²	107	74.4 Å²	74.4	66%	0.656	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-79.3	124	-174.8	45.7	0	0	0	0	108.3	P248	P248-T250 PolarHBondContact O-N 2.94Å
251	F	41.1	Very low	37.1	Very low	40 Å²	40	78.7 Å²	78.7	18%	0.175	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-100.3	133.1	169.8	-64.5	-87.2	0	0	0	108.2	Y249 M282 Y301 Y367 L370	Y249-F251 WeakPolarHBondContact O-CD2 3.38Å; F251-M282 HydrophobicContact CD1-CB 4.14Å; F251-M282 HydrophobicContact CE1-CB 3.69Å; F251-Y301 HydrophobicContact CE1-CE1 4.48Å; F251-Y367 HydrophobicContact CE1-CD2 4.23Å; F251-Y367 HydrophobicContact CE1-CE2 4.46Å; F251-Y367 AromaticContact CE2-CD2 3.55Å; F251-Y367 HydrophobicContact CE2-CD2 3.55Å; F251-Y367 HydrophobicContact CE2-CE2 4.24Å; F251-Y367 HydrophobicContact CE2-CG 4.32Å; F251-Y367 AromaticContact CZ-CD2 3.28Å; F251-Y367 HydrophobicContact CZ-CD2 3.28Å; F251-Y367 AromaticContact CZ-CE2 3.59Å; F251-Y367 HydrophobicContact CZ-CE2 3.59Å; F251-Y367 HydrophobicContact CZ-CG 4.41Å; F251-L370 HydrophobicContact CD1-CD2 4.01Å; F251-L370 HydrophobicContact CE1-CD2 3.68Å; F251-L370 HydrophobicContact CZ-CD2 4.31Å
252	I	28.5	Very low	36.4	Very low	60 Å²	60	84.4 Å²	84.4	31%	0.308	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-88.9	121.9	165.6	-56.4	170.3	0	0	0	106.5	S254 L281	I252-S254 PolarHBondContact O-N 3Å; I252-L281 HydrophobicContact CB-CD1 3.6Å; I252-L281 HydrophobicContact CB-CD2 4.19Å; I252-L281 HydrophobicContact CD1-CD1 4.3Å; I252-L281 HydrophobicContact CG1-CD1 4.02Å
253	P	29.2	Very low	35.4	Very low	92 Å²	92	92.3 Å²	92.3	60%	0.597	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-55.8	140.8	171.1	-21.3	31.5	0	0	0	110.3	R255	P253-R255 PolarHBondContact O-N 2.89Å
254	S	34.5	Very low	34.6	Very low	104 Å²	104	96.2 Å²	96.2	73%	0.727	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	13.1	-173.7	41.4	0	0	0	0	116.9	I252	I252-S254 PolarHBondContact O-N 3Å
255	R	29.9	Very low	33.8	Very low	232 Å²	232	100.1 Å²	100.1	88%	0.875	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.7	-177.2	-109.7	-176.3	-178.6	171.1	0.7	116.2	P253	P253-R255 PolarHBondContact O-N 2.89Å
256	Q	28	Very low	32.7	Very low	161 Å²	161	106.9 Å²	106.9	75%	0.752	58%	0.577	S	S	*	*	S	Bend	trans	-114.9	8.4	-169.3	-78.3	-169.1	-25.7	0	0	117.7
257	L	28.8	Very low	31.6	Very low	126 Å²	126	112.5 Å²	112.5	66%	0.66	60%	0.603	S	S	*	*			trans	-120	66.9	173.8	-146.4	81.6	0	0	0	112.9
258	H	27.2	Very low	30.7	Very low	193 Å²	193	114.8 Å²	114.8	89%	0.894	62%	0.617	S	S	*	*			trans	-99.1	61.9	154.1	-82.1	-58.1	0	0	0	109.2
259	S	29.6	Very low	29.8	Very low	99 Å²	99	116.1 Å²	116.1	69%	0.692	62%	0.621	S	S	*	*	S	Bend	trans	-179.8	80.2	163.4	55.9	0	0	0	0	112
260	S	30.3	Very low	28.8	Very low	90 Å²	90	117.2 Å²	117.2	63%	0.629	63%	0.625	S	S	*	*			trans	177.6	96.2	145.8	54.7	0	0	0	0	109.2	D262	S260-D262 PolarHBondContact O-N 3.33Å
261	T	26.1	Very low	28.8	Very low	132 Å²	132	115.4 Å²	115.4	81%	0.81	61%	0.607	S	S	*	*			trans	-65.3	111.1	155.1	35	0	0	0	0	108.1
262	D	28.4	Very low	28	Very low	152 Å²	152	116.9 Å²	116.9	81%	0.813	62%	0.619	S	S	*	*			trans	-166.1	137.2	149.4	-87.4	-29	0	0	0	109.1	S260 P264	S260-D262 PolarHBondContact O-N 3.33Å; D262-P264 WeakPolarHBondContact O-CD 3.28Å
263	H	24.1	Very low	28.1	Very low	193 Å²	193	117.5 Å²	117.5	89%	0.894	63%	0.628	S	S	*	*			trans	-50.1	119.5	-171.7	-74.3	-90.9	0	0	0	114.4
264	P	29.6	Very low	28.1	Very low	102 Å²	102	117.8 Å²	117.8	66%	0.662	63%	0.625	S	S	*	*			trans	-93.5	106.4	166.7	32.6	-24.5	0	0	0	109.5	D262 F266	D262-P264 WeakPolarHBondContact O-CD 3.28Å; P264-F266 PolarHBondContact O-N 3.25Å
265	S	25.4	Very low	28.1	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	63%	0.634	S	S	*	*			trans	-62.9	121	152.2	44.1	0	0	0	0	107.5	Q267	S265-Q267 PolarHBondContact O-N 3.48Å
266	F	27.1	Very low	28.1	Very low	153 Å²	153	115.7 Å²	115.7	67%	0.671	63%	0.626	S	S	*	*			trans	-66.7	89.3	-175.4	-87.3	-94.1	0	0	0	111	P264 T268	P264-F266 PolarHBondContact O-N 3.25Å; F266-T268 PolarHBondContact O-N 3.07Å
267	Q	22.7	Very low	28.1	Very low	126 Å²	126	112.7 Å²	112.7	59%	0.589	62%	0.623	S	S	*	*			trans	-77.2	111.8	159.7	-72.1	-179.4	-13.4	0	0	108	S265 I269	S265-Q267 PolarHBondContact O-N 3.48Å; Q267-I269 HydrophobicContact CB-CD1 3.76Å; Q267-I269 HydrophobicContact CB-CG1 4.03Å; Q267-I269 PolarHBondContact O-N 3.44Å
268	T	26.6	Very low	28	Very low	65 Å²	65	112.4 Å²	112.4	40%	0.399	62%	0.622	S	S	.	*			trans	-67	98.7	170.6	-33.2	0	0	0	0	108.5	F266 L300	F266-T268 PolarHBondContact O-N 3.07Å; T268-L300 HydrophobicContact CG2-CD2 3.91Å
269	I	24.1	Very low	28.2	Very low	71 Å²	71	107.7 Å²	107.7	36%	0.364	60%	0.604	S	S	.	*			trans	-106.4	128.3	-178.5	-71.5	162.7	0	0	0	109	Q267 Y280	Q267-I269 HydrophobicContact CB-CD1 3.76Å; Q267-I269 HydrophobicContact CB-CG1 4.03Å; Q267-I269 PolarHBondContact O-N 3.44Å; I269-Y280 HydrophobicContact CB-CD1 4.47Å; I269-Y280 HydrophobicContact CB-CD2 3.8Å; I269-Y280 HydrophobicContact CB-CE2 4.15Å; I269-Y280 HydrophobicContact CB-CG 3.98Å; I269-Y280 HydrophobicContact CD1-CD1 4.19Å; I269-Y280 HydrophobicContact CD1-CD2 3.78Å; I269-Y280 HydrophobicContact CD1-CE1 3.65Å; I269-Y280 HydrophobicContact CD1-CE2 3.2Å; I269-Y280 HydrophobicContact CD1-CG 4.25Å; I269-Y280 VanDerWaalsContact CD1-OH 3.29Å; I269-Y280 WeakPolarHBondContact CD1-OH 3.38Å; I269-Y280 HydrophobicContact CG1-CD2 4.39Å; I269-Y280 HydrophobicContact CG1-CE2 4.23Å; I269-Y280 HydrophobicContact CG2-CD2 3.55Å; I269-Y280 HydrophobicContact CG2-CE2 3.98Å; I269-Y280 HydrophobicContact CG2-CG 4.16Å
270	Y	29.3	Very low	28.5	Very low	60 Å²	60	109 Å²	109	24%	0.235	59%	0.594	C	S	.	*			trans	-83.8	156.5	174.1	-67.3	-90.5	0	0	0	110.5	C187 T272	C187-Y270 PolarHBondContact SG-OH 2.87Å; C187-Y270 VanDerWaalsContact SG-OH 3.32Å; Y270-T272 PolarHBondContact O-N 3.15Å
271	Y	33.7	Very low	29	Very low	70 Å²	70	107.5 Å²	107.5	28%	0.275	58%	0.579	S	S	.	*			trans	-59.1	113.6	-161.8	-49.9	-81.1	0	0	0	115.6	E241 Y249 D304	E241-Y271 WeakPolarHBondContact CG-O 3.49Å; E241-Y271 PolarHBondContact OE1-N 2.91Å; E241-Y271 VanDerWaalsContact OE1-O 3.05Å; Y249-Y271 AromaticContact CD1-CD1 3.41Å; Y249-Y271 HydrophobicContact CD1-CD1 3.41Å; Y249-Y271 VanDerWaalsContact CD1-CD1 3.41Å; Y249-Y271 HydrophobicContact CD1-CD2 4.11Å; Y249-Y271 AromaticContact CD1-CE1 3.82Å; Y249-Y271 HydrophobicContact CD1-CE1 3.82Å; Y249-Y271 HydrophobicContact CD1-CE2 4.43Å; Y249-Y271 AromaticContact CD1-CG 3.57Å; Y249-Y271 HydrophobicContact CD1-CG 3.57Å; Y249-Y271 AromaticContact CE1-CD1 3.69Å; Y249-Y271 HydrophobicContact CE1-CD1 3.69Å; Y249-Y271 AromaticContact CE1-CD2 3.46Å; Y249-Y271 HydrophobicContact CE1-CD2 3.46Å; Y249-Y271 VanDerWaalsContact CE1-CD2 3.46Å; Y249-Y271 HydrophobicContact CE1-CE1 4.12Å; Y249-Y271 AromaticContact CE1-CE2 3.9Å; Y249-Y271 HydrophobicContact CE1-CE2 3.9Å; Y249-Y271 AromaticContact CE1-CG 3.32Å; Y249-Y271 HydrophobicContact CE1-CG 3.32Å; Y271-D304 WeakPolarHBondContact OH-CB 3.22Å; Y271-D304 PolarHBondContact OH-OD1 3.4Å
272	T	25.6	Very low	29.9	Very low	71 Å²	71	103.5 Å²	103.5	44%	0.436	55%	0.552	S	S	.	*			trans	-121.4	131.3	156.6	72.6	0	0	0	0	110.3	Y270 D274	Y270-T272 PolarHBondContact O-N 3.15Å; T272-D274 PolarHBondContact O-N 3.07Å
273	S	30.1	Very low	31.1	Very low	72 Å²	72	99 Å²	99	50%	0.503	53%	0.527	S	S	.	.			trans	-88.9	55.6	159.7	172	0	0	0	0	107.9	L275	S273-L275 PolarHBondContact O-N 3.26Å
274	D	28.3	Very low	32.8	Very low	99 Å²	99	90.8 Å²	90.8	53%	0.529	49%	0.49	S	S	.	.			trans	-79	114.5	160.5	-71.5	-34.7	0	0	0	106.3	T272 V276	T272-D274 PolarHBondContact O-N 3.07Å; D274-V276 PolarHBondContact O-N 2.95Å
275	L	35	Very low	34.2	Very low	174 Å²	174	91 Å²	91	91%	0.911	48%	0.481	S	S	*	.	S	Bend	trans	-58.3	1.1	175.6	-94.3	146.1	0	0	0	113.4	S273	S273-L275 PolarHBondContact O-N 3.26Å
276	V	31.2	Very low	36	Very low	118 Å²	118	88.3 Å²	88.3	72%	0.715	46%	0.462	S	S	*	.	S	Bend	trans	-134.9	117.3	-178.5	-171.9	0	0	0	0	107.5	D274	D274-V276 PolarHBondContact O-N 2.95Å
277	S	27.6	Very low	37.3	Very low	97 Å²	97	87.8 Å²	87.8	68%	0.678	47%	0.466	S	S	*	.	S	Bend	trans	83.1	101.2	178.2	74	0	0	0	0	117.1
278	N	26.9	Very low	39.1	Very low	121 Å²	121	85.8 Å²	85.8	65%	0.647	48%	0.479	S	S	*	.			trans	55.1	80	156.8	-62.5	-8.8	0	0	0	116.5	Y280	N278-Y280 HydrophobicContact CB-CE2 3.96Å; N278-Y280 WeakPolarHBondContact O-CD2 3.4Å; N278-Y280 PolarHBondContact O-N 3.18Å
279	N	30.7	Very low	41	Very low	94 Å²	94	83.5 Å²	83.5	50%	0.503	47%	0.467	S	S	.	.			trans	-49	100	153.2	-67.5	-31.2	0	0	0	108.8	L281	N279-L281 VanDerWaalsContact C-N 3.25Å; N279-L281 PolarHBondContact O-N 3.38Å
280	Y	36.1	Very low	43.7	Very low	125 Å²	125	83 Å²	83	49%	0.49	47%	0.467	S	S	.	.			trans	-69.6	95.5	166.6	-74	-86.2	0	0	0	107.2	I269 N278 M282	I269-Y280 HydrophobicContact CB-CD1 4.47Å; I269-Y280 HydrophobicContact CB-CD2 3.8Å; I269-Y280 HydrophobicContact CB-CE2 4.15Å; I269-Y280 HydrophobicContact CB-CG 3.98Å; I269-Y280 HydrophobicContact CD1-CD1 4.19Å; I269-Y280 HydrophobicContact CD1-CD2 3.78Å; I269-Y280 HydrophobicContact CD1-CE1 3.65Å; I269-Y280 HydrophobicContact CD1-CE2 3.2Å; I269-Y280 HydrophobicContact CD1-CG 4.25Å; I269-Y280 VanDerWaalsContact CD1-OH 3.29Å; I269-Y280 WeakPolarHBondContact CD1-OH 3.38Å; I269-Y280 HydrophobicContact CG1-CD2 4.39Å; I269-Y280 HydrophobicContact CG1-CE2 4.23Å; I269-Y280 HydrophobicContact CG2-CD2 3.55Å; I269-Y280 HydrophobicContact CG2-CE2 3.98Å; I269-Y280 HydrophobicContact CG2-CG 4.16Å; N278-Y280 HydrophobicContact CB-CE2 3.96Å; N278-Y280 WeakPolarHBondContact O-CD2 3.4Å; N278-Y280 PolarHBondContact O-N 3.18Å; Y280-M282 PolarHBondContact O-N 2.92Å
281	L	41.1	Very low	46.2	Very low	60 Å²	60	80.5 Å²	80.5	31%	0.314	46%	0.458	S	S	.	.			trans	-79.8	111.2	-169.3	-178.5	59.9	0	0	0	109	I252 N279 N283	I252-L281 HydrophobicContact CB-CD1 3.6Å; I252-L281 HydrophobicContact CB-CD2 4.19Å; I252-L281 HydrophobicContact CD1-CD1 4.3Å; I252-L281 HydrophobicContact CG1-CD1 4.02Å; N279-L281 VanDerWaalsContact C-N 3.25Å; N279-L281 PolarHBondContact O-N 3.38Å; L281-N283 VanDerWaalsContact C-N 3.28Å; L281-N283 WeakPolarHBondContact CD2-ND2 2.97Å; L281-N283 HydrophobicContact CG-CB 4.33Å; L281-N283 VanDerWaalsContact CG-CG 3.47Å; L281-N283 WeakPolarHBondContact CG-OD1 3.32Å; L281-N283 PolarHBondContact O-N 3.28Å
282	M	44.1	Very low	48.6	Very low	48 Å²	48	80.3 Å²	80.3	24%	0.236	46%	0.46	C	S	.	.			trans	-64.3	92.8	164.3	-86.5	-64	-174.6	0	0	108.3	F251 Y280 L300 Y301	F251-M282 HydrophobicContact CD1-CB 4.14Å; F251-M282 HydrophobicContact CE1-CB 3.69Å; Y280-M282 PolarHBondContact O-N 2.92Å; M282-L300 HydrophobicContact CE-CB 4.01Å; M282-Y301 VanDerWaalsContact C-OH 3.29Å; M282-Y301 HydrophobicContact CB-CE1 4.04Å; M282-Y301 WeakPolarHBondContact CB-OH 3.4Å; M282-Y301 HydrophobicContact CG-CE1 4.16Å; M282-Y301 PolarHBondContact O-OH 2.96Å; M282-Y301 HydrophobicContact SD-CD2 4.36Å; M282-Y301 HydrophobicContact SD-CE1 3.98Å; M282-Y301 HydrophobicContact SD-CE2 3.72Å; M282-Y301 VanDerWaalsContact SD-CZ 3.53Å
283	N	53.4	Low	51.4	Low	57 Å²	57	80.3 Å²	80.3	31%	0.305	46%	0.455	S	S	.	.			trans	-115.4	127.8	174.8	-92.4	-8.8	0	0	0	108.7	L281 Q285	L281-N283 VanDerWaalsContact C-N 3.28Å; L281-N283 WeakPolarHBondContact CD2-ND2 2.97Å; L281-N283 HydrophobicContact CG-CB 4.33Å; L281-N283 VanDerWaalsContact CG-CG 3.47Å; L281-N283 WeakPolarHBondContact CG-OD1 3.32Å; L281-N283 PolarHBondContact O-N 3.28Å; N283-Q285 PolarHBondContact O-N 3.24Å
284	H	61	Low	54	Low	21 Å²	21	77.2 Å²	77.2	10%	0.097	43%	0.432	C	S	.	.			trans	-72.8	119.7	169.5	176.9	55.5	0	0	0	110.9	C286 E297 L370 I374 H377	H284-C286 PolarHBondContact CD2-SG 3.38Å; H284-C286 PolarHBondContact O-N 3.02Å; H284-E297 WeakPolarHBondContact CA-OE1 3.45Å; H284-E297 WeakPolarHBondContact CB-OE1 3.32Å; H284-E297 IonicContact CE1-OE2 3.31Å; H284-E297 IonicContact CG-OE1 2.8Å; H284-E297 IonicContact ND1-OE1 3.86Å; H284-E297 PolarHBondContact ND1-OE1 3.27Å; H284-E297 IonicContact ND1-OE2 3.44Å; H284-E297 PolarHBondContact ND1-OE2 3.38Å; H284-L370 HydrophobicContact CB-CD1 3.51Å; H284-I374 HydrophobicContact CB-CG1 4.14Å; H284-I374 WeakPolarHBondContact ND1-CG1 3.41Å; H284-H377 AromaticContact CE1-CD2 3.29Å; H284-H377 PolarHBondContact CE1-CD2 3.4Å; H284-H377 AromaticContact CE1-NE2 3.59Å; H284-H377 AromaticContact NE2-CD2 2.96Å; H284-H377 PolarHBondContact NE2-CD2 3.23Å; H284-H377 AromaticContact NE2-NE2 2.9Å; H284-H377 PolarHBondContact NE2-NE2 3.39Å
285	Q	58.5	Low	56.8	Low	105 Å²	105	73.9 Å²	73.9	49%	0.491	41%	0.413	S	S	.	.			trans	-88.4	90.3	179	-66.2	-176.7	-5.7	0	0	109.7	N283 L287	N283-Q285 PolarHBondContact O-N 3.24Å; Q285-L287 VanDerWaalsContact C-N 3.26Å; Q285-L287 PolarHBondContact O-N 3.1Å
286	C	62.5	Low	59.1	Low	47 Å²	47	71.4 Å²	71.4	32%	0.318	40%	0.396	S	S	.	.			trans	-68	-21.4	-178.8	-60.1	0	0	0	0	114.6	H37 H284	H37-C286 VanDerWaalsContact CD2-SG 3.55Å; H37-C286 PolarHBondContact NE2-SG 3.36Å; H37-C286 VanDerWaalsContact NE2-SG 3.39Å; H284-C286 PolarHBondContact CD2-SG 3.38Å; H284-C286 PolarHBondContact O-N 3.02Å
287	L	55.4	Low	61.5	Low	142 Å²	142	66.9 Å²	66.9	74%	0.743	37%	0.367	S	S	*	.	S	Bend	trans	-121.8	121.2	-166.6	-67.6	167.3	0	0	0	110.3	L34 Q285	L34-L287 HydrophobicContact CD1-CD2 4.26Å; Q285-L287 VanDerWaalsContact C-N 3.26Å; Q285-L287 PolarHBondContact O-N 3.1Å
288	G	59.7	Low	64.3	Low	84 Å²	84	62.2 Å²	62.2	87%	0.866	34%	0.335	S	S	*	.	S	Bend	trans	82.2	5.5	171	0	0	0	0	0	116.3
289	A	67.6	Low	66.9	Low	17 Å²	17	58.1 Å²	58.1	14%	0.14	31%	0.312	C	S	.	.			trans	-69.2	136.2	177.1	0	0	0	0	0	111.5	Q293 I294	A289-Q293 HydrophobicContact CB-CB 4.46Å; A289-I294 HydrophobicContact CB-CD1 4.32Å; A289-I294 HydrophobicContact CB-CG1 3.96Å
290	T	79.8	Confident	69.2	Low	61 Å²	61	56.3 Å²	56.3	37%	0.374	30%	0.302	S	S	.	.			trans	-70.1	152.5	169	65.7	0	0	0	0	109.7	E292 Q293 I294	T290-E292 WeakPolarHBondContact CB-OE2 3.25Å; T290-E292 PolarHBondContact O-N 3.43Å; T290-Q293 WeakPolarHBondContact O-CB 3.47Å; T290-Q293 PolarHBondContact O-N 3.37Å; T290-Q293 VanDerWaalsContact OG1-CG 3.27Å; T290-Q293 WeakPolarHBondContact OG1-CG 3.41Å; T290-Q293 PolarHBondContact OG1-N 2.95Å; T290-I294 PolarHBondContact O-N 2.83Å; T290-I294 VanDerWaalsContact O-N 3.14Å
291	P	81.9	Confident	71.4	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.052	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-26.9	177.4	23.4	-32.2	0	0	0	112.5	R295 A398 S399 I401 C423	P291-R295 WeakPolarHBondContact O-CG 3.14Å; P291-R295 PolarHBondContact O-N 3.23Å; P291-A398 WeakPolarHBondContact CG-O 3.45Å; P291-S399 VanDerWaalsContact CG-C 3.41Å; P291-I401 HydrophobicContact CB-CG1 4.27Å; P291-I401 HydrophobicContact CG-CG1 4.45Å; P291-C423 HydrophobicContact CB-CB 3.99Å
292	E	84.7	Confident	73.4	Confident	66 Å²	66	49.6 Å²	49.6	31%	0.308	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-48.1	170.8	-65.9	72	-154.8	0	0	111.7	T290 I294 R295 E296 S399	T290-E292 WeakPolarHBondContact CB-OE2 3.25Å; T290-E292 PolarHBondContact O-N 3.43Å; E292-I294 VanDerWaalsContact C-N 3.3Å; E292-I294 PolarHBondContact O-N 2.91Å; E292-R295 PolarHBondContact O-N 3.47Å; E292-R295 VanDerWaalsContact O-N 3.13Å; E292-R295 IonicContact OE1-NH1 3.07Å; E292-E296 PolarHBondContact O-N 3.41Å; E292-S399 WeakPolarHBondContact OE1-CA 3.33Å; E292-S399 PolarHBondContact OE1-N 2.84Å
293	Q	84	Confident	75.1	Confident	70 Å²	70	51 Å²	51	33%	0.327	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-39.2	177.7	-73.6	168	-13.6	0	0	112	A289 T290 R295 E296 E297	A289-Q293 HydrophobicContact CB-CB 4.46Å; T290-Q293 WeakPolarHBondContact O-CB 3.47Å; T290-Q293 PolarHBondContact O-N 3.37Å; T290-Q293 VanDerWaalsContact OG1-CG 3.27Å; T290-Q293 WeakPolarHBondContact OG1-CG 3.41Å; T290-Q293 PolarHBondContact OG1-N 2.95Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 2.96Å; Q293-E296 PolarHBondContact O-N 3.23Å; Q293-E297 WeakPolarHBondContact O-CB 3.45Å; Q293-E297 PolarHBondContact O-N 2.91Å
294	I	84.3	Confident	76.1	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-40	176.8	-65.1	166.1	0	0	0	111	A289 T290 E292 E297 V298 H377 C423	A289-I294 HydrophobicContact CB-CD1 4.32Å; A289-I294 HydrophobicContact CB-CG1 3.96Å; T290-I294 PolarHBondContact O-N 2.83Å; T290-I294 VanDerWaalsContact O-N 3.14Å; E292-I294 VanDerWaalsContact C-N 3.3Å; E292-I294 PolarHBondContact O-N 2.91Å; I294-E297 PolarHBondContact O-N 2.94Å; I294-V298 VanDerWaalsContact O-CG2 3.24Å; I294-V298 WeakPolarHBondContact O-CG2 3.39Å; I294-V298 PolarHBondContact O-N 2.91Å; I294-H377 HydrophobicContact CD1-CB 4.26Å; I294-H377 HydrophobicContact CG2-CB 4.16Å; I294-C423 HydrophobicContact CG2-CB 4.37Å
295	R	87.1	Confident	77.2	Confident	30 Å²	30	48.7 Å²	48.7	11%	0.113	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-42.6	176.4	-69	176.5	-163.9	122.1	10.5	111.8	P291 E292 Q293 E297 V298 E299 A398 C423	P291-R295 WeakPolarHBondContact O-CG 3.14Å; P291-R295 PolarHBondContact O-N 3.23Å; E292-R295 PolarHBondContact O-N 3.47Å; E292-R295 VanDerWaalsContact O-N 3.13Å; E292-R295 IonicContact OE1-NH1 3.07Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 2.96Å; R295-E297 VanDerWaalsContact C-N 3.34Å; R295-V298 PolarHBondContact O-N 3.31Å; R295-E299 PolarHBondContact O-N 3.38Å; R295-A398 VanDerWaalsContact CZ-O 3.31Å; R295-A398 PolarHBondContact NH1-O 2.99Å; R295-A398 PolarHBondContact NH2-O 3.12Å; R295-C423 PolarHBondContact NE-O 3.4Å; R295-C423 PolarHBondContact NH2-O 2.97Å
296	E	84.2	Confident	78.4	Confident	121 Å²	121	46.2 Å²	46.2	57%	0.565	25%	0.251	S	S	*	.	H	α-helix	trans	-62.1	-43.4	175.8	-71.3	178.7	-178	0	0	111.3	E292 Q293 E299 L300	E292-E296 PolarHBondContact O-N 3.41Å; Q293-E296 PolarHBondContact O-N 3.23Å; E296-E299 PolarHBondContact O-N 2.89Å; E296-L300 WeakPolarHBondContact O-CG 3.38Å; E296-L300 PolarHBondContact O-N 3.3Å
297	E	81.4	Confident	79	Confident	23 Å²	23	45.6 Å²	45.6	11%	0.107	25%	0.25	C	C	.	.	H	α-helix	trans	-58.5	-50.8	175.2	-174.2	-179.2	-174.2	0	0	111.2	H284 Q293 I294 R295 E299 L300 Y301 I374	H284-E297 WeakPolarHBondContact CA-OE1 3.45Å; H284-E297 WeakPolarHBondContact CB-OE1 3.32Å; H284-E297 IonicContact CE1-OE2 3.31Å; H284-E297 IonicContact CG-OE1 2.8Å; H284-E297 IonicContact ND1-OE1 3.86Å; H284-E297 PolarHBondContact ND1-OE1 3.27Å; H284-E297 IonicContact ND1-OE2 3.44Å; H284-E297 PolarHBondContact ND1-OE2 3.38Å; Q293-E297 WeakPolarHBondContact O-CB 3.45Å; Q293-E297 PolarHBondContact O-N 2.91Å; I294-E297 PolarHBondContact O-N 2.94Å; R295-E297 VanDerWaalsContact C-N 3.34Å; E297-E299 VanDerWaalsContact C-N 3.28Å; E297-E299 PolarHBondContact O-N 3.21Å; E297-L300 WeakPolarHBondContact O-CB 3.49Å; E297-L300 PolarHBondContact O-N 3.13Å; E297-L300 VanDerWaalsContact O-N 3.1Å; E297-Y301 HydrophobicContact CG-CD2 3.65Å; E297-Y301 HydrophobicContact CG-CE2 3.51Å; E297-Y301 VanDerWaalsContact O-CD2 3.3Å; E297-Y301 WeakPolarHBondContact O-CD2 3.19Å; E297-Y301 PolarHBondContact O-N 3.42Å; E297-Y301 WeakPolarHBondContact OE1-CE2 3.38Å; E297-I374 HydrophobicContact CG-CD1 4.45Å
298	V	85.9	Confident	80.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.2	-45.1	176.9	166.3	0	0	0	0	111.5	I294 R295 L300 Y301 R302 I374 L378 F434	I294-V298 VanDerWaalsContact O-CG2 3.24Å; I294-V298 WeakPolarHBondContact O-CG2 3.39Å; I294-V298 PolarHBondContact O-N 2.91Å; R295-V298 PolarHBondContact O-N 3.31Å; V298-L300 VanDerWaalsContact C-N 3.31Å; V298-L300 PolarHBondContact O-N 2.65Å; V298-Y301 PolarHBondContact O-N 3.18Å; V298-R302 WeakPolarHBondContact O-CB 3.06Å; V298-R302 PolarHBondContact O-N 2.95Å; V298-I374 HydrophobicContact CB-CG2 4.45Å; V298-I374 HydrophobicContact CG2-CG2 3.38Å; V298-L378 HydrophobicContact CB-CD2 4.4Å; V298-L378 HydrophobicContact CG1-CD2 3.76Å; V298-L378 HydrophobicContact CG2-CB 4.05Å; V298-L378 HydrophobicContact CG2-CD1 4.08Å; V298-L378 HydrophobicContact CG2-CD2 3.85Å; V298-L378 HydrophobicContact CG2-CG 4.19Å; V298-F434 HydrophobicContact CG1-CD1 3.95Å; V298-F434 HydrophobicContact CG1-CD2 4.4Å; V298-F434 HydrophobicContact CG1-CE1 4.23Å; V298-F434 HydrophobicContact CG1-CG 4.05Å; V298-F434 HydrophobicContact CG2-CE1 4.3Å
299	E	81.9	Confident	81.4	Confident	34 Å²	34	37.1 Å²	37.1	16%	0.159	19%	0.185	C	C	.	.	H	α-helix	trans	-64.5	-36.4	179.7	-81.7	-61.2	121.5	0	0	112.5	R295 E296 E297 R302 R303	R295-E299 PolarHBondContact O-N 3.38Å; E296-E299 PolarHBondContact O-N 2.89Å; E297-E299 VanDerWaalsContact C-N 3.28Å; E297-E299 PolarHBondContact O-N 3.21Å; E299-R302 IonicContact OE1-CZ 3.86Å; E299-R302 IonicContact OE1-NE 3.63Å; E299-R302 PolarHBondContact OE1-NE 2.87Å; E299-R302 IonicContact OE1-NH2 3.76Å; E299-R302 IonicContact OE2-CZ 3.88Å; E299-R302 IonicContact OE2-NE 3.72Å; E299-R302 PolarHBondContact OE2-NE 3.03Å; E299-R302 IonicContact OE2-NH2 3.83Å; E299-R302 PolarHBondContact OE2-NH2 2.95Å; E299-R303 VanDerWaalsContact O-CG 3.3Å; E299-R303 WeakPolarHBondContact O-CG 3.12Å; E299-R303 PolarHBondContact O-N 3.1Å; E299-R303 IonicContact OE2-NH2 2.72Å
300	L	79	Confident	81.9	Confident	56 Å²	56	39.8 Å²	39.8	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-65.4	-52.4	174.1	-68.4	170.7	0	0	0	111.7	T268 M282 E296 E297 V298 R302 R303 D304	T268-L300 HydrophobicContact CG2-CD2 3.91Å; M282-L300 HydrophobicContact CE-CB 4.01Å; E296-L300 WeakPolarHBondContact O-CG 3.38Å; E296-L300 PolarHBondContact O-N 3.3Å; E297-L300 WeakPolarHBondContact O-CB 3.49Å; E297-L300 PolarHBondContact O-N 3.13Å; E297-L300 VanDerWaalsContact O-N 3.1Å; V298-L300 VanDerWaalsContact C-N 3.31Å; V298-L300 PolarHBondContact O-N 2.65Å; L300-R302 VanDerWaalsContact C-N 3.3Å; L300-R302 PolarHBondContact O-N 2.88Å; L300-R303 PolarHBondContact O-N 2.76Å; L300-D304 PolarHBondContact O-N 3.45Å
301	Y	81.5	Confident	81.8	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-66.6	-30.9	-179.6	-79.9	-80.5	0	0	0	113.3	F251 M282 E297 V298 D304 F305 Y367 L370 L371 I374	F251-Y301 HydrophobicContact CE1-CE1 4.48Å; M282-Y301 VanDerWaalsContact C-OH 3.29Å; M282-Y301 HydrophobicContact CB-CE1 4.04Å; M282-Y301 WeakPolarHBondContact CB-OH 3.4Å; M282-Y301 HydrophobicContact CG-CE1 4.16Å; M282-Y301 PolarHBondContact O-OH 2.96Å; M282-Y301 HydrophobicContact SD-CD2 4.36Å; M282-Y301 HydrophobicContact SD-CE1 3.98Å; M282-Y301 HydrophobicContact SD-CE2 3.72Å; M282-Y301 VanDerWaalsContact SD-CZ 3.53Å; E297-Y301 HydrophobicContact CG-CD2 3.65Å; E297-Y301 HydrophobicContact CG-CE2 3.51Å; E297-Y301 VanDerWaalsContact O-CD2 3.3Å; E297-Y301 WeakPolarHBondContact O-CD2 3.19Å; E297-Y301 PolarHBondContact O-N 3.42Å; E297-Y301 WeakPolarHBondContact OE1-CE2 3.38Å; V298-Y301 PolarHBondContact O-N 3.18Å; Y301-D304 PolarHBondContact O-N 3.38Å; Y301-F305 WeakPolarHBondContact O-CB 3.05Å; Y301-F305 PolarHBondContact O-N 2.6Å; Y301-Y367 HydrophobicContact CD1-CE2 4.15Å; Y301-Y367 HydrophobicContact CE1-CE2 4.44Å; Y301-L370 HydrophobicContact CD1-CD2 4.42Å; Y301-L370 HydrophobicContact CE1-CD2 3.43Å; Y301-L370 VanDerWaalsContact CE1-CD2 3.43Å; Y301-L370 HydrophobicContact CE1-CG 3.97Å; Y301-L371 HydrophobicContact CD1-CD2 4.21Å; Y301-L371 HydrophobicContact CG-CD2 4.29Å; Y301-I374 HydrophobicContact CD1-CD1 4.13Å; Y301-I374 HydrophobicContact CD2-CD1 3.3Å; Y301-I374 HydrophobicContact CE1-CD1 4.18Å; Y301-I374 HydrophobicContact CE2-CD1 3.34Å; Y301-I374 HydrophobicContact CG-CD1 3.68Å
302	R	84.1	Confident	82.1	Confident	43 Å²	43	37.3 Å²	37.3	16%	0.162	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-43.1	173.2	-174.5	-170	66.1	68.7	-5.3	111.5	V298 E299 L300 N306 F434	V298-R302 WeakPolarHBondContact O-CB 3.06Å; V298-R302 PolarHBondContact O-N 2.95Å; E299-R302 IonicContact OE1-CZ 3.86Å; E299-R302 IonicContact OE1-NE 3.63Å; E299-R302 PolarHBondContact OE1-NE 2.87Å; E299-R302 IonicContact OE1-NH2 3.76Å; E299-R302 IonicContact OE2-CZ 3.88Å; E299-R302 IonicContact OE2-NE 3.72Å; E299-R302 PolarHBondContact OE2-NE 3.03Å; E299-R302 IonicContact OE2-NH2 3.83Å; E299-R302 PolarHBondContact OE2-NH2 2.95Å; L300-R302 VanDerWaalsContact C-N 3.3Å; L300-R302 PolarHBondContact O-N 2.88Å; R302-N306 PolarHBondContact NH1-ND2 3.34Å; R302-N306 WeakPolarHBondContact O-CB 3.28Å; R302-N306 VanDerWaalsContact O-CG 3.24Å; R302-N306 PolarHBondContact O-N 2.78Å; R302-N306 VanDerWaalsContact O-N 3.12Å; R302-N306 PolarHBondContact O-ND2 2.84Å; R302-F434 HydrophobicContact CB-CD2 4.17Å; R302-F434 HydrophobicContact CB-CE2 4.33Å; R302-F434 HydrophobicContact CG-CD2 4.37Å
303	R	78.4	Confident	82.1	Confident	79 Å²	79	37.8 Å²	37.8	30%	0.298	19%	0.188	S	C	.	.	H	α-helix	trans	-64.7	-44.5	176.1	-70.7	173.8	-156.4	156.4	8.1	110.6	E299 L300 N306 A307	E299-R303 VanDerWaalsContact O-CG 3.3Å; E299-R303 WeakPolarHBondContact O-CG 3.12Å; E299-R303 PolarHBondContact O-N 3.1Å; E299-R303 IonicContact OE2-NH2 2.72Å; L300-R303 PolarHBondContact O-N 2.76Å; R303-N306 PolarHBondContact O-N 3.03Å; R303-A307 WeakPolarHBondContact O-CB 3.2Å; R303-A307 PolarHBondContact O-N 2.74Å
304	D	75.9	Confident	82	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.027	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-48.7	176.4	-178.2	48.6	0	0	0	112.6	Y271 L300 Y301 N306 A307 R308 Y367	Y271-D304 WeakPolarHBondContact OH-CB 3.22Å; Y271-D304 PolarHBondContact OH-OD1 3.4Å; L300-D304 PolarHBondContact O-N 3.45Å; Y301-D304 PolarHBondContact O-N 3.38Å; D304-N306 VanDerWaalsContact C-N 3.31Å; D304-N306 PolarHBondContact O-N 3.45Å; D304-A307 PolarHBondContact O-N 3.36Å; D304-R308 VanDerWaalsContact CG-NE 3.3Å; D304-R308 WeakPolarHBondContact O-CG 3.31Å; D304-R308 PolarHBondContact O-N 3.28Å; D304-R308 IonicContact OD1-CZ 3.65Å; D304-R308 IonicContact OD1-NE 3.23Å; D304-R308 PolarHBondContact OD1-NE 2.69Å; D304-R308 IonicContact OD1-NH2 3.72Å; D304-R308 PolarHBondContact OD1-NH2 2.72Å; D304-R308 IonicContact OD2-CZ 2.75Å; D304-R308 VanDerWaalsContact OD2-CZ 3.23Å; D304-R308 IonicContact OD2-NE 3.23Å; D304-R308 PolarHBondContact OD2-NE 2.72Å; D304-R308 IonicContact OD2-NH2 2.97Å; D304-R308 PolarHBondContact OD2-NH2 3.4Å; D304-Y367 WeakPolarHBondContact OD2-CE2 3.25Å; D304-Y367 VanDerWaalsContact OD2-CZ 3.27Å; D304-Y367 PolarHBondContact OD2-OH 3.46Å
305	F	84.4	Confident	81.9	Confident	23 Å²	23	36.4 Å²	36.4	10%	0.101	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-44.7	177	174.9	-94.2	0	0	0	111.7	Y301 R308 L309 L363 Y367 L371 F438	Y301-F305 WeakPolarHBondContact O-CB 3.05Å; Y301-F305 PolarHBondContact O-N 2.6Å; F305-R308 PolarHBondContact O-N 2.81Å; F305-L309 HydrophobicContact CE1-CD2 4.19Å; F305-L309 WeakPolarHBondContact O-CB 3Å; F305-L309 PolarHBondContact O-N 3.46Å; F305-L363 HydrophobicContact CD2-CD1 4.47Å; F305-L363 HydrophobicContact CD2-CD2 3.82Å; F305-L363 HydrophobicContact CE2-CD1 3.91Å; F305-L363 HydrophobicContact CE2-CD2 4.02Å; F305-Y367 HydrophobicContact CD2-CE1 4.15Å; F305-Y367 PolarHBondContact N-OH 3.41Å; F305-L371 HydrophobicContact CB-CD1 4.5Å; F305-L371 HydrophobicContact CD2-CD1 3.78Å; F305-L371 HydrophobicContact CE2-CD1 4.48Å; F305-L371 HydrophobicContact CG-CD1 4.42Å; F305-F438 HydrophobicContact CD1-CZ 4.2Å; F305-F438 HydrophobicContact CD2-CE1 4.37Å; F305-F438 AromaticContact CD2-CZ 3.9Å; F305-F438 HydrophobicContact CD2-CZ 3.9Å; F305-F438 HydrophobicContact CE1-CZ 4.19Å; F305-F438 HydrophobicContact CE2-CE1 4.14Å; F305-F438 AromaticContact CE2-CZ 3.89Å; F305-F438 HydrophobicContact CE2-CZ 3.89Å; F305-F438 HydrophobicContact CG-CZ 4.07Å; F305-F438 HydrophobicContact CZ-CE1 4.5Å; F305-F438 HydrophobicContact CZ-CZ 4.04Å
306	N	82.3	Confident	82	Confident	53 Å²	53	35.6 Å²	35.6	28%	0.283	18%	0.182	S	C	.	.	H	α-helix	trans	-64.9	-41.6	178.4	-73.8	-17.7	0	0	0	112	R302 R303 D304 L309 V310	R302-N306 PolarHBondContact NH1-ND2 3.34Å; R302-N306 WeakPolarHBondContact O-CB 3.28Å; R302-N306 VanDerWaalsContact O-CG 3.24Å; R302-N306 PolarHBondContact O-N 2.78Å; R302-N306 VanDerWaalsContact O-N 3.12Å; R302-N306 PolarHBondContact O-ND2 2.84Å; R303-N306 PolarHBondContact O-N 3.03Å; D304-N306 VanDerWaalsContact C-N 3.31Å; D304-N306 PolarHBondContact O-N 3.45Å; N306-L309 PolarHBondContact O-N 3.36Å; N306-V310 VanDerWaalsContact O-CG2 3.29Å; N306-V310 WeakPolarHBondContact O-CG2 3.1Å; N306-V310 PolarHBondContact O-N 3.33Å
307	A	74.9	Confident	82.2	Confident	34 Å²	34	35.3 Å²	35.3	28%	0.281	18%	0.184	S	C	.	.	H	α-helix	trans	-60.9	-48.7	177.1	0	0	0	0	0	111	R303 D304 L309 V310 D311	R303-A307 WeakPolarHBondContact O-CB 3.2Å; R303-A307 PolarHBondContact O-N 2.74Å; D304-A307 PolarHBondContact O-N 3.36Å; A307-L309 VanDerWaalsContact C-N 3.33Å; A307-L309 PolarHBondContact O-N 2.88Å; A307-V310 PolarHBondContact O-N 2.72Å; A307-D311 PolarHBondContact O-N 2.79Å
308	R	81.3	Confident	82.3	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.011	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-40.2	176.4	-67.1	174	-170.2	-139.7	11.3	112.6	Y249 D304 F305 D311 I312 F362 L363	Y249-R308 HydrophobicContact CD2-CG 4.28Å; Y249-R308 HydrophobicContact CE2-CG 3.9Å; D304-R308 VanDerWaalsContact CG-NE 3.3Å; D304-R308 WeakPolarHBondContact O-CG 3.31Å; D304-R308 PolarHBondContact O-N 3.28Å; D304-R308 IonicContact OD1-CZ 3.65Å; D304-R308 IonicContact OD1-NE 3.23Å; D304-R308 PolarHBondContact OD1-NE 2.69Å; D304-R308 IonicContact OD1-NH2 3.72Å; D304-R308 PolarHBondContact OD1-NH2 2.72Å; D304-R308 IonicContact OD2-CZ 2.75Å; D304-R308 VanDerWaalsContact OD2-CZ 3.23Å; D304-R308 IonicContact OD2-NE 3.23Å; D304-R308 PolarHBondContact OD2-NE 2.72Å; D304-R308 IonicContact OD2-NH2 2.97Å; D304-R308 PolarHBondContact OD2-NH2 3.4Å; F305-R308 PolarHBondContact O-N 2.81Å; R308-D311 PolarHBondContact O-N 3.38Å; R308-I312 VanDerWaalsContact O-CG1 3.28Å; R308-I312 WeakPolarHBondContact O-CG1 3.47Å; R308-I312 PolarHBondContact O-N 3.44Å; R308-F362 PolarHBondContact NH1-O 2.71Å; R308-L363 HydrophobicContact CB-CD2 4.09Å
309	L	84	Confident	82.4	Confident	45 Å²	45	35.5 Å²	35.5	24%	0.236	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-41.1	177.1	-177.4	61.8	0	0	0	111.6	F305 N306 A307 I312 L313 W359	F305-L309 HydrophobicContact CE1-CD2 4.19Å; F305-L309 WeakPolarHBondContact O-CB 3Å; F305-L309 PolarHBondContact O-N 3.46Å; N306-L309 PolarHBondContact O-N 3.36Å; A307-L309 VanDerWaalsContact C-N 3.33Å; A307-L309 PolarHBondContact O-N 2.88Å; L309-I312 WeakPolarHBondContact O-CB 3.07Å; L309-I312 PolarHBondContact O-N 3.28Å; L309-L313 HydrophobicContact CG-CD1 4.31Å; L309-L313 WeakPolarHBondContact O-CG 3.12Å; L309-L313 PolarHBondContact O-N 3.47Å; L309-W359 HydrophobicContact CD1-CE3 4.41Å; L309-W359 HydrophobicContact CD1-CZ3 3.76Å
310	V	79.5	Confident	82.9	Confident	73 Å²	73	35.3 Å²	35.3	44%	0.442	19%	0.186	S	C	.	.	H	α-helix	trans	-63.1	-43.3	174.9	169.2	0	0	0	0	110.8	N306 A307 I312 L313 I314	N306-V310 VanDerWaalsContact O-CG2 3.29Å; N306-V310 WeakPolarHBondContact O-CG2 3.1Å; N306-V310 PolarHBondContact O-N 3.33Å; A307-V310 PolarHBondContact O-N 2.72Å; V310-I312 VanDerWaalsContact C-N 3.33Å; V310-I312 PolarHBondContact O-N 3.31Å; V310-L313 PolarHBondContact O-N 3.4Å; V310-I314 HydrophobicContact CG1-CD1 3.49Å; V310-I314 VanDerWaalsContact CG1-CD1 3.49Å; V310-I314 HydrophobicContact CG1-CG1 4.16Å; V310-I314 WeakPolarHBondContact O-CG1 3.49Å; V310-I314 PolarHBondContact O-N 2.85Å
311	D	78.2	Confident	83.3	Confident	17 Å²	17	35.2 Å²	35.2	9%	0.091	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-39.4	176.1	-70.6	-30	0	0	0	112.3	M243 A307 R308 G315 F362	M243-D311 HydrophobicContact CG-CB 4.49Å; M243-D311 WeakPolarHBondContact CG-OD1 3.47Å; A307-D311 PolarHBondContact O-N 2.79Å; R308-D311 PolarHBondContact O-N 3.38Å; D311-G315 PolarHBondContact O-N 3.49Å; D311-F362 HydrophobicContact CB-CE1 4.35Å; D311-F362 HydrophobicContact CB-CZ 4.35Å
312	I	86.2	Confident	83.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-53.6	172.4	-68.5	160.9	0	0	0	109.5	R308 L309 V310 G315 T316 F355 R358 W359 F362 L363	R308-I312 VanDerWaalsContact O-CG1 3.28Å; R308-I312 WeakPolarHBondContact O-CG1 3.47Å; R308-I312 PolarHBondContact O-N 3.44Å; L309-I312 WeakPolarHBondContact O-CB 3.07Å; L309-I312 PolarHBondContact O-N 3.28Å; V310-I312 VanDerWaalsContact C-N 3.33Å; V310-I312 PolarHBondContact O-N 3.31Å; I312-G315 PolarHBondContact O-N 2.89Å; I312-T316 HydrophobicContact CG2-CG2 4.4Å; I312-T316 VanDerWaalsContact O-CG2 3.25Å; I312-T316 WeakPolarHBondContact O-CG2 3.23Å; I312-T316 PolarHBondContact O-N 3.45Å; I312-T316 PolarHBondContact O-OG1 2.89Å; I312-F355 HydrophobicContact CG2-CD2 3.71Å; I312-F355 HydrophobicContact CG2-CE2 3.8Å; I312-R358 HydrophobicContact CG1-CB 4.36Å; I312-R358 HydrophobicContact CG2-CB 4.01Å; I312-W359 HydrophobicContact CD1-CE3 4.29Å; I312-F362 HydrophobicContact CD1-CB 3.88Å; I312-F362 HydrophobicContact CG1-CB 3.81Å; I312-F362 HydrophobicContact CG1-CD2 3.74Å; I312-F362 HydrophobicContact CG1-CG 4.05Å; I312-L363 HydrophobicContact CD1-CD1 3.53Å; I312-L363 HydrophobicContact CD1-CG 3.84Å
313	L	86.2	Confident	83.7	Confident	77 Å²	77	33.1 Å²	33.1	40%	0.403	18%	0.175	S	C	.	.	H	α-helix	trans	-61.7	-50	-176.1	-70.9	171.3	0	0	0	112	L309 V310 G315 T316 L317 F355	L309-L313 HydrophobicContact CG-CD1 4.31Å; L309-L313 WeakPolarHBondContact O-CG 3.12Å; L309-L313 PolarHBondContact O-N 3.47Å; V310-L313 PolarHBondContact O-N 3.4Å; L313-G315 VanDerWaalsContact C-N 3.3Å; L313-G315 PolarHBondContact O-N 2.9Å; L313-T316 WeakPolarHBondContact CA-OG1 3.17Å; L313-T316 PolarHBondContact O-N 3.22Å; L313-T316 PolarHBondContact O-OG1 3.41Å; L313-L317 WeakPolarHBondContact O-CG 3.36Å; L313-L317 PolarHBondContact O-N 3.42Å; L313-F355 HydrophobicContact CD2-CD2 4.48Å; L313-F355 HydrophobicContact CD2-CE2 4.17Å
314	I	80.4	Confident	84.3	Confident	41 Å²	41	29.4 Å²	29.4	21%	0.21	16%	0.161	C	C	.	.	H	α-helix	trans	-63.2	-41.5	178.9	-62.1	169.6	0	0	0	110.4	L172 M243 V310 T316 L317 H318	L172-I314 HydrophobicContact CD1-CG2 4.07Å; M243-I314 HydrophobicContact CE-CB 4.17Å; M243-I314 HydrophobicContact CE-CD1 4.4Å; M243-I314 HydrophobicContact CE-CG2 3.3Å; M243-I314 HydrophobicContact SD-CB 3.56Å; M243-I314 VanDerWaalsContact SD-CB 3.56Å; M243-I314 HydrophobicContact SD-CD1 3.52Å; M243-I314 VanDerWaalsContact SD-CD1 3.52Å; M243-I314 HydrophobicContact SD-CG1 4.14Å; M243-I314 HydrophobicContact SD-CG2 3.41Å; M243-I314 WeakPolarHBondContact SD-CG2 3.47Å; V310-I314 HydrophobicContact CG1-CD1 3.49Å; V310-I314 VanDerWaalsContact CG1-CD1 3.49Å; V310-I314 HydrophobicContact CG1-CG1 4.16Å; V310-I314 WeakPolarHBondContact O-CG1 3.49Å; V310-I314 PolarHBondContact O-N 2.85Å; I314-T316 VanDerWaalsContact C-N 3.3Å; I314-T316 PolarHBondContact O-N 3.41Å; I314-L317 PolarHBondContact O-N 2.83Å; I314-H318 WeakPolarHBondContact O-CB 3.05Å; I314-H318 PolarHBondContact O-N 3.33Å
315	G	82.3	Confident	84.9	Confident	6 Å²	6	34.1 Å²	34.1	6%	0.062	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-35	176	0	0	0	0	0	113.7	D311 I312 L313 A319 R358	D311-G315 PolarHBondContact O-N 3.49Å; I312-G315 PolarHBondContact O-N 2.89Å; L313-G315 VanDerWaalsContact C-N 3.3Å; L313-G315 PolarHBondContact O-N 2.9Å; G315-A319 PolarHBondContact O-N 3.47Å; G315-R358 VanDerWaalsContact C-NE 3.33Å; G315-R358 PolarHBondContact O-NE 2.81Å
316	T	91.1	Very high	84.9	Confident	13 Å²	13	33 Å²	33	8%	0.08	18%	0.177	C	C	.	.	H	α-helix	trans	-70.6	-45.3	174	56.8	0	0	0	0	112.2	I312 L313 I314 H318 A319 V320 V354 F355	I312-T316 HydrophobicContact CG2-CG2 4.4Å; I312-T316 VanDerWaalsContact O-CG2 3.25Å; I312-T316 WeakPolarHBondContact O-CG2 3.23Å; I312-T316 PolarHBondContact O-N 3.45Å; I312-T316 PolarHBondContact O-OG1 2.89Å; L313-T316 WeakPolarHBondContact CA-OG1 3.17Å; L313-T316 PolarHBondContact O-N 3.22Å; L313-T316 PolarHBondContact O-OG1 3.41Å; I314-T316 VanDerWaalsContact C-N 3.3Å; I314-T316 PolarHBondContact O-N 3.41Å; T316-H318 VanDerWaalsContact C-N 3.31Å; T316-H318 PolarHBondContact O-N 2.83Å; T316-A319 PolarHBondContact O-N 2.91Å; T316-V320 WeakPolarHBondContact O-CG2 3.39Å; T316-V320 PolarHBondContact O-N 2.9Å; T316-V354 HydrophobicContact CG2-CB 4.42Å; T316-V354 HydrophobicContact CG2-CG1 3.98Å; T316-F355 HydrophobicContact CG2-CB 3.65Å; T316-F355 HydrophobicContact CG2-CD2 4.1Å; T316-F355 HydrophobicContact CG2-CG 4.37Å
317	L	87.1	Confident	85.1	Confident	116 Å²	116	30.6 Å²	30.6	61%	0.607	16%	0.164	S	C	*	.	H	α-helix	trans	-62.1	-41.5	178.7	-70.7	171.5	0	0	0	111	L313 I314 A319 V320 Y321	L313-L317 WeakPolarHBondContact O-CG 3.36Å; L313-L317 PolarHBondContact O-N 3.42Å; I314-L317 PolarHBondContact O-N 2.83Å; L317-A319 PolarHBondContact O-N 3.28Å; L317-V320 PolarHBondContact O-N 2.98Å; L317-Y321 WeakPolarHBondContact O-CB 3.45Å; L317-Y321 PolarHBondContact O-N 3.41Å
318	H	84	Confident	85.6	Confident	22 Å²	22	30.7 Å²	30.7	10%	0.102	16%	0.159	C	C	.	.	H	α-helix	trans	-58.6	-46.8	174.7	-176.7	-80.5	0	0	0	112.1	Y168 I314 T316 Y321 Y322	Y168-H318 AromaticContact CE1-CD2 3.7Å; I314-H318 WeakPolarHBondContact O-CB 3.05Å; I314-H318 PolarHBondContact O-N 3.33Å; T316-H318 VanDerWaalsContact C-N 3.31Å; T316-H318 PolarHBondContact O-N 2.83Å; H318-Y321 PolarHBondContact O-N 2.97Å; H318-Y322 AromaticContact CD2-CD2 3.97Å; H318-Y322 AromaticContact CD2-CE2 3.77Å; H318-Y322 AromaticContact CE1-CD2 3.55Å; H318-Y322 AromaticContact CE1-CE2 3.83Å; H318-Y322 AromaticContact ND1-CD2 3.88Å; H318-Y322 AromaticContact NE2-CD2 3.62Å; H318-Y322 AromaticContact NE2-CE2 3.4Å; H318-Y322 WeakPolarHBondContact NE2-CE2 3.34Å; H318-Y322 WeakPolarHBondContact O-CD2 3.19Å; H318-Y322 PolarHBondContact O-N 3.41Å; H318-Y322 VanDerWaalsContact O-N 3.14Å
319	A	88.8	Confident	85.6	Confident	4 Å²	4	33.4 Å²	33.4	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-44.7	179.9	0	0	0	0	0	112.4	G315 T316 L317 G323 V354	G315-A319 PolarHBondContact O-N 3.47Å; T316-A319 PolarHBondContact O-N 2.91Å; L317-A319 PolarHBondContact O-N 3.28Å; A319-G323 WeakPolarHBondContact O-CA 3.28Å; A319-G323 PolarHBondContact O-N 3.46Å; A319-V354 HydrophobicContact CB-CB 4.5Å; A319-V354 HydrophobicContact CB-CG1 3.87Å; A319-V354 HydrophobicContact CB-CG2 4.04Å
320	V	91.7	Very high	85.4	Confident	30 Å²	30	31.5 Å²	31.5	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-40.1	178.5	176.2	0	0	0	0	111.3	T316 L317 C324 F325 C347	T316-V320 WeakPolarHBondContact O-CG2 3.39Å; T316-V320 PolarHBondContact O-N 2.9Å; L317-V320 PolarHBondContact O-N 2.98Å; V320-C324 WeakPolarHBondContact O-CA 3.49Å; V320-C324 WeakPolarHBondContact O-CB 3.38Å; V320-C324 PolarHBondContact O-N 3.04Å; V320-F325 PolarHBondContact O-N 3.14Å; V320-C347 HydrophobicContact CG1-CB 4.21Å
321	Y	86.7	Confident	85.4	Confident	54 Å²	54	29.5 Å²	29.5	21%	0.212	15%	0.151	C	C	.	.	I	π-helix	trans	-59.9	-57.1	179.6	178.8	-103	0	0	0	111.1	L165 L317 H318 F325 L326	L165-Y321 HydrophobicContact CD2-CE1 3.65Å; L165-Y321 WeakPolarHBondContact CD2-OH 3.45Å; L317-Y321 WeakPolarHBondContact O-CB 3.45Å; L317-Y321 PolarHBondContact O-N 3.41Å; H318-Y321 PolarHBondContact O-N 2.97Å; Y321-F325 HydrophobicContact CD2-CB 4.48Å; Y321-F325 AromaticContact CD2-CD1 3.78Å; Y321-F325 HydrophobicContact CD2-CD1 3.78Å; Y321-F325 AromaticContact CE2-CD1 3.87Å; Y321-F325 HydrophobicContact CE2-CD1 3.87Å; Y321-F325 HydrophobicContact CE2-CE1 4.41Å; Y321-F325 PolarHBondContact O-N 3.02Å; Y321-L326 HydrophobicContact CE1-CD1 4.3Å; Y321-L326 WeakPolarHBondContact O-CB 3.5Å; Y321-L326 PolarHBondContact O-N 3.28Å
322	Y	86.3	Confident	85.1	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-72.8	-41.5	-179.1	-77.1	-71.8	0	0	0	112.9	I99 M102 L165 Y168 H318 L326	I99-Y322 VanDerWaalsContact CG2-O 3.25Å; I99-Y322 WeakPolarHBondContact CG2-O 3.33Å; M102-Y322 HydrophobicContact CB-CD1 3.86Å; M102-Y322 HydrophobicContact CB-CE1 3.73Å; M102-Y322 HydrophobicContact CB-CE2 4.44Å; M102-Y322 HydrophobicContact CB-CG 4.3Å; M102-Y322 HydrophobicContact CE-CE1 4.23Å; M102-Y322 HydrophobicContact CE-CE2 3.99Å; M102-Y322 WeakPolarHBondContact CE-OH 3.37Å; M102-Y322 HydrophobicContact CG-CD1 4.28Å; M102-Y322 HydrophobicContact CG-CE1 3.68Å; L165-Y322 HydrophobicContact CD2-CE1 4.15Å; Y168-Y322 HydrophobicContact CD1-CE2 4.11Å; Y168-Y322 WeakPolarHBondContact CD1-OH 3.22Å; Y168-Y322 AromaticContact CE1-CE2 3.77Å; Y168-Y322 HydrophobicContact CE1-CE2 3.77Å; H318-Y322 AromaticContact CD2-CD2 3.97Å; H318-Y322 AromaticContact CD2-CE2 3.77Å; H318-Y322 AromaticContact CE1-CD2 3.55Å; H318-Y322 AromaticContact CE1-CE2 3.83Å; H318-Y322 AromaticContact ND1-CD2 3.88Å; H318-Y322 AromaticContact NE2-CD2 3.62Å; H318-Y322 AromaticContact NE2-CE2 3.4Å; H318-Y322 WeakPolarHBondContact NE2-CE2 3.34Å; H318-Y322 WeakPolarHBondContact O-CD2 3.19Å; H318-Y322 PolarHBondContact O-N 3.41Å; H318-Y322 VanDerWaalsContact O-N 3.14Å; Y322-L326 HydrophobicContact CD1-CD2 3.92Å; Y322-L326 HydrophobicContact CE1-CD2 4.16Å
323	G	88.4	Confident	84.2	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.01	17%	0.171	C	C	.	.	I	π-helix	trans	-76.7	-30.3	-173.7	0	0	0	0	0	114.4	T63 A319	T63-G323 WeakPolarHBondContact CA-O 3.26Å; T63-G323 WeakPolarHBondContact OG1-CA 3.44Å; A319-G323 WeakPolarHBondContact O-CA 3.28Å; A319-G323 PolarHBondContact O-N 3.46Å
324	C	91.1	Very high	83.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-129.1	-42.8	-171	-54.4	0	0	0	0	113.9	Q66 V320 I328 C347	Q66-C324 PolarHBondContact NE2-O 3.46Å; V320-C324 WeakPolarHBondContact O-CA 3.49Å; V320-C324 WeakPolarHBondContact O-CB 3.38Å; V320-C324 PolarHBondContact O-N 3.04Å; C324-I328 WeakPolarHBondContact O-CD1 3.5Å; C324-I328 WeakPolarHBondContact O-CG1 3.41Å; C324-C347 HydrophobicContact CB-CB 4.03Å; C324-C347 WeakPolarHBondContact CB-SG 3.29Å
325	F	87.3	Confident	82.7	Confident	104 Å²	104	45.6 Å²	45.6	46%	0.456	22%	0.224	S	C	.	.	I	π-helix	trans	-78.7	-40.7	-174.5	-168.8	-112.6	0	0	0	112.7	V320 Y321 I328 I329	V320-F325 PolarHBondContact O-N 3.14Å; Y321-F325 HydrophobicContact CD2-CB 4.48Å; Y321-F325 AromaticContact CD2-CD1 3.78Å; Y321-F325 HydrophobicContact CD2-CD1 3.78Å; Y321-F325 AromaticContact CE2-CD1 3.87Å; Y321-F325 HydrophobicContact CE2-CD1 3.87Å; Y321-F325 HydrophobicContact CE2-CE1 4.41Å; Y321-F325 PolarHBondContact O-N 3.02Å; F325-I328 WeakPolarHBondContact O-CB 3.35Å; F325-I328 PolarHBondContact O-N 3.28Å; F325-I329 HydrophobicContact CD1-CD1 3.51Å; F325-I329 HydrophobicContact CD1-CG1 4.38Å; F325-I329 HydrophobicContact CE1-CD1 3.3Å; F325-I329 HydrophobicContact CE1-CG1 4.15Å; F325-I329 HydrophobicContact CG-CD1 4.4Å; F325-I329 HydrophobicContact CZ-CD1 4.03Å; F325-I329 HydrophobicContact CZ-CG1 4.43Å; F325-I329 PolarHBondContact O-N 3.44Å
326	L	84.4	Confident	82.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-45.6	-178.6	-159.4	69.4	0	0	0	112.8	I99 L165 Y321 Y322 I328 I329 F330	I99-L326 HydrophobicContact CD1-CB 4.27Å; I99-L326 HydrophobicContact CD1-CD2 4.15Å; I99-L326 HydrophobicContact CD1-CG 4.44Å; I99-L326 HydrophobicContact CG1-CB 4.42Å; I99-L326 HydrophobicContact CG1-CD2 3.6Å; I99-L326 HydrophobicContact CG1-CG 4.39Å; L165-L326 HydrophobicContact CD1-CD1 3.83Å; L165-L326 HydrophobicContact CD2-CD1 3.69Å; L165-L326 HydrophobicContact CD2-CD2 4.07Å; L165-L326 HydrophobicContact CG-CD1 4.32Å; Y321-L326 HydrophobicContact CE1-CD1 4.3Å; Y321-L326 WeakPolarHBondContact O-CB 3.5Å; Y321-L326 PolarHBondContact O-N 3.28Å; Y322-L326 HydrophobicContact CD1-CD2 3.92Å; Y322-L326 HydrophobicContact CE1-CD2 4.16Å; L326-I328 PolarHBondContact O-N 2.85Å; L326-I329 PolarHBondContact O-N 3.02Å; L326-I329 VanDerWaalsContact O-N 3.12Å; L326-F330 HydrophobicContact CD1-CD2 3.98Å; L326-F330 HydrophobicContact CD1-CE2 3.56Å; L326-F330 HydrophobicContact CG-CD2 4.03Å; L326-F330 HydrophobicContact CG-CE2 4.03Å; L326-F330 WeakPolarHBondContact O-CD2 3.35Å; L326-F330 PolarHBondContact O-N 3.1Å
327	P	87	Confident	81.9	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-54.8	-36.7	173.2	-26.7	34.4	0	0	0	113.9	Q66 L70 I99 V331	Q66-P327 HydrophobicContact CG-CB 4.07Å; Q66-P327 HydrophobicContact CG-CG 4.28Å; L70-P327 HydrophobicContact CD1-CB 3.56Å; L70-P327 WeakPolarHBondContact CD1-O 3.11Å; I99-P327 HydrophobicContact CD1-CG 3.78Å; P327-V331 WeakPolarHBondContact O-CG2 3.28Å
328	I	85.7	Confident	81.7	Confident	35 Å²	35	50.5 Å²	50.5	18%	0.179	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-38.1	179.6	-62.4	167.3	0	0	0	111.1	Q66 L70 C324 F325 L326 Y340 C343	Q66-I328 VanDerWaalsContact NE2-CD1 3.34Å; L70-I328 HydrophobicContact CD2-CG1 4.44Å; C324-I328 WeakPolarHBondContact O-CD1 3.5Å; C324-I328 WeakPolarHBondContact O-CG1 3.41Å; F325-I328 WeakPolarHBondContact O-CB 3.35Å; F325-I328 PolarHBondContact O-N 3.28Å; L326-I328 PolarHBondContact O-N 2.85Å; I328-Y340 HydrophobicContact CG2-CD1 4.38Å; I328-Y340 HydrophobicContact CG2-CE1 4.42Å; I328-C343 HydrophobicContact CD1-CB 3.91Å; I328-C343 HydrophobicContact CG1-CB 4.24Å
329	I	81.1	Confident	82	Confident	61 Å²	61	51.7 Å²	51.7	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-68.8	-38	-178.1	-68.6	164.2	0	0	0	111.3	Y158 F325 L326 V331	Y158-I329 HydrophobicContact CD2-CG2 4.16Å; Y158-I329 HydrophobicContact CE2-CG2 3.79Å; F325-I329 HydrophobicContact CD1-CD1 3.51Å; F325-I329 HydrophobicContact CD1-CG1 4.38Å; F325-I329 HydrophobicContact CE1-CD1 3.3Å; F325-I329 HydrophobicContact CE1-CG1 4.15Å; F325-I329 HydrophobicContact CG-CD1 4.4Å; F325-I329 HydrophobicContact CZ-CD1 4.03Å; F325-I329 HydrophobicContact CZ-CG1 4.43Å; F325-I329 PolarHBondContact O-N 3.44Å; L326-I329 PolarHBondContact O-N 3.02Å; L326-I329 VanDerWaalsContact O-N 3.12Å; I329-V331 VanDerWaalsContact C-N 3.32Å; I329-V331 PolarHBondContact O-N 3.24Å
330	F	79.5	Confident	82.1	Confident	5 Å²	5	58.2 Å²	58.2	2%	0.022	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	15.2	-171.8	-76	-105.3	0	0	0	113.7	V95 I149 Y158 L165 L326 Q332	V95-F330 HydrophobicContact CB-CD1 4.39Å; V95-F330 HydrophobicContact CG1-CB 3.82Å; V95-F330 HydrophobicContact CG1-CD1 4.08Å; V95-F330 HydrophobicContact CG1-CD2 4.41Å; V95-F330 HydrophobicContact CG1-CG 3.85Å; V95-F330 HydrophobicContact CG2-CB 4.11Å; V95-F330 HydrophobicContact CG2-CD1 3.36Å; V95-F330 HydrophobicContact CG2-CE1 4.11Å; V95-F330 HydrophobicContact CG2-CG 3.95Å; I149-F330 HydrophobicContact CD1-CE1 4.39Å; I149-F330 HydrophobicContact CG2-CD1 4.2Å; I149-F330 HydrophobicContact CG2-CE1 4.09Å; Y158-F330 AromaticContact CE1-CD1 3.88Å; Y158-F330 HydrophobicContact CE1-CD1 3.88Å; Y158-F330 AromaticContact CE1-CE1 3.47Å; Y158-F330 HydrophobicContact CE1-CE1 3.47Å; Y158-F330 VanDerWaalsContact CE1-CE1 3.47Å; Y158-F330 HydrophobicContact CE1-CZ 4.04Å; Y158-F330 HydrophobicContact CE2-CD1 4.24Å; Y158-F330 HydrophobicContact CE2-CD2 4.42Å; Y158-F330 HydrophobicContact CE2-CE1 4.24Å; Y158-F330 HydrophobicContact CE2-CE2 4.46Å; Y158-F330 HydrophobicContact CE2-CG 4.29Å; Y158-F330 HydrophobicContact CE2-CZ 4.35Å; Y158-F330 AromaticContact CZ-CD1 3.35Å; Y158-F330 AromaticContact CZ-CE1 3.36Å; Y158-F330 AromaticContact CZ-CG 3.8Å; Y158-F330 AromaticContact CZ-CZ 3.87Å; Y158-F330 WeakPolarHBondContact OH-CA 3.12Å; Y158-F330 WeakPolarHBondContact OH-CD1 3.17Å; Y158-F330 VanDerWaalsContact OH-CE1 3.26Å; Y158-F330 WeakPolarHBondContact OH-CE1 3.39Å; Y158-F330 WeakPolarHBondContact OH-CG 3.4Å; L165-F330 HydrophobicContact CD1-CE2 3.83Å; L165-F330 HydrophobicContact CD1-CZ 3.68Å; L326-F330 HydrophobicContact CD1-CD2 3.98Å; L326-F330 HydrophobicContact CD1-CE2 3.56Å; L326-F330 HydrophobicContact CG-CD2 4.03Å; L326-F330 HydrophobicContact CG-CE2 4.03Å; L326-F330 WeakPolarHBondContact O-CD2 3.35Å; L326-F330 PolarHBondContact O-N 3.1Å; F330-Q332 PolarHBondContact O-N 3.19Å
331	V	79.9	Confident	82.1	Confident	30 Å²	30	65.5 Å²	65.5	18%	0.182	29%	0.292	C	S	.	.			trans	-66.9	121.5	172.1	176.2	0	0	0	0	109.4	L70 P327 I329 L336 I338	L70-V331 HydrophobicContact CD1-CG2 4.1Å; L70-V331 HydrophobicContact CD2-CG2 3.89Å; L70-V331 HydrophobicContact CG-CG2 4.43Å; P327-V331 WeakPolarHBondContact O-CG2 3.28Å; I329-V331 VanDerWaalsContact C-N 3.32Å; I329-V331 PolarHBondContact O-N 3.24Å; V331-L336 HydrophobicContact CG1-CD1 4.35Å; V331-I338 HydrophobicContact CB-CD1 4.28Å; V331-I338 HydrophobicContact CG1-CD1 3.42Å; V331-I338 VanDerWaalsContact CG1-CD1 3.42Å; V331-I338 HydrophobicContact CG2-CD1 4Å
332	Q	72.2	Confident	82.4	Confident	48 Å²	48	64 Å²	64	22%	0.224	29%	0.285	C	S	.	.			trans	-89.9	-33.4	-175	-69	172	-9.9	0	0	114.3	D92 E150 F330	D92-Q332 PolarHBondContact OD2-NE2 2.97Å; E150-Q332 PolarHBondContact O-NE2 3.4Å; F330-Q332 PolarHBondContact O-N 3.19Å
333	N	67.2	Low	82.7	Confident	55 Å²	55	64 Å²	64	29%	0.294	29%	0.286	S	S	.	.			trans	-93.1	117.8	-168.3	-60.5	-22.2	0	0	0	113.2	S90 H335 L336	S90-N333 WeakPolarHBondContact CB-ND2 3.26Å; S90-N333 PolarHBondContact OG-ND2 3.29Å; N333-H335 PolarHBondContact O-N 2.71Å; N333-L336 HydrophobicContact CB-CB 4.42Å; N333-L336 HydrophobicContact CB-CD1 3.68Å; N333-L336 HydrophobicContact CB-CG 3.78Å; N333-L336 PolarHBondContact O-N 3.32Å
334	E	66.5	Low	83	Confident	189 Å²	189	68.8 Å²	68.8	88%	0.883	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20	170.2	-64.5	-172.7	167.8	0	0	113.2
335	H	69.3	Low	83.1	Confident	181 Å²	181	70 Å²	70	84%	0.838	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-6.6	-178.7	-57.8	-52.1	0	0	0	114.3	N333 Y337	N333-H335 PolarHBondContact O-N 2.71Å; H335-Y337 PolarHBondContact O-N 3.49Å
336	L	77.3	Confident	83.5	Confident	30 Å²	30	65.4 Å²	65.4	16%	0.157	30%	0.296	C	S	.	.	S	Bend	trans	-77.5	121.9	177	-76.5	166.5	0	0	0	110.4	Y71 V331 N333 I338	Y71-L336 HydrophobicContact CD1-CD1 4Å; Y71-L336 HydrophobicContact CE1-CD1 4.13Å; V331-L336 HydrophobicContact CG1-CD1 4.35Å; N333-L336 HydrophobicContact CB-CB 4.42Å; N333-L336 HydrophobicContact CB-CD1 3.68Å; N333-L336 HydrophobicContact CB-CG 3.78Å; N333-L336 PolarHBondContact O-N 3.32Å; L336-I338 HydrophobicContact CB-CD1 4.08Å; L336-I338 HydrophobicContact CB-CG1 4.02Å; L336-I338 PolarHBondContact O-N 2.97Å; L336-I338 VanDerWaalsContact O-N 3.08Å
337	Y	78.5	Confident	84	Confident	195 Å²	195	65.9 Å²	65.9	77%	0.765	30%	0.299	S	S	*	.			trans	-78	93.4	173.6	-178.3	-106	0	0	0	110.9	R72 H335	R72-Y337 VanDerWaalsContact CZ-O 3.25Å; R72-Y337 PolarHBondContact NH1-O 3.01Å; R72-Y337 PolarHBondContact NH2-O 3.32Å; H335-Y337 PolarHBondContact O-N 3.49Å
338	I	83.8	Confident	84.4	Confident	14 Å²	14	72.3 Å²	72.3	7%	0.072	33%	0.327	C	S	.	.			trans	-100.1	130.2	-175.9	-61.4	170.9	0	0	0	111.1	L70 V331 L336 Y340	L70-I338 HydrophobicContact CD2-CD1 4.16Å; L70-I338 HydrophobicContact CD2-CG2 3.79Å; V331-I338 HydrophobicContact CB-CD1 4.28Å; V331-I338 HydrophobicContact CG1-CD1 3.42Å; V331-I338 VanDerWaalsContact CG1-CD1 3.42Å; V331-I338 HydrophobicContact CG2-CD1 4Å; L336-I338 HydrophobicContact CB-CD1 4.08Å; L336-I338 HydrophobicContact CB-CG1 4.02Å; L336-I338 PolarHBondContact O-N 2.97Å; L336-I338 VanDerWaalsContact O-N 3.08Å; I338-Y340 HydrophobicContact CB-CE1 4.47Å; I338-Y340 HydrophobicContact CB-CE2 4.26Å; I338-Y340 HydrophobicContact CG2-CD1 4.11Å; I338-Y340 HydrophobicContact CG2-CE1 4.08Å; I338-Y340 HydrophobicContact CG2-CG 4.35Å; I338-Y340 PolarHBondContact O-N 2.97Å
339	D	89.7	Confident	84.9	Confident	46 Å²	46	70.9 Å²	70.9	25%	0.246	32%	0.32	C	S	.	.			trans	-83.7	86.3	169.9	-173.3	-13.9	0	0	0	109.2	W341 W342 C343 K471	D339-W341 PolarHBondContact O-N 3.03Å; D339-W341 PolarHBondContact OD1-N 2.94Å; D339-W342 HydrophobicContact CB-CB 3.99Å; D339-W342 VanDerWaalsContact CG-CB 3.44Å; D339-W342 PolarHBondContact O-N 2.97Å; D339-W342 PolarHBondContact OD1-N 2.94Å; D339-W342 WeakPolarHBondContact OD2-CB 3.33Å; D339-C343 PolarHBondContact O-N 3.38Å; D339-C343 VanDerWaalsContact O-N 3.1Å; D339-C343 PolarHBondContact O-SG 3.35Å; D339-K471 IonicContact OD2-NZ 2.94Å; D339-K471 PolarHBondContact OD2-NZ 3.09Å
340	Y	90.1	Very high	85.6	Confident	141 Å²	141	68.1 Å²	68.1	55%	0.553	31%	0.306	S	S	*	.	H	α-helix	trans	-61.8	-30.6	179.9	-67.6	-75.8	0	0	0	112.7	I328 I338 C343 L344	I328-Y340 HydrophobicContact CG2-CD1 4.38Å; I328-Y340 HydrophobicContact CG2-CE1 4.42Å; I338-Y340 HydrophobicContact CB-CE1 4.47Å; I338-Y340 HydrophobicContact CB-CE2 4.26Å; I338-Y340 HydrophobicContact CG2-CD1 4.11Å; I338-Y340 HydrophobicContact CG2-CE1 4.08Å; I338-Y340 HydrophobicContact CG2-CG 4.35Å; I338-Y340 PolarHBondContact O-N 2.97Å; Y340-C343 PolarHBondContact O-N 2.96Å; Y340-L344 WeakPolarHBondContact O-CB 3.34Å; Y340-L344 PolarHBondContact O-N 3.47Å
341	W	92.1	Very high	86.3	Confident	184 Å²	184	68.6 Å²	68.6	70%	0.697	31%	0.312	S	S	*	.	H	α-helix	trans	-66.4	-44.7	178.4	-176.9	-105	0	0	0	110.8	D339 L344 Q345	D339-W341 PolarHBondContact O-N 3.03Å; D339-W341 PolarHBondContact OD1-N 2.94Å; W341-L344 HydrophobicContact CZ3-CD2 4.46Å; W341-L344 PolarHBondContact O-N 3.36Å; W341-Q345 WeakPolarHBondContact O-CB 3.4Å; W341-Q345 PolarHBondContact O-N 3.47Å
342	W	93.2	Very high	87.1	Confident	22 Å²	22	68.2 Å²	68.2	8%	0.083	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-43	174.4	-172.6	-97.8	0	0	0	112.5	N69 D339 L344 Q345 H346 V466 K471 L475	N69-W342 PolarHBondContact OD1-NE1 2.85Å; D339-W342 HydrophobicContact CB-CB 3.99Å; D339-W342 VanDerWaalsContact CG-CB 3.44Å; D339-W342 PolarHBondContact O-N 2.97Å; D339-W342 PolarHBondContact OD1-N 2.94Å; D339-W342 WeakPolarHBondContact OD2-CB 3.33Å; W342-L344 VanDerWaalsContact C-N 3.33Å; W342-L344 PolarHBondContact O-N 3.17Å; W342-Q345 WeakPolarHBondContact O-CB 3.5Å; W342-Q345 PolarHBondContact O-N 3.43Å; W342-H346 WeakPolarHBondContact O-CB 3.35Å; W342-H346 PolarHBondContact O-N 3.34Å; W342-V466 HydrophobicContact CH2-CG2 3.61Å; W342-V466 HydrophobicContact CZ3-CG2 3.59Å; W342-K471 HydrophobicContact CD2-CD 3.71Å; W342-K471 HydrophobicContact CD2-CG 4.07Å; W342-K471 HydrophobicContact CE3-CD 4Å; W342-K471 HydrophobicContact CG-CD 4.16Å; W342-K471 HydrophobicContact CG-CG 4.4Å; W342-K471 HydrophobicContact CH2-CB 4.2Å; W342-K471 HydrophobicContact CH2-CD 4.37Å; W342-K471 HydrophobicContact CZ2-CB 3.54Å; W342-K471 HydrophobicContact CZ2-CD 4.09Å; W342-K471 HydrophobicContact CZ2-CG 3.91Å; W342-K471 HydrophobicContact CZ3-CD 4.31Å; W342-L475 HydrophobicContact CH2-CD1 3.99Å; W342-L475 HydrophobicContact CH2-CD2 4.17Å; W342-L475 HydrophobicContact CH2-CG 4.13Å; W342-L475 HydrophobicContact CZ2-CD1 4.35Å; W342-L475 HydrophobicContact CZ2-CD2 4.3Å; W342-L475 HydrophobicContact CZ2-CG 4.09Å
343	C	93.3	Very high	88.3	Confident	1 Å²	1	66 Å²	66	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-40.6	177.3	-62.7	0	0	0	0	111.8	Q66 I328 D339 Y340 H346 C347	Q66-C343 PolarHBondContact NE2-O 3.47Å; I328-C343 HydrophobicContact CD1-CB 3.91Å; I328-C343 HydrophobicContact CG1-CB 4.24Å; D339-C343 PolarHBondContact O-N 3.38Å; D339-C343 VanDerWaalsContact O-N 3.1Å; D339-C343 PolarHBondContact O-SG 3.35Å; Y340-C343 PolarHBondContact O-N 2.96Å; C343-H346 PolarHBondContact O-N 2.69Å; C343-C347 PolarHBondContact O-N 2.78Å; C343-C347 PolarHBondContact O-SG 3.4Å
344	L	93.3	Very high	89.7	Confident	100 Å²	100	63.7 Å²	63.7	52%	0.524	29%	0.286	S	S	.	.	H	α-helix	trans	-68.3	-40.5	176.7	-177.1	64.5	0	0	0	112	Y340 W341 W342 H346 C347 F348	Y340-L344 WeakPolarHBondContact O-CB 3.34Å; Y340-L344 PolarHBondContact O-N 3.47Å; W341-L344 HydrophobicContact CZ3-CD2 4.46Å; W341-L344 PolarHBondContact O-N 3.36Å; W342-L344 VanDerWaalsContact C-N 3.33Å; W342-L344 PolarHBondContact O-N 3.17Å; L344-H346 VanDerWaalsContact C-N 3.32Å; L344-H346 PolarHBondContact O-N 2.87Å; L344-C347 WeakPolarHBondContact O-CB 3.36Å; L344-C347 PolarHBondContact O-N 3.46Å; L344-F348 PolarHBondContact O-N 3.48Å
345	Q	94.2	Very high	91.1	Very high	26 Å²	26	56.7 Å²	56.7	12%	0.121	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-45.3	172.9	171.1	-179.3	-13.6	0	0	111.1	W341 W342 C347 F348 L349 Y458 C462	W341-Q345 WeakPolarHBondContact O-CB 3.4Å; W341-Q345 PolarHBondContact O-N 3.47Å; W342-Q345 WeakPolarHBondContact O-CB 3.5Å; W342-Q345 PolarHBondContact O-N 3.43Å; Q345-C347 PolarHBondContact O-N 2.81Å; Q345-F348 PolarHBondContact O-N 3.43Å; Q345-L349 WeakPolarHBondContact O-CB 3.35Å; Q345-L349 PolarHBondContact O-N 2.68Å; Q345-Y458 HydrophobicContact CG-CE1 4.02Å; Q345-Y458 WeakPolarHBondContact CG-OH 3.14Å; Q345-Y458 PolarHBondContact NE2-OH 2.85Å; Q345-C462 PolarHBondContact NE2-SG 2.98Å
346	H	95.3	Very high	92.4	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-39.6	175.7	176.1	-100	0	0	0	112.1	S62 T65 Q66 W342 C343 L344 F348 L349 T350 D478	S62-H346 PolarHBondContact O-CE1 3.02Å; S62-H346 VanDerWaalsContact O-CE1 3.22Å; T65-H346 PolarHBondContact OG1-CE1 3.47Å; T65-H346 VanDerWaalsContact OG1-CE1 3.22Å; T65-H346 PolarHBondContact OG1-NE2 2.93Å; Q66-H346 PolarHBondContact OE1-ND1 3.38Å; W342-H346 WeakPolarHBondContact O-CB 3.35Å; W342-H346 PolarHBondContact O-N 3.34Å; C343-H346 PolarHBondContact O-N 2.69Å; L344-H346 VanDerWaalsContact C-N 3.32Å; L344-H346 PolarHBondContact O-N 2.87Å; H346-F348 PolarHBondContact O-N 2.86Å; H346-L349 PolarHBondContact O-N 3.39Å; H346-T350 VanDerWaalsContact O-CB 3.27Å; H346-T350 WeakPolarHBondContact O-CB 3.04Å; H346-T350 PolarHBondContact O-N 2.85Å; H346-T350 PolarHBondContact O-OG1 3.12Å; H346-D478 IonicContact CD2-OD2 3.26Å; H346-D478 PolarHBondContact CD2-OD2 3Å; H346-D478 VanDerWaalsContact CD2-OD2 3.3Å; H346-D478 IonicContact NE2-OD2 3.03Å
347	C	95.2	Very high	93.2	Very high	10 Å²	10	46.9 Å²	46.9	7%	0.068	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-47.8	172	-63.7	0	0	0	0	112	V320 C324 C343 L344 Q345 G351	V320-C347 HydrophobicContact CG1-CB 4.21Å; C324-C347 HydrophobicContact CB-CB 4.03Å; C324-C347 WeakPolarHBondContact CB-SG 3.29Å; C343-C347 PolarHBondContact O-N 2.78Å; C343-C347 PolarHBondContact O-SG 3.4Å; L344-C347 WeakPolarHBondContact O-CB 3.36Å; L344-C347 PolarHBondContact O-N 3.46Å; Q345-C347 PolarHBondContact O-N 2.81Å; C347-G351 PolarHBondContact O-N 2.81Å
348	F	95.4	Very high	93.9	Very high	137 Å²	137	39 Å²	39	60%	0.601	18%	0.176	S	C	*	.	H	α-helix	trans	-66.1	-44.9	-178.5	-178.9	-98.7	0	0	0	111.8	L344 Q345 H346 G351 L352	L344-F348 PolarHBondContact O-N 3.48Å; Q345-F348 PolarHBondContact O-N 3.43Å; H346-F348 PolarHBondContact O-N 2.86Å; F348-G351 PolarHBondContact O-N 2.81Å; F348-L352 HydrophobicContact CE1-CD1 4.35Å; F348-L352 PolarHBondContact O-N 2.7Å
349	L	95.4	Very high	94.3	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-47.6	178.2	-178.2	59.2	0	0	0	111.4	Q345 H346 G351 L352 V353 Y458 Q459	Q345-L349 WeakPolarHBondContact O-CB 3.35Å; Q345-L349 PolarHBondContact O-N 2.68Å; H346-L349 PolarHBondContact O-N 3.39Å; L349-G351 VanDerWaalsContact C-N 3.3Å; L349-G351 PolarHBondContact O-N 2.93Å; L349-L352 WeakPolarHBondContact O-CB 3.4Å; L349-L352 PolarHBondContact O-N 3.44Å; L349-V353 HydrophobicContact CD1-CG2 4.47Å; L349-V353 VanDerWaalsContact O-CG2 3.32Å; L349-V353 WeakPolarHBondContact O-CG2 3.25Å; L349-V353 PolarHBondContact O-N 3.42Å; L349-Y458 HydrophobicContact CD1-CD1 4.43Å; L349-Q459 HydrophobicContact CD1-CG 4.22Å; L349-Q459 HydrophobicContact CD2-CG 3.78Å
350	T	95.6	Very high	94.5	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-56.8	-45.3	174.2	-63.5	0	0	0	0	110.8	S62 H346 L352 V353 V354	S62-T350 WeakPolarHBondContact OG-CG2 3.3Å; S62-T350 PolarHBondContact OG-OG1 2.8Å; H346-T350 VanDerWaalsContact O-CB 3.27Å; H346-T350 WeakPolarHBondContact O-CB 3.04Å; H346-T350 PolarHBondContact O-N 2.85Å; H346-T350 PolarHBondContact O-OG1 3.12Å; T350-L352 VanDerWaalsContact C-N 3.33Å; T350-L352 PolarHBondContact O-N 3.42Å; T350-V353 PolarHBondContact O-N 2.89Å; T350-V354 HydrophobicContact CG2-CG2 4.17Å; T350-V354 VanDerWaalsContact O-CG2 3.25Å; T350-V354 WeakPolarHBondContact O-CG2 3.27Å; T350-V354 PolarHBondContact O-N 3.17Å
351	G	95.8	Very high	94.4	Very high	14 Å²	14	31.5 Å²	31.5	14%	0.144	14%	0.143	C	C	.	.	H	α-helix	trans	-58.5	-43.4	177.1	0	0	0	0	0	113.2	C347 F348 L349 F355	C347-G351 PolarHBondContact O-N 2.81Å; F348-G351 PolarHBondContact O-N 2.81Å; L349-G351 VanDerWaalsContact C-N 3.3Å; L349-G351 PolarHBondContact O-N 2.93Å; G351-F355 VanDerWaalsContact O-CB 3.22Å; G351-F355 WeakPolarHBondContact O-CB 3.25Å; G351-F355 PolarHBondContact O-N 3.44Å
352	L	96.8	Very high	94.1	Very high	22 Å²	22	23.1 Å²	23.1	12%	0.115	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-46.6	176.6	-159.9	175	0	0	0	111.1	F348 L349 T350 F355 L356 S455	F348-L352 HydrophobicContact CE1-CD1 4.35Å; F348-L352 PolarHBondContact O-N 2.7Å; L349-L352 WeakPolarHBondContact O-CB 3.4Å; L349-L352 PolarHBondContact O-N 3.44Å; T350-L352 VanDerWaalsContact C-N 3.33Å; T350-L352 PolarHBondContact O-N 3.42Å; L352-F355 WeakPolarHBondContact O-CB 3.42Å; L352-F355 PolarHBondContact O-N 2.77Å; L352-L356 HydrophobicContact CD2-CD1 3.29Å; L352-L356 HydrophobicContact CD2-CG 3.75Å; L352-L356 WeakPolarHBondContact O-CG 3.29Å; L352-L356 PolarHBondContact O-N 3.45Å; L352-S455 WeakPolarHBondContact CD1-OG 3.46Å; L352-S455 WeakPolarHBondContact CD2-OG 3.46Å
353	V	96.9	Very high	93.9	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-44.8	179.3	175.4	0	0	0	0	111.8	L58 L349 T350 F355 L357 F481 C482 N485	L58-V353 HydrophobicContact CD1-CG1 3.79Å; L58-V353 HydrophobicContact CD2-CG1 3.85Å; L349-V353 HydrophobicContact CD1-CG2 4.47Å; L349-V353 VanDerWaalsContact O-CG2 3.32Å; L349-V353 WeakPolarHBondContact O-CG2 3.25Å; L349-V353 PolarHBondContact O-N 3.42Å; T350-V353 PolarHBondContact O-N 2.89Å; V353-F355 VanDerWaalsContact C-N 3.34Å; V353-L357 WeakPolarHBondContact O-CB 3.24Å; V353-L357 PolarHBondContact O-N 3.15Å; V353-L357 VanDerWaalsContact O-N 3.13Å; V353-F481 HydrophobicContact CG1-CB 3.59Å; V353-C482 WeakPolarHBondContact CG2-SG 3.22Å; V353-N485 PolarHBondContact O-ND2 3.47Å; V353-N485 VanDerWaalsContact O-ND2 3.1Å
354	V	95.5	Very high	93.6	Very high	6 Å²	6	23.2 Å²	23.2	4%	0.036	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-40.4	175.8	178.8	0	0	0	0	110.5	L58 T316 A319 T350 L357 R358	L58-V354 HydrophobicContact CD2-CB 4.27Å; L58-V354 HydrophobicContact CD2-CG2 3.48Å; L58-V354 VanDerWaalsContact CD2-CG2 3.48Å; L58-V354 HydrophobicContact CG-CG2 4.05Å; T316-V354 HydrophobicContact CG2-CB 4.42Å; T316-V354 HydrophobicContact CG2-CG1 3.98Å; A319-V354 HydrophobicContact CB-CB 4.5Å; A319-V354 HydrophobicContact CB-CG1 3.87Å; A319-V354 HydrophobicContact CB-CG2 4.04Å; T350-V354 HydrophobicContact CG2-CG2 4.17Å; T350-V354 VanDerWaalsContact O-CG2 3.25Å; T350-V354 WeakPolarHBondContact O-CG2 3.27Å; T350-V354 PolarHBondContact O-N 3.17Å; V354-L357 PolarHBondContact O-N 2.9Å; V354-R358 HydrophobicContact CG1-CG 4.24Å; V354-R358 WeakPolarHBondContact O-CB 3.36Å; V354-R358 WeakPolarHBondContact O-CG 3.32Å; V354-R358 PolarHBondContact O-N 2.8Å
355	F	96.2	Very high	93.3	Very high	43 Å²	43	19.2 Å²	19.2	19%	0.189	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-48.1	178.8	175.2	-95.2	0	0	0	111.8	I312 L313 T316 G351 L352 V353 L357 R358 W359	I312-F355 HydrophobicContact CG2-CD2 3.71Å; I312-F355 HydrophobicContact CG2-CE2 3.8Å; L313-F355 HydrophobicContact CD2-CD2 4.48Å; L313-F355 HydrophobicContact CD2-CE2 4.17Å; T316-F355 HydrophobicContact CG2-CB 3.65Å; T316-F355 HydrophobicContact CG2-CD2 4.1Å; T316-F355 HydrophobicContact CG2-CG 4.37Å; G351-F355 VanDerWaalsContact O-CB 3.22Å; G351-F355 WeakPolarHBondContact O-CB 3.25Å; G351-F355 PolarHBondContact O-N 3.44Å; L352-F355 WeakPolarHBondContact O-CB 3.42Å; L352-F355 PolarHBondContact O-N 2.77Å; V353-F355 VanDerWaalsContact C-N 3.34Å; F355-L357 VanDerWaalsContact C-N 3.32Å; F355-L357 PolarHBondContact O-N 3.44Å; F355-R358 PolarHBondContact O-N 3.33Å; F355-W359 HydrophobicContact CE1-CE3 4.13Å; F355-W359 HydrophobicContact CE2-CE3 4.2Å; F355-W359 AromaticContact CZ-CE3 3.56Å; F355-W359 HydrophobicContact CZ-CE3 3.56Å; F355-W359 AromaticContact CZ-CZ3 3.99Å; F355-W359 HydrophobicContact CZ-CZ3 3.99Å; F355-W359 VanDerWaalsContact O-CB 3.28Å; F355-W359 WeakPolarHBondContact O-CB 3Å; F355-W359 PolarHBondContact O-N 3.5Å
356	L	96.8	Very high	92.8	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-62.3	-39.9	178.1	-73.7	173.3	0	0	0	112.3	L352 H360 L448 L451 N485 H489	L352-L356 HydrophobicContact CD2-CD1 3.29Å; L352-L356 HydrophobicContact CD2-CG 3.75Å; L352-L356 WeakPolarHBondContact O-CG 3.29Å; L352-L356 PolarHBondContact O-N 3.45Å; L356-H360 PolarHBondContact O-N 3.08Å; L356-H360 VanDerWaalsContact O-N 3.1Å; L356-L448 HydrophobicContact CD2-CD2 4.16Å; L356-L451 HydrophobicContact CD2-CB 4.15Å; L356-N485 HydrophobicContact CB-CB 4.28Å; L356-N485 WeakPolarHBondContact CB-OD1 3.45Å; L356-N485 HydrophobicContact CD1-CB 4.34Å; L356-H489 PolarHBondContact O-NE2 3.14Å; L356-H489 VanDerWaalsContact O-NE2 3.07Å
357	L	94.9	Very high	92.4	Very high	3 Å²	3	19.2 Å²	19.2	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-68.5	-45.5	179.2	176.6	58.9	0	0	0	111.4	L46 F51 L54 L58 V353 V354 F355 H360 Y361 N485	L46-L357 HydrophobicContact CD2-CD1 4.27Å; F51-L357 HydrophobicContact CD2-CD1 4.42Å; F51-L357 HydrophobicContact CD2-CG 4.34Å; F51-L357 HydrophobicContact CE2-CG 4.13Å; L54-L357 HydrophobicContact CB-CD2 4.41Å; L54-L357 HydrophobicContact CD2-CD1 3.44Å; L54-L357 VanDerWaalsContact CD2-CD1 3.44Å; L54-L357 HydrophobicContact CD2-CD2 3.62Å; L54-L357 HydrophobicContact CD2-CG 4.18Å; L54-L357 HydrophobicContact CG-CD2 3.8Å; L58-L357 HydrophobicContact CD2-CD2 4.22Å; V353-L357 WeakPolarHBondContact O-CB 3.24Å; V353-L357 PolarHBondContact O-N 3.15Å; V353-L357 VanDerWaalsContact O-N 3.13Å; V354-L357 PolarHBondContact O-N 2.9Å; F355-L357 VanDerWaalsContact C-N 3.32Å; F355-L357 PolarHBondContact O-N 3.44Å; L357-H360 PolarHBondContact O-N 3.36Å; L357-Y361 PolarHBondContact O-N 3.06Å; L357-N485 WeakPolarHBondContact CA-OD1 3.4Å; L357-N485 PolarHBondContact N-OD1 2.94Å
358	R	91.9	Very high	92	Very high	30 Å²	30	19.2 Å²	19.2	11%	0.113	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-43.4	176.2	-76.3	-175.5	173.5	-88.2	-3.6	111.4	F51 I312 G315 V354 F355 H360 Y361 F362	F51-R358 HydrophobicContact CE2-CG 4.31Å; F51-R358 HydrophobicContact CZ-CG 4.05Å; I312-R358 HydrophobicContact CG1-CB 4.36Å; I312-R358 HydrophobicContact CG2-CB 4.01Å; G315-R358 VanDerWaalsContact C-NE 3.33Å; G315-R358 PolarHBondContact O-NE 2.81Å; V354-R358 HydrophobicContact CG1-CG 4.24Å; V354-R358 WeakPolarHBondContact O-CB 3.36Å; V354-R358 WeakPolarHBondContact O-CG 3.32Å; V354-R358 PolarHBondContact O-N 2.8Å; F355-R358 PolarHBondContact O-N 3.33Å; R358-H360 VanDerWaalsContact C-N 3.32Å; R358-H360 PolarHBondContact O-N 3.32Å; R358-Y361 PolarHBondContact O-N 3.28Å; R358-Y361 VanDerWaalsContact O-N 3.13Å; R358-F362 HydrophobicContact CB-CD2 4.27Å; R358-F362 HydrophobicContact CB-CE2 4.47Å; R358-F362 WeakPolarHBondContact O-CD2 3Å; R358-F362 PolarHBondContact O-N 3.37Å
359	W	93.7	Very high	91.6	Very high	20 Å²	20	13.3 Å²	13.3	8%	0.076	7%	0.069	C	C	.	.	H	α-helix	trans	-54.8	-49.6	175.6	-175.3	-69.9	0	0	0	111.2	L309 I312 F355 Y361 F362 L363 I444 L448	L309-W359 HydrophobicContact CD1-CE3 4.41Å; L309-W359 HydrophobicContact CD1-CZ3 3.76Å; I312-W359 HydrophobicContact CD1-CE3 4.29Å; F355-W359 HydrophobicContact CE1-CE3 4.13Å; F355-W359 HydrophobicContact CE2-CE3 4.2Å; F355-W359 AromaticContact CZ-CE3 3.56Å; F355-W359 HydrophobicContact CZ-CE3 3.56Å; F355-W359 AromaticContact CZ-CZ3 3.99Å; F355-W359 HydrophobicContact CZ-CZ3 3.99Å; F355-W359 VanDerWaalsContact O-CB 3.28Å; F355-W359 WeakPolarHBondContact O-CB 3Å; F355-W359 PolarHBondContact O-N 3.5Å; W359-Y361 PolarHBondContact O-N 2.86Å; W359-F362 PolarHBondContact O-N 3.48Å; W359-L363 HydrophobicContact CD2-CB 4.47Å; W359-L363 HydrophobicContact CD2-CD1 3.98Å; W359-L363 HydrophobicContact CE3-CD1 3.99Å; W359-L363 HydrophobicContact CH2-CD1 3.83Å; W359-L363 HydrophobicContact CZ2-CD1 3.78Å; W359-L363 HydrophobicContact CZ3-CD1 3.93Å; W359-L363 CarbonylContact O-C 3.39Å; W359-L363 WeakPolarHBondContact O-CA 3.31Å; W359-L363 PolarHBondContact O-N 3.18Å; W359-I444 HydrophobicContact CZ2-CG2 3.76Å; W359-L448 HydrophobicContact CD2-CD1 4.36Å; W359-L448 HydrophobicContact CD2-CD2 3.83Å; W359-L448 HydrophobicContact CE3-CD2 4.44Å; W359-L448 HydrophobicContact CG-CD1 4.27Å; W359-L448 HydrophobicContact CG-CD2 3.83Å; W359-L448 HydrophobicContact CZ2-CD1 4.26Å
360	H	92.4	Very high	91.1	Very high	13 Å²	13	14.1 Å²	14.1	6%	0.06	7%	0.074	C	C	.	.	H	α-helix	trans	-56.4	-36.8	179.7	-179.2	82.9	0	0	0	112.8	L356 L357 R358 N492	L356-H360 PolarHBondContact O-N 3.08Å; L356-H360 VanDerWaalsContact O-N 3.1Å; L357-H360 PolarHBondContact O-N 3.36Å; R358-H360 VanDerWaalsContact C-N 3.32Å; R358-H360 PolarHBondContact O-N 3.32Å; H360-N492 PolarHBondContact CE1-ND2 2.83Å; H360-N492 PolarHBondContact ND1-ND2 2.9Å
361	Y	89.5	Confident	90.8	Very high	11 Å²	11	13.9 Å²	13.9	4%	0.043	7%	0.073	C	C	.	.	H	α-helix	trans	-78.9	-48	-178.3	-177.6	-97.3	0	0	0	113.6	L46 R48 F51 P246 P248 L357 R358 W359	L46-Y361 HydrophobicContact CB-CD2 4.4Å; R48-Y361 WeakPolarHBondContact CA-OH 2.99Å; R48-Y361 WeakPolarHBondContact CB-OH 3.4Å; R48-Y361 WeakPolarHBondContact CG-OH 3.35Å; F51-Y361 HydrophobicContact CB-CD2 3.43Å; F51-Y361 VanDerWaalsContact CB-CD2 3.43Å; F51-Y361 HydrophobicContact CB-CE2 3.48Å; F51-Y361 VanDerWaalsContact CB-CE2 3.48Å; F51-Y361 HydrophobicContact CB-CG 4.12Å; F51-Y361 AromaticContact CD1-CD1 3.8Å; F51-Y361 HydrophobicContact CD1-CD1 3.8Å; F51-Y361 AromaticContact CD1-CD2 3.9Å; F51-Y361 HydrophobicContact CD1-CD2 3.9Å; F51-Y361 AromaticContact CD1-CE1 3.81Å; F51-Y361 HydrophobicContact CD1-CE1 3.81Å; F51-Y361 AromaticContact CD1-CE2 3.88Å; F51-Y361 HydrophobicContact CD1-CE2 3.88Å; F51-Y361 AromaticContact CD1-CG 3.82Å; F51-Y361 HydrophobicContact CD1-CG 3.82Å; F51-Y361 AromaticContact CD1-CZ 3.79Å; F51-Y361 HydrophobicContact CD2-CD1 4.23Å; F51-Y361 AromaticContact CD2-CD2 3.73Å; F51-Y361 HydrophobicContact CD2-CD2 3.73Å; F51-Y361 HydrophobicContact CD2-CE2 4.47Å; F51-Y361 AromaticContact CD2-CG 3.54Å; F51-Y361 HydrophobicContact CD2-CG 3.54Å; F51-Y361 AromaticContact CE1-CD1 3.82Å; F51-Y361 HydrophobicContact CE1-CD1 3.82Å; F51-Y361 HydrophobicContact CE1-CE1 4.04Å; F51-Y361 HydrophobicContact CE1-CG 4.11Å; F51-Y361 HydrophobicContact CE2-CD1 4.23Å; F51-Y361 HydrophobicContact CE2-CD2 4.48Å; F51-Y361 AromaticContact CE2-CG 3.85Å; F51-Y361 HydrophobicContact CE2-CG 3.85Å; F51-Y361 HydrophobicContact CG-CD1 4.01Å; F51-Y361 AromaticContact CG-CD2 3.37Å; F51-Y361 HydrophobicContact CG-CD2 3.37Å; F51-Y361 HydrophobicContact CG-CE1 4.3Å; F51-Y361 AromaticContact CG-CE2 3.68Å; F51-Y361 HydrophobicContact CG-CE2 3.68Å; F51-Y361 AromaticContact CG-CG 3.51Å; F51-Y361 HydrophobicContact CG-CG 3.51Å; F51-Y361 HydrophobicContact CZ-CD1 4.03Å; F51-Y361 HydrophobicContact CZ-CG 4.12Å; P246-Y361 HydrophobicContact CB-CD1 4.35Å; P246-Y361 HydrophobicContact CB-CE1 3.77Å; P246-Y361 HydrophobicContact CG-CE1 4.47Å; P246-Y361 WeakPolarHBondContact O-CE1 3.07Å; P246-Y361 PolarHBondContact O-OH 3.46Å; P248-Y361 HydrophobicContact CB-CE1 4.21Å; P248-Y361 HydrophobicContact CB-CE2 4.18Å; P248-Y361 WeakPolarHBondContact CD-OH 3.28Å; P248-Y361 HydrophobicContact CG-CE2 4.2Å; P248-Y361 VanDerWaalsContact CG-OH 3.32Å; P248-Y361 WeakPolarHBondContact CG-OH 3.26Å; L357-Y361 PolarHBondContact O-N 3.06Å; R358-Y361 PolarHBondContact O-N 3.28Å; R358-Y361 VanDerWaalsContact O-N 3.13Å; W359-Y361 PolarHBondContact O-N 2.86Å
362	F	85.8	Confident	90.5	Very high	7 Å²	7	13.7 Å²	13.7	3%	0.031	7%	0.068	C	C	.	.	H	α-helix	trans	-83.2	-31	-174.5	-75.9	-79.6	0	0	0	113.8	F51 P246 R308 D311 I312 R358 W359 P364	F51-F362 HydrophobicContact CZ-CE2 4.44Å; P246-F362 HydrophobicContact CB-CE1 3.58Å; P246-F362 HydrophobicContact CB-CE2 3.98Å; P246-F362 HydrophobicContact CB-CZ 3.23Å; P246-F362 HydrophobicContact CG-CZ 4.49Å; R308-F362 PolarHBondContact NH1-O 2.71Å; D311-F362 HydrophobicContact CB-CE1 4.35Å; D311-F362 HydrophobicContact CB-CZ 4.35Å; I312-F362 HydrophobicContact CD1-CB 3.88Å; I312-F362 HydrophobicContact CG1-CB 3.81Å; I312-F362 HydrophobicContact CG1-CD2 3.74Å; I312-F362 HydrophobicContact CG1-CG 4.05Å; R358-F362 HydrophobicContact CB-CD2 4.27Å; R358-F362 HydrophobicContact CB-CE2 4.47Å; R358-F362 WeakPolarHBondContact O-CD2 3Å; R358-F362 PolarHBondContact O-N 3.37Å; W359-F362 PolarHBondContact O-N 3.48Å; F362-P364 VanDerWaalsContact O-CD 3.32Å; F362-P364 WeakPolarHBondContact O-CD 3.28Å
363	L	88.9	Confident	90.1	Very high	3 Å²	3	14.6 Å²	14.6	2%	0.016	7%	0.07	C	C	.	.	S	Bend	trans	-121.5	69.2	-178.7	-66.9	172.7	0	0	0	110.2	F305 R308 I312 W359 Y367	F305-L363 HydrophobicContact CD2-CD1 4.47Å; F305-L363 HydrophobicContact CD2-CD2 3.82Å; F305-L363 HydrophobicContact CE2-CD1 3.91Å; F305-L363 HydrophobicContact CE2-CD2 4.02Å; R308-L363 HydrophobicContact CB-CD2 4.09Å; I312-L363 HydrophobicContact CD1-CD1 3.53Å; I312-L363 HydrophobicContact CD1-CG 3.84Å; W359-L363 HydrophobicContact CD2-CB 4.47Å; W359-L363 HydrophobicContact CD2-CD1 3.98Å; W359-L363 HydrophobicContact CE3-CD1 3.99Å; W359-L363 HydrophobicContact CH2-CD1 3.83Å; W359-L363 HydrophobicContact CZ2-CD1 3.78Å; W359-L363 HydrophobicContact CZ3-CD1 3.93Å; W359-L363 CarbonylContact O-C 3.39Å; W359-L363 WeakPolarHBondContact O-CA 3.31Å; W359-L363 PolarHBondContact O-N 3.18Å; L363-Y367 HydrophobicContact CD2-CD1 3.61Å; L363-Y367 HydrophobicContact CD2-CE1 3.46Å; L363-Y367 VanDerWaalsContact CD2-CE1 3.46Å
364	P	86.8	Confident	89.6	Confident	22 Å²	22	14.5 Å²	14.5	14%	0.143	7%	0.069	C	C	.	.			trans	-66.9	159.1	177.9	29.9	-35.8	0	0	0	111.6	F362 D366 Y367 I368	F362-P364 VanDerWaalsContact O-CD 3.32Å; F362-P364 WeakPolarHBondContact O-CD 3.28Å; P364-D366 VanDerWaalsContact C-N 3.3Å; P364-D366 PolarHBondContact O-N 3.31Å; P364-Y367 WeakPolarHBondContact O-CB 3.35Å; P364-Y367 PolarHBondContact O-N 2.91Å; P364-I368 PolarHBondContact O-N 3.19Å
365	C	87.2	Confident	89.4	Confident	16 Å²	16	14.2 Å²	14.2	11%	0.108	7%	0.067	C	C	.	.	H	α-helix	trans	-60.5	-35	-178.7	-68.6	0	0	0	0	114.1	F40 Y367 I368 D369 N492 V496	F40-C365 HydrophobicContact CE1-CB 4.46Å; F40-C365 HydrophobicContact CZ-CB 4.08Å; C365-Y367 PolarHBondContact O-N 3.19Å; C365-I368 CarbonylContact O-C 3.5Å; C365-I368 PolarHBondContact O-N 2.58Å; C365-I368 VanDerWaalsContact O-N 3.1Å; C365-D369 PolarHBondContact O-N 2.78Å; C365-N492 WeakPolarHBondContact SG-CB 3.3Å; C365-N492 PolarHBondContact SG-ND2 2.83Å; C365-N492 VanDerWaalsContact SG-ND2 3.38Å; C365-V496 HydrophobicContact CB-CG2 4.27Å
366	D	83.8	Confident	88.9	Confident	33 Å²	33	13 Å²	13	18%	0.176	6%	0.062	C	C	.	.	H	α-helix	trans	-59.2	-34.9	175.4	-47.8	-15.5	0	0	0	111.8	F40 V43 K45 P364 D369 L370	F40-D366 WeakPolarHBondContact CD1-OD1 3.32Å; F40-D366 WeakPolarHBondContact CE1-OD1 3.28Å; V43-D366 WeakPolarHBondContact CG2-OD1 3.49Å; K45-D366 WeakPolarHBondContact CE-OD2 3.14Å; K45-D366 IonicContact NZ-OD2 3.75Å; K45-D366 PolarHBondContact NZ-OD2 3.26Å; P364-D366 VanDerWaalsContact C-N 3.3Å; P364-D366 PolarHBondContact O-N 3.31Å; D366-D369 PolarHBondContact O-N 2.8Å; D366-L370 PolarHBondContact O-N 3.44Å
367	Y	85	Confident	88.4	Confident	1 Å²	1	13.7 Å²	13.7	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-73.2	-37.5	177.4	178.8	-108.6	0	0	0	111.3	F251 Y301 D304 F305 L363 P364 C365 D369 L370 L371	F251-Y367 HydrophobicContact CE1-CD2 4.23Å; F251-Y367 HydrophobicContact CE1-CE2 4.46Å; F251-Y367 AromaticContact CE2-CD2 3.55Å; F251-Y367 HydrophobicContact CE2-CD2 3.55Å; F251-Y367 HydrophobicContact CE2-CE2 4.24Å; F251-Y367 HydrophobicContact CE2-CG 4.32Å; F251-Y367 AromaticContact CZ-CD2 3.28Å; F251-Y367 HydrophobicContact CZ-CD2 3.28Å; F251-Y367 AromaticContact CZ-CE2 3.59Å; F251-Y367 HydrophobicContact CZ-CE2 3.59Å; F251-Y367 HydrophobicContact CZ-CG 4.41Å; Y301-Y367 HydrophobicContact CD1-CE2 4.15Å; Y301-Y367 HydrophobicContact CE1-CE2 4.44Å; D304-Y367 WeakPolarHBondContact OD2-CE2 3.25Å; D304-Y367 VanDerWaalsContact OD2-CZ 3.27Å; D304-Y367 PolarHBondContact OD2-OH 3.46Å; F305-Y367 HydrophobicContact CD2-CE1 4.15Å; F305-Y367 PolarHBondContact N-OH 3.41Å; L363-Y367 HydrophobicContact CD2-CD1 3.61Å; L363-Y367 HydrophobicContact CD2-CE1 3.46Å; L363-Y367 VanDerWaalsContact CD2-CE1 3.46Å; P364-Y367 WeakPolarHBondContact O-CB 3.35Å; P364-Y367 PolarHBondContact O-N 2.91Å; C365-Y367 PolarHBondContact O-N 3.19Å; Y367-D369 VanDerWaalsContact C-N 3.31Å; Y367-L370 HydrophobicContact CD2-CD2 4.44Å; Y367-L370 WeakPolarHBondContact O-CB 3.09Å; Y367-L370 PolarHBondContact O-N 2.62Å; Y367-L371 HydrophobicContact CD1-CD1 3.92Å; Y367-L371 HydrophobicContact CE1-CD1 3.53Å; Y367-L371 HydrophobicContact CE1-CG 4.19Å; Y367-L371 WeakPolarHBondContact O-CG 3.46Å; Y367-L371 PolarHBondContact O-N 3.44Å
368	I	88.7	Confident	88.1	Confident	11 Å²	11	13.6 Å²	13.6	6%	0.056	7%	0.065	C	C	.	.	H	α-helix	trans	-65.5	-36.6	172.5	-56.7	-56.6	0	0	0	111.1	P364 C365 L371 H372 P441 I444	P364-I368 PolarHBondContact O-N 3.19Å; C365-I368 CarbonylContact O-C 3.5Å; C365-I368 PolarHBondContact O-N 2.58Å; C365-I368 VanDerWaalsContact O-N 3.1Å; I368-L371 HydrophobicContact CD1-CD1 4.22Å; I368-L371 PolarHBondContact O-N 3.3Å; I368-H372 WeakPolarHBondContact O-CB 3.42Å; I368-H372 PolarHBondContact O-N 3Å; I368-P441 HydrophobicContact CG2-CB 3.86Å; I368-I444 HydrophobicContact CD1-CD1 4.47Å; I368-I444 HydrophobicContact CG2-CD1 4.15Å
369	D	86.3	Confident	88	Confident	12 Å²	12	12.1 Å²	12.1	6%	0.064	6%	0.06	C	C	.	.	H	α-helix	trans	-61.2	-44.7	171.4	171.6	64.6	0	0	0	111.3	F40 C365 D366 Y367 L371 H372 R373 Y500	F40-D369 WeakPolarHBondContact CB-OD2 3.25Å; F40-D369 HydrophobicContact CD2-CB 3.91Å; F40-D369 HydrophobicContact CE2-CB 4.28Å; F40-D369 HydrophobicContact CG-CB 4.21Å; C365-D369 PolarHBondContact O-N 2.78Å; D366-D369 PolarHBondContact O-N 2.8Å; Y367-D369 VanDerWaalsContact C-N 3.31Å; D369-L371 PolarHBondContact O-N 2.93Å; D369-H372 WeakPolarHBondContact O-CB 3.32Å; D369-H372 PolarHBondContact O-N 3.11Å; D369-R373 WeakPolarHBondContact O-CG 3.42Å; D369-R373 PolarHBondContact O-N 3.26Å; D369-R373 IonicContact OD1-CZ 3.47Å; D369-R373 IonicContact OD1-NE 2.78Å; D369-R373 PolarHBondContact OD1-NE 2.96Å; D369-R373 IonicContact OD1-NH2 3.23Å; D369-R373 PolarHBondContact OD1-NH2 3.32Å; D369-R373 IonicContact OD2-CZ 3.03Å; D369-R373 VanDerWaalsContact OD2-CZ 3.23Å; D369-R373 IonicContact OD2-NE 3.76Å; D369-R373 PolarHBondContact OD2-NE 3.46Å; D369-R373 IonicContact OD2-NH2 2.85Å; D369-R373 PolarHBondContact OD2-NH2 3.12Å; D369-Y500 WeakPolarHBondContact CA-OH 3.32Å; D369-Y500 WeakPolarHBondContact CB-OH 2.93Å; D369-Y500 PolarHBondContact OD1-OH 3.24Å
370	L	85	Confident	87.9	Confident	22 Å²	22	11.2 Å²	11.2	12%	0.115	6%	0.056	C	C	.	.	H	α-helix	trans	-58.2	-47.4	175.5	-177.6	60.6	0	0	0	112.3	F251 H284 Y301 D366 Y367 H372 R373 I374	F251-L370 HydrophobicContact CD1-CD2 4.01Å; F251-L370 HydrophobicContact CE1-CD2 3.68Å; F251-L370 HydrophobicContact CZ-CD2 4.31Å; H284-L370 HydrophobicContact CB-CD1 3.51Å; Y301-L370 HydrophobicContact CD1-CD2 4.42Å; Y301-L370 HydrophobicContact CE1-CD2 3.43Å; Y301-L370 VanDerWaalsContact CE1-CD2 3.43Å; Y301-L370 HydrophobicContact CE1-CG 3.97Å; D366-L370 PolarHBondContact O-N 3.44Å; Y367-L370 HydrophobicContact CD2-CD2 4.44Å; Y367-L370 WeakPolarHBondContact O-CB 3.09Å; Y367-L370 PolarHBondContact O-N 2.62Å; L370-H372 VanDerWaalsContact C-N 3.3Å; L370-H372 PolarHBondContact O-N 3.36Å; L370-R373 PolarHBondContact O-N 3Å; L370-I374 HydrophobicContact CD1-CD1 4.3Å; L370-I374 HydrophobicContact CG-CD1 4.14Å; L370-I374 WeakPolarHBondContact O-CD1 3.34Å; L370-I374 WeakPolarHBondContact O-CG1 3.23Å; L370-I374 PolarHBondContact O-N 2.85Å; L370-I374 VanDerWaalsContact O-N 3.11Å
371	L	89.5	Confident	87.8	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.5	-39	176.1	-68	172.8	0	0	0	112.1	Y301 F305 Y367 I368 D369 I374 S375 F434 F438	Y301-L371 HydrophobicContact CD1-CD2 4.21Å; Y301-L371 HydrophobicContact CG-CD2 4.29Å; F305-L371 HydrophobicContact CB-CD1 4.5Å; F305-L371 HydrophobicContact CD2-CD1 3.78Å; F305-L371 HydrophobicContact CE2-CD1 4.48Å; F305-L371 HydrophobicContact CG-CD1 4.42Å; Y367-L371 HydrophobicContact CD1-CD1 3.92Å; Y367-L371 HydrophobicContact CE1-CD1 3.53Å; Y367-L371 HydrophobicContact CE1-CG 4.19Å; Y367-L371 WeakPolarHBondContact O-CG 3.46Å; Y367-L371 PolarHBondContact O-N 3.44Å; I368-L371 HydrophobicContact CD1-CD1 4.22Å; I368-L371 PolarHBondContact O-N 3.3Å; D369-L371 PolarHBondContact O-N 2.93Å; L371-I374 PolarHBondContact O-N 3.12Å; L371-S375 WeakPolarHBondContact O-CB 3.4Å; L371-S375 PolarHBondContact O-N 2.93Å; L371-F434 HydrophobicContact CD2-CE2 4.03Å; L371-F434 HydrophobicContact CD2-CZ 3.86Å; L371-F438 HydrophobicContact CB-CB 4.42Å; L371-F438 HydrophobicContact CB-CD1 3.78Å; L371-F438 HydrophobicContact CB-CD2 4.34Å; L371-F438 HydrophobicContact CB-CE1 4.12Å; L371-F438 HydrophobicContact CB-CG 3.93Å; L371-F438 HydrophobicContact CD1-CD1 4.07Å; L371-F438 HydrophobicContact CD1-CE1 3.51Å; L371-F438 HydrophobicContact CD1-CE2 4.34Å; L371-F438 HydrophobicContact CD1-CZ 3.68Å; L371-F438 HydrophobicContact CG-CE1 4.42Å
372	H	89.6	Confident	87.8	Confident	9 Å²	9	16 Å²	16	4%	0.042	8%	0.078	C	C	.	.	H	α-helix	trans	-62.3	-48.5	174.6	171.3	61.8	0	0	0	111.8	I368 D369 L370 I374 S375 M376 F438 D439 P441 Y500 E503	I368-H372 WeakPolarHBondContact O-CB 3.42Å; I368-H372 PolarHBondContact O-N 3Å; D369-H372 WeakPolarHBondContact O-CB 3.32Å; D369-H372 PolarHBondContact O-N 3.11Å; L370-H372 VanDerWaalsContact C-N 3.3Å; L370-H372 PolarHBondContact O-N 3.36Å; H372-I374 VanDerWaalsContact C-N 3.31Å; H372-I374 PolarHBondContact O-N 3.32Å; H372-S375 WeakPolarHBondContact CA-OG 3.4Å; H372-S375 WeakPolarHBondContact O-CB 3.39Å; H372-S375 PolarHBondContact O-N 2.75Å; H372-S375 VanDerWaalsContact O-N 3.07Å; H372-S375 PolarHBondContact O-OG 3.34Å; H372-M376 WeakPolarHBondContact O-CG 3.27Å; H372-M376 PolarHBondContact O-N 2.88Å; H372-F438 WeakPolarHBondContact CA-O 3.4Å; H372-F438 WeakPolarHBondContact CB-O 3.43Å; H372-F438 PolarHBondContact ND1-O 3.22Å; H372-D439 PolarHBondContact CE1-O 3.1Å; H372-D439 PolarHBondContact ND1-O 3.42Å; H372-D439 VanDerWaalsContact ND1-O 3.12Å; H372-P441 HydrophobicContact CB-CB 4.36Å; H372-P441 HydrophobicContact CB-CG 4.13Å; H372-Y500 AromaticContact CD2-CE1 3.39Å; H372-Y500 WeakPolarHBondContact CD2-CE1 3.3Å; H372-Y500 AromaticContact CD2-CZ 3.76Å; H372-Y500 AromaticContact NE2-CE1 3.6Å; H372-E503 IonicContact NE2-OE2 3.41Å
373	R	87.1	Confident	87.8	Confident	42 Å²	42	21.1 Å²	21.1	16%	0.158	11%	0.106	C	C	.	.	H	α-helix	trans	-55.9	-45.4	177.5	-65.8	173.8	-168.4	-96.5	-12.4	112.2	H37 C38 D369 L370 S375 M376 H377	H37-R373 WeakPolarHBondContact ND1-CG 3.33Å; C38-R373 PolarHBondContact O-NH1 2.96Å; C38-R373 PolarHBondContact O-NH2 3.42Å; D369-R373 WeakPolarHBondContact O-CG 3.42Å; D369-R373 PolarHBondContact O-N 3.26Å; D369-R373 IonicContact OD1-CZ 3.47Å; D369-R373 IonicContact OD1-NE 2.78Å; D369-R373 PolarHBondContact OD1-NE 2.96Å; D369-R373 IonicContact OD1-NH2 3.23Å; D369-R373 PolarHBondContact OD1-NH2 3.32Å; D369-R373 IonicContact OD2-CZ 3.03Å; D369-R373 VanDerWaalsContact OD2-CZ 3.23Å; D369-R373 IonicContact OD2-NE 3.76Å; D369-R373 PolarHBondContact OD2-NE 3.46Å; D369-R373 IonicContact OD2-NH2 2.85Å; D369-R373 PolarHBondContact OD2-NH2 3.12Å; L370-R373 PolarHBondContact O-N 3Å; R373-S375 VanDerWaalsContact C-N 3.34Å; R373-M376 WeakPolarHBondContact O-CB 3.44Å; R373-M376 PolarHBondContact O-N 2.91Å; R373-H377 PolarHBondContact O-CD2 2.91Å
374	I	86.8	Confident	87.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-43.1	177.6	-64.5	160.5	0	0	0	110.2	H284 E297 V298 Y301 L370 L371 H372 M376 H377 L378 F434	H284-I374 HydrophobicContact CB-CG1 4.14Å; H284-I374 WeakPolarHBondContact ND1-CG1 3.41Å; E297-I374 HydrophobicContact CG-CD1 4.45Å; V298-I374 HydrophobicContact CB-CG2 4.45Å; V298-I374 HydrophobicContact CG2-CG2 3.38Å; Y301-I374 HydrophobicContact CD1-CD1 4.13Å; Y301-I374 HydrophobicContact CD2-CD1 3.3Å; Y301-I374 HydrophobicContact CE1-CD1 4.18Å; Y301-I374 HydrophobicContact CE2-CD1 3.34Å; Y301-I374 HydrophobicContact CG-CD1 3.68Å; L370-I374 HydrophobicContact CD1-CD1 4.3Å; L370-I374 HydrophobicContact CG-CD1 4.14Å; L370-I374 WeakPolarHBondContact O-CD1 3.34Å; L370-I374 WeakPolarHBondContact O-CG1 3.23Å; L370-I374 PolarHBondContact O-N 2.85Å; L370-I374 VanDerWaalsContact O-N 3.11Å; L371-I374 PolarHBondContact O-N 3.12Å; H372-I374 VanDerWaalsContact C-N 3.31Å; H372-I374 PolarHBondContact O-N 3.32Å; I374-M376 PolarHBondContact O-N 3.4Å; I374-H377 PolarHBondContact O-N 2.79Å; I374-H377 VanDerWaalsContact O-N 3.15Å; I374-L378 PolarHBondContact O-N 3.45Å; I374-L378 VanDerWaalsContact O-N 3.08Å; I374-F434 HydrophobicContact CG2-CE1 4.14Å; I374-F434 HydrophobicContact CG2-CZ 4.41Å
375	S	90.5	Very high	86.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-36.5	177.6	80.9	0	0	0	0	112.5	L371 H372 R373 H377 L378 G379 Y435 F438	L371-S375 WeakPolarHBondContact O-CB 3.4Å; L371-S375 PolarHBondContact O-N 2.93Å; H372-S375 WeakPolarHBondContact CA-OG 3.4Å; H372-S375 WeakPolarHBondContact O-CB 3.39Å; H372-S375 PolarHBondContact O-N 2.75Å; H372-S375 VanDerWaalsContact O-N 3.07Å; H372-S375 PolarHBondContact O-OG 3.34Å; R373-S375 VanDerWaalsContact C-N 3.34Å; S375-H377 VanDerWaalsContact C-N 3.3Å; S375-H377 PolarHBondContact O-N 2.83Å; S375-L378 PolarHBondContact O-N 3.45Å; S375-G379 PolarHBondContact O-N 3.35Å; S375-G379 VanDerWaalsContact O-N 3.1Å; S375-Y435 VanDerWaalsContact O-CD2 3.31Å; S375-Y435 WeakPolarHBondContact O-CD2 3.38Å; S375-F438 PolarHBondContact OG-O 3.36Å
376	M	86.5	Confident	85	Confident	16 Å²	16	32.6 Å²	32.6	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-27.5	178.6	-69.9	-63.3	-72.2	0	0	113.9	V35 H372 R373 I374 I420	V35-M376 HydrophobicContact CG1-CB 4.01Å; H372-M376 WeakPolarHBondContact O-CG 3.27Å; H372-M376 PolarHBondContact O-N 2.88Å; R373-M376 WeakPolarHBondContact O-CB 3.44Å; R373-M376 PolarHBondContact O-N 2.91Å; I374-M376 PolarHBondContact O-N 3.4Å; M376-I420 HydrophobicContact CE-CD1 3.35Å; M376-I420 HydrophobicContact CE-CG1 3.88Å
377	H	86.2	Confident	83.6	Confident	17 Å²	17	42.3 Å²	42.3	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-86.2	-28.3	173.4	-68.5	-84.9	0	0	0	113.2	H37 H284 I294 R373 I374 S375 C423	H37-H377 AromaticContact CE1-CD2 3.93Å; H37-H377 AromaticContact CE1-NE2 3.43Å; H37-H377 PolarHBondContact CE1-NE2 2.87Å; H37-H377 AromaticContact NE2-CE1 3.86Å; H37-H377 AromaticContact NE2-NE2 3.16Å; H37-H377 PolarHBondContact NE2-NE2 3.17Å; H37-H377 VanDerWaalsContact NE2-NE2 3.16Å; H284-H377 AromaticContact CE1-CD2 3.29Å; H284-H377 PolarHBondContact CE1-CD2 3.4Å; H284-H377 AromaticContact CE1-NE2 3.59Å; H284-H377 AromaticContact NE2-CD2 2.96Å; H284-H377 PolarHBondContact NE2-CD2 3.23Å; H284-H377 AromaticContact NE2-NE2 2.9Å; H284-H377 PolarHBondContact NE2-NE2 3.39Å; I294-H377 HydrophobicContact CD1-CB 4.26Å; I294-H377 HydrophobicContact CG2-CB 4.16Å; R373-H377 PolarHBondContact O-CD2 2.91Å; I374-H377 PolarHBondContact O-N 2.79Å; I374-H377 VanDerWaalsContact O-N 3.15Å; S375-H377 VanDerWaalsContact C-N 3.3Å; S375-H377 PolarHBondContact O-N 2.83Å; H377-C423 PolarHBondContact O-SG 3.32Å
378	L	89.5	Confident	82.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-50.4	178.1	-179.5	63.6	0	0	0	111.6	V298 I374 S375 N422 C423 A424 H431 F434	V298-L378 HydrophobicContact CB-CD2 4.4Å; V298-L378 HydrophobicContact CG1-CD2 3.76Å; V298-L378 HydrophobicContact CG2-CB 4.05Å; V298-L378 HydrophobicContact CG2-CD1 4.08Å; V298-L378 HydrophobicContact CG2-CD2 3.85Å; V298-L378 HydrophobicContact CG2-CG 4.19Å; I374-L378 PolarHBondContact O-N 3.45Å; I374-L378 VanDerWaalsContact O-N 3.08Å; S375-L378 PolarHBondContact O-N 3.45Å; L378-N422 CarbonylContact O-C 3.55Å; L378-N422 WeakPolarHBondContact O-CA 3.16Å; L378-N422 PolarHBondContact O-OD1 2.81Å; L378-N422 VanDerWaalsContact O-OD1 3.09Å; L378-C423 PolarHBondContact O-N 3.43Å; L378-A424 HydrophobicContact CD1-CB 3.97Å; L378-A424 HydrophobicContact CG-CB 4.2Å; L378-A424 PolarHBondContact O-N 2.79Å; L378-H431 HydrophobicContact CD1-CB 4.37Å; L378-H431 HydrophobicContact CD2-CB 3.98Å; L378-H431 HydrophobicContact CG-CB 4.46Å; L378-F434 HydrophobicContact CD2-CB 4.45Å; L378-F434 HydrophobicContact CD2-CD1 3.89Å
379	G	89.5	Confident	80.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.			trans	65.9	-169.3	-171.3	0	0	0	0	0	113.7	S375 V418 Y435	S375-G379 PolarHBondContact O-N 3.35Å; S375-G379 VanDerWaalsContact O-N 3.1Å; G379-V418 CarbonylContact C-O 3.58Å; G379-V418 WeakPolarHBondContact CA-O 3.45Å; G379-Y435 WeakPolarHBondContact O-CB 3.39Å
380	S	91.4	Very high	79	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	168.2	179.4	-176.3	0	0	0	0	111.6	V418 N422 S432	S380-V418 PolarHBondContact N-O 3.05Å; S380-V418 PolarHBondContact O-N 3.07Å; S380-N422 PolarHBondContact N-OD1 3.35Å; S380-N422 PolarHBondContact O-ND2 3.32Å; S380-S432 PolarHBondContact OG-OG 3.44Å; S380-S432 VanDerWaalsContact OG-OG 3.09Å
381	W	90.9	Very high	77.6	Confident	20 Å²	20	63.9 Å²	63.9	8%	0.076	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.5	176.4	-68	100.7	0	0	0	110.7	W396 Y402 V408 F415 R416 N422 A424 P426	W381-W396 AromaticContact CZ2-CD1 3.82Å; W381-Y402 HydrophobicContact CH2-CD1 4.48Å; W381-Y402 AromaticContact CH2-CD2 3.83Å; W381-Y402 HydrophobicContact CH2-CD2 3.83Å; W381-Y402 HydrophobicContact CH2-CE2 4.37Å; W381-Y402 AromaticContact CH2-CG 3.87Å; W381-Y402 HydrophobicContact CH2-CG 3.87Å; W381-Y402 AromaticContact CZ2-CD2 3.75Å; W381-Y402 HydrophobicContact CZ2-CD2 3.75Å; W381-Y402 HydrophobicContact CZ2-CE2 4.23Å; W381-Y402 HydrophobicContact CZ2-CG 4.25Å; W381-V408 HydrophobicContact CH2-CB 3.86Å; W381-V408 HydrophobicContact CH2-CG2 3.5Å; W381-V408 HydrophobicContact CZ3-CB 3.88Å; W381-V408 HydrophobicContact CZ3-CG2 3.79Å; W381-F415 HydrophobicContact CB-CB 4.16Å; W381-F415 HydrophobicContact CB-CD1 4.08Å; W381-F415 HydrophobicContact CB-CG 4.47Å; W381-F415 HydrophobicContact CD2-CB 4.11Å; W381-F415 HydrophobicContact CE3-CB 3.64Å; W381-F415 HydrophobicContact CG-CB 4.38Å; W381-F415 HydrophobicContact CZ3-CB 4.43Å; W381-R416 WeakPolarHBondContact CA-O 3.41Å; W381-R416 VanDerWaalsContact CE3-C 3.49Å; W381-N422 WeakPolarHBondContact CH2-ND2 3.45Å; W381-N422 WeakPolarHBondContact CZ2-ND2 3.36Å; W381-N422 PolarHBondContact NE1-ND2 2.98Å; W381-A424 PolarHBondContact NE1-O 3.18Å; W381-P426 HydrophobicContact CB-CB 4.41Å; W381-P426 HydrophobicContact CD2-CB 4.05Å; W381-P426 HydrophobicContact CG-CB 3.84Å
382	E	87.7	Confident	76.5	Confident	105 Å²	105	67 Å²	67	49%	0.491	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.3	172.9	-175.9	178.7	-161	0	0	110.4	S384 F415 R416 V418	E382-S384 PolarHBondContact O-N 3.47Å; E382-F415 CarbonylContact O-C 3.59Å; E382-F415 WeakPolarHBondContact O-CA 3.46Å; E382-R416 PolarHBondContact N-O 2.97Å; E382-R416 PolarHBondContact O-N 3.5Å; E382-R416 IonicContact OE2-NH1 3.05Å; E382-V418 HydrophobicContact CB-CG2 3.85Å
383	N	86.7	Confident	75.5	Confident	114 Å²	114	67.9 Å²	67.9	61%	0.61	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	107.8	174.2	-69.6	-34.2	0	0	0	109.7	L385 F415	N383-L385 PolarHBondContact O-N 3.49Å; N383-F415 WeakPolarHBondContact OD1-CD1 3.37Å; N383-F415 WeakPolarHBondContact OD1-CE1 3.48Å
384	S	75.9	Confident	75.2	Confident	28 Å²	28	68.4 Å²	68.4	20%	0.196	36%	0.359	C	S	.	.			trans	-78.7	109.2	172.6	55.8	0	0	0	0	109.7	E382 T386 L414	E382-S384 PolarHBondContact O-N 3.47Å; S384-T386 PolarHBondContact O-N 3.12Å; S384-L414 PolarHBondContact N-O 3.47Å; S384-L414 VanDerWaalsContact N-O 3.14Å; S384-L414 VanDerWaalsContact OG-CB 3.31Å; S384-L414 WeakPolarHBondContact OG-CB 3.43Å; S384-L414 PolarHBondContact OG-O 3.02Å; S384-L414 VanDerWaalsContact OG-O 3.04Å
385	L	66.1	Low	75.1	Confident	169 Å²	169	72.6 Å²	72.6	89%	0.885	39%	0.388	S	S	*	.			trans	-71	-12.9	178.4	-72.6	164.1	0	0	0	113.7	N383 R387	N383-L385 PolarHBondContact O-N 3.49Å; L385-R387 VanDerWaalsContact C-N 3.28Å; L385-R387 PolarHBondContact O-N 3.46Å
386	T	61.8	Low	75	Confident	85 Å²	85	75.1 Å²	75.1	52%	0.521	40%	0.398	S	S	.	.			trans	-72.4	81.8	-178.2	53.9	0	0	0	0	111	S384 S388	S384-T386 PolarHBondContact O-N 3.12Å; T386-S388 PolarHBondContact O-N 3.39Å
387	R	55.6	Low	75	Confident	238 Å²	238	76.4 Å²	76.4	90%	0.898	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.4	179.9	-160.8	178.7	-171.4	-174.7	3.2	113.6	L385	L385-R387 VanDerWaalsContact C-N 3.28Å; L385-R387 PolarHBondContact O-N 3.46Å
388	S	52.5	Low	74.9	Confident	123 Å²	123	77.3 Å²	77.3	86%	0.86	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	0.4	-163.4	39.7	0	0	0	0	116.3	T386	T386-S388 PolarHBondContact O-N 3.39Å
389	G	54.1	Low	74.7	Confident	46 Å²	46	81 Å²	81	47%	0.474	45%	0.445	S	S	.	.	S	Bend	trans	-112.9	-21.8	-162.2	0	0	0	0	0	120.2
390	Y	56.1	Low	74.5	Confident	152 Å²	152	82.8 Å²	82.8	60%	0.596	46%	0.456	S	S	*	.			trans	-139.9	82.6	-165.1	-57.7	-79.3	0	0	0	113.6	N392	Y390-N392 PolarHBondContact O-N 3.08Å
391	L	56.6	Low	74.2	Confident	177 Å²	177	85 Å²	85	93%	0.927	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.7	167.3	-79.2	153.9	0	0	0	113.1
392	N	64.6	Low	74	Confident	66 Å²	66	84.3 Å²	84.3	35%	0.353	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	27.1	-174.2	-59.5	-3.5	0	0	0	113.7	T21 Y390 I394	T21-N392 PolarHBondContact OG1-ND2 3.36Å; Y390-N392 PolarHBondContact O-N 3.08Å; N392-I394 PolarHBondContact O-N 2.93Å
393	A	69.5	Low	74	Confident	28 Å²	28	79.9 Å²	79.9	23%	0.231	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-65.5	133.5	174.7	0	0	0	0	0	111	K409 L414	A393-K409 HydrophobicContact CB-CB 4.29Å; A393-L414 HydrophobicContact CB-CD2 3.65Å
394	I	81.1	Confident	73.9	Confident	53 Å²	53	77.7 Å²	77.7	27%	0.272	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	146.6	178.3	-54.4	162.4	0	0	0	109.5	C25 N392 V408 K409	C25-I394 HydrophobicContact CB-CD1 3.6Å; C25-I394 HydrophobicContact CB-CG1 4.4Å; C25-I394 WeakPolarHBondContact SG-CD1 3.34Å; N392-I394 PolarHBondContact O-N 2.93Å; I394-V408 CarbonylContact O-C 3.59Å; I394-V408 WeakPolarHBondContact O-CA 3.35Å; I394-V408 WeakPolarHBondContact O-CG1 3.36Å; I394-K409 PolarHBondContact O-N 3.43Å
395	S	84.9	Confident	74.3	Confident	87 Å²	87	77.8 Å²	77.8	61%	0.608	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	137.6	169	52.6	0	0	0	0	111.3	S397	S395-S397 PolarHBondContact O-N 3.11Å
396	W	87	Confident	75.2	Confident	53 Å²	53	70.3 Å²	70.3	20%	0.201	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-61.1	139	175.2	-177.2	77.3	0	0	0	111.6	W381 A398 Y402 V408 K409 H410 E425 P426	W381-W396 AromaticContact CZ2-CD1 3.82Å; W396-A398 HydrophobicContact CH2-CB 3.74Å; W396-A398 HydrophobicContact CZ2-CB 4.26Å; W396-A398 HydrophobicContact CZ3-CB 4.16Å; W396-Y402 AromaticContact CD1-CE2 3.69Å; W396-Y402 AromaticContact NE1-CE2 3.99Å; W396-V408 HydrophobicContact CB-CG1 3.36Å; W396-V408 HydrophobicContact CG-CG1 4.17Å; W396-K409 PolarHBondContact N-O 3.29Å; W396-H410 HydrophobicContact CB-CB 4.17Å; W396-H410 AromaticContact CE3-CD2 3.93Å; W396-H410 AromaticContact CE3-NE2 3.98Å; W396-E425 HydrophobicContact CH2-CG 4.07Å; W396-E425 HydrophobicContact CZ2-CB 4.25Å; W396-E425 HydrophobicContact CZ2-CG 4.15Å; W396-P426 HydrophobicContact CB-CG 4.13Å; W396-P426 HydrophobicContact CD2-CG 3.96Å; W396-P426 HydrophobicContact CG-CG 3.62Å; W396-P426 VanDerWaalsContact NE1-CD 3.25Å
397	S	86.4	Confident	76.4	Confident	43 Å²	43	68 Å²	68	30%	0.301	39%	0.39	S	S	.	.			trans	-127.4	134.7	173.9	-178.1	0	0	0	0	109.4	S395 S399 Y402	S395-S397 PolarHBondContact O-N 3.11Å; S397-S399 VanDerWaalsContact C-N 3.29Å; S397-S399 PolarHBondContact O-N 3.15Å; S397-S399 PolarHBondContact OG-OG 3.25Å; S397-Y402 PolarHBondContact N-OH 3.23Å
398	A	85.8	Confident	77.8	Confident	36 Å²	36	56.7 Å²	56.7	30%	0.298	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.9	-179.8	0	0	0	0	0	112.7	P291 R295 W396 T400	P291-A398 WeakPolarHBondContact CG-O 3.45Å; R295-A398 VanDerWaalsContact CZ-O 3.31Å; R295-A398 PolarHBondContact NH1-O 2.99Å; R295-A398 PolarHBondContact NH2-O 3.12Å; W396-A398 HydrophobicContact CH2-CB 3.74Å; W396-A398 HydrophobicContact CZ2-CB 4.26Å; W396-A398 HydrophobicContact CZ3-CB 4.16Å; A398-T400 VanDerWaalsContact C-N 3.34Å; A398-T400 PolarHBondContact O-N 3.27Å
399	S	84.5	Confident	79.3	Confident	79 Å²	79	56.8 Å²	56.8	55%	0.552	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	3.6	-173.3	60.2	0	0	0	0	114.6	P291 E292 S397	P291-S399 VanDerWaalsContact CG-C 3.41Å; E292-S399 WeakPolarHBondContact OE1-CA 3.33Å; E292-S399 PolarHBondContact OE1-N 2.84Å; S397-S399 VanDerWaalsContact C-N 3.29Å; S397-S399 PolarHBondContact O-N 3.15Å; S397-S399 PolarHBondContact OG-OG 3.25Å
400	T	84.8	Confident	80.7	Confident	36 Å²	36	56.2 Å²	56.2	22%	0.221	32%	0.317	C	S	.	.			trans	-111.6	133.7	-174.8	-53.6	0	0	0	0	111	V29 A398 Y402	V29-T400 HydrophobicContact CG1-CG2 3.49Å; V29-T400 VanDerWaalsContact CG1-CG2 3.49Å; V29-T400 HydrophobicContact CG2-CG2 4.48Å; A398-T400 VanDerWaalsContact C-N 3.34Å; A398-T400 PolarHBondContact O-N 3.27Å; T400-Y402 HydrophobicContact CG2-CE1 4.17Å; T400-Y402 HydrophobicContact CG2-CE2 4.45Å
401	I	85.2	Confident	81.7	Confident	47 Å²	47	56 Å²	56	24%	0.241	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-88.7	123	171	-56.2	176.6	0	0	0	107.8	V32 P291 N421	V32-I401 HydrophobicContact CG1-CG2 3.85Å; V32-I401 HydrophobicContact CG2-CB 4.28Å; V32-I401 HydrophobicContact CG2-CG2 4.18Å; P291-I401 HydrophobicContact CB-CG1 4.27Å; P291-I401 HydrophobicContact CG-CG1 4.45Å; I401-N421 HydrophobicContact CG2-CB 3.85Å
402	Y	87.8	Confident	82.6	Confident	6 Å²	6	57 Å²	57	2%	0.024	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.4	-179.5	-65.1	-81.6	0	0	0	110.6	W381 W396 S397 T400 V406 V408 N422	W381-Y402 HydrophobicContact CH2-CD1 4.48Å; W381-Y402 AromaticContact CH2-CD2 3.83Å; W381-Y402 HydrophobicContact CH2-CD2 3.83Å; W381-Y402 HydrophobicContact CH2-CE2 4.37Å; W381-Y402 AromaticContact CH2-CG 3.87Å; W381-Y402 HydrophobicContact CH2-CG 3.87Å; W381-Y402 AromaticContact CZ2-CD2 3.75Å; W381-Y402 HydrophobicContact CZ2-CD2 3.75Å; W381-Y402 HydrophobicContact CZ2-CE2 4.23Å; W381-Y402 HydrophobicContact CZ2-CG 4.25Å; W396-Y402 AromaticContact CD1-CE2 3.69Å; W396-Y402 AromaticContact NE1-CE2 3.99Å; S397-Y402 PolarHBondContact N-OH 3.23Å; T400-Y402 HydrophobicContact CG2-CE1 4.17Å; T400-Y402 HydrophobicContact CG2-CE2 4.45Å; Y402-V406 HydrophobicContact CD1-CG1 4.05Å; Y402-V408 HydrophobicContact CD1-CG2 3.87Å; Y402-V408 HydrophobicContact CE1-CG2 3.68Å; Y402-V408 HydrophobicContact CG-CG2 4.44Å; Y402-N422 PolarHBondContact N-O 3.15Å; Y402-N422 WeakPolarHBondContact O-CB 3.47Å; Y402-N422 PolarHBondContact O-N 3.37Å
403	P	86.1	Confident	83.4	Confident	11 Å²	11	55.1 Å²	55.1	7%	0.071	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	162	172	30.9	-34.4	0	0	0	111.2	V28 G405 V406 S417	V28-P403 HydrophobicContact CG1-CG 3.51Å; P403-G405 PolarHBondContact O-N 3.07Å; P403-V406 HydrophobicContact CG-CG2 3.74Å; P403-V406 WeakPolarHBondContact O-CG2 3.34Å; P403-V406 PolarHBondContact O-N 3.16Å; P403-S417 PolarHBondContact O-OG 3.39Å
404	C	84.5	Confident	84.2	Confident	69 Å²	69	55.7 Å²	55.7	47%	0.466	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	133.8	179.8	-170.3	0	0	0	0	113.9	V406 G419 I420	C404-V406 VanDerWaalsContact C-N 3.34Å; C404-V406 PolarHBondContact O-N 3.43Å; C404-G419 WeakPolarHBondContact CA-O 3.29Å; C404-G419 WeakPolarHBondContact CB-O 3.26Å; C404-I420 PolarHBondContact N-O 3.38Å
405	G	85	Confident	84.5	Confident	29 Å²	29	54.2 Å²	54.2	30%	0.299	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-4.6	169.9	0	0	0	0	0	115.9	P403 S417	P403-G405 PolarHBondContact O-N 3.07Å; G405-S417 PolarHBondContact N-O 2.9Å; G405-S417 PolarHBondContact N-OG 2.93Å
406	V	85.9	Confident	84.7	Confident	13 Å²	13	55.3 Å²	55.3	8%	0.079	30%	0.301	C	S	.	.			trans	-65.4	134.4	171.5	178.3	0	0	0	0	110.3	V28 Y402 P403 C404 V408 S417	V28-V406 HydrophobicContact CG1-CG2 3.85Å; Y402-V406 HydrophobicContact CD1-CG1 4.05Å; P403-V406 HydrophobicContact CG-CG2 3.74Å; P403-V406 WeakPolarHBondContact O-CG2 3.34Å; P403-V406 PolarHBondContact O-N 3.16Å; C404-V406 VanDerWaalsContact C-N 3.34Å; C404-V406 PolarHBondContact O-N 3.43Å; V406-V408 HydrophobicContact CG1-CG2 4.04Å; V406-S417 PolarHBondContact N-OG 2.96Å; V406-S417 PolarHBondContact O-N 3.26Å; V406-S417 PolarHBondContact O-OG 3.29Å
407	V	85.4	Confident	84.7	Confident	35 Å²	35	52.8 Å²	52.8	21%	0.212	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.6	177.6	-178.2	0	0	0	0	110	L414 F415 R416	V407-L414 HydrophobicContact CG1-CB 4.48Å; V407-L414 HydrophobicContact CG1-CD2 3.95Å; V407-F415 CarbonylContact C-O 3.6Å; V407-F415 VanDerWaalsContact CA-O 3.3Å; V407-F415 WeakPolarHBondContact CA-O 3.21Å; V407-R416 HydrophobicContact CG2-CB 4.34Å; V407-R416 HydrophobicContact CG2-CG 4.37Å
408	V	86.1	Confident	84.7	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.7	-174.4	-179.4	0	0	0	0	109.9	W381 I394 W396 Y402 V406 F415	W381-V408 HydrophobicContact CH2-CB 3.86Å; W381-V408 HydrophobicContact CH2-CG2 3.5Å; W381-V408 HydrophobicContact CZ3-CB 3.88Å; W381-V408 HydrophobicContact CZ3-CG2 3.79Å; I394-V408 CarbonylContact O-C 3.59Å; I394-V408 WeakPolarHBondContact O-CA 3.35Å; I394-V408 WeakPolarHBondContact O-CG1 3.36Å; W396-V408 HydrophobicContact CB-CG1 3.36Å; W396-V408 HydrophobicContact CG-CG1 4.17Å; Y402-V408 HydrophobicContact CD1-CG2 3.87Å; Y402-V408 HydrophobicContact CE1-CG2 3.68Å; Y402-V408 HydrophobicContact CG-CG2 4.44Å; V406-V408 HydrophobicContact CG1-CG2 4.04Å; V408-F415 PolarHBondContact N-O 3.42Å; V408-F415 PolarHBondContact O-N 2.63Å
409	K	84.4	Confident	84.7	Confident	125 Å²	125	51.1 Å²	51.1	54%	0.543	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.2	175.6	-173.3	179.2	178.1	-178.1	0	110.4	A393 I394 W396 G413	A393-K409 HydrophobicContact CB-CB 4.29Å; I394-K409 PolarHBondContact O-N 3.43Å; W396-K409 PolarHBondContact N-O 3.29Å; K409-G413 WeakPolarHBondContact CA-O 3.29Å
410	H	83.5	Confident	84.7	Confident	34 Å²	34	50.3 Å²	50.3	16%	0.157	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.1	176.9	-174	-117.5	0	0	0	111.2	W396 Q412 G413 F415 P426	W396-H410 HydrophobicContact CB-CB 4.17Å; W396-H410 AromaticContact CE3-CD2 3.93Å; W396-H410 AromaticContact CE3-NE2 3.98Å; H410-Q412 PolarHBondContact O-N 3.27Å; H410-G413 PolarHBondContact N-O 3.17Å; H410-G413 VanDerWaalsContact N-O 3.07Å; H410-G413 PolarHBondContact O-N 3Å; H410-F415 HydrophobicContact CB-CD2 4.08Å; H410-F415 HydrophobicContact CB-CE2 4.07Å; H410-F415 WeakPolarHBondContact O-CE2 3.45Å; H410-P426 HydrophobicContact CB-CB 3.98Å; H410-P426 HydrophobicContact CB-CG 3.53Å; H410-P426 PolarHBondContact CE1-O 2.87Å; H410-P426 VanDerWaalsContact CG-CG 3.49Å; H410-P426 PolarHBondContact ND1-O 3.37Å
411	M	76.4	Confident	84.7	Confident	149 Å²	149	49.1 Å²	49.1	73%	0.734	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.8	44.3	178.9	-65.6	-162.8	-69.9	0	0	115.3	G413	M411-G413 PolarHBondContact O-N 3.32Å
412	Q	75.2	Confident	84.8	Confident	197 Å²	197	46.9 Å²	46.9	92%	0.921	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	2.6	-177	-50.3	179.3	-5.6	0	0	116.9	H410	H410-Q412 PolarHBondContact O-N 3.27Å
413	G	82	Confident	84.8	Confident	26 Å²	26	46.7 Å²	46.7	27%	0.268	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	158.3	172.1	0	0	0	0	0	113.9	K409 H410 M411	K409-G413 WeakPolarHBondContact CA-O 3.29Å; H410-G413 PolarHBondContact N-O 3.17Å; H410-G413 VanDerWaalsContact N-O 3.07Å; H410-G413 PolarHBondContact O-N 3Å; M411-G413 PolarHBondContact O-N 3.32Å
414	L	85.4	Confident	85	Confident	41 Å²	41	46.2 Å²	46.2	22%	0.215	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.1	169.5	-75.6	161.4	0	0	0	108.8	S384 A393 V407	S384-L414 PolarHBondContact N-O 3.47Å; S384-L414 VanDerWaalsContact N-O 3.14Å; S384-L414 VanDerWaalsContact OG-CB 3.31Å; S384-L414 WeakPolarHBondContact OG-CB 3.43Å; S384-L414 PolarHBondContact OG-O 3.02Å; S384-L414 VanDerWaalsContact OG-O 3.04Å; A393-L414 HydrophobicContact CB-CD2 3.65Å; V407-L414 HydrophobicContact CG1-CB 4.48Å; V407-L414 HydrophobicContact CG1-CD2 3.95Å
415	F	88	Confident	85.2	Confident	21 Å²	21	46.3 Å²	46.3	9%	0.092	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.6	-177.6	-63.5	-89.6	0	0	0	110.1	W381 E382 N383 V407 V408 H410 P426	W381-F415 HydrophobicContact CB-CB 4.16Å; W381-F415 HydrophobicContact CB-CD1 4.08Å; W381-F415 HydrophobicContact CB-CG 4.47Å; W381-F415 HydrophobicContact CD2-CB 4.11Å; W381-F415 HydrophobicContact CE3-CB 3.64Å; W381-F415 HydrophobicContact CG-CB 4.38Å; W381-F415 HydrophobicContact CZ3-CB 4.43Å; E382-F415 CarbonylContact O-C 3.59Å; E382-F415 WeakPolarHBondContact O-CA 3.46Å; N383-F415 WeakPolarHBondContact OD1-CD1 3.37Å; N383-F415 WeakPolarHBondContact OD1-CE1 3.48Å; V407-F415 CarbonylContact C-O 3.6Å; V407-F415 VanDerWaalsContact CA-O 3.3Å; V407-F415 WeakPolarHBondContact CA-O 3.21Å; V408-F415 PolarHBondContact N-O 3.42Å; V408-F415 PolarHBondContact O-N 2.63Å; H410-F415 HydrophobicContact CB-CD2 4.08Å; H410-F415 HydrophobicContact CB-CE2 4.07Å; H410-F415 WeakPolarHBondContact O-CE2 3.45Å; F415-P426 HydrophobicContact CB-CB 4.2Å; F415-P426 HydrophobicContact CD1-CB 4.18Å; F415-P426 HydrophobicContact CD2-CB 3.79Å; F415-P426 HydrophobicContact CE1-CB 4.49Å; F415-P426 HydrophobicContact CE2-CB 4.17Å; F415-P426 HydrophobicContact CG-CB 3.79Å
416	R	88.7	Confident	85.3	Confident	110 Å²	110	45 Å²	45	42%	0.415	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.4	174.5	-178.3	176.7	176.9	-113.4	-0.9	109.5	W381 E382 V407	W381-R416 WeakPolarHBondContact CA-O 3.41Å; W381-R416 VanDerWaalsContact CE3-C 3.49Å; E382-R416 PolarHBondContact N-O 2.97Å; E382-R416 PolarHBondContact O-N 3.5Å; E382-R416 IonicContact OE2-NH1 3.05Å; V407-R416 HydrophobicContact CG2-CB 4.34Å; V407-R416 HydrophobicContact CG2-CG 4.37Å
417	S	87.9	Confident	85.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	135.4	177.2	49.1	0	0	0	0	111.6	P403 G405 V406 N422	P403-S417 PolarHBondContact O-OG 3.39Å; G405-S417 PolarHBondContact N-O 2.9Å; G405-S417 PolarHBondContact N-OG 2.93Å; V406-S417 PolarHBondContact N-OG 2.96Å; V406-S417 PolarHBondContact O-N 3.26Å; V406-S417 PolarHBondContact O-OG 3.29Å; S417-N422 WeakPolarHBondContact CB-ND2 3.34Å
418	V	87.2	Confident	85.3	Confident	34 Å²	34	47 Å²	47	21%	0.206	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.8	178.9	-178.3	0	0	0	0	108.1	G379 S380 E382 Y435	G379-V418 CarbonylContact C-O 3.58Å; G379-V418 WeakPolarHBondContact CA-O 3.45Å; S380-V418 PolarHBondContact N-O 3.05Å; S380-V418 PolarHBondContact O-N 3.07Å; E382-V418 HydrophobicContact CB-CG2 3.85Å; V418-Y435 HydrophobicContact CG1-CE1 3.94Å
419	G	85.1	Confident	85.4	Confident	11 Å²	11	57.4 Å²	57.4	11%	0.113	28%	0.284	C	S	.	.	S	Bend	trans	108.8	168.9	-174.7	0	0	0	0	0	112.4	C404	C404-G419 WeakPolarHBondContact CA-O 3.29Å; C404-G419 WeakPolarHBondContact CB-O 3.26Å
420	I	83.6	Confident	85.6	Confident	61 Å²	61	54.7 Å²	54.7	31%	0.313	28%	0.275	S	S	.	.	S	Bend	trans	-63.8	-52.7	179.8	-61.5	-178.2	0	0	0	109.6	P33 V35 M376 C404	P33-I420 HydrophobicContact CB-CG2 4.29Å; P33-I420 HydrophobicContact CG-CG2 3.73Å; V35-I420 HydrophobicContact CG2-CG2 4.3Å; M376-I420 HydrophobicContact CE-CD1 3.35Å; M376-I420 HydrophobicContact CE-CG1 3.88Å; C404-I420 PolarHBondContact N-O 3.38Å
421	N	85.1	Confident	85.9	Confident	11 Å²	11	53.5 Å²	53.5	6%	0.059	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142	174.1	-66.6	-7.7	0	0	0	108.1	V32 P33 V35 I401	V32-N421 WeakPolarHBondContact CG1-ND2 3.43Å; V32-N421 WeakPolarHBondContact CG1-OD1 3.49Å; P33-N421 PolarHBondContact O-ND2 3.01Å; P33-N421 PolarHBondContact O-OD1 3.37Å; P33-N421 VanDerWaalsContact O-OD1 3.13Å; V35-N421 HydrophobicContact CG2-CB 4.37Å; V35-N421 WeakPolarHBondContact CG2-ND2 3.32Å; I401-N421 HydrophobicContact CG2-CB 3.85Å
422	N	88.1	Confident	86.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	108.7	-178.8	-172.1	25.5	0	0	0	110.3	L378 S380 W381 Y402 S417 A424	L378-N422 CarbonylContact O-C 3.55Å; L378-N422 WeakPolarHBondContact O-CA 3.16Å; L378-N422 PolarHBondContact O-OD1 2.81Å; L378-N422 VanDerWaalsContact O-OD1 3.09Å; S380-N422 PolarHBondContact N-OD1 3.35Å; S380-N422 PolarHBondContact O-ND2 3.32Å; W381-N422 WeakPolarHBondContact CH2-ND2 3.45Å; W381-N422 WeakPolarHBondContact CZ2-ND2 3.36Å; W381-N422 PolarHBondContact NE1-ND2 2.98Å; Y402-N422 PolarHBondContact N-O 3.15Å; Y402-N422 WeakPolarHBondContact O-CB 3.47Å; Y402-N422 PolarHBondContact O-N 3.37Å; S417-N422 WeakPolarHBondContact CB-ND2 3.34Å; N422-A424 WeakPolarHBondContact OD1-CB 3.34Å; N422-A424 PolarHBondContact OD1-N 3.1Å
423	C	88.3	Confident	87.3	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.014	22%	0.223	C	C	.	.			trans	-105.3	-5.6	172.8	-55.3	0	0	0	0	111.4	P291 I294 R295 H377 L378	P291-C423 HydrophobicContact CB-CB 3.99Å; I294-C423 HydrophobicContact CG2-CB 4.37Å; R295-C423 PolarHBondContact NE-O 3.4Å; R295-C423 PolarHBondContact NH2-O 2.97Å; H377-C423 PolarHBondContact O-SG 3.32Å; L378-C423 PolarHBondContact O-N 3.43Å
424	A	89.3	Confident	87.8	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.017	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-61	157.1	-176.4	0	0	0	0	0	112.6	L378 W381 N422 H431	L378-A424 HydrophobicContact CD1-CB 3.97Å; L378-A424 HydrophobicContact CG-CB 4.2Å; L378-A424 PolarHBondContact O-N 2.79Å; W381-A424 PolarHBondContact NE1-O 3.18Å; N422-A424 WeakPolarHBondContact OD1-CB 3.34Å; N422-A424 PolarHBondContact OD1-N 3.1Å; A424-H431 HydrophobicContact CB-CB 4.01Å
425	E	89.3	Confident	88.1	Confident	71 Å²	71	42.3 Å²	42.3	33%	0.332	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-84.9	127.1	169.6	-174.2	-172.6	-173.3	0	0	110.8	W396 G427 N428 H431	W396-E425 HydrophobicContact CH2-CG 4.07Å; W396-E425 HydrophobicContact CZ2-CB 4.25Å; W396-E425 HydrophobicContact CZ2-CG 4.15Å; E425-G427 PolarHBondContact O-N 3.44Å; E425-N428 HydrophobicContact CB-CB 3.98Å; E425-N428 HydrophobicContact CG-CB 4.39Å; E425-N428 WeakPolarHBondContact O-CB 3.38Å; E425-N428 PolarHBondContact O-N 3.03Å; E425-N428 PolarHBondContact OE2-ND2 3.47Å; E425-H431 PolarHBondContact N-ND1 3.21Å
426	P	86.3	Confident	88.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	123.7	179.8	21.6	-27.9	0	0	0	112.1	W381 W396 H410 F415	W381-P426 HydrophobicContact CB-CB 4.41Å; W381-P426 HydrophobicContact CD2-CB 4.05Å; W381-P426 HydrophobicContact CG-CB 3.84Å; W396-P426 HydrophobicContact CB-CG 4.13Å; W396-P426 HydrophobicContact CD2-CG 3.96Å; W396-P426 HydrophobicContact CG-CG 3.62Å; W396-P426 VanDerWaalsContact NE1-CD 3.25Å; H410-P426 HydrophobicContact CB-CB 3.98Å; H410-P426 HydrophobicContact CB-CG 3.53Å; H410-P426 PolarHBondContact CE1-O 2.87Å; H410-P426 VanDerWaalsContact CG-CG 3.49Å; H410-P426 PolarHBondContact ND1-O 3.37Å; F415-P426 HydrophobicContact CB-CB 4.2Å; F415-P426 HydrophobicContact CD1-CB 4.18Å; F415-P426 HydrophobicContact CD2-CB 3.79Å; F415-P426 HydrophobicContact CE1-CB 4.49Å; F415-P426 HydrophobicContact CE2-CB 4.17Å; F415-P426 HydrophobicContact CG-CB 3.79Å
427	G	84.9	Confident	88.3	Confident	48 Å²	48	45.5 Å²	45.5	50%	0.495	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	-12.9	-176.5	0	0	0	0	0	114.2	E425 R429	E425-G427 PolarHBondContact O-N 3.44Å; G427-R429 PolarHBondContact O-N 2.82Å
428	N	87.1	Confident	88.5	Confident	42 Å²	42	45.8 Å²	45.8	23%	0.225	23%	0.225	C	C	.	.			trans	-76.4	106.3	176	-169.2	-26.6	0	0	0	110.7	E425 L430 S432	E425-N428 HydrophobicContact CB-CB 3.98Å; E425-N428 HydrophobicContact CG-CB 4.39Å; E425-N428 WeakPolarHBondContact O-CB 3.38Å; E425-N428 PolarHBondContact O-N 3.03Å; E425-N428 PolarHBondContact OE2-ND2 3.47Å; N428-L430 PolarHBondContact O-N 3.37Å; N428-L430 WeakPolarHBondContact OD1-CB 3.39Å; N428-L430 PolarHBondContact OD1-N 3.3Å; N428-S432 PolarHBondContact O-N 3.32Å
429	R	88.1	Confident	88.6	Confident	220 Å²	220	46.9 Å²	46.9	83%	0.83	23%	0.23	S	C	*	.	H	α-helix	trans	-64.5	-25.9	-179	-65.4	-176.5	-178.3	-179.8	0.4	112.9	G427 R433	G427-R429 PolarHBondContact O-N 2.82Å; R429-R433 VanDerWaalsContact O-CB 3.28Å; R429-R433 WeakPolarHBondContact O-CB 3.49Å; R429-R433 PolarHBondContact O-N 3.39Å
430	L	88.6	Confident	88.8	Confident	68 Å²	68	47.4 Å²	47.4	36%	0.356	23%	0.23	S	C	.	.	H	α-helix	trans	-69.1	-48	-177.6	-60.2	175.2	0	0	0	110.9	N428 R433 F434	N428-L430 PolarHBondContact O-N 3.37Å; N428-L430 WeakPolarHBondContact OD1-CB 3.39Å; N428-L430 PolarHBondContact OD1-N 3.3Å; L430-R433 PolarHBondContact O-N 2.96Å; L430-F434 WeakPolarHBondContact O-CB 3.47Å; L430-F434 PolarHBondContact O-N 2.72Å
431	H	90.1	Very high	89	Confident	8 Å²	8	44.6 Å²	44.6	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-45.6	175.3	-65.3	158	0	0	0	111.6	L378 A424 E425 R433 F434 Y435	L378-H431 HydrophobicContact CD1-CB 4.37Å; L378-H431 HydrophobicContact CD2-CB 3.98Å; L378-H431 HydrophobicContact CG-CB 4.46Å; A424-H431 HydrophobicContact CB-CB 4.01Å; E425-H431 PolarHBondContact N-ND1 3.21Å; H431-R433 PolarHBondContact O-N 2.79Å; H431-F434 PolarHBondContact O-N 3.25Å; H431-Y435 WeakPolarHBondContact O-CB 3.47Å; H431-Y435 PolarHBondContact O-N 2.88Å
432	S	90.1	Very high	89.3	Confident	31 Å²	31	46 Å²	46	22%	0.217	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-45.9	178.7	-168.6	0	0	0	0	111.9	S380 N428 Y435 F436	S380-S432 PolarHBondContact OG-OG 3.44Å; S380-S432 VanDerWaalsContact OG-OG 3.09Å; N428-S432 PolarHBondContact O-N 3.32Å; S432-Y435 PolarHBondContact O-N 2.99Å; S432-F436 WeakPolarHBondContact O-CD2 3.44Å; S432-F436 PolarHBondContact O-N 2.77Å; S432-F436 WeakPolarHBondContact OG-CE2 3.46Å
433	R	91.1	Very high	89.5	Confident	127 Å²	127	53.4 Å²	53.4	48%	0.479	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-42.4	176.6	-172.3	-178.8	73.5	173.6	4.8	112.1	R429 L430 H431 F436 I437	R429-R433 VanDerWaalsContact O-CB 3.28Å; R429-R433 WeakPolarHBondContact O-CB 3.49Å; R429-R433 PolarHBondContact O-N 3.39Å; L430-R433 PolarHBondContact O-N 2.96Å; H431-R433 PolarHBondContact O-N 2.79Å; R433-F436 PolarHBondContact O-N 2.98Å; R433-I437 HydrophobicContact CG-CD1 3.69Å; R433-I437 HydrophobicContact CG-CG1 4.39Å; R433-I437 VanDerWaalsContact O-CG1 3.25Å; R433-I437 WeakPolarHBondContact O-CG1 3.48Å; R433-I437 PolarHBondContact O-N 3.1Å; R433-I437 VanDerWaalsContact O-N 3.09Å
434	F	91.9	Very high	89.7	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-48.2	177.7	-174.3	-90.3	0	0	0	110.9	V298 R302 L371 I374 L378 L430 H431 I437 F438	V298-F434 HydrophobicContact CG1-CD1 3.95Å; V298-F434 HydrophobicContact CG1-CD2 4.4Å; V298-F434 HydrophobicContact CG1-CE1 4.23Å; V298-F434 HydrophobicContact CG1-CG 4.05Å; V298-F434 HydrophobicContact CG2-CE1 4.3Å; R302-F434 HydrophobicContact CB-CD2 4.17Å; R302-F434 HydrophobicContact CB-CE2 4.33Å; R302-F434 HydrophobicContact CG-CD2 4.37Å; L371-F434 HydrophobicContact CD2-CE2 4.03Å; L371-F434 HydrophobicContact CD2-CZ 3.86Å; I374-F434 HydrophobicContact CG2-CE1 4.14Å; I374-F434 HydrophobicContact CG2-CZ 4.41Å; L378-F434 HydrophobicContact CD2-CB 4.45Å; L378-F434 HydrophobicContact CD2-CD1 3.89Å; L430-F434 WeakPolarHBondContact O-CB 3.47Å; L430-F434 PolarHBondContact O-N 2.72Å; H431-F434 PolarHBondContact O-N 3.25Å; F434-I437 PolarHBondContact O-N 2.77Å; F434-F438 HydrophobicContact CD1-CD2 4.19Å; F434-F438 AromaticContact CD2-CD2 3.7Å; F434-F438 HydrophobicContact CD2-CD2 3.7Å; F434-F438 AromaticContact CD2-CE2 3.64Å; F434-F438 HydrophobicContact CD2-CE2 3.64Å; F434-F438 HydrophobicContact CE1-CD2 4.12Å; F434-F438 AromaticContact CE2-CD2 3.63Å; F434-F438 HydrophobicContact CE2-CD2 3.63Å; F434-F438 AromaticContact CE2-CE2 3.56Å; F434-F438 HydrophobicContact CE2-CE2 3.56Å; F434-F438 AromaticContact CG-CD2 3.99Å; F434-F438 HydrophobicContact CG-CD2 3.99Å; F434-F438 HydrophobicContact CG-CE2 4.35Å; F434-F438 AromaticContact CZ-CD2 3.84Å; F434-F438 HydrophobicContact CZ-CD2 3.84Å; F434-F438 HydrophobicContact CZ-CE2 4.21Å; F434-F438 VanDerWaalsContact O-CD2 3.26Å; F434-F438 WeakPolarHBondContact O-CD2 3.49Å; F434-F438 PolarHBondContact O-N 3.16Å; F434-F438 VanDerWaalsContact O-N 3.15Å
435	Y	91.7	Very high	89.8	Confident	14 Å²	14	54.8 Å²	54.8	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-56.1	-54.8	175.2	179.4	-103.4	0	0	0	111.5	S375 G379 V418 H431 S432 I437 F438 D439	S375-Y435 VanDerWaalsContact O-CD2 3.31Å; S375-Y435 WeakPolarHBondContact O-CD2 3.38Å; G379-Y435 WeakPolarHBondContact O-CB 3.39Å; V418-Y435 HydrophobicContact CG1-CE1 3.94Å; H431-Y435 WeakPolarHBondContact O-CB 3.47Å; H431-Y435 PolarHBondContact O-N 2.88Å; S432-Y435 PolarHBondContact O-N 2.99Å; Y435-I437 VanDerWaalsContact C-N 3.31Å; Y435-I437 PolarHBondContact O-N 3.08Å; Y435-F438 PolarHBondContact O-N 3.07Å; Y435-D439 HydrophobicContact CE1-CB 4.36Å; Y435-D439 HydrophobicContact CE2-CB 4.25Å; Y435-D439 WeakPolarHBondContact CE2-OD1 3.46Å; Y435-D439 WeakPolarHBondContact O-CA 3.37Å; Y435-D439 WeakPolarHBondContact O-CB 3.26Å; Y435-D439 PolarHBondContact O-N 3.1Å; Y435-D439 PolarHBondContact OH-OD1 3.4Å
436	F	90.1	Very high	90	Very high	126 Å²	126	54.6 Å²	54.6	55%	0.553	27%	0.265	S	S	*	.	H	α-helix	trans	-64.3	-29.9	-175.9	-72.2	-56.8	0	0	0	115	S432 R433	S432-F436 WeakPolarHBondContact O-CD2 3.44Å; S432-F436 PolarHBondContact O-N 2.77Å; S432-F436 WeakPolarHBondContact OG-CE2 3.46Å; R433-F436 PolarHBondContact O-N 2.98Å
437	I	91.2	Very high	90.5	Very high	73 Å²	73	59.2 Å²	59.2	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-74.3	-40.2	177.6	-68.4	171.3	0	0	0	111.1	R433 F434 Y435 I444	R433-I437 HydrophobicContact CG-CD1 3.69Å; R433-I437 HydrophobicContact CG-CG1 4.39Å; R433-I437 VanDerWaalsContact O-CG1 3.25Å; R433-I437 WeakPolarHBondContact O-CG1 3.48Å; R433-I437 PolarHBondContact O-N 3.1Å; R433-I437 VanDerWaalsContact O-N 3.09Å; F434-I437 PolarHBondContact O-N 2.77Å; Y435-I437 VanDerWaalsContact C-N 3.31Å; Y435-I437 PolarHBondContact O-N 3.08Å; I437-I444 HydrophobicContact CG2-CD1 4.25Å
438	F	92	Very high	91	Very high	5 Å²	5	57.3 Å²	57.3	2%	0.022	27%	0.266	C	S	.	.	H	α-helix	trans	-104.9	-4.5	-171.4	-59.6	-63.8	0	0	0	114.7	F305 L371 H372 S375 F434 Y435 N440 I444	F305-F438 HydrophobicContact CD1-CZ 4.2Å; F305-F438 HydrophobicContact CD2-CE1 4.37Å; F305-F438 AromaticContact CD2-CZ 3.9Å; F305-F438 HydrophobicContact CD2-CZ 3.9Å; F305-F438 HydrophobicContact CE1-CZ 4.19Å; F305-F438 HydrophobicContact CE2-CE1 4.14Å; F305-F438 AromaticContact CE2-CZ 3.89Å; F305-F438 HydrophobicContact CE2-CZ 3.89Å; F305-F438 HydrophobicContact CG-CZ 4.07Å; F305-F438 HydrophobicContact CZ-CE1 4.5Å; F305-F438 HydrophobicContact CZ-CZ 4.04Å; L371-F438 HydrophobicContact CB-CB 4.42Å; L371-F438 HydrophobicContact CB-CD1 3.78Å; L371-F438 HydrophobicContact CB-CD2 4.34Å; L371-F438 HydrophobicContact CB-CE1 4.12Å; L371-F438 HydrophobicContact CB-CG 3.93Å; L371-F438 HydrophobicContact CD1-CD1 4.07Å; L371-F438 HydrophobicContact CD1-CE1 3.51Å; L371-F438 HydrophobicContact CD1-CE2 4.34Å; L371-F438 HydrophobicContact CD1-CZ 3.68Å; L371-F438 HydrophobicContact CG-CE1 4.42Å; H372-F438 WeakPolarHBondContact CA-O 3.4Å; H372-F438 WeakPolarHBondContact CB-O 3.43Å; H372-F438 PolarHBondContact ND1-O 3.22Å; S375-F438 PolarHBondContact OG-O 3.36Å; F434-F438 HydrophobicContact CD1-CD2 4.19Å; F434-F438 AromaticContact CD2-CD2 3.7Å; F434-F438 HydrophobicContact CD2-CD2 3.7Å; F434-F438 AromaticContact CD2-CE2 3.64Å; F434-F438 HydrophobicContact CD2-CE2 3.64Å; F434-F438 HydrophobicContact CE1-CD2 4.12Å; F434-F438 AromaticContact CE2-CD2 3.63Å; F434-F438 HydrophobicContact CE2-CD2 3.63Å; F434-F438 AromaticContact CE2-CE2 3.56Å; F434-F438 HydrophobicContact CE2-CE2 3.56Å; F434-F438 AromaticContact CG-CD2 3.99Å; F434-F438 HydrophobicContact CG-CD2 3.99Å; F434-F438 HydrophobicContact CG-CE2 4.35Å; F434-F438 AromaticContact CZ-CD2 3.84Å; F434-F438 HydrophobicContact CZ-CD2 3.84Å; F434-F438 HydrophobicContact CZ-CE2 4.21Å; F434-F438 VanDerWaalsContact O-CD2 3.26Å; F434-F438 WeakPolarHBondContact O-CD2 3.49Å; F434-F438 PolarHBondContact O-N 3.16Å; F434-F438 VanDerWaalsContact O-N 3.15Å; Y435-F438 PolarHBondContact O-N 3.07Å; F438-N440 PolarHBondContact O-N 2.71Å; F438-I444 HydrophobicContact CD1-CD1 3.8Å; F438-I444 HydrophobicContact CE1-CD1 3.71Å
439	D	89.2	Confident	91.4	Very high	58 Å²	58	57.5 Å²	57.5	31%	0.31	27%	0.266	S	S	.	.	S	Bend	trans	-57.8	-35	176.9	176.7	71.8	0	0	0	112.1	H372 Y435	H372-D439 PolarHBondContact CE1-O 3.1Å; H372-D439 PolarHBondContact ND1-O 3.42Å; H372-D439 VanDerWaalsContact ND1-O 3.12Å; Y435-D439 HydrophobicContact CE1-CB 4.36Å; Y435-D439 HydrophobicContact CE2-CB 4.25Å; Y435-D439 WeakPolarHBondContact CE2-OD1 3.46Å; Y435-D439 WeakPolarHBondContact O-CA 3.37Å; Y435-D439 WeakPolarHBondContact O-CB 3.26Å; Y435-D439 PolarHBondContact O-N 3.1Å; Y435-D439 PolarHBondContact OH-OD1 3.4Å
440	N	88.6	Confident	91.8	Very high	21 Å²	21	51 Å²	51	11%	0.112	25%	0.254	C	S	.	.			trans	-130.4	101.3	174.3	-177.2	8	0	0	0	111.8	F438 K442 Y443	F438-N440 PolarHBondContact O-N 2.71Å; N440-K442 PolarHBondContact O-N 3.43Å; N440-K442 VanDerWaalsContact O-N 3.08Å; N440-K442 VanDerWaalsContact OD1-CB 3.23Å; N440-K442 WeakPolarHBondContact OD1-CB 3.3Å; N440-K442 WeakPolarHBondContact OD1-CG 3.45Å; N440-K442 PolarHBondContact OD1-N 3.09Å; N440-Y443 HydrophobicContact CB-CD2 3.61Å; N440-Y443 HydrophobicContact CB-CE2 3.52Å; N440-Y443 WeakPolarHBondContact ND2-CE2 3.33Å; N440-Y443 WeakPolarHBondContact O-CD2 3.17Å; N440-Y443 PolarHBondContact O-N 3.36Å; N440-Y443 VanDerWaalsContact O-N 3.15Å
441	P	88.9	Confident	92.2	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-14.8	-177	25.3	-33.4	0	0	0	113.3	I368 H372 Y443 S445 V496 Y500	I368-P441 HydrophobicContact CG2-CB 3.86Å; H372-P441 HydrophobicContact CB-CB 4.36Å; H372-P441 HydrophobicContact CB-CG 4.13Å; P441-Y443 VanDerWaalsContact C-N 3.25Å; P441-Y443 PolarHBondContact O-N 2.77Å; P441-S445 PolarHBondContact O-N 3.24Å; P441-V496 HydrophobicContact CB-CG1 4.46Å; P441-Y500 HydrophobicContact CB-CE2 3.99Å; P441-Y500 HydrophobicContact CG-CD1 4.15Å; P441-Y500 HydrophobicContact CG-CD2 3.58Å; P441-Y500 HydrophobicContact CG-CE1 3.84Å; P441-Y500 HydrophobicContact CG-CE2 3.19Å; P441-Y500 HydrophobicContact CG-CG 4.02Å
442	K	90.9	Very high	92.6	Very high	40 Å²	40	50.2 Å²	50.2	17%	0.174	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-32.8	174.1	-61.6	180	-176.7	-176.9	0	112.2	N440 S446 V496 Y500	N440-K442 PolarHBondContact O-N 3.43Å; N440-K442 VanDerWaalsContact O-N 3.08Å; N440-K442 VanDerWaalsContact OD1-CB 3.23Å; N440-K442 WeakPolarHBondContact OD1-CB 3.3Å; N440-K442 WeakPolarHBondContact OD1-CG 3.45Å; N440-K442 PolarHBondContact OD1-N 3.09Å; K442-S446 WeakPolarHBondContact O-CB 3.17Å; K442-S446 PolarHBondContact O-N 3.12Å; K442-V496 HydrophobicContact CG-CG1 4.15Å; K442-Y500 WeakPolarHBondContact CE-O 3.3Å; K442-Y500 VanDerWaalsContact NZ-C 3.26Å; K442-Y500 PolarHBondContact NZ-O 3.42Å
443	Y	91.4	Very high	92.9	Very high	156 Å²	156	50.6 Å²	50.6	61%	0.612	25%	0.253	S	S	*	.	H	α-helix	trans	-64.7	-48.5	-178	-66.2	-50.7	0	0	0	111.7	N440 P441 S445 S446 M447	N440-Y443 HydrophobicContact CB-CD2 3.61Å; N440-Y443 HydrophobicContact CB-CE2 3.52Å; N440-Y443 WeakPolarHBondContact ND2-CE2 3.33Å; N440-Y443 WeakPolarHBondContact O-CD2 3.17Å; N440-Y443 PolarHBondContact O-N 3.36Å; N440-Y443 VanDerWaalsContact O-N 3.15Å; P441-Y443 VanDerWaalsContact C-N 3.25Å; P441-Y443 PolarHBondContact O-N 2.77Å; Y443-S445 PolarHBondContact O-N 3.15Å; Y443-S446 PolarHBondContact O-N 3.1Å; Y443-M447 WeakPolarHBondContact O-CB 3.34Å; Y443-M447 PolarHBondContact O-N 3Å
444	I	92.9	Very high	93.2	Very high	22 Å²	22	50 Å²	50	11%	0.113	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-49.1	178.5	-62.8	175.1	0	0	0	109.9	W359 I368 I437 F438 S446 M447 L448	W359-I444 HydrophobicContact CZ2-CG2 3.76Å; I368-I444 HydrophobicContact CD1-CD1 4.47Å; I368-I444 HydrophobicContact CG2-CD1 4.15Å; I437-I444 HydrophobicContact CG2-CD1 4.25Å; F438-I444 HydrophobicContact CD1-CD1 3.8Å; F438-I444 HydrophobicContact CE1-CD1 3.71Å; I444-S446 PolarHBondContact O-N 3.22Å; I444-M447 PolarHBondContact O-N 3.42Å; I444-L448 HydrophobicContact CG2-CD1 4.1Å; I444-L448 WeakPolarHBondContact O-CG 3.41Å; I444-L448 PolarHBondContact O-N 2.92Å; I444-L448 VanDerWaalsContact O-N 3.14Å
445	S	92.5	Very high	93.3	Very high	10 Å²	10	49.9 Å²	49.9	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-39.4	-179.3	-174	0	0	0	0	112.9	P441 Y443 L448 L449 S493	P441-S445 PolarHBondContact O-N 3.24Å; Y443-S445 PolarHBondContact O-N 3.15Å; S445-L448 PolarHBondContact O-N 3.29Å; S445-L449 PolarHBondContact O-N 3.27Å; S445-S493 WeakPolarHBondContact OG-CA 3.39Å; S445-S493 WeakPolarHBondContact OG-CB 3.42Å; S445-S493 PolarHBondContact OG-N 2.86Å
446	S	93.6	Very high	93.6	Very high	68 Å²	68	49.8 Å²	49.8	48%	0.476	25%	0.254	S	S	.	.	H	α-helix	trans	-67.6	-35.6	175.6	-172.6	0	0	0	0	112.3	K442 Y443 I444 L449 C450	K442-S446 WeakPolarHBondContact O-CB 3.17Å; K442-S446 PolarHBondContact O-N 3.12Å; Y443-S446 PolarHBondContact O-N 3.1Å; I444-S446 PolarHBondContact O-N 3.22Å; S446-L449 PolarHBondContact O-N 3.46Å; S446-C450 WeakPolarHBondContact O-CB 3.31Å; S446-C450 PolarHBondContact O-N 2.93Å
447	M	94.9	Very high	93.9	Very high	98 Å²	98	49.6 Å²	49.6	48%	0.483	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-44.8	176.2	-171.7	-168.5	87.3	0	0	110.9	Y443 I444 C450 L451	Y443-M447 WeakPolarHBondContact O-CB 3.34Å; Y443-M447 PolarHBondContact O-N 3Å; I444-M447 PolarHBondContact O-N 3.42Å; M447-C450 WeakPolarHBondContact O-CB 3.1Å; M447-C450 PolarHBondContact O-N 3.08Å; M447-L451 HydrophobicContact CE-CD1 3.94Å; M447-L451 HydrophobicContact CG-CD1 4.22Å; M447-L451 WeakPolarHBondContact O-CG 3.11Å; M447-L451 PolarHBondContact O-N 3.2Å
448	L	95.9	Very high	94.1	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-37	177.8	-63.6	162.2	0	0	0	112.3	L356 W359 I444 S445 L451 S452	L356-L448 HydrophobicContact CD2-CD2 4.16Å; W359-L448 HydrophobicContact CD2-CD1 4.36Å; W359-L448 HydrophobicContact CD2-CD2 3.83Å; W359-L448 HydrophobicContact CE3-CD2 4.44Å; W359-L448 HydrophobicContact CG-CD1 4.27Å; W359-L448 HydrophobicContact CG-CD2 3.83Å; W359-L448 HydrophobicContact CZ2-CD1 4.26Å; I444-L448 HydrophobicContact CG2-CD1 4.1Å; I444-L448 WeakPolarHBondContact O-CG 3.41Å; I444-L448 PolarHBondContact O-N 2.92Å; I444-L448 VanDerWaalsContact O-N 3.14Å; S445-L448 PolarHBondContact O-N 3.29Å; L448-L451 PolarHBondContact O-N 3.04Å; L448-S452 WeakPolarHBondContact O-CB 3.29Å; L448-S452 PolarHBondContact O-N 3.14Å; L448-S452 PolarHBondContact O-OG 3.46Å
449	L	96.1	Very high	94.1	Very high	45 Å²	45	49.6 Å²	49.6	24%	0.236	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-42	172.5	-179.4	59.3	0	0	0	111.5	S445 S446 S452 S453 L486	S445-L449 PolarHBondContact O-N 3.27Å; S446-L449 PolarHBondContact O-N 3.46Å; L449-S452 WeakPolarHBondContact CA-OG 3.15Å; L449-S452 PolarHBondContact O-N 3.47Å; L449-S452 PolarHBondContact O-OG 3.36Å; L449-S453 VanDerWaalsContact O-CB 3.27Å; L449-S453 WeakPolarHBondContact O-CB 3.34Å; L449-S453 PolarHBondContact O-N 3.34Å; L449-S453 PolarHBondContact O-OG 3.03Å; L449-L486 HydrophobicContact CD1-CD1 4.04Å
450	C	97.3	Very high	94.3	Very high	85 Å²	85	50.2 Å²	50.2	57%	0.574	26%	0.262	S	S	*	.	H	α-helix	trans	-61.8	-47.2	175.7	-173.6	0	0	0	0	111.1	S446 M447 S453 F454	S446-C450 WeakPolarHBondContact O-CB 3.31Å; S446-C450 PolarHBondContact O-N 2.93Å; M447-C450 WeakPolarHBondContact O-CB 3.1Å; M447-C450 PolarHBondContact O-N 3.08Å; C450-S453 PolarHBondContact O-N 2.87Å; C450-F454 VanDerWaalsContact O-CB 3.26Å; C450-F454 WeakPolarHBondContact O-CB 3.17Å; C450-F454 PolarHBondContact O-N 2.72Å
451	L	97	Very high	94.6	Very high	57 Å²	57	55.1 Å²	55.1	30%	0.298	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-48.6	176.7	-77	161.7	0	0	0	112.1	L356 M447 L448 F454 S455	L356-L451 HydrophobicContact CD2-CB 4.15Å; M447-L451 HydrophobicContact CE-CD1 3.94Å; M447-L451 HydrophobicContact CG-CD1 4.22Å; M447-L451 WeakPolarHBondContact O-CG 3.11Å; M447-L451 PolarHBondContact O-N 3.2Å; L448-L451 PolarHBondContact O-N 3.04Å; L451-F454 WeakPolarHBondContact O-CB 3.21Å; L451-F454 PolarHBondContact O-N 3.3Å; L451-S455 PolarHBondContact O-N 3.45Å; L451-S455 PolarHBondContact O-OG 3.2Å
452	S	96.7	Very high	94.9	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.007	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-39	178.4	54.1	0	0	0	0	113.2	L448 L449 S455 V456	L448-S452 WeakPolarHBondContact O-CB 3.29Å; L448-S452 PolarHBondContact O-N 3.14Å; L448-S452 PolarHBondContact O-OG 3.46Å; L449-S452 WeakPolarHBondContact CA-OG 3.15Å; L449-S452 PolarHBondContact O-N 3.47Å; L449-S452 PolarHBondContact O-OG 3.36Å; S452-S455 PolarHBondContact O-N 3.19Å; S452-V456 PolarHBondContact O-N 3.13Å
453	S	97.4	Very high	94.9	Very high	39 Å²	39	56 Å²	56	27%	0.273	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-41.1	174.8	-56.4	0	0	0	0	111.2	L449 C450 S455 V456 L457	L449-S453 VanDerWaalsContact O-CB 3.27Å; L449-S453 WeakPolarHBondContact O-CB 3.34Å; L449-S453 PolarHBondContact O-N 3.34Å; L449-S453 PolarHBondContact O-OG 3.03Å; C450-S453 PolarHBondContact O-N 2.87Å; S453-S455 PolarHBondContact O-N 3.03Å; S453-V456 PolarHBondContact O-N 3.29Å; S453-L457 WeakPolarHBondContact O-CB 3.31Å; S453-L457 VanDerWaalsContact O-CG 3.3Å; S453-L457 WeakPolarHBondContact O-CG 3.33Å; S453-L457 PolarHBondContact O-N 3.26Å
454	F	96.6	Very high	95	Very high	116 Å²	116	57.3 Å²	57.3	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-43.2	175.2	177.2	-98.6	0	0	0	111.6	C450 L451 V456 L457 Y458	C450-F454 VanDerWaalsContact O-CB 3.26Å; C450-F454 WeakPolarHBondContact O-CB 3.17Å; C450-F454 PolarHBondContact O-N 2.72Å; L451-F454 WeakPolarHBondContact O-CB 3.21Å; L451-F454 PolarHBondContact O-N 3.3Å; F454-V456 PolarHBondContact O-N 3Å; F454-L457 PolarHBondContact O-N 3.28Å; F454-Y458 WeakPolarHBondContact O-CB 3.28Å; F454-Y458 PolarHBondContact O-N 3.29Å
455	S	95.6	Very high	95	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.014	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-44.3	176.6	-50.2	0	0	0	0	112.9	L352 L451 S452 S453 Q459	L352-S455 WeakPolarHBondContact CD1-OG 3.46Å; L352-S455 WeakPolarHBondContact CD2-OG 3.46Å; L451-S455 PolarHBondContact O-N 3.45Å; L451-S455 PolarHBondContact O-OG 3.2Å; S452-S455 PolarHBondContact O-N 3.19Å; S453-S455 PolarHBondContact O-N 3.03Å; S455-Q459 WeakPolarHBondContact O-CG 3.46Å; S455-Q459 PolarHBondContact O-N 3.47Å
456	V	96.4	Very high	94.9	Very high	12 Å²	12	64.9 Å²	64.9	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-67.7	-47	178.6	173.1	0	0	0	0	110.9	S452 S453 F454 Y458 Q459 C460 C482 F483 L486	S452-V456 PolarHBondContact O-N 3.13Å; S453-V456 PolarHBondContact O-N 3.29Å; F454-V456 PolarHBondContact O-N 3Å; V456-Y458 VanDerWaalsContact C-N 3.29Å; V456-Y458 PolarHBondContact O-N 3.18Å; V456-Q459 PolarHBondContact O-N 3.41Å; V456-C460 PolarHBondContact O-N 2.99Å; V456-C460 PolarHBondContact O-SG 3.43Å; V456-C460 VanDerWaalsContact O-SG 3.36Å; V456-C482 HydrophobicContact CG2-CB 3.8Å; V456-F483 HydrophobicContact CG1-CD1 4.29Å; V456-F483 HydrophobicContact CG1-CE1 3.65Å; V456-F483 HydrophobicContact CG1-CZ 3.91Å; V456-F483 HydrophobicContact CG2-CD1 4.46Å; V456-L486 HydrophobicContact CG2-CB 4.13Å; V456-L486 HydrophobicContact CG2-CD2 4.06Å
457	L	96.1	Very high	94.7	Very high	123 Å²	123	67.7 Å²	67.7	64%	0.644	35%	0.346	S	S	*	.	H	α-helix	trans	-61.2	-40.4	178.2	-72.2	173.8	0	0	0	111.8	S453 F454 C460 F461	S453-L457 WeakPolarHBondContact O-CB 3.31Å; S453-L457 VanDerWaalsContact O-CG 3.3Å; S453-L457 WeakPolarHBondContact O-CG 3.33Å; S453-L457 PolarHBondContact O-N 3.26Å; F454-L457 PolarHBondContact O-N 3.28Å; L457-C460 PolarHBondContact O-N 2.76Å; L457-F461 WeakPolarHBondContact O-CB 3.46Å; L457-F461 PolarHBondContact O-N 2.77Å
458	Y	95.5	Very high	94.5	Very high	71 Å²	71	66.9 Å²	66.9	28%	0.278	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-45.9	175.3	-178.8	-108.6	0	0	0	111.6	Q345 L349 F454 V456 F461 C462	Q345-Y458 HydrophobicContact CG-CE1 4.02Å; Q345-Y458 WeakPolarHBondContact CG-OH 3.14Å; Q345-Y458 PolarHBondContact NE2-OH 2.85Å; L349-Y458 HydrophobicContact CD1-CD1 4.43Å; F454-Y458 WeakPolarHBondContact O-CB 3.28Å; F454-Y458 PolarHBondContact O-N 3.29Å; V456-Y458 VanDerWaalsContact C-N 3.29Å; V456-Y458 PolarHBondContact O-N 3.18Å; Y458-F461 WeakPolarHBondContact O-CB 3.31Å; Y458-F461 PolarHBondContact O-N 3.5Å; Y458-C462 PolarHBondContact O-N 3.44Å; Y458-C462 PolarHBondContact O-SG 3.13Å
459	Q	93.8	Very high	94.2	Very high	7 Å²	7	69.9 Å²	69.9	3%	0.033	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-42.6	175.3	-78.9	175.9	-23.1	0	0	112.9	L349 S455 V456 F461 C462 S463 L475 D478 A479 C482	L349-Q459 HydrophobicContact CD1-CG 4.22Å; L349-Q459 HydrophobicContact CD2-CG 3.78Å; S455-Q459 WeakPolarHBondContact O-CG 3.46Å; S455-Q459 PolarHBondContact O-N 3.47Å; V456-Q459 PolarHBondContact O-N 3.41Å; Q459-F461 VanDerWaalsContact C-N 3.32Å; Q459-F461 PolarHBondContact O-N 2.91Å; Q459-C462 PolarHBondContact O-N 3.21Å; Q459-S463 VanDerWaalsContact O-CB 3.29Å; Q459-S463 WeakPolarHBondContact O-CB 3.25Å; Q459-S463 PolarHBondContact O-N 2.98Å; Q459-L475 HydrophobicContact CG-CD2 4.46Å; Q459-D478 VanDerWaalsContact NE2-C 3.25Å; Q459-D478 PolarHBondContact NE2-O 2.94Å; Q459-A479 VanDerWaalsContact OE1-CA 3.29Å; Q459-C482 PolarHBondContact NE2-SG 2.86Å; Q459-C482 PolarHBondContact OE1-SG 2.86Å
460	C	93.4	Very high	94	Very high	70 Å²	70	68.1 Å²	68.1	47%	0.473	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-42.4	175.3	-69.1	0	0	0	0	111.4	V456 L457 S463 Y464	V456-C460 PolarHBondContact O-N 2.99Å; V456-C460 PolarHBondContact O-SG 3.43Å; V456-C460 VanDerWaalsContact O-SG 3.36Å; L457-C460 PolarHBondContact O-N 2.76Å; C460-S463 PolarHBondContact O-N 3.02Å; C460-Y464 PolarHBondContact O-N 3.37Å; C460-Y464 VanDerWaalsContact O-N 3.13Å
461	F	94.7	Very high	93.8	Very high	125 Å²	125	64.7 Å²	64.7	55%	0.548	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-49.8	175.3	179.7	-97.1	0	0	0	111.2	L457 Y458 Q459 S463 Y464 W465	L457-F461 WeakPolarHBondContact O-CB 3.46Å; L457-F461 PolarHBondContact O-N 2.77Å; Y458-F461 WeakPolarHBondContact O-CB 3.31Å; Y458-F461 PolarHBondContact O-N 3.5Å; Q459-F461 VanDerWaalsContact C-N 3.32Å; Q459-F461 PolarHBondContact O-N 2.91Å; F461-S463 VanDerWaalsContact C-N 3.32Å; F461-S463 PolarHBondContact O-N 3.3Å; F461-Y464 WeakPolarHBondContact O-CB 3.28Å; F461-Y464 PolarHBondContact O-N 2.78Å; F461-Y464 VanDerWaalsContact O-N 3.14Å; F461-W465 AromaticContact CD1-CD1 3.88Å; F461-W465 AromaticContact CD2-NE1 3.76Å; F461-W465 AromaticContact CE1-CD1 3.57Å; F461-W465 AromaticContact CE1-NE1 3.65Å; F461-W465 AromaticContact CE2-CD1 3.75Å; F461-W465 AromaticContact CE2-NE1 3.11Å; F461-W465 AromaticContact CZ-CD1 3.51Å; F461-W465 AromaticContact CZ-NE1 3.05Å; F461-W465 PolarHBondContact O-N 3Å
462	C	93.9	Very high	93.6	Very high	10 Å²	10	65.1 Å²	65.1	7%	0.068	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-41.5	177	-67	0	0	0	0	112.1	Q345 Y458 Q459 Y464 W465 V466 L475	Q345-C462 PolarHBondContact NE2-SG 2.98Å; Y458-C462 PolarHBondContact O-N 3.44Å; Y458-C462 PolarHBondContact O-SG 3.13Å; Q459-C462 PolarHBondContact O-N 3.21Å; C462-Y464 PolarHBondContact O-N 2.87Å; C462-W465 PolarHBondContact O-N 3.09Å; C462-V466 VanDerWaalsContact O-CB 3.28Å; C462-V466 WeakPolarHBondContact O-CB 3.49Å; C462-V466 WeakPolarHBondContact O-CG2 3.49Å; C462-V466 PolarHBondContact O-N 3.26Å; C462-L475 HydrophobicContact CB-CD1 4.07Å; C462-L475 HydrophobicContact CB-CD2 4.14Å
463	S	92.2	Very high	93.4	Very high	51 Å²	51	68.8 Å²	68.8	36%	0.357	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-24.9	178.3	-173.9	0	0	0	0	113.2	Q459 C460 F461	Q459-S463 VanDerWaalsContact O-CB 3.29Å; Q459-S463 WeakPolarHBondContact O-CB 3.25Å; Q459-S463 PolarHBondContact O-N 2.98Å; C460-S463 PolarHBondContact O-N 3.02Å; F461-S463 VanDerWaalsContact C-N 3.32Å; F461-S463 PolarHBondContact O-N 3.3Å
464	Y	92.5	Very high	93.3	Very high	183 Å²	183	67.2 Å²	67.2	72%	0.718	33%	0.329	S	S	*	.	H	α-helix	trans	-76.6	-37.3	175.1	177.2	-98	0	0	0	112.3	C460 F461 C462	C460-Y464 PolarHBondContact O-N 3.37Å; C460-Y464 VanDerWaalsContact O-N 3.13Å; F461-Y464 WeakPolarHBondContact O-CB 3.28Å; F461-Y464 PolarHBondContact O-N 2.78Å; F461-Y464 VanDerWaalsContact O-N 3.14Å; C462-Y464 PolarHBondContact O-N 2.87Å
465	W	92.3	Very high	93.2	Very high	167 Å²	167	62.1 Å²	62.1	63%	0.633	31%	0.307	S	S	*	.	H	α-helix	trans	-83.9	-26.5	-177.3	-74.9	103.8	0	0	0	114	F461 C462	F461-W465 AromaticContact CD1-CD1 3.88Å; F461-W465 AromaticContact CD2-NE1 3.76Å; F461-W465 AromaticContact CE1-CD1 3.57Å; F461-W465 AromaticContact CE1-NE1 3.65Å; F461-W465 AromaticContact CE2-CD1 3.75Å; F461-W465 AromaticContact CE2-NE1 3.11Å; F461-W465 AromaticContact CZ-CD1 3.51Å; F461-W465 AromaticContact CZ-NE1 3.05Å; F461-W465 PolarHBondContact O-N 3Å; C462-W465 PolarHBondContact O-N 3.09Å
466	V	91.9	Very high	93.1	Very high	25 Å²	25	66.6 Å²	66.6	15%	0.152	33%	0.329	C	S	.	.			trans	-89.2	119.4	-172.2	169.3	0	0	0	0	110.8	W342 C462 K471	W342-V466 HydrophobicContact CH2-CG2 3.61Å; W342-V466 HydrophobicContact CZ3-CG2 3.59Å; C462-V466 VanDerWaalsContact O-CB 3.28Å; C462-V466 WeakPolarHBondContact O-CB 3.49Å; C462-V466 WeakPolarHBondContact O-CG2 3.49Å; C462-V466 PolarHBondContact O-N 3.26Å; V466-K471 HydrophobicContact CG1-CB 3.31Å; V466-K471 HydrophobicContact CG1-CD 3.89Å; V466-K471 HydrophobicContact CG1-CG 4.18Å
467	C	89.3	Confident	93	Very high	127 Å²	127	67.7 Å²	67.7	86%	0.858	33%	0.334	S	S	*	.			trans	-97.2	-13	175.6	-61.9	0	0	0	0	113.4
468	E	90.2	Very high	92.9	Very high	80 Å²	80	62 Å²	62	37%	0.374	31%	0.305	S	S	.	.			trans	-77.6	127.4	-174.4	-62.9	169.7	-134.8	0	0	111	Y470 K471 L472	E468-Y470 HydrophobicContact CB-CD1 4.11Å; E468-Y470 HydrophobicContact CB-CE1 3.76Å; E468-Y470 HydrophobicContact CG-CE1 4.34Å; E468-Y470 PolarHBondContact O-N 3.45Å; E468-Y470 WeakPolarHBondContact OE2-CE1 3.45Å; E468-Y470 PolarHBondContact OE2-OH 3.26Å; E468-K471 HydrophobicContact CB-CB 4.27Å; E468-K471 HydrophobicContact CB-CD 4.02Å; E468-K471 HydrophobicContact CB-CG 4.02Å; E468-K471 VanDerWaalsContact CD-NZ 3.27Å; E468-K471 HydrophobicContact CG-CD 4.41Å; E468-K471 PolarHBondContact O-N 3.39Å; E468-K471 IonicContact OE1-NZ 2.82Å; E468-K471 PolarHBondContact OE1-NZ 2.94Å; E468-K471 WeakPolarHBondContact OE2-CD 3.27Å; E468-K471 WeakPolarHBondContact OE2-CE 3.47Å; E468-K471 IonicContact OE2-NZ 3.12Å; E468-K471 PolarHBondContact OE2-NZ 3.23Å; E468-K471 VanDerWaalsContact OE2-NZ 3.12Å; E468-L472 PolarHBondContact O-N 2.93Å
469	W	90.3	Very high	92.9	Very high	72 Å²	72	59.5 Å²	59.5	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-58.5	-42.3	-171.2	66.6	-90.1	0	0	0	113.4	M68 W76 P85 L472 I473	M68-W469 HydrophobicContact CE-CH2 3.42Å; M68-W469 VanDerWaalsContact CE-CH2 3.42Å; M68-W469 HydrophobicContact CE-CZ3 3.46Å; M68-W469 VanDerWaalsContact CE-CZ3 3.46Å; W76-W469 AromaticContact CH2-CD1 3.96Å; W76-W469 AromaticContact CH2-NE1 3.57Å; W76-W469 AromaticContact CZ3-CD1 3.87Å; W76-W469 AromaticContact CZ3-NE1 3.24Å; P85-W469 HydrophobicContact CB-CH2 3.63Å; P85-W469 HydrophobicContact CB-CZ2 4.05Å; P85-W469 HydrophobicContact CB-CZ3 4.42Å; W469-L472 WeakPolarHBondContact O-CB 3.42Å; W469-L472 PolarHBondContact O-N 2.8Å; W469-I473 HydrophobicContact CE3-CD1 3.65Å; W469-I473 HydrophobicContact CZ3-CD1 3.9Å; W469-I473 WeakPolarHBondContact O-CG1 3.24Å; W469-I473 PolarHBondContact O-N 3.19Å
470	Y	90.1	Very high	92.9	Very high	8 Å²	8	65 Å²	65	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-71.1	-38.7	-176.3	70.1	-85.3	0	0	0	111.5	N69 R72 E468 L472 I473 G474	N69-Y470 HydrophobicContact CB-CE2 4.46Å; N69-Y470 WeakPolarHBondContact OD1-CD2 3.41Å; R72-Y470 HydrophobicContact CB-CD1 4.45Å; R72-Y470 VanDerWaalsContact CD-OH 3.23Å; R72-Y470 WeakPolarHBondContact CD-OH 3.29Å; R72-Y470 HydrophobicContact CG-CE1 4.46Å; R72-Y470 PolarHBondContact NE-OH 2.95Å; E468-Y470 HydrophobicContact CB-CD1 4.11Å; E468-Y470 HydrophobicContact CB-CE1 3.76Å; E468-Y470 HydrophobicContact CG-CE1 4.34Å; E468-Y470 PolarHBondContact O-N 3.45Å; E468-Y470 WeakPolarHBondContact OE2-CE1 3.45Å; E468-Y470 PolarHBondContact OE2-OH 3.26Å; Y470-L472 VanDerWaalsContact C-N 3.32Å; Y470-I473 PolarHBondContact O-N 2.82Å; Y470-G474 PolarHBondContact O-N 2.99Å
471	K	94.1	Very high	93.1	Very high	12 Å²	12	62.7 Å²	62.7	5%	0.052	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-41.2	173.4	-63.5	-172.3	173.9	163.2	0	110.4	D339 W342 V466 E468 G474 L475	D339-K471 IonicContact OD2-NZ 2.94Å; D339-K471 PolarHBondContact OD2-NZ 3.09Å; W342-K471 HydrophobicContact CD2-CD 3.71Å; W342-K471 HydrophobicContact CD2-CG 4.07Å; W342-K471 HydrophobicContact CE3-CD 4Å; W342-K471 HydrophobicContact CG-CD 4.16Å; W342-K471 HydrophobicContact CG-CG 4.4Å; W342-K471 HydrophobicContact CH2-CB 4.2Å; W342-K471 HydrophobicContact CH2-CD 4.37Å; W342-K471 HydrophobicContact CZ2-CB 3.54Å; W342-K471 HydrophobicContact CZ2-CD 4.09Å; W342-K471 HydrophobicContact CZ2-CG 3.91Å; W342-K471 HydrophobicContact CZ3-CD 4.31Å; V466-K471 HydrophobicContact CG1-CB 3.31Å; V466-K471 HydrophobicContact CG1-CD 3.89Å; V466-K471 HydrophobicContact CG1-CG 4.18Å; E468-K471 HydrophobicContact CB-CB 4.27Å; E468-K471 HydrophobicContact CB-CD 4.02Å; E468-K471 HydrophobicContact CB-CG 4.02Å; E468-K471 VanDerWaalsContact CD-NZ 3.27Å; E468-K471 HydrophobicContact CG-CD 4.41Å; E468-K471 PolarHBondContact O-N 3.39Å; E468-K471 IonicContact OE1-NZ 2.82Å; E468-K471 PolarHBondContact OE1-NZ 2.94Å; E468-K471 WeakPolarHBondContact OE2-CD 3.27Å; E468-K471 WeakPolarHBondContact OE2-CE 3.47Å; E468-K471 IonicContact OE2-NZ 3.12Å; E468-K471 PolarHBondContact OE2-NZ 3.23Å; E468-K471 VanDerWaalsContact OE2-NZ 3.12Å; K471-G474 PolarHBondContact O-N 2.79Å; K471-L475 WeakPolarHBondContact O-CG 3.49Å; K471-L475 PolarHBondContact O-N 3.04Å
472	L	93.7	Very high	93.2	Very high	66 Å²	66	56.9 Å²	56.9	35%	0.346	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-44.5	176.2	-176	66.5	0	0	0	112.1	E468 W469 Y470 G474 L475 I476	E468-L472 PolarHBondContact O-N 2.93Å; W469-L472 WeakPolarHBondContact O-CB 3.42Å; W469-L472 PolarHBondContact O-N 2.8Å; Y470-L472 VanDerWaalsContact C-N 3.32Å; L472-G474 VanDerWaalsContact C-N 3.33Å; L472-G474 PolarHBondContact O-N 3.36Å; L472-L475 PolarHBondContact O-N 3.01Å; L472-I476 HydrophobicContact CG-CD1 4.06Å; L472-I476 VanDerWaalsContact O-CG1 3.28Å; L472-I476 WeakPolarHBondContact O-CG1 3.31Å; L472-I476 PolarHBondContact O-N 3.29Å
473	I	92.6	Very high	93.3	Very high	79 Å²	79	61.6 Å²	61.6	41%	0.405	30%	0.304	S	S	.	.	H	α-helix	trans	-59.4	-45.5	175.4	-69	172.6	0	0	0	110.6	W469 Y470 L475 I476 I477	W469-I473 HydrophobicContact CE3-CD1 3.65Å; W469-I473 HydrophobicContact CZ3-CD1 3.9Å; W469-I473 WeakPolarHBondContact O-CG1 3.24Å; W469-I473 PolarHBondContact O-N 3.19Å; Y470-I473 PolarHBondContact O-N 2.82Å; I473-L475 PolarHBondContact O-N 2.76Å; I473-I476 PolarHBondContact O-N 3.19Å; I473-I477 HydrophobicContact CG2-CD1 3.94Å; I473-I477 WeakPolarHBondContact O-CG1 3.43Å; I473-I477 PolarHBondContact O-N 3.48Å; I473-I477 VanDerWaalsContact O-N 3.07Å
474	G	93.4	Very high	93.4	Very high	6 Å²	6	62 Å²	62	6%	0.062	30%	0.302	C	S	.	.	H	α-helix	trans	-58.4	-47.1	176.2	0	0	0	0	0	112.6	Y470 K471 L472 I476 I477 D478	Y470-G474 PolarHBondContact O-N 2.99Å; K471-G474 PolarHBondContact O-N 2.79Å; L472-G474 VanDerWaalsContact C-N 3.33Å; L472-G474 PolarHBondContact O-N 3.36Å; G474-I476 VanDerWaalsContact C-N 3.34Å; G474-I476 PolarHBondContact O-N 3.21Å; G474-I477 PolarHBondContact O-N 2.67Å; G474-D478 PolarHBondContact O-N 3.34Å
475	L	94.7	Very high	93.6	Very high	9 Å²	9	53.5 Å²	53.5	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-39.2	176.3	-72.2	175.2	0	0	0	113	W342 Q459 C462 K471 L472 I473 A479	W342-L475 HydrophobicContact CH2-CD1 3.99Å; W342-L475 HydrophobicContact CH2-CD2 4.17Å; W342-L475 HydrophobicContact CH2-CG 4.13Å; W342-L475 HydrophobicContact CZ2-CD1 4.35Å; W342-L475 HydrophobicContact CZ2-CD2 4.3Å; W342-L475 HydrophobicContact CZ2-CG 4.09Å; Q459-L475 HydrophobicContact CG-CD2 4.46Å; C462-L475 HydrophobicContact CB-CD1 4.07Å; C462-L475 HydrophobicContact CB-CD2 4.14Å; K471-L475 WeakPolarHBondContact O-CG 3.49Å; K471-L475 PolarHBondContact O-N 3.04Å; L472-L475 PolarHBondContact O-N 3.01Å; I473-L475 PolarHBondContact O-N 2.76Å; L475-A479 WeakPolarHBondContact O-CB 3.15Å; L475-A479 PolarHBondContact O-N 3.27Å
476	I	94.1	Very high	93.8	Very high	95 Å²	95	47.6 Å²	47.6	49%	0.487	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-45.5	177.8	-70.8	164.7	0	0	0	110.5	L472 I473 G474 A479 L480	L472-I476 HydrophobicContact CG-CD1 4.06Å; L472-I476 VanDerWaalsContact O-CG1 3.28Å; L472-I476 WeakPolarHBondContact O-CG1 3.31Å; L472-I476 PolarHBondContact O-N 3.29Å; I473-I476 PolarHBondContact O-N 3.19Å; G474-I476 VanDerWaalsContact C-N 3.34Å; G474-I476 PolarHBondContact O-N 3.21Å; I476-A479 WeakPolarHBondContact O-CB 3.41Å; I476-A479 PolarHBondContact O-N 2.77Å; I476-L480 PolarHBondContact O-N 3.48Å
477	I	94.4	Very high	94	Very high	36 Å²	36	52.9 Å²	52.9	19%	0.185	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-49	179.5	-70.1	172.3	0	0	0	110.4	T61 T65 I473 G474 A479 L480 F481	T61-I477 HydrophobicContact CG2-CG2 3.97Å; T65-I477 HydrophobicContact CG2-CB 4.25Å; T65-I477 HydrophobicContact CG2-CD1 3.94Å; T65-I477 HydrophobicContact CG2-CG2 4.22Å; I473-I477 HydrophobicContact CG2-CD1 3.94Å; I473-I477 WeakPolarHBondContact O-CG1 3.43Å; I473-I477 PolarHBondContact O-N 3.48Å; I473-I477 VanDerWaalsContact O-N 3.07Å; G474-I477 PolarHBondContact O-N 2.67Å; I477-A479 VanDerWaalsContact C-N 3.25Å; I477-A479 PolarHBondContact O-N 3.45Å; I477-L480 WeakPolarHBondContact O-CB 3.2Å; I477-L480 PolarHBondContact O-N 2.92Å; I477-F481 HydrophobicContact CG2-CE2 4.5Å; I477-F481 WeakPolarHBondContact O-CD2 3.08Å
478	D	94.1	Very high	94.3	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-31.3	178.1	-68.8	-25.3	0	0	0	112	H346 Q459 G474 L480 F481 C482	H346-D478 IonicContact CD2-OD2 3.26Å; H346-D478 PolarHBondContact CD2-OD2 3Å; H346-D478 VanDerWaalsContact CD2-OD2 3.3Å; H346-D478 IonicContact NE2-OD2 3.03Å; Q459-D478 VanDerWaalsContact NE2-C 3.25Å; Q459-D478 PolarHBondContact NE2-O 2.94Å; G474-D478 PolarHBondContact O-N 3.34Å; D478-L480 VanDerWaalsContact C-N 3.31Å; D478-L480 PolarHBondContact O-N 3.3Å; D478-F481 PolarHBondContact O-N 3.48Å; D478-C482 PolarHBondContact O-N 3.28Å
479	A	94.4	Very high	94.5	Very high	18 Å²	18	43.8 Å²	43.8	15%	0.149	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-36.8	178.1	0	0	0	0	0	112.4	Q459 L475 I476 I477 F481 C482 F483	Q459-A479 VanDerWaalsContact OE1-CA 3.29Å; L475-A479 WeakPolarHBondContact O-CB 3.15Å; L475-A479 PolarHBondContact O-N 3.27Å; I476-A479 WeakPolarHBondContact O-CB 3.41Å; I476-A479 PolarHBondContact O-N 2.77Å; I477-A479 VanDerWaalsContact C-N 3.25Å; I477-A479 PolarHBondContact O-N 3.45Å; A479-F481 VanDerWaalsContact C-N 3.28Å; A479-F481 PolarHBondContact O-N 3.02Å; A479-C482 PolarHBondContact O-N 3.05Å; A479-F483 HydrophobicContact CB-CD2 4.29Å; A479-F483 HydrophobicContact CB-CE2 4.19Å; A479-F483 WeakPolarHBondContact O-CD2 3.03Å; A479-F483 PolarHBondContact O-N 3.45Å
480	L	95.4	Very high	94.7	Very high	121 Å²	121	41.9 Å²	41.9	63%	0.634	21%	0.21	S	C	*	.	H	α-helix	trans	-56.6	-43.7	176.8	-64.4	174.2	0	0	0	111.6	I476 I477 D478 L484	I476-L480 PolarHBondContact O-N 3.48Å; I477-L480 WeakPolarHBondContact O-CB 3.2Å; I477-L480 PolarHBondContact O-N 2.92Å; D478-L480 VanDerWaalsContact C-N 3.31Å; D478-L480 PolarHBondContact O-N 3.3Å; L480-L484 WeakPolarHBondContact O-CB 3.37Å; L480-L484 PolarHBondContact O-N 2.98Å; L480-L484 VanDerWaalsContact O-N 3.14Å
481	F	96.3	Very high	94.9	Very high	23 Å²	23	44.4 Å²	44.4	10%	0.101	22%	0.22	C	C	.	.	H	α-helix	trans	-75.7	-33.6	178.7	-63.1	-82.2	0	0	0	112.7	L54 M57 L58 T61 V353 I477 D478 A479 L484 N485	L54-F481 HydrophobicContact CD1-CD1 3.86Å; L54-F481 HydrophobicContact CD1-CE1 3.6Å; L54-F481 HydrophobicContact CG-CD1 4.44Å; L54-F481 HydrophobicContact CG-CE1 4.32Å; M57-F481 HydrophobicContact CB-CE1 4.44Å; M57-F481 HydrophobicContact CB-CZ 4.2Å; L58-F481 HydrophobicContact CB-CD1 4.01Å; L58-F481 HydrophobicContact CB-CE1 3.72Å; L58-F481 HydrophobicContact CB-CZ 4.03Å; L58-F481 HydrophobicContact CD1-CB 4.03Å; L58-F481 HydrophobicContact CD1-CD1 3.98Å; L58-F481 HydrophobicContact CD1-CD2 3.72Å; L58-F481 HydrophobicContact CD1-CE1 4.34Å; L58-F481 HydrophobicContact CD1-CE2 4.12Å; L58-F481 HydrophobicContact CD1-CG 3.65Å; L58-F481 HydrophobicContact CD1-CZ 4.41Å; L58-F481 HydrophobicContact CG-CD1 4.44Å; T61-F481 HydrophobicContact CG2-CE2 4.45Å; T61-F481 WeakPolarHBondContact OG1-CE2 3.36Å; V353-F481 HydrophobicContact CG1-CB 3.59Å; I477-F481 HydrophobicContact CG2-CE2 4.5Å; I477-F481 WeakPolarHBondContact O-CD2 3.08Å; D478-F481 PolarHBondContact O-N 3.48Å; A479-F481 VanDerWaalsContact C-N 3.28Å; A479-F481 PolarHBondContact O-N 3.02Å; F481-L484 PolarHBondContact O-N 3.37Å; F481-N485 WeakPolarHBondContact O-CB 3.33Å; F481-N485 PolarHBondContact O-N 3.24Å; F481-N485 PolarHBondContact O-ND2 2.79Å
482	C	96.2	Very high	94.8	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-45.2	173	-83	0	0	0	0	112.4	V353 V456 Q459 D478 A479 L484 N485 L486	V353-C482 WeakPolarHBondContact CG2-SG 3.22Å; V456-C482 HydrophobicContact CG2-CB 3.8Å; Q459-C482 PolarHBondContact NE2-SG 2.86Å; Q459-C482 PolarHBondContact OE1-SG 2.86Å; D478-C482 PolarHBondContact O-N 3.28Å; A479-C482 PolarHBondContact O-N 3.05Å; C482-L484 VanDerWaalsContact C-N 3.32Å; C482-L484 PolarHBondContact O-N 3.21Å; C482-N485 PolarHBondContact O-N 2.8Å; C482-L486 WeakPolarHBondContact O-CB 3.44Å; C482-L486 PolarHBondContact O-N 2.88Å
483	F	96.3	Very high	94.8	Very high	110 Å²	110	42 Å²	42	48%	0.482	21%	0.209	S	C	.	.	H	α-helix	trans	-64	-38.1	175.7	-78.6	-63.5	0	0	0	112.1	V456 A479 L486 Y487	V456-F483 HydrophobicContact CG1-CD1 4.29Å; V456-F483 HydrophobicContact CG1-CE1 3.65Å; V456-F483 HydrophobicContact CG1-CZ 3.91Å; V456-F483 HydrophobicContact CG2-CD1 4.46Å; A479-F483 HydrophobicContact CB-CD2 4.29Å; A479-F483 HydrophobicContact CB-CE2 4.19Å; A479-F483 WeakPolarHBondContact O-CD2 3.03Å; A479-F483 PolarHBondContact O-N 3.45Å; F483-L486 PolarHBondContact O-N 3.33Å; F483-Y487 WeakPolarHBondContact O-CB 3.33Å; F483-Y487 PolarHBondContact O-N 3.42Å
484	L	95.6	Very high	94.8	Very high	60 Å²	60	44 Å²	44	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-61.5	-47.1	173.2	178.7	61	0	0	0	111.7	L54 L480 F481 C482 L486 Y487 L488	L54-L484 HydrophobicContact CD1-CD2 3.53Å; L54-L484 HydrophobicContact CD2-CD2 3.36Å; L54-L484 HydrophobicContact CG-CD2 4.06Å; L480-L484 WeakPolarHBondContact O-CB 3.37Å; L480-L484 PolarHBondContact O-N 2.98Å; L480-L484 VanDerWaalsContact O-N 3.14Å; F481-L484 PolarHBondContact O-N 3.37Å; C482-L484 VanDerWaalsContact C-N 3.32Å; C482-L484 PolarHBondContact O-N 3.21Å; L484-L486 PolarHBondContact O-N 2.75Å; L484-Y487 PolarHBondContact O-N 3.25Å; L484-L488 HydrophobicContact CD1-CD1 4.44Å; L484-L488 HydrophobicContact CD1-CG 4.39Å; L484-L488 HydrophobicContact CG-CD1 4.31Å; L484-L488 VanDerWaalsContact O-CG 3.31Å; L484-L488 WeakPolarHBondContact O-CG 3.4Å; L484-L488 PolarHBondContact O-N 3.42Å
485	N	96.6	Very high	94.6	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-43.8	175.2	-87.4	-50.5	0	0	0	111.9	V353 L356 L357 F481 C482 Y487 L488 H489	V353-N485 PolarHBondContact O-ND2 3.47Å; V353-N485 VanDerWaalsContact O-ND2 3.1Å; L356-N485 HydrophobicContact CB-CB 4.28Å; L356-N485 WeakPolarHBondContact CB-OD1 3.45Å; L356-N485 HydrophobicContact CD1-CB 4.34Å; L357-N485 WeakPolarHBondContact CA-OD1 3.4Å; L357-N485 PolarHBondContact N-OD1 2.94Å; F481-N485 WeakPolarHBondContact O-CB 3.33Å; F481-N485 PolarHBondContact O-N 3.24Å; F481-N485 PolarHBondContact O-ND2 2.79Å; C482-N485 PolarHBondContact O-N 2.8Å; N485-Y487 VanDerWaalsContact C-N 3.34Å; N485-Y487 PolarHBondContact O-N 3.25Å; N485-L488 PolarHBondContact O-N 2.93Å; N485-H489 WeakPolarHBondContact O-CB 3.49Å; N485-H489 PolarHBondContact O-CD2 3.38Å; N485-H489 PolarHBondContact O-N 2.99Å
486	L	97	Very high	94.4	Very high	43 Å²	43	45.5 Å²	45.5	23%	0.225	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-44.6	176.6	-179.4	64.3	0	0	0	111.1	L449 V456 C482 F483 L484 S490	L449-L486 HydrophobicContact CD1-CD1 4.04Å; V456-L486 HydrophobicContact CG2-CB 4.13Å; V456-L486 HydrophobicContact CG2-CD2 4.06Å; C482-L486 WeakPolarHBondContact O-CB 3.44Å; C482-L486 PolarHBondContact O-N 2.88Å; F483-L486 PolarHBondContact O-N 3.33Å; L484-L486 PolarHBondContact O-N 2.75Å; L486-S490 WeakPolarHBondContact O-CB 3.11Å; L486-S490 PolarHBondContact O-N 3.17Å; L486-S490 PolarHBondContact O-OG 3.28Å
487	Y	95.7	Very high	94.3	Very high	135 Å²	135	46.5 Å²	46.5	53%	0.529	23%	0.229	S	C	.	.	H	α-helix	trans	-59.9	-47.9	175	168.3	-105.6	0	0	0	112	F483 L484 N485 S490 R491	F483-Y487 WeakPolarHBondContact O-CB 3.33Å; F483-Y487 PolarHBondContact O-N 3.42Å; L484-Y487 PolarHBondContact O-N 3.25Å; N485-Y487 VanDerWaalsContact C-N 3.34Å; N485-Y487 PolarHBondContact O-N 3.25Å; Y487-S490 WeakPolarHBondContact CA-OG 3.34Å; Y487-S490 PolarHBondContact O-OG 3.3Å; Y487-R491 VanDerWaalsContact O-CB 3.28Å; Y487-R491 WeakPolarHBondContact O-CB 3.33Å; Y487-R491 PolarHBondContact O-N 3.35Å
488	L	94.4	Very high	94	Very high	13 Å²	13	50.9 Å²	50.9	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-46	-179.6	-71.1	177.2	0	0	0	112.3	L484 N485 N492	L484-L488 HydrophobicContact CD1-CD1 4.44Å; L484-L488 HydrophobicContact CD1-CG 4.39Å; L484-L488 HydrophobicContact CG-CD1 4.31Å; L484-L488 VanDerWaalsContact O-CG 3.31Å; L484-L488 WeakPolarHBondContact O-CG 3.4Å; L484-L488 PolarHBondContact O-N 3.42Å; N485-L488 PolarHBondContact O-N 2.93Å; L488-N492 WeakPolarHBondContact O-CB 3.46Å; L488-N492 PolarHBondContact O-N 3.08Å; L488-N492 PolarHBondContact O-OD1 3.16Å
489	H	95.4	Very high	93.7	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.019	25%	0.248	C	C	.	.	H	α-helix	trans	-77.4	-33.8	-178.1	-71.2	-62.4	0	0	0	112.9	L356 N485 N492 S493	L356-H489 PolarHBondContact O-NE2 3.14Å; L356-H489 VanDerWaalsContact O-NE2 3.07Å; N485-H489 WeakPolarHBondContact O-CB 3.49Å; N485-H489 PolarHBondContact O-CD2 3.38Å; N485-H489 PolarHBondContact O-N 2.99Å; H489-N492 PolarHBondContact O-N 3.15Å; H489-S493 VanDerWaalsContact O-CB 3.28Å; H489-S493 WeakPolarHBondContact O-CB 3.42Å; H489-S493 PolarHBondContact O-N 3.13Å
490	S	94.6	Very high	93.3	Very high	32 Å²	32	50.8 Å²	50.8	22%	0.224	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-46.3	173.8	59.6	0	0	0	0	111.9	L486 Y487 N492 S493 I494	L486-S490 WeakPolarHBondContact O-CB 3.11Å; L486-S490 PolarHBondContact O-N 3.17Å; L486-S490 PolarHBondContact O-OG 3.28Å; Y487-S490 WeakPolarHBondContact CA-OG 3.34Å; Y487-S490 PolarHBondContact O-OG 3.3Å; S490-N492 VanDerWaalsContact C-N 3.3Å; S490-N492 PolarHBondContact O-N 3.27Å; S490-S493 PolarHBondContact O-N 3.02Å; S490-S493 VanDerWaalsContact O-N 3.17Å; S490-I494 VanDerWaalsContact O-CG1 3.27Å; S490-I494 WeakPolarHBondContact O-CG1 3.38Å; S490-I494 PolarHBondContact O-N 3.1Å
491	R	94	Very high	92.7	Very high	61 Å²	61	47.4 Å²	47.4	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-54.8	-48.3	174.2	-176.7	-168.8	73	-178.7	7.6	111.3	P44 Y487 L495	P44-R491 PolarHBondContact O-NH2 3.16Å; P44-R491 VanDerWaalsContact O-NH2 3.15Å; Y487-R491 VanDerWaalsContact O-CB 3.28Å; Y487-R491 WeakPolarHBondContact O-CB 3.33Å; Y487-R491 PolarHBondContact O-N 3.35Å; R491-L495 WeakPolarHBondContact O-CB 3.47Å; R491-L495 PolarHBondContact O-N 3.43Å
492	N	92.1	Very high	91.8	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.048	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-41.9	178.5	-79.7	6.4	0	0	0	112	H360 C365 L488 H489 S490 L495 V496	H360-N492 PolarHBondContact CE1-ND2 2.83Å; H360-N492 PolarHBondContact ND1-ND2 2.9Å; C365-N492 WeakPolarHBondContact SG-CB 3.3Å; C365-N492 PolarHBondContact SG-ND2 2.83Å; C365-N492 VanDerWaalsContact SG-ND2 3.38Å; L488-N492 WeakPolarHBondContact O-CB 3.46Å; L488-N492 PolarHBondContact O-N 3.08Å; L488-N492 PolarHBondContact O-OD1 3.16Å; H489-N492 PolarHBondContact O-N 3.15Å; S490-N492 VanDerWaalsContact C-N 3.3Å; S490-N492 PolarHBondContact O-N 3.27Å; N492-L495 PolarHBondContact O-N 2.97Å; N492-V496 WeakPolarHBondContact O-CB 3.07Å; N492-V496 VanDerWaalsContact O-CG2 3.29Å; N492-V496 WeakPolarHBondContact O-CG2 3.44Å; N492-V496 PolarHBondContact O-N 2.85Å
493	S	92.9	Very high	90.6	Very high	19 Å²	19	52.6 Å²	52.6	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-43.5	178.5	-169	0	0	0	0	113.2	S445 H489 S490 L495 V496 H497	S445-S493 WeakPolarHBondContact OG-CA 3.39Å; S445-S493 WeakPolarHBondContact OG-CB 3.42Å; S445-S493 PolarHBondContact OG-N 2.86Å; H489-S493 VanDerWaalsContact O-CB 3.28Å; H489-S493 WeakPolarHBondContact O-CB 3.42Å; H489-S493 PolarHBondContact O-N 3.13Å; S490-S493 PolarHBondContact O-N 3.02Å; S490-S493 VanDerWaalsContact O-N 3.17Å; S493-L495 VanDerWaalsContact C-N 3.29Å; S493-L495 PolarHBondContact O-N 3.41Å; S493-V496 PolarHBondContact O-N 2.88Å; S493-H497 WeakPolarHBondContact O-CB 3.27Å; S493-H497 PolarHBondContact O-N 3.47Å
494	I	92.4	Very high	88.9	Confident	121 Å²	121	53.4 Å²	53.4	62%	0.621	26%	0.257	S	S	*	.	H	α-helix	trans	-59.8	-43.7	174.7	-67.5	164.5	0	0	0	110.1	S490 H497 F498	S490-I494 VanDerWaalsContact O-CG1 3.27Å; S490-I494 WeakPolarHBondContact O-CG1 3.38Å; S490-I494 PolarHBondContact O-N 3.1Å; I494-H497 PolarHBondContact O-N 3.4Å; I494-F498 WeakPolarHBondContact O-CB 3.47Å; I494-F498 PolarHBondContact O-N 3.09Å
495	L	90.8	Very high	87	Confident	39 Å²	39	52.6 Å²	52.6	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-52.3	178.1	-175	66.9	0	0	0	112.4	F40 P41 V43 R491 N492 S493 H497 F498 V499	F40-L495 HydrophobicContact CE1-CD2 3.86Å; F40-L495 HydrophobicContact CZ-CD2 3.74Å; F40-L495 HydrophobicContact CZ-CG 4.17Å; P41-L495 HydrophobicContact CG-CD1 3.6Å; P41-L495 HydrophobicContact CG-CD2 4.33Å; P41-L495 HydrophobicContact CG-CG 4.33Å; V43-L495 HydrophobicContact CG2-CD2 3.21Å; R491-L495 WeakPolarHBondContact O-CB 3.47Å; R491-L495 PolarHBondContact O-N 3.43Å; N492-L495 PolarHBondContact O-N 2.97Å; S493-L495 VanDerWaalsContact C-N 3.29Å; S493-L495 PolarHBondContact O-N 3.41Å; L495-H497 VanDerWaalsContact C-N 3.29Å; L495-H497 PolarHBondContact O-N 3.49Å; L495-F498 PolarHBondContact O-N 3.21Å; L495-V499 WeakPolarHBondContact O-CG2 3.2Å; L495-V499 PolarHBondContact O-N 3.35Å
496	V	90.8	Very high	84.8	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-41.2	178.3	170.4	0	0	0	0	110.1	F40 C365 P441 K442 N492 S493 F498 Y500	F40-V496 HydrophobicContact CZ-CG2 4.45Å; C365-V496 HydrophobicContact CB-CG2 4.27Å; P441-V496 HydrophobicContact CB-CG1 4.46Å; K442-V496 HydrophobicContact CG-CG1 4.15Å; N492-V496 WeakPolarHBondContact O-CB 3.07Å; N492-V496 VanDerWaalsContact O-CG2 3.29Å; N492-V496 WeakPolarHBondContact O-CG2 3.44Å; N492-V496 PolarHBondContact O-N 2.85Å; S493-V496 PolarHBondContact O-N 2.88Å; V496-F498 PolarHBondContact O-N 3.04Å; V496-Y500 HydrophobicContact CB-CD2 4.49Å; V496-Y500 HydrophobicContact CG1-CD2 3.7Å; V496-Y500 HydrophobicContact CG1-CE2 4.03Å; V496-Y500 VanDerWaalsContact O-CD2 3.25Å; V496-Y500 WeakPolarHBondContact O-CD2 3.48Å; V496-Y500 PolarHBondContact O-N 3.07Å
497	H	90.6	Very high	82.6	Confident	116 Å²	116	59.2 Å²	59.2	54%	0.537	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-47.6	176	-174	91.6	0	0	0	111.6	S493 I494 L495 S501	S493-H497 WeakPolarHBondContact O-CB 3.27Å; S493-H497 PolarHBondContact O-N 3.47Å; I494-H497 PolarHBondContact O-N 3.4Å; L495-H497 VanDerWaalsContact C-N 3.29Å; L495-H497 PolarHBondContact O-N 3.49Å; H497-S501 WeakPolarHBondContact O-CB 3.36Å; H497-S501 PolarHBondContact O-N 3.41Å; H497-S501 PolarHBondContact O-OG 3.49Å
498	F	88.8	Confident	80	Confident	127 Å²	127	58.1 Å²	58.1	56%	0.557	30%	0.296	S	S	*	.	H	α-helix	trans	-60.7	-50.7	179.6	-179.6	-100.8	0	0	0	111.8	I494 L495 V496 S501	I494-F498 WeakPolarHBondContact O-CB 3.47Å; I494-F498 PolarHBondContact O-N 3.09Å; L495-F498 PolarHBondContact O-N 3.21Å; V496-F498 PolarHBondContact O-N 3.04Å; F498-S501 PolarHBondContact O-N 3.47Å; F498-S501 PolarHBondContact O-OG 2.9Å
499	V	87.1	Confident	77.7	Confident	9 Å²	9	61.1 Å²	61.1	6%	0.055	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-52.3	-178.2	174.6	0	0	0	0	111.3	C38 F40 P41 L495 S501 Q502	C38-V499 HydrophobicContact CB-CG1 3.94Å; F40-V499 HydrophobicContact CD2-CG1 4.15Å; F40-V499 HydrophobicContact CD2-CG2 4.31Å; F40-V499 HydrophobicContact CE2-CG2 4.28Å; P41-V499 HydrophobicContact CG-CG2 4.49Å; L495-V499 WeakPolarHBondContact O-CG2 3.2Å; L495-V499 PolarHBondContact O-N 3.35Å; V499-S501 PolarHBondContact O-N 3.01Å; V499-Q502 PolarHBondContact O-N 2.89Å
500	Y	86.9	Confident	75.1	Confident	11 Å²	11	65.4 Å²	65.4	4%	0.043	34%	0.341	C	S	.	.	H	α-helix	trans	-87.7	-0.2	-174.3	-63.8	-72.6	0	0	0	114	F40 D369 H372 P441 K442 V496 Q502 E503	F40-Y500 HydrophobicContact CE2-CE2 4.44Å; D369-Y500 WeakPolarHBondContact CA-OH 3.32Å; D369-Y500 WeakPolarHBondContact CB-OH 2.93Å; D369-Y500 PolarHBondContact OD1-OH 3.24Å; H372-Y500 AromaticContact CD2-CE1 3.39Å; H372-Y500 WeakPolarHBondContact CD2-CE1 3.3Å; H372-Y500 AromaticContact CD2-CZ 3.76Å; H372-Y500 AromaticContact NE2-CE1 3.6Å; P441-Y500 HydrophobicContact CB-CE2 3.99Å; P441-Y500 HydrophobicContact CG-CD1 4.15Å; P441-Y500 HydrophobicContact CG-CD2 3.58Å; P441-Y500 HydrophobicContact CG-CE1 3.84Å; P441-Y500 HydrophobicContact CG-CE2 3.19Å; P441-Y500 HydrophobicContact CG-CG 4.02Å; K442-Y500 WeakPolarHBondContact CE-O 3.3Å; K442-Y500 VanDerWaalsContact NZ-C 3.26Å; K442-Y500 PolarHBondContact NZ-O 3.42Å; V496-Y500 HydrophobicContact CB-CD2 4.49Å; V496-Y500 HydrophobicContact CG1-CD2 3.7Å; V496-Y500 HydrophobicContact CG1-CE2 4.03Å; V496-Y500 VanDerWaalsContact O-CD2 3.25Å; V496-Y500 WeakPolarHBondContact O-CD2 3.48Å; V496-Y500 PolarHBondContact O-N 3.07Å; Y500-Q502 VanDerWaalsContact C-N 3.29Å; Y500-E503 VanDerWaalsContact CD1-OE2 3.27Å; Y500-E503 WeakPolarHBondContact CD1-OE2 3.31Å
501	S	83.4	Confident	72.3	Confident	50 Å²	50	72 Å²	72	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-69.2	-33.1	166.1	67.1	0	0	0	0	111	H497 F498 V499	H497-S501 WeakPolarHBondContact O-CB 3.36Å; H497-S501 PolarHBondContact O-N 3.41Å; H497-S501 PolarHBondContact O-OG 3.49Å; F498-S501 PolarHBondContact O-N 3.47Å; F498-S501 PolarHBondContact O-OG 2.9Å; V499-S501 PolarHBondContact O-N 3.01Å
502	Q	76	Confident	69.8	Low	92 Å²	92	74 Å²	74	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-71.2	-36.1	-178.2	-58.6	-176.7	28	0	0	112.3	V499 Y500 K504 G505 W506	V499-Q502 PolarHBondContact O-N 2.89Å; Y500-Q502 VanDerWaalsContact C-N 3.29Å; Q502-K504 PolarHBondContact O-N 3.37Å; Q502-G505 WeakPolarHBondContact O-CA 3.39Å; Q502-G505 PolarHBondContact O-N 3.07Å; Q502-G505 VanDerWaalsContact O-N 3.08Å; Q502-W506 PolarHBondContact O-N 3.27Å
503	E	70.3	Confident	67.2	Low	42 Å²	42	74.8 Å²	74.8	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-39.6	-178.5	-169	176.7	-178.7	0	0	113.2	H372 Y500 G505 W506 S507	H372-E503 IonicContact NE2-OE2 3.41Å; Y500-E503 VanDerWaalsContact CD1-OE2 3.27Å; Y500-E503 WeakPolarHBondContact CD1-OE2 3.31Å; E503-G505 VanDerWaalsContact C-N 3.26Å; E503-G505 PolarHBondContact O-N 3.17Å; E503-W506 WeakPolarHBondContact O-CB 3.4Å; E503-W506 PolarHBondContact O-N 2.81Å; E503-W506 VanDerWaalsContact O-N 3.1Å; E503-S507 PolarHBondContact O-N 2.84Å; E503-S507 VanDerWaalsContact O-N 3.11Å
504	K	62.3	Low	64.7	Low	128 Å²	128	79 Å²	79	56%	0.557	41%	0.407	S	S	*	.	H	α-helix	trans	-66.8	-29	174.6	-70.6	-167.2	177.9	-172.9	0	112.6	Q502 W506 S507 L508	Q502-K504 PolarHBondContact O-N 3.37Å; K504-W506 PolarHBondContact O-N 3.01Å; K504-S507 PolarHBondContact O-N 2.85Å; K504-S507 PolarHBondContact O-OG 3.5Å; K504-S507 VanDerWaalsContact O-OG 3.1Å; K504-L508 PolarHBondContact O-N 2.86Å
505	G	55.6	Low	62	Low	43 Å²	43	76.3 Å²	76.3	44%	0.443	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-37.5	171.5	0	0	0	0	0	111.8	Q502 E503 S509	Q502-G505 WeakPolarHBondContact O-CA 3.39Å; Q502-G505 PolarHBondContact O-N 3.07Å; Q502-G505 VanDerWaalsContact O-N 3.08Å; E503-G505 VanDerWaalsContact C-N 3.26Å; E503-G505 PolarHBondContact O-N 3.17Å; G505-S509 VanDerWaalsContact O-CB 3.28Å; G505-S509 WeakPolarHBondContact O-CB 3.31Å; G505-S509 PolarHBondContact O-N 3.19Å; G505-S509 VanDerWaalsContact O-N 3.16Å
506	W	49.3	Very low	59.2	Low	130 Å²	130	77.5 Å²	77.5	49%	0.492	41%	0.411	S	S	.	.	H	α-helix	trans	-75	-37.4	177.5	-63	-7.4	0	0	0	113.1	Q502 E503 K504 N510	Q502-W506 PolarHBondContact O-N 3.27Å; E503-W506 WeakPolarHBondContact O-CB 3.4Å; E503-W506 PolarHBondContact O-N 2.81Å; E503-W506 VanDerWaalsContact O-N 3.1Å; K504-W506 PolarHBondContact O-N 3.01Å; W506-N510 WeakPolarHBondContact O-CB 3.37Å; W506-N510 PolarHBondContact O-N 2.8Å
507	S	50.6	Low	56.4	Low	55 Å²	55	83.2 Å²	83.2	39%	0.385	44%	0.441	S	S	.	.	H	α-helix	trans	-67.3	-43.7	177.2	68	0	0	0	0	111.8	E503 K504 N510 Y511	E503-S507 PolarHBondContact O-N 2.84Å; E503-S507 VanDerWaalsContact O-N 3.11Å; K504-S507 PolarHBondContact O-N 2.85Å; K504-S507 PolarHBondContact O-OG 3.5Å; K504-S507 VanDerWaalsContact O-OG 3.1Å; S507-N510 PolarHBondContact O-N 2.86Å; S507-Y511 WeakPolarHBondContact O-CD2 3.49Å; S507-Y511 PolarHBondContact O-N 2.69Å
508	L	42.5	Very low	53.6	Low	113 Å²	113	87.1 Å²	87.1	59%	0.592	45%	0.451	S	S	*	.	H	α-helix	trans	-65.2	-41.2	177.1	-153.1	85.5	0	0	0	112.1	K504 N510 Y511 L512	K504-L508 PolarHBondContact O-N 2.86Å; L508-N510 VanDerWaalsContact C-N 3.31Å; L508-N510 PolarHBondContact O-N 2.95Å; L508-Y511 PolarHBondContact O-N 3.17Å; L508-L512 HydrophobicContact CD2-CD1 4.17Å; L508-L512 HydrophobicContact CG-CD1 4.2Å; L508-L512 WeakPolarHBondContact O-CB 3.35Å; L508-L512 WeakPolarHBondContact O-CG 3.37Å; L508-L512 PolarHBondContact O-N 3.04Å
509	S	45.2	Very low	50.9	Low	75 Å²	75	87.7 Å²	87.7	52%	0.524	46%	0.459	S	S	.	.	H	α-helix	trans	-58.2	-41.1	172.2	170.7	0	0	0	0	112.1	G505 G513	G505-S509 VanDerWaalsContact O-CB 3.28Å; G505-S509 WeakPolarHBondContact O-CB 3.31Å; G505-S509 PolarHBondContact O-N 3.19Å; G505-S509 VanDerWaalsContact O-N 3.16Å; S509-G513 WeakPolarHBondContact O-CA 3.46Å; S509-G513 PolarHBondContact O-N 2.94Å
510	N	40.8	Very low	48.3	Very low	95 Å²	95	96.1 Å²	96.1	51%	0.508	50%	0.495	S	S	.	.	H	α-helix	trans	-69.3	-40.1	177.4	-77.3	-16.2	0	0	0	112.1	W506 S507 L508 G513 I514	W506-N510 WeakPolarHBondContact O-CB 3.37Å; W506-N510 PolarHBondContact O-N 2.8Å; S507-N510 PolarHBondContact O-N 2.86Å; L508-N510 VanDerWaalsContact C-N 3.31Å; L508-N510 PolarHBondContact O-N 2.95Å; N510-G513 PolarHBondContact O-N 3.04Å; N510-I514 WeakPolarHBondContact O-CB 3.35Å; N510-I514 VanDerWaalsContact O-CD1 3.31Å; N510-I514 WeakPolarHBondContact O-CD1 3.5Å; N510-I514 WeakPolarHBondContact O-CG1 3.13Å; N510-I514 PolarHBondContact O-N 3.14Å
511	Y	36.1	Very low	45.7	Very low	170 Å²	170	100 Å²	100	67%	0.667	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-39.8	175.9	-82.2	-74.3	0	0	0	112.7	S507 L508 S515	S507-Y511 WeakPolarHBondContact O-CD2 3.49Å; S507-Y511 PolarHBondContact O-N 2.69Å; L508-Y511 PolarHBondContact O-N 3.17Å; Y511-S515 PolarHBondContact O-N 3.03Å; Y511-S515 PolarHBondContact O-OG 3.08Å
512	L	40.5	Very low	43.2	Very low	103 Å²	103	102.2 Å²	102.2	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-73.5	-36.4	175.7	-72.7	167.7	0	0	0	112.1	L508 S515 S516	L508-L512 HydrophobicContact CD2-CD1 4.17Å; L508-L512 HydrophobicContact CG-CD1 4.2Å; L508-L512 WeakPolarHBondContact O-CB 3.35Å; L508-L512 WeakPolarHBondContact O-CG 3.37Å; L508-L512 PolarHBondContact O-N 3.04Å; L512-S515 WeakPolarHBondContact CA-OG 3.46Å; L512-S515 PolarHBondContact O-N 2.89Å; L512-S515 PolarHBondContact O-OG 3.36Å; L512-S516 VanDerWaalsContact O-CB 3.3Å; L512-S516 WeakPolarHBondContact O-CB 3.37Å; L512-S516 PolarHBondContact O-N 2.79Å; L512-S516 PolarHBondContact O-OG 3.16Å
513	G	37.4	Very low	41	Very low	26 Å²	26	102.9 Å²	102.9	27%	0.268	55%	0.554	S	S	.	*	H	α-helix	trans	-65.7	-38.6	176.3	0	0	0	0	0	112.7	S509 N510 L517	S509-G513 WeakPolarHBondContact O-CA 3.46Å; S509-G513 PolarHBondContact O-N 2.94Å; N510-G513 PolarHBondContact O-N 3.04Å; G513-L517 WeakPolarHBondContact O-CB 3.45Å; G513-L517 WeakPolarHBondContact O-CD1 3.49Å; G513-L517 PolarHBondContact O-N 2.95Å
514	I	41.8	Very low	39.1	Very low	106 Å²	106	105.9 Å²	105.9	54%	0.544	58%	0.58	S	S	.	*	H	α-helix	trans	-76.4	-29.6	179.8	-64.2	164	0	0	0	112.1	N510	N510-I514 WeakPolarHBondContact O-CB 3.35Å; N510-I514 VanDerWaalsContact O-CD1 3.31Å; N510-I514 WeakPolarHBondContact O-CD1 3.5Å; N510-I514 WeakPolarHBondContact O-CG1 3.13Å; N510-I514 PolarHBondContact O-N 3.14Å
515	S	34.4	Very low	37.6	Very low	65 Å²	65	104.2 Å²	104.2	46%	0.455	58%	0.584	S	S	.	*	H	α-helix	trans	-84.3	-35.8	178.5	50.8	0	0	0	0	113.4	Y511 L512	Y511-S515 PolarHBondContact O-N 3.03Å; Y511-S515 PolarHBondContact O-OG 3.08Å; L512-S515 WeakPolarHBondContact CA-OG 3.46Å; L512-S515 PolarHBondContact O-N 2.89Å; L512-S515 PolarHBondContact O-OG 3.36Å
516	S	33.3	Very low	36.3	Very low	64 Å²	64	107.6 Å²	107.6	45%	0.448	60%	0.601	S	S	.	*	H	α-helix	trans	-77.8	-33.8	-179.8	58	0	0	0	0	114	L512 R518	L512-S516 VanDerWaalsContact O-CB 3.3Å; L512-S516 WeakPolarHBondContact O-CB 3.37Å; L512-S516 PolarHBondContact O-N 2.79Å; L512-S516 PolarHBondContact O-OG 3.16Å; S516-R518 PolarHBondContact O-N 2.98Å
517	L	32.4	Very low	35.5	Very low	127 Å²	127	107 Å²	107	67%	0.665	61%	0.612	S	S	*	*	H	α-helix	trans	-77.3	-18.2	-178.4	-78.4	162.4	0	0	0	114.4	G513 S521	G513-L517 WeakPolarHBondContact O-CB 3.45Å; G513-L517 WeakPolarHBondContact O-CD1 3.49Å; G513-L517 PolarHBondContact O-N 2.95Å; L517-S521 PolarHBondContact O-OG 3.46Å; L517-S521 VanDerWaalsContact O-OG 3.13Å
518	R	31.5	Very low	34.5	Very low	198 Å²	198	110.9 Å²	110.9	75%	0.747	63%	0.633	S	S	*	*	H	α-helix	trans	-86.8	-20.2	175.8	-70.5	-168	-161.6	-158.7	4.5	114.1	S516	S516-R518 PolarHBondContact O-N 2.98Å
519	L	32.5	Very low	34	Very low	139 Å²	139	110.5 Å²	110.5	73%	0.728	64%	0.64	S	S	*	*	H	α-helix	trans	-80.7	-19.2	176.1	-88.9	155.2	0	0	0	113.1
520	F	31.7	Very low	33.5	Very low	187 Å²	187	114.6 Å²	114.6	82%	0.82	66%	0.655	S	S	*	*	S	Bend	trans	-104.3	-0.7	-177.6	-85.1	-76.3	0	0	0	115.9
521	S	32.2	Very low	32.9	Very low	91 Å²	91	114.5 Å²	114.5	64%	0.636	66%	0.662	S	S	*	*			trans	-105.7	5.4	-179.4	52.6	0	0	0	0	115.4	L517 S523	L517-S521 PolarHBondContact O-OG 3.46Å; L517-S521 VanDerWaalsContact O-OG 3.13Å; S521-S523 VanDerWaalsContact C-N 3.34Å; S521-S523 PolarHBondContact O-N 3.38Å
522	S	31.3	Very low	33.1	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	69%	0.691	S	S	*	*	S	Bend	trans	-87.3	66.5	168.2	61.6	0	0	0	0	111.5
523	S	29.5	Very low	32.7	Very low	106 Å²	106	118.7 Å²	118.7	74%	0.741	70%	0.699	S	S	*	*			trans	175.2	76.9	161.7	40.9	0	0	0	0	113.4	S521	S521-S523 VanDerWaalsContact C-N 3.34Å; S521-S523 PolarHBondContact O-N 3.38Å
524	S	30	Very low	32.5	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	72%	0.722	S	S	*	*			trans	-174.5	106	153.1	48	0	0	0	0	109.1
525	S	31.8	Very low	31.9	Very low	92 Å²	92	124.5 Å²	124.5	64%	0.643	73%	0.731	S	S	*	*				100	97.3	111	62.6	0	0	0	0	110.5
526	S	28.4	Very low	31.8	Very low	115 Å²	115	128 Å²	128	80%	0.804	75%	0.748	S	S	*	*				39.4	89.3	67.7	76.1	0	0	0	0	114.1
527	T	32.7	Very low	31.7	Very low	117 Å²	117	132 Å²	132	72%	0.718	77%	0.767	S	S	*	*			trans	-174.7	99	155.7	27.6	0	0	0	0	106.8
528	T	27.9	Very low	31.7	Very low	136 Å²	136	132.3 Å²	132.3	83%	0.834	77%	0.773	S	S	*	*				44.8	106.3	89.6	58.2	0	0	0	0	115.4
529	S	33.9	Very low	31.7	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	78%	0.775	S	S	*	*			trans	-153.1	98.8	152.3	58.6	0	0	0	0	107.3
530	I	34.2	Very low	31.6	Very low	160 Å²	160	126.8 Å²	126.8	82%	0.821	78%	0.779	S	S	*	*				92.5	121.3	88.8	-72.2	159.5	0	0	0	111.6
531	S	28.5	Very low	31.6	Very low	94 Å²	94	121.8 Å²	121.8	66%	0.657	78%	0.775	S	S	*	*			trans	-46.7	145.1	172.6	48.3	0	0	0	0	116.2
532	N	39.1	Very low	31.6	Very low	241 Å²	241	124.5 Å²	124.5	100%	1.289	79%	0.788	S	S	*	*				-119	0	118.2	-91.8	-15.2	0	0	0	108.6

Retrieved 532 of 532 residues in 989.6 ms (Link to these results)

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