A0A077ZGD6_TRITR Loading...

Diuretic hormone receptor

AlphaFold DB , UniProt , Accession A0A077ZGD6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 269 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	33.5	Very low	51.1	Low	236 Å²	236	115.4 Å²	115.4	100%	1.163	57%	0.573	S	S	*	*				0	112	0	-73.2	171.9	72.2	0	0	106.7	K3	M1-K3 PolarHBondContact O-N 3.36Å
2	E	31.3	Very low	52.1	Low	194 Å²	194	117.8 Å²	117.8	91%	0.907	58%	0.582	S	S	*	*			trans	-58.7	121.8	174.3	-141.5	163.7	163.2	0	0	107.5	Q4	E2-Q4 PolarHBondContact O-N 2.88Å
3	K	38.6	Very low	52.7	Low	188 Å²	188	112.5 Å²	112.5	82%	0.817	58%	0.576	S	S	*	*			trans	-63.2	113.2	173.8	-74.6	-172.6	176.3	-171.7	0	106.1	M1 Q5	M1-K3 PolarHBondContact O-N 3.36Å; K3-Q5 PolarHBondContact O-N 3.08Å
4	Q	46.4	Very low	53.7	Low	163 Å²	163	110.4 Å²	110.4	76%	0.762	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-52.5	130.2	172.3	-81.1	173.3	-62.5	0	0	108.1	E2 L6	E2-Q4 PolarHBondContact O-N 2.88Å; Q4-L6 PolarHBondContact O-N 3.13Å
5	Q	50.2	Low	53.8	Low	162 Å²	162	109.1 Å²	109.1	76%	0.757	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-62.5	119.9	-179.2	-161.2	136.1	-28.4	0	0	107.9	K3 R11	K3-Q5 PolarHBondContact O-N 3.08Å; Q5-R11 VanDerWaalsContact CG-NH2 3.26Å
6	L	55.4	Low	53.6	Low	50 Å²	50	110.8 Å²	110.8	26%	0.262	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-50.6	133.8	176.8	-94.3	75.5	0	0	0	109.4	Q4 C10 A28	Q4-L6 PolarHBondContact O-N 3.13Å; L6-C10 HydrophobicContact CD2-CB 4.28Å; L6-A28 HydrophobicContact CD2-CB 3.99Å
7	P	59.5	Low	53.4	Low	38 Å²	38	110.1 Å²	110.1	25%	0.247	57%	0.573	C	S	.	*	P	Polyproline II helix	trans	-50	147.3	170.3	-24.9	32.9	0	0	0	110.8	S9 C10 R11 F30	P7-S9 PolarHBondContact O-N 3.1Å; P7-C10 PolarHBondContact O-N 3.45Å; P7-R11 PolarHBondContact O-N 3.08Å; P7-F30 HydrophobicContact CG-CB 4.49Å; P7-F30 HydrophobicContact CG-CD1 3.79Å; P7-F30 HydrophobicContact CG-CE1 4.17Å; P7-F30 HydrophobicContact CG-CG 4.12Å
8	A	58.8	Low	53.3	Low	65 Å²	65	110.3 Å²	110.3	54%	0.537	57%	0.566	S	S	.	*	H	α-helix	trans	-55.5	-41.1	-178.1	0	0	0	0	0	111.6	C10 R11 E12	A8-C10 PolarHBondContact O-N 2.84Å; A8-R11 PolarHBondContact O-N 3.36Å; A8-R11 VanDerWaalsContact O-N 3.12Å; A8-E12 WeakPolarHBondContact O-CB 3.19Å; A8-E12 WeakPolarHBondContact O-CG 3.4Å; A8-E12 PolarHBondContact O-N 3.17Å
9	S	62.1	Low	53	Low	60 Å²	60	112.1 Å²	112.1	42%	0.42	58%	0.575	S	S	.	*	H	α-helix	trans	-54.2	-46	174.1	52.1	0	0	0	0	113.1	P7 R11 E12 G13	P7-S9 PolarHBondContact O-N 3.1Å; S9-R11 VanDerWaalsContact C-N 3.35Å; S9-R11 PolarHBondContact O-N 3.22Å; S9-E12 PolarHBondContact O-N 3.05Å; S9-G13 PolarHBondContact O-N 3.21Å
10	C	64.9	Low	52.7	Low	3 Å²	3	114.4 Å²	114.4	2%	0.02	59%	0.588	C	S	.	*	H	α-helix	trans	-72.1	-29.7	179.3	-169.2	0	0	0	0	112.5	L6 P7 A8 C35	L6-C10 HydrophobicContact CD2-CB 4.28Å; P7-C10 PolarHBondContact O-N 3.45Å; A8-C10 PolarHBondContact O-N 2.84Å; C10-C35 WeakPolarHBondContact CA-SG 3.37Å; C10-C35 HydrophobicContact CB-CB 3.75Å; C10-C35 WeakPolarHBondContact CB-SG 3.29Å; C10-C35 WeakPolarHBondContact SG-CB 3.02Å; C10-C35 CovalentContact SG-SG 2.03Å; C10-C35 PolarHBondContact SG-SG 3.24Å
11	R	61.5	Low	52.4	Low	110 Å²	110	111.3 Å²	111.3	42%	0.415	58%	0.584	S	S	.	*	H	α-helix	trans	-73.7	-41.8	174.5	-158.7	-177.3	-59.4	-142.4	0.2	111.6	Q5 P7 A8 S9 W14 N15	Q5-R11 VanDerWaalsContact CG-NH2 3.26Å; P7-R11 PolarHBondContact O-N 3.08Å; A8-R11 PolarHBondContact O-N 3.36Å; A8-R11 VanDerWaalsContact O-N 3.12Å; S9-R11 VanDerWaalsContact C-N 3.35Å; S9-R11 PolarHBondContact O-N 3.22Å; R11-W14 PolarHBondContact O-N 3.35Å; R11-N15 VanDerWaalsContact O-CB 3.27Å; R11-N15 WeakPolarHBondContact O-CB 3.5Å; R11-N15 PolarHBondContact O-N 2.93Å; R11-N15 PolarHBondContact O-ND2 3.05Å; R11-N15 PolarHBondContact O-OD1 3.23Å
12	E	62.8	Low	53.5	Low	144 Å²	144	102.9 Å²	102.9	67%	0.673	54%	0.544	S	S	*	.	H	α-helix	trans	-64.2	-41.3	177.7	-75.7	176.4	-171.8	0	0	112	A8 S9 W14 N15	A8-E12 WeakPolarHBondContact O-CB 3.19Å; A8-E12 WeakPolarHBondContact O-CG 3.4Å; A8-E12 PolarHBondContact O-N 3.17Å; S9-E12 PolarHBondContact O-N 3.05Å; E12-W14 PolarHBondContact O-N 2.78Å; E12-N15 PolarHBondContact O-N 3.26Å
13	G	60.6	Low	55	Low	50 Å²	50	98.9 Å²	98.9	52%	0.515	54%	0.544	S	S	.	.	H	α-helix	trans	-60.4	-27.5	179.4	0	0	0	0	0	114.8	S9	S9-G13 PolarHBondContact O-N 3.21Å
14	W	66.6	Low	56.9	Low	82 Å²	82	98.1 Å²	98.1	31%	0.311	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	11.1	-175.1	-58.7	109.1	0	0	0	114.5	R11 E12 T16 A28 C35 P37 M47	R11-W14 PolarHBondContact O-N 3.35Å; E12-W14 PolarHBondContact O-N 2.78Å; W14-T16 VanDerWaalsContact C-N 3.26Å; W14-T16 PolarHBondContact O-N 2.92Å; W14-T16 VanDerWaalsContact O-N 3.15Å; W14-A28 HydrophobicContact CB-CB 4.4Å; W14-A28 HydrophobicContact CG-CB 4.31Å; W14-C35 PolarHBondContact NE1-SG 2.95Å; W14-P37 HydrophobicContact CD2-CB 4.11Å; W14-P37 HydrophobicContact CE3-CB 4.06Å; W14-P37 HydrophobicContact CH2-CB 3.48Å; W14-P37 VanDerWaalsContact CH2-CB 3.48Å; W14-P37 HydrophobicContact CH2-CG 4.41Å; W14-P37 HydrophobicContact CZ2-CB 3.48Å; W14-P37 VanDerWaalsContact CZ2-CB 3.48Å; W14-P37 HydrophobicContact CZ2-CG 4.36Å; W14-P37 HydrophobicContact CZ3-CB 3.74Å; W14-M47 HydrophobicContact CH2-CE 4.02Å; W14-M47 HydrophobicContact CZ2-CE 3.54Å
15	N	55.6	Low	58.7	Low	92 Å²	92	91.6 Å²	91.6	49%	0.492	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	0.4	-172	-104.8	-12.5	0	0	0	115.9	R11 E12	R11-N15 VanDerWaalsContact O-CB 3.27Å; R11-N15 WeakPolarHBondContact O-CB 3.5Å; R11-N15 PolarHBondContact O-N 2.93Å; R11-N15 PolarHBondContact O-ND2 3.05Å; R11-N15 PolarHBondContact O-OD1 3.23Å; E12-N15 PolarHBondContact O-N 3.26Å
16	T	49.7	Very low	60.5	Low	136 Å²	136	84 Å²	84	83%	0.834	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.7	-19.1	-179.7	18.5	0	0	0	0	116.1	W14	W14-T16 VanDerWaalsContact C-N 3.26Å; W14-T16 PolarHBondContact O-N 2.92Å; W14-T16 VanDerWaalsContact O-N 3.15Å
17	T	50	Low	61.9	Low	99 Å²	99	85.2 Å²	85.2	61%	0.607	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-14.9	-167.9	-22.1	0	0	0	0	115.4
18	Y	51.9	Low	63.1	Low	114 Å²	114	84.2 Å²	84.2	45%	0.447	49%	0.489	S	S	.	.			trans	-155.2	34.8	-169.2	-122.9	-89.7	0	0	0	118.7	N20 L22	Y18-N20 PolarHBondContact O-N 3.31Å; Y18-L22 HydrophobicContact CD1-CB 3.74Å; Y18-L22 HydrophobicContact CD1-CD1 3.94Å; Y18-L22 HydrophobicContact CD1-CG 4.03Å; Y18-L22 HydrophobicContact CE1-CB 3.33Å; Y18-L22 HydrophobicContact CE1-CD1 3.4Å; Y18-L22 VanDerWaalsContact CE1-CD1 3.4Å; Y18-L22 HydrophobicContact CE1-CG 3.23Å
19	I	47.1	Very low	64.3	Low	143 Å²	143	83.5 Å²	83.5	73%	0.733	48%	0.476	S	S	*	.	S	Bend	trans	-63	-17.9	170.2	-68.2	179.3	0	0	0	112.3
20	N	48.7	Very low	65.2	Low	159 Å²	159	84 Å²	84	85%	0.85	47%	0.471	S	S	*	.	S	Bend	trans	-126.8	-0.3	-169.5	-73.5	-21.8	0	0	0	118.4	Y18	Y18-N20 PolarHBondContact O-N 3.31Å
21	G	46	Very low	65.8	Low	49 Å²	49	84.8 Å²	84.8	51%	0.505	48%	0.475	S	S	.	.	S	Bend	trans	-107.5	-21.2	-168	0	0	0	0	0	118.7
22	L	55.9	Low	66.3	Low	59 Å²	59	81.2 Å²	81.2	31%	0.309	47%	0.473	S	S	.	.			trans	-128.5	71.2	-164.2	-95.1	164.7	0	0	0	108.7	Y18 K24 A40	Y18-L22 HydrophobicContact CD1-CB 3.74Å; Y18-L22 HydrophobicContact CD1-CD1 3.94Å; Y18-L22 HydrophobicContact CD1-CG 4.03Å; Y18-L22 HydrophobicContact CE1-CB 3.33Å; Y18-L22 HydrophobicContact CE1-CD1 3.4Å; Y18-L22 VanDerWaalsContact CE1-CD1 3.4Å; Y18-L22 HydrophobicContact CE1-CG 3.23Å; L22-K24 PolarHBondContact O-N 2.81Å; L22-A40 HydrophobicContact CD1-CB 4.14Å; L22-A40 HydrophobicContact CD2-CB 3.53Å; L22-A40 HydrophobicContact CG-CB 4.45Å
23	A	64	Low	66.7	Low	110 Å²	110	77.1 Å²	77.1	91%	0.909	45%	0.453	S	S	*	.	S	Bend	trans	-59.9	-14.6	174.7	0	0	0	0	0	113.3
24	K	77	Confident	67.5	Low	173 Å²	173	75.5 Å²	75.5	75%	0.752	43%	0.433	S	S	*	.	S	Bend	trans	-135.9	86.4	176.7	-69.2	-177.6	-179.7	179.3	0	110.3	L22 S41	L22-K24 PolarHBondContact O-N 2.81Å; K24-S41 WeakPolarHBondContact O-CB 3.18Å; K24-S41 PolarHBondContact O-N 3.22Å
25	G	85.1	Confident	68.3	Low	25 Å²	25	73 Å²	73	26%	0.258	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	-178.9	176.8	0	0	0	0	0	112.2	T39	G25-T39 CarbonylContact C-O 3.59Å; G25-T39 VanDerWaalsContact CA-O 3.32Å; G25-T39 WeakPolarHBondContact CA-O 3.25Å
26	C	87	Confident	69.7	Low	3 Å²	3	68.6 Å²	68.6	2%	0.02	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.3	173.8	-56.4	0	0	0	0	109.2	P38 T39 C67 G71 S72 W73	C26-P38 CarbonylContact O-C 3.53Å; C26-P38 WeakPolarHBondContact O-CA 3.35Å; C26-T39 PolarHBondContact N-O 3.41Å; C26-T39 PolarHBondContact O-N 3.35Å; C26-C67 HydrophobicContact CB-CB 3.89Å; C26-C67 WeakPolarHBondContact CB-SG 3.44Å; C26-C67 PolarHBondContact N-SG 2.88Å; C26-C67 WeakPolarHBondContact SG-CA 3.2Å; C26-C67 WeakPolarHBondContact SG-CB 3.48Å; C26-C67 CovalentContact SG-SG 2.04Å; C26-C67 PolarHBondContact SG-SG 2.85Å; C26-G71 VanDerWaalsContact SG-C 3.6Å; C26-S72 PolarHBondContact SG-O 3.45Å; C26-S72 VanDerWaalsContact SG-O 3.38Å; C26-W73 HydrophobicContact CB-CD2 3.69Å; C26-W73 HydrophobicContact CB-CE3 4.26Å; C26-W73 HydrophobicContact CB-CG 4.13Å; C26-W73 HydrophobicContact CB-CH2 4.3Å; C26-W73 HydrophobicContact CB-CZ2 3.67Å
27	S	85.8	Confident	71.5	Confident	75 Å²	75	62.9 Å²	62.9	52%	0.524	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-70.8	164.4	175.3	58.2	0	0	0	0	111.4	D29 W73	S27-D29 PolarHBondContact O-N 2.95Å; S27-W73 PolarHBondContact O-NE1 3.48Å
28	A	84.3	Confident	73.2	Confident	17 Å²	17	60.1 Å²	60.1	14%	0.14	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-50.7	137.8	169.1	0	0	0	0	0	110.8	L6 W14 W36 P38	L6-A28 HydrophobicContact CD2-CB 3.99Å; W14-A28 HydrophobicContact CB-CB 4.4Å; W14-A28 HydrophobicContact CG-CB 4.31Å; A28-W36 VanDerWaalsContact CA-O 3.31Å; A28-W36 WeakPolarHBondContact CA-O 3.44Å; A28-P38 HydrophobicContact CB-CG 4.07Å
29	D	83.8	Confident	74.8	Confident	50 Å²	50	55.3 Å²	55.3	27%	0.267	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	142.2	-175	-173.5	53.6	0	0	0	110.2	S27 W36 R65 W73	S27-D29 PolarHBondContact O-N 2.95Å; D29-W36 PolarHBondContact N-O 3.49Å; D29-W36 WeakPolarHBondContact O-CB 3.35Å; D29-W36 PolarHBondContact O-N 3.19Å; D29-R65 IonicContact OD2-CZ 2.71Å; D29-R65 VanDerWaalsContact OD2-CZ 3.25Å; D29-R65 IonicContact OD2-NH1 3.82Å; D29-R65 PolarHBondContact OD2-NH1 2.92Å; D29-R65 IonicContact OD2-NH2 2.75Å; D29-R65 PolarHBondContact OD2-NH2 3.36Å; D29-W73 VanDerWaalsContact CB-CD1 3.47Å; D29-W73 HydrophobicContact CB-CG 4.44Å; D29-W73 VanDerWaalsContact CB-NE1 3.31Å
30	F	81	Confident	76.8	Confident	72 Å²	72	49.7 Å²	49.7	32%	0.316	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121	176.9	179.4	-113.8	0	0	0	108.8	P7 G32 T34 C35	P7-F30 HydrophobicContact CG-CB 4.49Å; P7-F30 HydrophobicContact CG-CD1 3.79Å; P7-F30 HydrophobicContact CG-CE1 4.17Å; P7-F30 HydrophobicContact CG-CG 4.12Å; F30-G32 VanDerWaalsContact CZ-CA 3.49Å; F30-G32 WeakPolarHBondContact CZ-O 3.17Å; F30-T34 WeakPolarHBondContact CD2-O 3.32Å; F30-C35 HydrophobicContact CD2-CB 4.45Å
31	D	77.5	Confident	78.7	Confident	18 Å²	18	43.6 Å²	43.6	10%	0.096	28%	0.281	C	S	.	.			trans	-91.5	0.2	-177.3	69.4	-4.6	0	0	0	113.9	F33 T34 W36 A76 Y78 Y169	D31-F33 PolarHBondContact OD1-N 2.85Å; D31-T34 PolarHBondContact N-O 2.98Å; D31-T34 PolarHBondContact OD1-N 3.21Å; D31-W36 VanDerWaalsContact CG-NE1 3.32Å; D31-W36 PolarHBondContact OD2-NE1 3.46Å; D31-A76 WeakPolarHBondContact OD2-CB 3.49Å; D31-Y78 PolarHBondContact OD1-OH 2.9Å; D31-Y78 PolarHBondContact OD2-OH 2.82Å; D31-Y169 VanDerWaalsContact O-CE2 3.22Å; D31-Y169 WeakPolarHBondContact O-CE2 3.17Å
32	G	72.3	Confident	80.8	Confident	36 Å²	36	45.8 Å²	45.8	37%	0.371	28%	0.28	S	S	.	.	S	Bend	trans	107.2	-17.3	-175.4	0	0	0	0	0	114.3	F30	F30-G32 VanDerWaalsContact CZ-CA 3.49Å; F30-G32 WeakPolarHBondContact CZ-O 3.17Å
33	F	70.2	Confident	82.5	Confident	57 Å²	57	48.3 Å²	48.3	25%	0.25	29%	0.29	C	S	.	.	S	Bend	trans	-124.8	-48.5	178.2	-62.6	-83	0	0	0	111.4	D31 P50 F53	D31-F33 PolarHBondContact OD1-N 2.85Å; F33-P50 HydrophobicContact CB-CG 3.99Å; F33-F53 HydrophobicContact CD1-CE2 4.42Å
34	T	77.5	Confident	83.8	Confident	16 Å²	16	45.6 Å²	45.6	10%	0.098	26%	0.263	C	S	.	.			trans	-121.7	138.6	-174.4	-46.5	0	0	0	0	110.9	F30 D31 W36 M47 P50 Y78	F30-T34 WeakPolarHBondContact CD2-O 3.32Å; D31-T34 PolarHBondContact N-O 2.98Å; D31-T34 PolarHBondContact OD1-N 3.21Å; T34-W36 PolarHBondContact O-N 3.07Å; T34-M47 HydrophobicContact CG2-CB 3.73Å; T34-M47 HydrophobicContact CG2-CG 3.8Å; T34-P50 WeakPolarHBondContact OG1-CG 3.42Å; T34-Y78 WeakPolarHBondContact CB-OH 3.45Å; T34-Y78 PolarHBondContact OG1-OH 2.87Å
35	C	83.5	Confident	84.4	Confident	30 Å²	30	37.8 Å²	37.8	20%	0.203	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	107.5	168.1	178.7	0	0	0	0	110	C10 W14 F30	C10-C35 WeakPolarHBondContact CA-SG 3.37Å; C10-C35 HydrophobicContact CB-CB 3.75Å; C10-C35 WeakPolarHBondContact CB-SG 3.29Å; C10-C35 WeakPolarHBondContact SG-CB 3.02Å; C10-C35 CovalentContact SG-SG 2.03Å; C10-C35 PolarHBondContact SG-SG 3.24Å; W14-C35 PolarHBondContact NE1-SG 2.95Å; F30-C35 HydrophobicContact CD2-CB 4.45Å
36	W	85.9	Confident	84.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.2	-179.2	-66.3	88.7	0	0	0	111.5	A28 D29 D31 T34 S45 M47 Q64 R65 W73 A76	A28-W36 VanDerWaalsContact CA-O 3.31Å; A28-W36 WeakPolarHBondContact CA-O 3.44Å; D29-W36 PolarHBondContact N-O 3.49Å; D29-W36 WeakPolarHBondContact O-CB 3.35Å; D29-W36 PolarHBondContact O-N 3.19Å; D31-W36 VanDerWaalsContact CG-NE1 3.32Å; D31-W36 PolarHBondContact OD2-NE1 3.46Å; T34-W36 PolarHBondContact O-N 3.07Å; W36-S45 WeakPolarHBondContact CZ3-O 3.29Å; W36-M47 HydrophobicContact CE3-CG 4.14Å; W36-M47 HydrophobicContact CH2-CB 4.31Å; W36-M47 HydrophobicContact CZ3-CB 4.12Å; W36-M47 HydrophobicContact CZ3-CG 4.09Å; W36-Q64 VanDerWaalsContact CH2-C 3.46Å; W36-R65 HydrophobicContact CD2-CB 3.72Å; W36-R65 HydrophobicContact CD2-CG 4.33Å; W36-R65 HydrophobicContact CE3-CB 3.57Å; W36-R65 HydrophobicContact CH2-CB 3.56Å; W36-R65 HydrophobicContact CZ2-CB 3.69Å; W36-R65 HydrophobicContact CZ3-CB 3.49Å; W36-R65 VanDerWaalsContact CZ3-CB 3.49Å; W36-W73 HydrophobicContact CB-CH2 4.18Å; W36-W73 HydrophobicContact CB-CZ2 4.12Å; W36-A76 HydrophobicContact CZ2-CB 3.69Å
37	P	86.5	Confident	84.6	Confident	16 Å²	16	44.3 Å²	44.3	10%	0.104	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-74.1	155.5	179.9	30.9	-31.2	0	0	0	111.3	W14 T39 S45 M47 W73	W14-P37 HydrophobicContact CD2-CB 4.11Å; W14-P37 HydrophobicContact CE3-CB 4.06Å; W14-P37 HydrophobicContact CH2-CB 3.48Å; W14-P37 VanDerWaalsContact CH2-CB 3.48Å; W14-P37 HydrophobicContact CH2-CG 4.41Å; W14-P37 HydrophobicContact CZ2-CB 3.48Å; W14-P37 VanDerWaalsContact CZ2-CB 3.48Å; W14-P37 HydrophobicContact CZ2-CG 4.36Å; W14-P37 HydrophobicContact CZ3-CB 3.74Å; P37-T39 PolarHBondContact O-N 3.27Å; P37-T39 VanDerWaalsContact O-N 3.15Å; P37-T39 PolarHBondContact O-OG1 3.04Å; P37-S45 WeakPolarHBondContact CD-OG 3.25Å; P37-S45 WeakPolarHBondContact CG-OG 3.48Å; P37-M47 HydrophobicContact CB-CE 4.25Å; P37-M47 VanDerWaalsContact CD-CE 3.48Å; P37-M47 HydrophobicContact CG-CE 3.79Å; P37-W73 WeakPolarHBondContact O-CH2 3.26Å; P37-W73 VanDerWaalsContact O-CZ2 3.28Å; P37-W73 WeakPolarHBondContact O-CZ2 3.31Å
38	P	85.4	Confident	84.5	Confident	40 Å²	40	45 Å²	45	26%	0.26	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-53.3	123.9	165.9	-20.1	31.4	0	0	0	110.3	C26 A28	C26-P38 CarbonylContact O-C 3.53Å; C26-P38 WeakPolarHBondContact O-CA 3.35Å; A28-P38 HydrophobicContact CB-CG 4.07Å
39	T	87.2	Confident	84.3	Confident	14 Å²	14	44.4 Å²	44.4	9%	0.086	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141	-172	-63.7	0	0	0	0	110.7	G25 C26 P37 H43 S45 C67 W73	G25-T39 CarbonylContact C-O 3.59Å; G25-T39 VanDerWaalsContact CA-O 3.32Å; G25-T39 WeakPolarHBondContact CA-O 3.25Å; C26-T39 PolarHBondContact N-O 3.41Å; C26-T39 PolarHBondContact O-N 3.35Å; P37-T39 PolarHBondContact O-N 3.27Å; P37-T39 VanDerWaalsContact O-N 3.15Å; P37-T39 PolarHBondContact O-OG1 3.04Å; T39-H43 HydrophobicContact CG2-CB 3.97Å; T39-S45 WeakPolarHBondContact OG1-CB 3.48Å; T39-C67 HydrophobicContact CG2-CB 4.01Å; T39-W73 VanDerWaalsContact CB-CH2 3.49Å; T39-W73 HydrophobicContact CG2-CH2 4.39Å; T39-W73 WeakPolarHBondContact OG1-CH2 3.44Å
40	A	87.8	Confident	83.8	Confident	25 Å²	25	42.6 Å²	42.6	21%	0.207	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	148.2	179.3	0	0	0	0	0	112.1	L22 N42 H43	L22-A40 HydrophobicContact CD1-CB 4.14Å; L22-A40 HydrophobicContact CD2-CB 3.53Å; L22-A40 HydrophobicContact CG-CB 4.45Å; A40-N42 PolarHBondContact O-N 3.49Å; A40-H43 HydrophobicContact CB-CB 4.27Å; A40-H43 WeakPolarHBondContact O-CB 3.4Å; A40-H43 PolarHBondContact O-N 3.27Å
41	S	89	Confident	83	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	135.2	172.6	177.8	0	0	0	0	110.5	K24 H43 P69	K24-S41 WeakPolarHBondContact O-CB 3.18Å; K24-S41 PolarHBondContact O-N 3.22Å; S41-H43 VanDerWaalsContact C-N 3.32Å; S41-H43 PolarHBondContact O-N 2.94Å; S41-H43 PolarHBondContact O-ND1 2.92Å; S41-P69 VanDerWaalsContact OG-CA 3.24Å; S41-P69 WeakPolarHBondContact OG-CA 3.24Å; S41-P69 PolarHBondContact OG-O 3.44Å
42	N	89.9	Confident	82.1	Confident	94 Å²	94	44 Å²	44	50%	0.503	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	28.4	179.8	-146.4	61.2	0	0	0	114.7	A40 Y66 C67 P69	A40-N42 PolarHBondContact O-N 3.49Å; N42-Y66 VanDerWaalsContact CG-OH 3.26Å; N42-Y66 PolarHBondContact OD1-OH 2.82Å; N42-C67 WeakPolarHBondContact CA-O 3.5Å; N42-C67 PolarHBondContact N-O 3.41Å; N42-P69 HydrophobicContact CB-CG 4.35Å; N42-P69 WeakPolarHBondContact OD1-CG 3.39Å
43	H	91.5	Very high	81.5	Confident	112 Å²	112	42.9 Å²	42.9	52%	0.519	24%	0.238	S	C	.	.			trans	-124.4	153.5	176.2	-68.6	70.5	0	0	0	111.5	T39 A40 S41 C67	T39-H43 HydrophobicContact CG2-CB 3.97Å; A40-H43 HydrophobicContact CB-CB 4.27Å; A40-H43 WeakPolarHBondContact O-CB 3.4Å; A40-H43 PolarHBondContact O-N 3.27Å; S41-H43 VanDerWaalsContact C-N 3.32Å; S41-H43 PolarHBondContact O-N 2.94Å; S41-H43 PolarHBondContact O-ND1 2.92Å; H43-C67 WeakPolarHBondContact O-CB 3.5Å; H43-C67 PolarHBondContact O-N 3.16Å
44	T	91.4	Very high	80.7	Confident	54 Å²	54	43 Å²	43	33%	0.331	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.1	173.6	-51.4	0	0	0	0	109.6	F46 Q64 Y66	T44-F46 HydrophobicContact CG2-CE1 4.25Å; T44-F46 HydrophobicContact CG2-CE2 3.97Å; T44-F46 HydrophobicContact CG2-CZ 3.8Å; T44-Q64 HydrophobicContact CG2-CB 3.89Å; T44-Y66 WeakPolarHBondContact OG1-CD2 3.26Å
45	S	89.4	Confident	79.6	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.063	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	144.2	169	-170.9	0	0	0	0	109.9	W36 P37 T39 Q64 R65	W36-S45 WeakPolarHBondContact CZ3-O 3.29Å; P37-S45 WeakPolarHBondContact CD-OG 3.25Å; P37-S45 WeakPolarHBondContact CG-OG 3.48Å; T39-S45 WeakPolarHBondContact OG1-CB 3.48Å; S45-Q64 CarbonylContact O-C 3.59Å; S45-Q64 VanDerWaalsContact O-CA 3.26Å; S45-Q64 WeakPolarHBondContact O-CA 3.29Å; S45-R65 PolarHBondContact N-O 3.16Å; S45-R65 PolarHBondContact O-N 2.92Å
46	F	89.7	Confident	78	Confident	120 Å²	120	49.7 Å²	49.7	53%	0.526	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.3	175.8	-61.8	-89.7	0	0	0	109	T44 S63 Q64	T44-F46 HydrophobicContact CG2-CE1 4.25Å; T44-F46 HydrophobicContact CG2-CE2 3.97Å; T44-F46 HydrophobicContact CG2-CZ 3.8Å; F46-S63 CarbonylContact C-O 3.55Å; F46-S63 VanDerWaalsContact CA-O 3.31Å; F46-S63 WeakPolarHBondContact CA-O 3.47Å; F46-Q64 HydrophobicContact CD1-CB 3.74Å; F46-Q64 HydrophobicContact CE1-CB 3.74Å
47	M	87.3	Confident	76.5	Confident	44 Å²	44	59.6 Å²	59.6	22%	0.217	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.6	176.4	-82.8	-66.5	174.6	0	0	109.5	W14 T34 W36 P37 S63	W14-M47 HydrophobicContact CH2-CE 4.02Å; W14-M47 HydrophobicContact CZ2-CE 3.54Å; T34-M47 HydrophobicContact CG2-CB 3.73Å; T34-M47 HydrophobicContact CG2-CG 3.8Å; W36-M47 HydrophobicContact CE3-CG 4.14Å; W36-M47 HydrophobicContact CH2-CB 4.31Å; W36-M47 HydrophobicContact CZ3-CB 4.12Å; W36-M47 HydrophobicContact CZ3-CG 4.09Å; P37-M47 HydrophobicContact CB-CE 4.25Å; P37-M47 VanDerWaalsContact CD-CE 3.48Å; P37-M47 HydrophobicContact CG-CE 3.79Å; M47-S63 PolarHBondContact N-O 2.97Å; M47-S63 WeakPolarHBondContact O-CA 3.35Å; M47-S63 PolarHBondContact O-N 2.96Å; M47-S63 PolarHBondContact O-OG 3.34Å
48	D	83.5	Confident	74.9	Confident	90 Å²	90	65.8 Å²	65.8	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	154.6	173.7	-53.8	-40.5	0	0	0	110.1
49	C	80	Confident	73.7	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.034	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-59.6	138.4	179.3	-60.3	0	0	0	0	110.5	M54 Y60 G61 C81	C49-M54 WeakPolarHBondContact O-CE 3.37Å; C49-Y60 PolarHBondContact SG-O 2.98Å; C49-G61 PolarHBondContact SG-O 3.22Å; C49-C81 VanDerWaalsContact CA-SG 3.58Å; C49-C81 HydrophobicContact CB-CB 3.82Å; C49-C81 WeakPolarHBondContact CB-SG 3.41Å; C49-C81 WeakPolarHBondContact SG-CA 3.27Å; C49-C81 WeakPolarHBondContact SG-CB 3.46Å; C49-C81 CovalentContact SG-SG 2.02Å; C49-C81 PolarHBondContact SG-SG 2.93Å
50	P	72.5	Confident	72.7	Confident	11 Å²	11	71.1 Å²	71.1	7%	0.071	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-53.7	145.9	175.3	-23.4	29.2	0	0	0	111.9	F33 T34 E52 F53 Y78	F33-P50 HydrophobicContact CB-CG 3.99Å; T34-P50 WeakPolarHBondContact OG1-CG 3.42Å; P50-E52 WeakPolarHBondContact CB-OE2 3.43Å; P50-E52 PolarHBondContact O-N 3.36Å; P50-F53 HydrophobicContact CB-CD2 3.82Å; P50-F53 HydrophobicContact CB-CE2 4.07Å; P50-F53 HydrophobicContact CG-CD2 3.83Å; P50-F53 HydrophobicContact CG-CE2 3.86Å; P50-F53 PolarHBondContact O-N 2.83Å; P50-Y78 HydrophobicContact CG-CD1 4.46Å; P50-Y78 HydrophobicContact CG-CE1 3.86Å
51	A	65.5	Low	72.3	Confident	56 Å²	56	70.7 Å²	70.7	46%	0.463	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-58.1	-24.4	-178.6	0	0	0	0	0	112.5	F53 M54	A51-F53 PolarHBondContact O-N 3.33Å; A51-M54 HydrophobicContact CB-CE 4.27Å; A51-M54 CarbonylContact O-C 3.59Å; A51-M54 WeakPolarHBondContact O-CA 3.5Å; A51-M54 WeakPolarHBondContact O-CB 3.25Å; A51-M54 PolarHBondContact O-N 3.3Å
52	E	58.7	Low	72	Confident	64 Å²	64	71.9 Å²	71.9	30%	0.299	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-62.8	-27.2	175.2	-59.4	90.9	155.8	0	0	113.2	P50 E243	P50-E52 WeakPolarHBondContact CB-OE2 3.43Å; P50-E52 PolarHBondContact O-N 3.36Å; E52-E243 HydrophobicContact CG-CB 3.91Å; E52-E243 HydrophobicContact CG-CG 4.38Å
53	F	58.5	Low	71.8	Confident	13 Å²	13	67.4 Å²	67.4	6%	0.057	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-85.1	-17.2	172.2	-61.2	-76.8	0	0	0	112.3	F33 P50 A51 L55 L85 H166	F33-F53 HydrophobicContact CD1-CE2 4.42Å; P50-F53 HydrophobicContact CB-CD2 3.82Å; P50-F53 HydrophobicContact CB-CE2 4.07Å; P50-F53 HydrophobicContact CG-CD2 3.83Å; P50-F53 HydrophobicContact CG-CE2 3.86Å; P50-F53 PolarHBondContact O-N 2.83Å; A51-F53 PolarHBondContact O-N 3.33Å; F53-L55 VanDerWaalsContact C-N 3.34Å; F53-L55 PolarHBondContact O-N 2.69Å; F53-L55 VanDerWaalsContact O-N 3.12Å; F53-L85 HydrophobicContact CB-CD2 4.41Å; F53-L85 HydrophobicContact CD1-CD2 3.76Å; F53-H166 AromaticContact CE1-CD2 3.82Å; F53-H166 AromaticContact CE1-CE1 3.98Å; F53-H166 AromaticContact CE1-NE2 3.03Å; F53-H166 WeakPolarHBondContact CE1-NE2 3.42Å; F53-H166 AromaticContact CE2-NE2 3.74Å; F53-H166 AromaticContact CZ-CD2 3.99Å; F53-H166 AromaticContact CZ-CE1 3.35Å; F53-H166 WeakPolarHBondContact CZ-CE1 3.32Å; F53-H166 AromaticContact CZ-NE2 2.85Å; F53-H166 WeakPolarHBondContact CZ-NE2 3.47Å
54	M	53.7	Low	71.7	Confident	60 Å²	60	65.6 Å²	65.6	30%	0.296	34%	0.335	S	S	.	.			trans	-86	71.7	176.6	-62.9	-164.3	-88.8	0	0	110.2	C49 A51 L56 K58 Y60	C49-M54 WeakPolarHBondContact O-CE 3.37Å; A51-M54 HydrophobicContact CB-CE 4.27Å; A51-M54 CarbonylContact O-C 3.59Å; A51-M54 WeakPolarHBondContact O-CA 3.5Å; A51-M54 WeakPolarHBondContact O-CB 3.25Å; A51-M54 PolarHBondContact O-N 3.3Å; M54-L56 CarbonylContact C-O 3.58Å; M54-L56 PolarHBondContact O-N 3.43Å; M54-L56 VanDerWaalsContact O-N 3.12Å; M54-K58 WeakPolarHBondContact CG-O 3.27Å; M54-Y60 HydrophobicContact CG-CD2 4.39Å
55	L	53.7	Low	71.6	Confident	97 Å²	97	64.1 Å²	64.1	51%	0.508	32%	0.323	S	S	.	.	S	Bend	trans	-58.5	-23.4	173.3	-70.2	177.4	0	0	0	113.2	F53 L85 Y89	F53-L55 VanDerWaalsContact C-N 3.34Å; F53-L55 PolarHBondContact O-N 2.69Å; F53-L55 VanDerWaalsContact O-N 3.12Å; L55-L85 HydrophobicContact CD1-CD1 4.01Å; L55-L85 HydrophobicContact CG-CD1 4.36Å; L55-Y89 HydrophobicContact CD1-CE2 3.92Å; L55-Y89 WeakPolarHBondContact CD1-OH 3.5Å
56	L	50.8	Low	71.6	Confident	89 Å²	89	67.3 Å²	67.3	47%	0.466	34%	0.335	S	S	.	.	S	Bend	trans	-128.8	145.5	166.3	-62.7	174.7	0	0	0	105.4	M54 K58 F88	M54-L56 CarbonylContact C-O 3.58Å; M54-L56 PolarHBondContact O-N 3.43Å; M54-L56 VanDerWaalsContact O-N 3.12Å; L56-K58 PolarHBondContact O-N 3.26Å; L56-F88 HydrophobicContact CD1-CE1 4Å; L56-F88 HydrophobicContact CD1-CE2 3.73Å; L56-F88 HydrophobicContact CD1-CZ 3.21Å; L56-F88 HydrophobicContact CG-CE1 4.49Å; L56-F88 HydrophobicContact CG-CZ 4.13Å
57	E	53.7	Low	71.6	Confident	208 Å²	208	61.6 Å²	61.6	97%	0.972	31%	0.309	S	S	*	.	S	Bend	trans	-58.8	42.2	-178.9	-155.5	170.1	-165.7	0	0	114.3
58	K	53.6	Low	71.8	Confident	145 Å²	145	63.9 Å²	63.9	63%	0.63	32%	0.318	S	S	*	.	S	Bend	trans	-118.5	132	177.4	-99	-176.3	175.1	177.2	0	108.3	M54 L56 Y60	M54-K58 WeakPolarHBondContact CG-O 3.27Å; L56-K58 PolarHBondContact O-N 3.26Å; K58-Y60 HydrophobicContact CB-CE1 4.15Å; K58-Y60 HydrophobicContact CB-CE2 3.94Å; K58-Y60 WeakPolarHBondContact O-CD2 3.45Å; K58-Y60 WeakPolarHBondContact O-CE2 3.29Å; K58-Y60 PolarHBondContact O-N 2.9Å
59	E	60.7	Low	71.9	Confident	139 Å²	139	63.5 Å²	63.5	65%	0.65	32%	0.321	S	S	*	.			trans	-73.6	107.8	-179.4	-163.1	157.6	-149.6	0	0	109.5	G61	E59-G61 PolarHBondContact O-N 3.47Å
60	Y	66.6	Low	72.3	Confident	27 Å²	27	69.1 Å²	69.1	11%	0.106	35%	0.351	C	S	.	.			trans	-98.1	51.5	-174.4	-66.7	-67.5	0	0	0	112.4	C49 M54 K58 C81 N84 F88	C49-Y60 PolarHBondContact SG-O 2.98Å; M54-Y60 HydrophobicContact CG-CD2 4.39Å; K58-Y60 HydrophobicContact CB-CE1 4.15Å; K58-Y60 HydrophobicContact CB-CE2 3.94Å; K58-Y60 WeakPolarHBondContact O-CD2 3.45Å; K58-Y60 WeakPolarHBondContact O-CE2 3.29Å; K58-Y60 PolarHBondContact O-N 2.9Å; Y60-C81 WeakPolarHBondContact O-CA 3.31Å; Y60-N84 HydrophobicContact CD1-CB 4.28Å; Y60-N84 HydrophobicContact CG-CB 4.49Å; Y60-N84 PolarHBondContact O-ND2 3.06Å; Y60-F88 HydrophobicContact CE1-CB 4.27Å; Y60-F88 HydrophobicContact CE1-CD2 4.36Å; Y60-F88 HydrophobicContact CE1-CG 4.36Å
61	G	77.6	Confident	72.8	Confident	17 Å²	17	70.2 Å²	70.2	18%	0.175	36%	0.364	C	S	.	.			trans	89.6	-160	173.1	0	0	0	0	0	114	C49 E59	C49-G61 PolarHBondContact SG-O 3.22Å; E59-G61 PolarHBondContact O-N 3.47Å
62	T	84	Confident	73.9	Confident	56 Å²	56	69.8 Å²	69.8	34%	0.344	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	144.8	-170.6	58.6	0	0	0	0	112.6	E80	T62-E80 PolarHBondContact N-OE2 3.25Å; T62-E80 PolarHBondContact OG1-OE2 2.92Å
63	S	84.9	Confident	75.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	147.8	168.1	68.2	0	0	0	0	110	F46 M47 D77	F46-S63 CarbonylContact C-O 3.55Å; F46-S63 VanDerWaalsContact CA-O 3.31Å; F46-S63 WeakPolarHBondContact CA-O 3.47Å; M47-S63 PolarHBondContact N-O 2.97Å; M47-S63 WeakPolarHBondContact O-CA 3.35Å; M47-S63 PolarHBondContact O-N 2.96Å; M47-S63 PolarHBondContact O-OG 3.34Å; S63-D77 WeakPolarHBondContact CA-O 3.45Å
64	Q	89.6	Confident	76.5	Confident	74 Å²	74	68.5 Å²	68.5	35%	0.346	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.4	-178.6	67.4	179.9	-10.2	0	0	112.7	W36 T44 S45 F46 D77	W36-Q64 VanDerWaalsContact CH2-C 3.46Å; T44-Q64 HydrophobicContact CG2-CB 3.89Å; S45-Q64 CarbonylContact O-C 3.59Å; S45-Q64 VanDerWaalsContact O-CA 3.26Å; S45-Q64 WeakPolarHBondContact O-CA 3.29Å; F46-Q64 HydrophobicContact CD1-CB 3.74Å; F46-Q64 HydrophobicContact CE1-CB 3.74Å; Q64-D77 HydrophobicContact CG-CB 3.75Å; Q64-D77 PolarHBondContact N-O 3.46Å; Q64-D77 PolarHBondContact NE2-OD2 2.94Å; Q64-D77 PolarHBondContact O-N 3.34Å
65	R	88.7	Confident	78.1	Confident	23 Å²	23	72.8 Å²	72.8	9%	0.087	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	133	176.3	-165.7	177.7	-175	-166.2	-4	111.4	D29 W36 S45 W73 G74 A76	D29-R65 IonicContact OD2-CZ 2.71Å; D29-R65 VanDerWaalsContact OD2-CZ 3.25Å; D29-R65 IonicContact OD2-NH1 3.82Å; D29-R65 PolarHBondContact OD2-NH1 2.92Å; D29-R65 IonicContact OD2-NH2 2.75Å; D29-R65 PolarHBondContact OD2-NH2 3.36Å; W36-R65 HydrophobicContact CD2-CB 3.72Å; W36-R65 HydrophobicContact CD2-CG 4.33Å; W36-R65 HydrophobicContact CE3-CB 3.57Å; W36-R65 HydrophobicContact CH2-CB 3.56Å; W36-R65 HydrophobicContact CZ2-CB 3.69Å; W36-R65 HydrophobicContact CZ3-CB 3.49Å; W36-R65 VanDerWaalsContact CZ3-CB 3.49Å; S45-R65 PolarHBondContact N-O 3.16Å; S45-R65 PolarHBondContact O-N 2.92Å; R65-W73 HydrophobicContact CB-CE3 4.43Å; R65-W73 HydrophobicContact CB-CZ3 4.27Å; R65-W73 HydrophobicContact CG-CE3 3.79Å; R65-W73 HydrophobicContact CG-CZ3 4.13Å; R65-G74 PolarHBondContact NE-O 3.42Å; R65-A76 HydrophobicContact CB-CB 4.33Å; R65-A76 HydrophobicContact CG-CB 4.15Å
66	Y	90.6	Very high	79.6	Confident	76 Å²	76	69.1 Å²	69.1	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.4	-176.4	-170.1	-104.8	0	0	0	112.7	N42 T44 F68 G74	N42-Y66 VanDerWaalsContact CG-OH 3.26Å; N42-Y66 PolarHBondContact OD1-OH 2.82Å; T44-Y66 WeakPolarHBondContact OG1-CD2 3.26Å; Y66-F68 AromaticContact CD1-CD1 3.75Å; Y66-F68 HydrophobicContact CD1-CD1 3.75Å; Y66-F68 AromaticContact CD1-CE1 3.84Å; Y66-F68 HydrophobicContact CD1-CE1 3.84Å; Y66-F68 HydrophobicContact CD1-CG 4.16Å; Y66-F68 HydrophobicContact CD1-CZ 4.34Å; Y66-F68 AromaticContact CE1-CD1 3.7Å; Y66-F68 HydrophobicContact CE1-CD1 3.7Å; Y66-F68 HydrophobicContact CE1-CE1 4.04Å; Y66-F68 HydrophobicContact CE1-CG 4.34Å; Y66-G74 PolarHBondContact O-N 3.02Å
67	C	89.9	Confident	81.2	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	113.8	171.6	176.3	0	0	0	0	111.2	C26 T39 N42 H43 W73	C26-C67 HydrophobicContact CB-CB 3.89Å; C26-C67 WeakPolarHBondContact CB-SG 3.44Å; C26-C67 PolarHBondContact N-SG 2.88Å; C26-C67 WeakPolarHBondContact SG-CA 3.2Å; C26-C67 WeakPolarHBondContact SG-CB 3.48Å; C26-C67 CovalentContact SG-SG 2.04Å; C26-C67 PolarHBondContact SG-SG 2.85Å; T39-C67 HydrophobicContact CG2-CB 4.01Å; N42-C67 WeakPolarHBondContact CA-O 3.5Å; N42-C67 PolarHBondContact N-O 3.41Å; H43-C67 WeakPolarHBondContact O-CB 3.5Å; H43-C67 PolarHBondContact O-N 3.16Å; C67-W73 HydrophobicContact CB-CE3 4.23Å; C67-W73 HydrophobicContact CB-CZ3 4.11Å
68	F	90.2	Very high	82.5	Confident	91 Å²	91	58.4 Å²	58.4	40%	0.399	31%	0.308	S	S	.	.			trans	-72.4	155.6	-179.2	-72.1	-69.8	0	0	0	112.7	Y66 N70 G71 S72 G74	Y66-F68 AromaticContact CD1-CD1 3.75Å; Y66-F68 HydrophobicContact CD1-CD1 3.75Å; Y66-F68 AromaticContact CD1-CE1 3.84Å; Y66-F68 HydrophobicContact CD1-CE1 3.84Å; Y66-F68 HydrophobicContact CD1-CG 4.16Å; Y66-F68 HydrophobicContact CD1-CZ 4.34Å; Y66-F68 AromaticContact CE1-CD1 3.7Å; Y66-F68 HydrophobicContact CE1-CD1 3.7Å; Y66-F68 HydrophobicContact CE1-CE1 4.04Å; Y66-F68 HydrophobicContact CE1-CG 4.34Å; F68-N70 WeakPolarHBondContact CB-OD1 3.49Å; F68-N70 PolarHBondContact O-N 2.94Å; F68-N70 VanDerWaalsContact O-N 3.08Å; F68-G71 PolarHBondContact O-N 3.48Å; F68-S72 WeakPolarHBondContact CB-O 3.48Å; F68-S72 PolarHBondContact N-O 3.42Å; F68-G74 VanDerWaalsContact CE2-CA 3.49Å
69	P	87	Confident	83.7	Confident	83 Å²	83	56 Å²	56	54%	0.539	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.1	179.7	-28.7	36.1	0	0	0	115.8	S41 N42 G71	S41-P69 VanDerWaalsContact OG-CA 3.24Å; S41-P69 WeakPolarHBondContact OG-CA 3.24Å; S41-P69 PolarHBondContact OG-O 3.44Å; N42-P69 HydrophobicContact CB-CG 4.35Å; N42-P69 WeakPolarHBondContact OD1-CG 3.39Å; P69-G71 PolarHBondContact O-N 3.02Å
70	N	88	Confident	84.6	Confident	123 Å²	123	53.5 Å²	53.5	66%	0.658	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-1.3	177.3	67.2	-5.8	0	0	0	113.9	F68 S72	F68-N70 WeakPolarHBondContact CB-OD1 3.49Å; F68-N70 PolarHBondContact O-N 2.94Å; F68-N70 VanDerWaalsContact O-N 3.08Å; N70-S72 VanDerWaalsContact C-N 3.34Å; N70-S72 PolarHBondContact ND2-OG 2.72Å; N70-S72 VanDerWaalsContact OD1-CB 3.3Å; N70-S72 WeakPolarHBondContact OD1-CB 3.28Å; N70-S72 PolarHBondContact OD1-N 2.87Å; N70-S72 PolarHBondContact OD1-OG 2.94Å
71	G	83.6	Confident	85.1	Confident	34 Å²	34	52.2 Å²	52.2	35%	0.351	29%	0.289	S	S	.	.	S	Bend	trans	80.6	10.1	-176	0	0	0	0	0	114.5	C26 F68 P69	C26-G71 VanDerWaalsContact SG-C 3.6Å; F68-G71 PolarHBondContact O-N 3.48Å; P69-G71 PolarHBondContact O-N 3.02Å
72	S	87.6	Confident	84.8	Confident	46 Å²	46	53.1 Å²	53.1	32%	0.322	29%	0.289	S	S	.	.			trans	-93	143.9	173.3	72.3	0	0	0	0	111.5	C26 F68 N70	C26-S72 PolarHBondContact SG-O 3.45Å; C26-S72 VanDerWaalsContact SG-O 3.38Å; F68-S72 WeakPolarHBondContact CB-O 3.48Å; F68-S72 PolarHBondContact N-O 3.42Å; N70-S72 VanDerWaalsContact C-N 3.34Å; N70-S72 PolarHBondContact ND2-OG 2.72Å; N70-S72 VanDerWaalsContact OD1-CB 3.3Å; N70-S72 WeakPolarHBondContact OD1-CB 3.28Å; N70-S72 PolarHBondContact OD1-N 2.87Å; N70-S72 PolarHBondContact OD1-OG 2.94Å
73	W	84.8	Confident	84.2	Confident	39 Å²	39	53.2 Å²	53.2	15%	0.148	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	138.2	172.1	-76	114	0	0	0	111.8	C26 S27 D29 W36 P37 T39 R65 C67	C26-W73 HydrophobicContact CB-CD2 3.69Å; C26-W73 HydrophobicContact CB-CE3 4.26Å; C26-W73 HydrophobicContact CB-CG 4.13Å; C26-W73 HydrophobicContact CB-CH2 4.3Å; C26-W73 HydrophobicContact CB-CZ2 3.67Å; S27-W73 PolarHBondContact O-NE1 3.48Å; D29-W73 VanDerWaalsContact CB-CD1 3.47Å; D29-W73 HydrophobicContact CB-CG 4.44Å; D29-W73 VanDerWaalsContact CB-NE1 3.31Å; W36-W73 HydrophobicContact CB-CH2 4.18Å; W36-W73 HydrophobicContact CB-CZ2 4.12Å; P37-W73 WeakPolarHBondContact O-CH2 3.26Å; P37-W73 VanDerWaalsContact O-CZ2 3.28Å; P37-W73 WeakPolarHBondContact O-CZ2 3.31Å; T39-W73 VanDerWaalsContact CB-CH2 3.49Å; T39-W73 HydrophobicContact CG2-CH2 4.39Å; T39-W73 WeakPolarHBondContact OG1-CH2 3.44Å; R65-W73 HydrophobicContact CB-CE3 4.43Å; R65-W73 HydrophobicContact CB-CZ3 4.27Å; R65-W73 HydrophobicContact CG-CE3 3.79Å; R65-W73 HydrophobicContact CG-CZ3 4.13Å; C67-W73 HydrophobicContact CB-CE3 4.23Å; C67-W73 HydrophobicContact CB-CZ3 4.11Å
74	G	87.3	Confident	83.6	Confident	11 Å²	11	55.2 Å²	55.2	11%	0.113	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	176.9	164	0	0	0	0	0	113	R65 Y66 F68	R65-G74 PolarHBondContact NE-O 3.42Å; Y66-G74 PolarHBondContact O-N 3.02Å; F68-G74 VanDerWaalsContact CE2-CA 3.49Å
75	I	86.4	Confident	82.6	Confident	150 Å²	150	51.9 Å²	51.9	77%	0.769	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	135.4	172.6	-57.5	171.8	0	0	0	108
76	A	85.4	Confident	81.6	Confident	21 Å²	21	53.4 Å²	53.4	17%	0.174	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	139.1	174.4	0	0	0	0	0	110.9	D31 W36 R65 Y78	D31-A76 WeakPolarHBondContact OD2-CB 3.49Å; W36-A76 HydrophobicContact CZ2-CB 3.69Å; R65-A76 HydrophobicContact CB-CB 4.33Å; R65-A76 HydrophobicContact CG-CB 4.15Å; A76-Y78 HydrophobicContact CB-CD2 4.09Å; A76-Y78 HydrophobicContact CB-CE2 3.43Å; A76-Y78 VanDerWaalsContact CB-CE2 3.43Å
77	D	85	Confident	80.5	Confident	57 Å²	57	55.9 Å²	55.9	31%	0.305	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	112.7	179.3	179.8	9.8	0	0	0	109.7	S63 Q64 T79	S63-D77 WeakPolarHBondContact CA-O 3.45Å; Q64-D77 HydrophobicContact CG-CB 3.75Å; Q64-D77 PolarHBondContact N-O 3.46Å; Q64-D77 PolarHBondContact NE2-OD2 2.94Å; Q64-D77 PolarHBondContact O-N 3.34Å; D77-T79 WeakPolarHBondContact OD1-CB 3.22Å; D77-T79 PolarHBondContact OD1-N 3.13Å; D77-T79 PolarHBondContact OD1-OG1 3.35Å
78	Y	81.4	Confident	79.2	Confident	14 Å²	14	57.3 Å²	57.3	6%	0.055	33%	0.326	C	S	.	.			trans	-110.9	18.6	178.4	-65.8	-83.1	0	0	0	111.6	D31 T34 P50 A76 E80 C81 L82 H166	D31-Y78 PolarHBondContact OD1-OH 2.9Å; D31-Y78 PolarHBondContact OD2-OH 2.82Å; T34-Y78 WeakPolarHBondContact CB-OH 3.45Å; T34-Y78 PolarHBondContact OG1-OH 2.87Å; P50-Y78 HydrophobicContact CG-CD1 4.46Å; P50-Y78 HydrophobicContact CG-CE1 3.86Å; A76-Y78 HydrophobicContact CB-CD2 4.09Å; A76-Y78 HydrophobicContact CB-CE2 3.43Å; A76-Y78 VanDerWaalsContact CB-CE2 3.43Å; Y78-E80 VanDerWaalsContact C-N 3.32Å; Y78-E80 PolarHBondContact O-N 3.09Å; Y78-C81 WeakPolarHBondContact O-CB 3.19Å; Y78-C81 PolarHBondContact O-N 3.3Å; Y78-L82 PolarHBondContact O-N 2.89Å; Y78-H166 AromaticContact CD2-CE1 3.86Å; Y78-H166 AromaticContact CG-CE1 3.82Å
79	T	78	Confident	77.7	Confident	94 Å²	94	56.9 Å²	56.9	58%	0.577	32%	0.322	S	S	*	.	H	α-helix	trans	-60.6	-40.3	-172.1	-55.8	0	0	0	0	112.4	D77 L82 S83	D77-T79 WeakPolarHBondContact OD1-CB 3.22Å; D77-T79 PolarHBondContact OD1-N 3.13Å; D77-T79 PolarHBondContact OD1-OG1 3.35Å; T79-L82 PolarHBondContact O-N 3.48Å; T79-S83 PolarHBondContact O-N 2.91Å; T79-S83 PolarHBondContact O-OG 3.17Å
80	E	79.7	Confident	76.7	Confident	87 Å²	87	56.6 Å²	56.6	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-47.4	178.4	-173.3	-178.6	-166.1	0	0	111.6	T62 Y78 L82 S83 N84	T62-E80 PolarHBondContact N-OE2 3.25Å; T62-E80 PolarHBondContact OG1-OE2 2.92Å; Y78-E80 VanDerWaalsContact C-N 3.32Å; Y78-E80 PolarHBondContact O-N 3.09Å; E80-L82 PolarHBondContact O-N 3.37Å; E80-S83 WeakPolarHBondContact CA-OG 3.49Å; E80-S83 PolarHBondContact O-N 2.89Å; E80-S83 PolarHBondContact O-OG 3.36Å; E80-N84 WeakPolarHBondContact O-CB 3.42Å; E80-N84 PolarHBondContact O-N 3.24Å; E80-N84 PolarHBondContact O-ND2 3.46Å
81	C	77.4	Confident	75.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-52.6	-44.9	173.6	-58.3	0	0	0	0	111.2	C49 Y60 Y78 L85	C49-C81 VanDerWaalsContact CA-SG 3.58Å; C49-C81 HydrophobicContact CB-CB 3.82Å; C49-C81 WeakPolarHBondContact CB-SG 3.41Å; C49-C81 WeakPolarHBondContact SG-CA 3.27Å; C49-C81 WeakPolarHBondContact SG-CB 3.46Å; C49-C81 CovalentContact SG-SG 2.02Å; C49-C81 PolarHBondContact SG-SG 2.93Å; Y60-C81 WeakPolarHBondContact O-CA 3.31Å; Y78-C81 WeakPolarHBondContact O-CB 3.19Å; Y78-C81 PolarHBondContact O-N 3.3Å; C81-L85 WeakPolarHBondContact O-CB 3.46Å; C81-L85 PolarHBondContact O-N 3.17Å
82	L	72.4	Confident	74.6	Confident	36 Å²	36	56.9 Å²	56.9	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-73.5	-40.3	-178.6	-176.5	62.5	0	0	0	113.1	Y78 T79 E80 N84 L85 A86 L163 H166	Y78-L82 PolarHBondContact O-N 2.89Å; T79-L82 PolarHBondContact O-N 3.48Å; E80-L82 PolarHBondContact O-N 3.37Å; L82-N84 VanDerWaalsContact C-N 3.33Å; L82-L85 PolarHBondContact O-N 3.14Å; L82-A86 VanDerWaalsContact O-CB 3.25Å; L82-A86 WeakPolarHBondContact O-CB 3.42Å; L82-A86 PolarHBondContact O-N 3.24Å; L82-L163 WeakPolarHBondContact CD1-O 2.89Å; L82-H166 HydrophobicContact CD2-CB 4.23Å
83	S	71.1	Confident	73.3	Confident	59 Å²	59	59 Å²	59	41%	0.413	33%	0.33	S	S	.	.	H	α-helix	trans	-64.7	-42.2	177.9	58.7	0	0	0	0	111	T79 E80 A86 E87	T79-S83 PolarHBondContact O-N 2.91Å; T79-S83 PolarHBondContact O-OG 3.17Å; E80-S83 WeakPolarHBondContact CA-OG 3.49Å; E80-S83 PolarHBondContact O-N 2.89Å; E80-S83 PolarHBondContact O-OG 3.36Å; S83-A86 PolarHBondContact O-N 3.12Å; S83-E87 WeakPolarHBondContact O-CB 3.36Å; S83-E87 PolarHBondContact O-N 3.22Å
84	N	71.1	Confident	72.3	Confident	42 Å²	42	60.1 Å²	60.1	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-41.8	176.7	-68.2	-18.5	0	0	0	110.9	Y60 E80 L82 E87 F88	Y60-N84 HydrophobicContact CD1-CB 4.28Å; Y60-N84 HydrophobicContact CG-CB 4.49Å; Y60-N84 PolarHBondContact O-ND2 3.06Å; E80-N84 WeakPolarHBondContact O-CB 3.42Å; E80-N84 PolarHBondContact O-N 3.24Å; E80-N84 PolarHBondContact O-ND2 3.46Å; L82-N84 VanDerWaalsContact C-N 3.33Å; N84-E87 PolarHBondContact O-N 3.22Å; N84-F88 WeakPolarHBondContact O-CB 3.42Å; N84-F88 PolarHBondContact O-N 3.03Å
85	L	69.1	Low	71.3	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-47.2	172.5	-178.4	58.7	0	0	0	110.9	F53 L55 C81 L82 E87 F88 Y89 L163	F53-L85 HydrophobicContact CB-CD2 4.41Å; F53-L85 HydrophobicContact CD1-CD2 3.76Å; L55-L85 HydrophobicContact CD1-CD1 4.01Å; L55-L85 HydrophobicContact CG-CD1 4.36Å; C81-L85 WeakPolarHBondContact O-CB 3.46Å; C81-L85 PolarHBondContact O-N 3.17Å; L82-L85 PolarHBondContact O-N 3.14Å; L85-E87 VanDerWaalsContact C-N 3.35Å; L85-E87 PolarHBondContact O-N 2.84Å; L85-F88 CarbonylContact O-C 3.55Å; L85-F88 WeakPolarHBondContact O-CB 3.33Å; L85-F88 PolarHBondContact O-N 3.24Å; L85-Y89 HydrophobicContact CD1-CD2 3.78Å; L85-Y89 HydrophobicContact CD1-CE2 3.58Å; L85-Y89 HydrophobicContact CD2-CE2 4.03Å; L85-Y89 HydrophobicContact CG-CD2 3.69Å; L85-Y89 HydrophobicContact CG-CE2 3.59Å; L85-Y89 WeakPolarHBondContact O-CB 3.43Å; L85-Y89 WeakPolarHBondContact O-CD2 3.46Å; L85-Y89 PolarHBondContact O-N 3.41Å; L85-L163 HydrophobicContact CD2-CD1 4.42Å
86	A	66.6	Low	70.4	Confident	54 Å²	54	56.7 Å²	56.7	45%	0.446	33%	0.329	S	S	.	.	H	α-helix	trans	-62.9	-37.8	178.6	0	0	0	0	0	112.8	L82 S83 Y89 S90	L82-A86 VanDerWaalsContact O-CB 3.25Å; L82-A86 WeakPolarHBondContact O-CB 3.42Å; L82-A86 PolarHBondContact O-N 3.24Å; S83-A86 PolarHBondContact O-N 3.12Å; A86-Y89 CarbonylContact O-C 3.53Å; A86-Y89 WeakPolarHBondContact O-CB 3.2Å; A86-Y89 PolarHBondContact O-N 3.07Å; A86-S90 PolarHBondContact O-N 2.92Å
87	E	67.6	Low	70	Confident	129 Å²	129	63.7 Å²	63.7	60%	0.603	35%	0.351	S	S	*	.	H	α-helix	trans	-69.1	-42	174.5	-174.1	172.6	-178.6	0	0	111.4	S83 N84 L85 Y89 S90 S91	S83-E87 WeakPolarHBondContact O-CB 3.36Å; S83-E87 PolarHBondContact O-N 3.22Å; N84-E87 PolarHBondContact O-N 3.22Å; L85-E87 VanDerWaalsContact C-N 3.35Å; L85-E87 PolarHBondContact O-N 2.84Å; E87-Y89 VanDerWaalsContact C-N 3.31Å; E87-Y89 PolarHBondContact O-N 2.95Å; E87-S90 WeakPolarHBondContact O-CA 3.37Å; E87-S90 WeakPolarHBondContact O-CB 3.42Å; E87-S90 PolarHBondContact O-N 3.36Å; E87-S90 PolarHBondContact O-OG 2.85Å; E87-S91 PolarHBondContact O-N 3.21Å; E87-S91 PolarHBondContact O-OG 2.91Å
88	F	64.2	Low	69.8	Low	29 Å²	29	66.2 Å²	66.2	13%	0.127	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-44	169	179.4	-99.2	0	0	0	111.3	L56 Y60 N84 L85 S90 S91 E92	L56-F88 HydrophobicContact CD1-CE1 4Å; L56-F88 HydrophobicContact CD1-CE2 3.73Å; L56-F88 HydrophobicContact CD1-CZ 3.21Å; L56-F88 HydrophobicContact CG-CE1 4.49Å; L56-F88 HydrophobicContact CG-CZ 4.13Å; Y60-F88 HydrophobicContact CE1-CB 4.27Å; Y60-F88 HydrophobicContact CE1-CD2 4.36Å; Y60-F88 HydrophobicContact CE1-CG 4.36Å; N84-F88 WeakPolarHBondContact O-CB 3.42Å; N84-F88 PolarHBondContact O-N 3.03Å; L85-F88 CarbonylContact O-C 3.55Å; L85-F88 WeakPolarHBondContact O-CB 3.33Å; L85-F88 PolarHBondContact O-N 3.24Å; F88-S90 PolarHBondContact O-N 3.21Å; F88-S90 VanDerWaalsContact O-N 3.14Å; F88-S91 WeakPolarHBondContact CA-OG 3.2Å; F88-S91 PolarHBondContact O-N 2.87Å; F88-S91 PolarHBondContact O-OG 3.42Å; F88-S91 VanDerWaalsContact O-OG 3.07Å; F88-E92 HydrophobicContact CE1-CB 4.26Å; F88-E92 HydrophobicContact CE2-CB 4.15Å; F88-E92 HydrophobicContact CZ-CB 3.76Å; F88-E92 HydrophobicContact CZ-CG 4Å; F88-E92 PolarHBondContact O-N 2.95Å; F88-E92 VanDerWaalsContact O-N 3.11Å
89	Y	58.9	Low	69.8	Low	83 Å²	83	70.6 Å²	70.6	33%	0.325	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-24.2	172.1	-94.1	-78.9	0	0	0	113.1	L55 L85 A86 E87 L96	L55-Y89 HydrophobicContact CD1-CE2 3.92Å; L55-Y89 WeakPolarHBondContact CD1-OH 3.5Å; L85-Y89 HydrophobicContact CD1-CD2 3.78Å; L85-Y89 HydrophobicContact CD1-CE2 3.58Å; L85-Y89 HydrophobicContact CD2-CE2 4.03Å; L85-Y89 HydrophobicContact CG-CD2 3.69Å; L85-Y89 HydrophobicContact CG-CE2 3.59Å; L85-Y89 WeakPolarHBondContact O-CB 3.43Å; L85-Y89 WeakPolarHBondContact O-CD2 3.46Å; L85-Y89 PolarHBondContact O-N 3.41Å; A86-Y89 CarbonylContact O-C 3.53Å; A86-Y89 WeakPolarHBondContact O-CB 3.2Å; A86-Y89 PolarHBondContact O-N 3.07Å; E87-Y89 VanDerWaalsContact C-N 3.31Å; E87-Y89 PolarHBondContact O-N 2.95Å; Y89-L96 HydrophobicContact CD1-CD1 3.86Å; Y89-L96 HydrophobicContact CD1-CD2 3.49Å; Y89-L96 VanDerWaalsContact CD1-CD2 3.49Å; Y89-L96 HydrophobicContact CD1-CG 4.25Å; Y89-L96 HydrophobicContact CE1-CD2 3.6Å; Y89-L96 HydrophobicContact CG-CD1 4.33Å; Y89-L96 WeakPolarHBondContact O-CD1 3.35Å
90	S	64.4	Low	70	Confident	77 Å²	77	72.3 Å²	72.3	54%	0.538	38%	0.384	S	S	.	.	H	α-helix	trans	-86.7	-26.3	176.6	80.3	0	0	0	0	113	A86 E87 F88 V93	A86-S90 PolarHBondContact O-N 2.92Å; E87-S90 WeakPolarHBondContact O-CA 3.37Å; E87-S90 WeakPolarHBondContact O-CB 3.42Å; E87-S90 PolarHBondContact O-N 3.36Å; E87-S90 PolarHBondContact O-OG 2.85Å; F88-S90 PolarHBondContact O-N 3.21Å; F88-S90 VanDerWaalsContact O-N 3.14Å; S90-V93 WeakPolarHBondContact O-CG2 3.41Å
91	S	63.7	Low	70.4	Confident	77 Å²	77	70.3 Å²	70.3	54%	0.538	38%	0.382	S	S	.	.	H	α-helix	trans	-92.7	-33.9	-172.9	56.6	0	0	0	0	113.9	E87 F88 V93	E87-S91 PolarHBondContact O-N 3.21Å; E87-S91 PolarHBondContact O-OG 2.91Å; F88-S91 WeakPolarHBondContact CA-OG 3.2Å; F88-S91 PolarHBondContact O-N 2.87Å; F88-S91 PolarHBondContact O-OG 3.42Å; F88-S91 VanDerWaalsContact O-OG 3.07Å; S91-V93 PolarHBondContact O-N 3.41Å
92	E	64.6	Low	70.9	Confident	85 Å²	85	75.2 Å²	75.2	40%	0.397	41%	0.406	S	S	.	.	S	Bend	trans	-85.4	56.9	177.8	-155.9	69	-125.2	0	0	111.9	F88 S94 L96	F88-E92 HydrophobicContact CE1-CB 4.26Å; F88-E92 HydrophobicContact CE2-CB 4.15Å; F88-E92 HydrophobicContact CZ-CB 3.76Å; F88-E92 HydrophobicContact CZ-CG 4Å; F88-E92 PolarHBondContact O-N 2.95Å; F88-E92 VanDerWaalsContact O-N 3.11Å; E92-S94 PolarHBondContact O-N 3.24Å; E92-L96 HydrophobicContact CB-CD1 4.01Å; E92-L96 WeakPolarHBondContact O-CB 3.4Å; E92-L96 VanDerWaalsContact O-CD1 3.23Å; E92-L96 WeakPolarHBondContact O-CD1 3.38Å; E92-L96 WeakPolarHBondContact O-CG 3.48Å; E92-L96 PolarHBondContact O-N 3.28Å
93	V	59.2	Low	71.6	Confident	91 Å²	91	77.1 Å²	77.1	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-58.9	-34.6	-161.8	177.7	0	0	0	0	114.9	S90 S91 R97	S90-V93 WeakPolarHBondContact O-CG2 3.41Å; S91-V93 PolarHBondContact O-N 3.41Å; V93-R97 WeakPolarHBondContact O-CB 3.34Å; V93-R97 PolarHBondContact O-N 3.34Å; V93-R97 VanDerWaalsContact O-N 3.09Å
94	S	63.9	Low	72.6	Confident	63 Å²	63	79.8 Å²	79.8	44%	0.441	41%	0.413	S	S	.	.	H	α-helix	trans	-71.8	-56.4	-172.2	49.9	0	0	0	0	112.5	E92 L96 R97 H98	E92-S94 PolarHBondContact O-N 3.24Å; S94-L96 PolarHBondContact O-N 2.94Å; S94-R97 PolarHBondContact O-N 3.42Å; S94-H98 PolarHBondContact O-CD2 3.5Å; S94-H98 PolarHBondContact O-N 3.31Å
95	S	67.3	Low	73.7	Confident	65 Å²	65	83.6 Å²	83.6	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-60.6	-37.5	-178	-51	0	0	0	0	110.8	H98 L99	S95-H98 WeakPolarHBondContact O-CB 3.25Å; S95-H98 PolarHBondContact O-N 2.88Å; S95-L99 PolarHBondContact O-N 2.9Å; S95-L99 VanDerWaalsContact O-N 3.14Å
96	L	68.3	Low	74.9	Confident	24 Å²	24	89.8 Å²	89.8	13%	0.126	46%	0.456	C	S	.	.	H	α-helix	trans	-75.3	-34.5	-177.8	-62.8	174.8	0	0	0	113.2	Y89 E92 S94 H98 L99 K100	Y89-L96 HydrophobicContact CD1-CD1 3.86Å; Y89-L96 HydrophobicContact CD1-CD2 3.49Å; Y89-L96 VanDerWaalsContact CD1-CD2 3.49Å; Y89-L96 HydrophobicContact CD1-CG 4.25Å; Y89-L96 HydrophobicContact CE1-CD2 3.6Å; Y89-L96 HydrophobicContact CG-CD1 4.33Å; Y89-L96 WeakPolarHBondContact O-CD1 3.35Å; E92-L96 HydrophobicContact CB-CD1 4.01Å; E92-L96 WeakPolarHBondContact O-CB 3.4Å; E92-L96 VanDerWaalsContact O-CD1 3.23Å; E92-L96 WeakPolarHBondContact O-CD1 3.38Å; E92-L96 WeakPolarHBondContact O-CG 3.48Å; E92-L96 PolarHBondContact O-N 3.28Å; S94-L96 PolarHBondContact O-N 2.94Å; L96-H98 PolarHBondContact O-N 2.86Å; L96-L99 HydrophobicContact CD2-CD1 4.13Å; L96-L99 PolarHBondContact O-N 3.32Å; L96-K100 WeakPolarHBondContact O-CB 3.48Å; L96-K100 PolarHBondContact O-N 2.95Å
97	R	76	Confident	76.2	Confident	168 Å²	168	92.2 Å²	92.2	63%	0.634	45%	0.454	S	S	*	.	H	α-helix	trans	-59.8	-38.5	171.6	-176.9	172.6	62.2	-169.5	-2.3	111.1	V93 S94 A101	V93-R97 WeakPolarHBondContact O-CB 3.34Å; V93-R97 PolarHBondContact O-N 3.34Å; V93-R97 VanDerWaalsContact O-N 3.09Å; S94-R97 PolarHBondContact O-N 3.42Å; R97-A101 VanDerWaalsContact O-CB 3.25Å; R97-A101 WeakPolarHBondContact O-CB 3.45Å; R97-A101 PolarHBondContact O-N 2.92Å
98	H	80.9	Confident	77.7	Confident	110 Å²	110	89.7 Å²	89.7	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-47.2	174.9	-68	-70.3	0	0	0	111.7	S94 S95 L96 K100 A101 M102	S94-H98 PolarHBondContact O-CD2 3.5Å; S94-H98 PolarHBondContact O-N 3.31Å; S95-H98 WeakPolarHBondContact O-CB 3.25Å; S95-H98 PolarHBondContact O-N 2.88Å; L96-H98 PolarHBondContact O-N 2.86Å; H98-K100 PolarHBondContact O-N 3.14Å; H98-A101 PolarHBondContact O-N 3.26Å; H98-M102 WeakPolarHBondContact O-CB 3.26Å; H98-M102 VanDerWaalsContact O-CG 3.28Å; H98-M102 WeakPolarHBondContact O-CG 3.49Å; H98-M102 PolarHBondContact O-N 2.82Å
99	L	80.8	Confident	79.2	Confident	105 Å²	105	89.9 Å²	89.9	55%	0.55	46%	0.457	S	S	.	.	H	α-helix	trans	-61.8	-44.2	178	-68.4	174.4	0	0	0	112.5	S95 L96 M102 Y103	S95-L99 PolarHBondContact O-N 2.9Å; S95-L99 VanDerWaalsContact O-N 3.14Å; L96-L99 HydrophobicContact CD2-CD1 4.13Å; L96-L99 PolarHBondContact O-N 3.32Å; L99-M102 PolarHBondContact O-N 3.42Å; L99-Y103 WeakPolarHBondContact O-CB 3.32Å; L99-Y103 PolarHBondContact O-N 3.35Å
100	K	81.7	Confident	81.1	Confident	131 Å²	131	88.2 Å²	88.2	57%	0.57	45%	0.451	S	S	*	.	H	α-helix	trans	-63.1	-43.4	176.2	-175.4	171.7	-178.4	173.5	0	111.7	L96 H98 Y103 Y104	L96-K100 WeakPolarHBondContact O-CB 3.48Å; L96-K100 PolarHBondContact O-N 2.95Å; H98-K100 PolarHBondContact O-N 3.14Å; K100-Y103 PolarHBondContact O-N 2.98Å; K100-Y104 HydrophobicContact CD-CE2 4.19Å; K100-Y104 HydrophobicContact CG-CD2 3.92Å; K100-Y104 HydrophobicContact CG-CE2 3.57Å; K100-Y104 WeakPolarHBondContact O-CD2 3.46Å; K100-Y104 PolarHBondContact O-N 3.42Å; K100-Y104 VanDerWaalsContact O-N 3.1Å
101	A	88.3	Confident	82.7	Confident	44 Å²	44	86.2 Å²	86.2	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175.3	0	0	0	0	0	111.6	R97 H98 Y103 Y104 I105	R97-A101 VanDerWaalsContact O-CB 3.25Å; R97-A101 WeakPolarHBondContact O-CB 3.45Å; R97-A101 PolarHBondContact O-N 2.92Å; H98-A101 PolarHBondContact O-N 3.26Å; A101-Y103 PolarHBondContact O-N 3.23Å; A101-Y104 PolarHBondContact O-N 3.39Å; A101-I105 WeakPolarHBondContact O-CB 3.29Å; A101-I105 WeakPolarHBondContact O-CD1 3.45Å; A101-I105 WeakPolarHBondContact O-CG1 3.37Å; A101-I105 PolarHBondContact O-N 3.4Å
102	M	88.9	Confident	84.3	Confident	104 Å²	104	85.9 Å²	85.9	51%	0.512	43%	0.43	S	S	.	.	H	α-helix	trans	-58.1	-47	175.4	-73.5	-177.1	-175.8	0	0	111.2	H98 L99 Y104 I105 Y106	H98-M102 WeakPolarHBondContact O-CB 3.26Å; H98-M102 VanDerWaalsContact O-CG 3.28Å; H98-M102 WeakPolarHBondContact O-CG 3.49Å; H98-M102 PolarHBondContact O-N 2.82Å; L99-M102 PolarHBondContact O-N 3.42Å; M102-Y104 PolarHBondContact O-N 2.82Å; M102-I105 PolarHBondContact O-N 3.33Å; M102-Y106 HydrophobicContact CB-CD2 4.39Å; M102-Y106 HydrophobicContact CB-CE2 4.37Å; M102-Y106 WeakPolarHBondContact O-CD2 3.29Å; M102-Y106 PolarHBondContact O-N 3.23Å
103	Y	87.5	Confident	85.9	Confident	75 Å²	75	84.4 Å²	84.4	29%	0.294	43%	0.429	S	S	.	.	H	α-helix	trans	-54.3	-51.1	176.7	170.5	-98	0	0	0	112.1	L99 K100 A101 Y106 W107	L99-Y103 WeakPolarHBondContact O-CB 3.32Å; L99-Y103 PolarHBondContact O-N 3.35Å; K100-Y103 PolarHBondContact O-N 2.98Å; A101-Y103 PolarHBondContact O-N 3.23Å; Y103-Y106 PolarHBondContact O-N 2.93Å; Y103-W107 WeakPolarHBondContact O-CB 3.42Å; Y103-W107 PolarHBondContact O-N 3.47Å
104	Y	91.1	Very high	87.8	Confident	116 Å²	116	81.6 Å²	81.6	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-66.3	-39	179.1	-75.5	-65.4	0	0	0	112.9	K100 A101 M102 W107 V108	K100-Y104 HydrophobicContact CD-CE2 4.19Å; K100-Y104 HydrophobicContact CG-CD2 3.92Å; K100-Y104 HydrophobicContact CG-CE2 3.57Å; K100-Y104 WeakPolarHBondContact O-CD2 3.46Å; K100-Y104 PolarHBondContact O-N 3.42Å; K100-Y104 VanDerWaalsContact O-N 3.1Å; A101-Y104 PolarHBondContact O-N 3.39Å; M102-Y104 PolarHBondContact O-N 2.82Å; Y104-W107 PolarHBondContact O-N 2.94Å; Y104-V108 WeakPolarHBondContact O-CB 3.48Å; Y104-V108 VanDerWaalsContact O-CG2 3.31Å; Y104-V108 WeakPolarHBondContact O-CG2 3.25Å; Y104-V108 PolarHBondContact O-N 3.41Å
105	I	94.5	Very high	89.4	Confident	122 Å²	122	84.8 Å²	84.8	63%	0.626	42%	0.421	S	S	*	.	H	α-helix	trans	-61.6	-47.4	176.9	-69.7	164.2	0	0	0	110.2	A101 M102 G109	A101-I105 WeakPolarHBondContact O-CB 3.29Å; A101-I105 WeakPolarHBondContact O-CD1 3.45Å; A101-I105 WeakPolarHBondContact O-CG1 3.37Å; A101-I105 PolarHBondContact O-N 3.4Å; M102-I105 PolarHBondContact O-N 3.33Å; I105-G109 PolarHBondContact O-N 2.83Å
106	Y	94	Very high	90.9	Very high	133 Å²	133	88.9 Å²	88.9	52%	0.522	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-48	175.6	-79.5	-64.2	0	0	0	111.1	M102 Y103 V108 G109 Y110	M102-Y106 HydrophobicContact CB-CD2 4.39Å; M102-Y106 HydrophobicContact CB-CE2 4.37Å; M102-Y106 WeakPolarHBondContact O-CD2 3.29Å; M102-Y106 PolarHBondContact O-N 3.23Å; Y103-Y106 PolarHBondContact O-N 2.93Å; Y106-V108 PolarHBondContact O-N 3.39Å; Y106-G109 PolarHBondContact O-N 3.32Å; Y106-Y110 HydrophobicContact CD1-CD2 4.36Å; Y106-Y110 AromaticContact CD1-CE2 3.87Å; Y106-Y110 HydrophobicContact CD1-CE2 3.87Å; Y106-Y110 WeakPolarHBondContact O-CB 3.36Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.38Å; Y106-Y110 PolarHBondContact O-N 3.48Å
107	W	95.3	Very high	92.3	Very high	105 Å²	105	89.4 Å²	89.4	40%	0.398	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-46.6	-178.6	-166	93.2	0	0	0	112.4	Y103 Y104 T111	Y103-W107 WeakPolarHBondContact O-CB 3.42Å; Y103-W107 PolarHBondContact O-N 3.47Å; Y104-W107 PolarHBondContact O-N 2.94Å; W107-T111 HydrophobicContact CD2-CG2 4.24Å; W107-T111 HydrophobicContact CE3-CG2 4.15Å; W107-T111 HydrophobicContact CH2-CG2 4.14Å; W107-T111 HydrophobicContact CZ2-CG2 4.23Å; W107-T111 HydrophobicContact CZ3-CG2 4.1Å; W107-T111 WeakPolarHBondContact O-CB 3.28Å; W107-T111 VanDerWaalsContact O-CG2 3.28Å; W107-T111 WeakPolarHBondContact O-CG2 3.11Å; W107-T111 PolarHBondContact O-N 2.82Å; W107-T111 VanDerWaalsContact O-N 3.09Å; W107-T111 PolarHBondContact O-OG1 3.06Å
108	V	97.1	Very high	93.4	Very high	76 Å²	76	85.4 Å²	85.4	46%	0.461	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-43.7	175.4	174.4	0	0	0	0	111.1	Y104 Y106 Y110 T111 V112	Y104-V108 WeakPolarHBondContact O-CB 3.48Å; Y104-V108 VanDerWaalsContact O-CG2 3.31Å; Y104-V108 WeakPolarHBondContact O-CG2 3.25Å; Y104-V108 PolarHBondContact O-N 3.41Å; Y106-V108 PolarHBondContact O-N 3.39Å; V108-Y110 PolarHBondContact O-N 2.72Å; V108-T111 WeakPolarHBondContact CA-OG1 3.46Å; V108-T111 PolarHBondContact O-N 2.86Å; V108-T111 PolarHBondContact O-OG1 2.89Å; V108-V112 HydrophobicContact CG1-CG2 4.35Å; V108-V112 WeakPolarHBondContact O-CB 3.46Å; V108-V112 VanDerWaalsContact O-CG2 3.29Å; V108-V112 WeakPolarHBondContact O-CG2 3.37Å; V108-V112 PolarHBondContact O-N 3.35Å
109	G	97.7	Very high	94.2	Very high	33 Å²	33	82.7 Å²	82.7	34%	0.34	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-45.1	179.8	0	0	0	0	0	113.1	I105 Y106 S113	I105-G109 PolarHBondContact O-N 2.83Å; Y106-G109 PolarHBondContact O-N 3.32Å; G109-S113 VanDerWaalsContact O-CB 3.29Å; G109-S113 WeakPolarHBondContact O-CB 3.5Å; G109-S113 PolarHBondContact O-N 3.38Å; G109-S113 PolarHBondContact O-OG 3.44Å
110	Y	97.8	Very high	95	Very high	49 Å²	49	79.1 Å²	79.1	19%	0.192	41%	0.406	C	S	.	.	H	α-helix	trans	-68.6	-38.4	178.7	-85.2	-73.3	0	0	0	112.6	Y106 V108 S113 L114 H148 C149 W152	Y106-Y110 HydrophobicContact CD1-CD2 4.36Å; Y106-Y110 AromaticContact CD1-CE2 3.87Å; Y106-Y110 HydrophobicContact CD1-CE2 3.87Å; Y106-Y110 WeakPolarHBondContact O-CB 3.36Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.38Å; Y106-Y110 PolarHBondContact O-N 3.48Å; V108-Y110 PolarHBondContact O-N 2.72Å; Y110-S113 PolarHBondContact O-N 3.03Å; Y110-L114 VanDerWaalsContact O-CB 3.31Å; Y110-L114 WeakPolarHBondContact O-CB 3.24Å; Y110-L114 PolarHBondContact O-N 2.94Å; Y110-H148 AromaticContact CE1-CD2 3.95Å; Y110-H148 AromaticContact CE1-NE2 3.61Å; Y110-H148 AromaticContact CZ-NE2 3.9Å; Y110-H148 PolarHBondContact OH-NE2 3.41Å; Y110-C149 HydrophobicContact CD1-CB 3.96Å; Y110-W152 HydrophobicContact CD1-CB 4.37Å; Y110-W152 HydrophobicContact CD1-CG 4.34Å; Y110-W152 AromaticContact CD2-CD1 3.13Å; Y110-W152 AromaticContact CD2-CG 3.96Å; Y110-W152 HydrophobicContact CD2-CG 3.96Å; Y110-W152 AromaticContact CD2-NE1 3.28Å; Y110-W152 VanDerWaalsContact CD2-NE1 3.28Å; Y110-W152 HydrophobicContact CE1-CB 4.29Å; Y110-W152 HydrophobicContact CE1-CG 4.22Å; Y110-W152 AromaticContact CE2-CD1 3.39Å; Y110-W152 HydrophobicContact CE2-CD2 4.09Å; Y110-W152 AromaticContact CE2-CE2 3.8Å; Y110-W152 AromaticContact CE2-CG 3.84Å; Y110-W152 HydrophobicContact CE2-CG 3.84Å; Y110-W152 AromaticContact CE2-NE1 3.34Å; Y110-W152 VanDerWaalsContact CE2-NE1 3.34Å; Y110-W152 AromaticContact CG-CD1 3.5Å; Y110-W152 VanDerWaalsContact CG-CD1 3.5Å; Y110-W152 HydrophobicContact CG-CG 4.21Å; Y110-W152 AromaticContact CZ-CD1 3.94Å; Y110-W152 AromaticContact CZ-CG 3.96Å
111	T	98	Very high	95.7	Very high	35 Å²	35	73.7 Å²	73.7	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-45.6	176.7	48.2	0	0	0	0	111.6	W107 V108 L114 M115 I153	W107-T111 HydrophobicContact CD2-CG2 4.24Å; W107-T111 HydrophobicContact CE3-CG2 4.15Å; W107-T111 HydrophobicContact CH2-CG2 4.14Å; W107-T111 HydrophobicContact CZ2-CG2 4.23Å; W107-T111 HydrophobicContact CZ3-CG2 4.1Å; W107-T111 WeakPolarHBondContact O-CB 3.28Å; W107-T111 VanDerWaalsContact O-CG2 3.28Å; W107-T111 WeakPolarHBondContact O-CG2 3.11Å; W107-T111 PolarHBondContact O-N 2.82Å; W107-T111 VanDerWaalsContact O-N 3.09Å; W107-T111 PolarHBondContact O-OG1 3.06Å; V108-T111 WeakPolarHBondContact CA-OG1 3.46Å; V108-T111 PolarHBondContact O-N 2.86Å; V108-T111 PolarHBondContact O-OG1 2.89Å; T111-L114 PolarHBondContact O-N 3.25Å; T111-M115 WeakPolarHBondContact O-CG 3.23Å; T111-M115 PolarHBondContact O-N 3.22Å; T111-M115 VanDerWaalsContact O-N 3.13Å; T111-I153 HydrophobicContact CG2-CD1 3.65Å; T111-I153 HydrophobicContact CG2-CG1 4.21Å
112	V	98.3	Very high	96	Very high	69 Å²	69	73.8 Å²	73.8	42%	0.418	38%	0.384	S	S	.	.	H	α-helix	trans	-61.5	-45.9	175.1	172.5	0	0	0	0	110.9	V108 L114 M115 F116	V108-V112 HydrophobicContact CG1-CG2 4.35Å; V108-V112 WeakPolarHBondContact O-CB 3.46Å; V108-V112 VanDerWaalsContact O-CG2 3.29Å; V108-V112 WeakPolarHBondContact O-CG2 3.37Å; V108-V112 PolarHBondContact O-N 3.35Å; V112-L114 VanDerWaalsContact C-N 3.35Å; V112-L114 PolarHBondContact O-N 2.68Å; V112-M115 PolarHBondContact O-N 3.19Å; V112-F116 HydrophobicContact CG1-CD2 3.77Å; V112-F116 HydrophobicContact CG1-CE2 3.54Å; V112-F116 VanDerWaalsContact O-CD2 3.25Å; V112-F116 WeakPolarHBondContact O-CD2 3.38Å; V112-F116 PolarHBondContact O-N 3.46Å
113	S	98.3	Very high	96.4	Very high	55 Å²	55	73.1 Å²	73.1	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-59.2	-45.2	177.5	-60	0	0	0	0	111.7	G109 Y110 M115 F116 L117	G109-S113 VanDerWaalsContact O-CB 3.29Å; G109-S113 WeakPolarHBondContact O-CB 3.5Å; G109-S113 PolarHBondContact O-N 3.38Å; G109-S113 PolarHBondContact O-OG 3.44Å; Y110-S113 PolarHBondContact O-N 3.03Å; S113-M115 VanDerWaalsContact C-N 3.31Å; S113-M115 PolarHBondContact O-N 3.18Å; S113-F116 PolarHBondContact O-N 3.32Å; S113-L117 WeakPolarHBondContact O-CB 3.44Å; S113-L117 WeakPolarHBondContact O-CD1 3.35Å; S113-L117 WeakPolarHBondContact O-CG 3.13Å; S113-L117 PolarHBondContact O-N 3.31Å
114	L	98.3	Very high	96.7	Very high	32 Å²	32	72 Å²	72	17%	0.168	38%	0.378	C	S	.	.	H	α-helix	trans	-57.3	-44.1	177	179.7	60.5	0	0	0	111.7	Y110 T111 V112 F116 L117 L118 A146 C149 A150 I153	Y110-L114 VanDerWaalsContact O-CB 3.31Å; Y110-L114 WeakPolarHBondContact O-CB 3.24Å; Y110-L114 PolarHBondContact O-N 2.94Å; T111-L114 PolarHBondContact O-N 3.25Å; V112-L114 VanDerWaalsContact C-N 3.35Å; V112-L114 PolarHBondContact O-N 2.68Å; L114-F116 PolarHBondContact O-N 3.17Å; L114-L117 PolarHBondContact O-N 3.43Å; L114-L118 HydrophobicContact CD1-CD1 4.04Å; L114-L118 HydrophobicContact CD1-CG 4.03Å; L114-L118 HydrophobicContact CG-CD1 3.99Å; L114-L118 HydrophobicContact CG-CG 4.39Å; L114-L118 WeakPolarHBondContact O-CB 3.44Å; L114-L118 VanDerWaalsContact O-CG 3.26Å; L114-L118 WeakPolarHBondContact O-CG 3.28Å; L114-L118 PolarHBondContact O-N 2.89Å; L114-A146 HydrophobicContact CD1-CB 4.18Å; L114-A146 WeakPolarHBondContact CD1-O 3.35Å; L114-C149 HydrophobicContact CB-CB 3.96Å; L114-C149 HydrophobicContact CD1-CB 4.24Å; L114-A150 HydrophobicContact CD1-CB 4.38Å; L114-A150 HydrophobicContact CD2-CB 4.32Å; L114-I153 HydrophobicContact CD2-CD1 4Å
115	M	98.3	Very high	96.7	Very high	130 Å²	130	71.7 Å²	71.7	64%	0.64	38%	0.383	S	S	*	.	H	α-helix	trans	-60.7	-46.4	178.7	-68.2	-57.9	-63.4	0	0	112.3	T111 V112 S113 L118 A119	T111-M115 WeakPolarHBondContact O-CG 3.23Å; T111-M115 PolarHBondContact O-N 3.22Å; T111-M115 VanDerWaalsContact O-N 3.13Å; V112-M115 PolarHBondContact O-N 3.19Å; S113-M115 VanDerWaalsContact C-N 3.31Å; S113-M115 PolarHBondContact O-N 3.18Å; M115-L118 PolarHBondContact O-N 3.11Å; M115-A119 WeakPolarHBondContact O-CB 3.41Å; M115-A119 PolarHBondContact O-N 3.18Å
116	F	98.4	Very high	96.7	Very high	151 Å²	151	72 Å²	72	66%	0.662	39%	0.386	S	S	*	.	H	α-helix	trans	-66.1	-39.5	177.7	-76.4	-68.5	0	0	0	112.6	V112 S113 L114 A119 A120	V112-F116 HydrophobicContact CG1-CD2 3.77Å; V112-F116 HydrophobicContact CG1-CE2 3.54Å; V112-F116 VanDerWaalsContact O-CD2 3.25Å; V112-F116 WeakPolarHBondContact O-CD2 3.38Å; V112-F116 PolarHBondContact O-N 3.46Å; S113-F116 PolarHBondContact O-N 3.32Å; L114-F116 PolarHBondContact O-N 3.17Å; F116-A119 PolarHBondContact O-N 2.97Å; F116-A120 WeakPolarHBondContact O-CB 3.16Å; F116-A120 PolarHBondContact O-N 3.46Å
117	L	98.1	Very high	96.7	Very high	34 Å²	34	72.3 Å²	72.3	18%	0.178	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-43	177.5	-68.9	165.1	0	0	0	111.6	S113 L114 A120 L121 I142 F145 A146	S113-L117 WeakPolarHBondContact O-CB 3.44Å; S113-L117 WeakPolarHBondContact O-CD1 3.35Å; S113-L117 WeakPolarHBondContact O-CG 3.13Å; S113-L117 PolarHBondContact O-N 3.31Å; L114-L117 PolarHBondContact O-N 3.43Å; L117-A120 PolarHBondContact O-N 2.93Å; L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 3.25Å; L117-I142 HydrophobicContact CB-CG2 4.33Å; L117-I142 HydrophobicContact CD2-CG2 3.78Å; L117-F145 HydrophobicContact CD1-CB 3.95Å; L117-F145 HydrophobicContact CD2-CB 4.24Å; L117-A146 HydrophobicContact CB-CB 4.06Å; L117-A146 HydrophobicContact CD1-CB 4.48Å
118	L	98	Very high	96.5	Very high	85 Å²	85	76.9 Å²	76.9	45%	0.445	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-41	175.6	-71	174.9	0	0	0	111.7	L114 M115 L121 A122	L114-L118 HydrophobicContact CD1-CD1 4.04Å; L114-L118 HydrophobicContact CD1-CG 4.03Å; L114-L118 HydrophobicContact CG-CD1 3.99Å; L114-L118 HydrophobicContact CG-CG 4.39Å; L114-L118 WeakPolarHBondContact O-CB 3.44Å; L114-L118 VanDerWaalsContact O-CG 3.26Å; L114-L118 WeakPolarHBondContact O-CG 3.28Å; L114-L118 PolarHBondContact O-N 2.89Å; M115-L118 PolarHBondContact O-N 3.11Å; L118-L121 PolarHBondContact O-N 3.33Å; L118-A122 WeakPolarHBondContact O-CB 3.47Å; L118-A122 PolarHBondContact O-N 3.24Å
119	A	98	Very high	96.2	Very high	52 Å²	52	78.3 Å²	78.3	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-43.2	174.1	0	0	0	0	0	111.8	M115 F116 A122 I123	M115-A119 WeakPolarHBondContact O-CB 3.41Å; M115-A119 PolarHBondContact O-N 3.18Å; F116-A119 PolarHBondContact O-N 2.97Å; A119-A122 PolarHBondContact O-N 2.86Å; A119-I123 WeakPolarHBondContact O-CG1 3.24Å; A119-I123 PolarHBondContact O-N 3.33Å; A119-I123 VanDerWaalsContact O-N 3.08Å
120	A	96.9	Very high	95.8	Very high	31 Å²	31	79.3 Å²	79.3	26%	0.256	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-46.3	176.2	0	0	0	0	0	112.2	F116 L117 A122 I123 F124 I142	F116-A120 WeakPolarHBondContact O-CB 3.16Å; F116-A120 PolarHBondContact O-N 3.46Å; L117-A120 PolarHBondContact O-N 2.93Å; A120-A122 VanDerWaalsContact C-N 3.34Å; A120-A122 PolarHBondContact O-N 2.7Å; A120-I123 WeakPolarHBondContact O-CB 3.26Å; A120-I123 PolarHBondContact O-N 3.03Å; A120-F124 WeakPolarHBondContact O-CD2 3.36Å; A120-F124 PolarHBondContact O-N 3.46Å; A120-I142 HydrophobicContact CB-CG2 4.45Å
121	L	96.2	Very high	95.5	Very high	17 Å²	17	84.3 Å²	84.3	9%	0.089	43%	0.433	C	S	.	.	H	α-helix	trans	-59.6	-44.1	175.5	-73	168.5	0	0	0	111.7	L117 L118 I123 F124 I125 S139 I142 L143 A146	L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 3.25Å; L118-L121 PolarHBondContact O-N 3.33Å; L121-I123 VanDerWaalsContact C-N 3.27Å; L121-I123 PolarHBondContact O-N 3.4Å; L121-F124 PolarHBondContact O-N 3.24Å; L121-I125 WeakPolarHBondContact O-CB 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.27Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.48Å; L121-S139 WeakPolarHBondContact CD2-O 3.45Å; L121-I142 HydrophobicContact CD1-CG2 4.2Å; L121-I142 HydrophobicContact CD2-CB 3.98Å; L121-I142 HydrophobicContact CD2-CG2 3.76Å; L121-I142 HydrophobicContact CG-CB 4.38Å; L121-I142 HydrophobicContact CG-CG2 3.6Å; L121-L143 HydrophobicContact CD1-CB 4.43Å; L121-L143 HydrophobicContact CD1-CD1 4.13Å; L121-L143 HydrophobicContact CD2-CB 4.21Å; L121-A146 HydrophobicContact CD1-CB 4.02Å
122	A	96.4	Very high	95.1	Very high	45 Å²	45	86 Å²	86	37%	0.372	45%	0.446	S	S	.	.	H	α-helix	trans	-59.1	-40.1	177.7	0	0	0	0	0	111.6	L118 A119 A120 N126	L118-A122 WeakPolarHBondContact O-CB 3.47Å; L118-A122 PolarHBondContact O-N 3.24Å; A119-A122 PolarHBondContact O-N 2.86Å; A120-A122 VanDerWaalsContact C-N 3.34Å; A120-A122 PolarHBondContact O-N 2.7Å; A122-N126 VanDerWaalsContact O-CB 3.29Å; A122-N126 WeakPolarHBondContact O-CB 3.46Å; A122-N126 VanDerWaalsContact O-CG 3.27Å; A122-N126 PolarHBondContact O-N 2.98Å; A122-N126 PolarHBondContact O-ND2 3.1Å
123	I	95.9	Very high	94.7	Very high	90 Å²	90	85.2 Å²	85.2	46%	0.462	44%	0.439	S	S	.	.	H	α-helix	trans	-62.4	-54.7	174.4	-66.5	165.7	0	0	0	109.9	A119 A120 L121 I125 N126 Y127 L130	A119-I123 WeakPolarHBondContact O-CG1 3.24Å; A119-I123 PolarHBondContact O-N 3.33Å; A119-I123 VanDerWaalsContact O-N 3.08Å; A120-I123 WeakPolarHBondContact O-CB 3.26Å; A120-I123 PolarHBondContact O-N 3.03Å; L121-I123 VanDerWaalsContact C-N 3.27Å; L121-I123 PolarHBondContact O-N 3.4Å; I123-I125 VanDerWaalsContact C-N 3.27Å; I123-I125 PolarHBondContact O-N 3.42Å; I123-N126 PolarHBondContact O-N 3.31Å; I123-Y127 HydrophobicContact CB-CD2 4.46Å; I123-Y127 HydrophobicContact CG2-CD2 3.71Å; I123-Y127 HydrophobicContact CG2-CE2 3.93Å; I123-Y127 WeakPolarHBondContact O-CD2 3.25Å; I123-Y127 PolarHBondContact O-N 3.13Å; I123-Y127 VanDerWaalsContact O-N 3.13Å; I123-L130 HydrophobicContact CG2-CD1 4.43Å
124	F	93.8	Very high	94.3	Very high	52 Å²	52	87.7 Å²	87.7	23%	0.228	44%	0.44	C	S	.	.	H	α-helix	trans	-59	-35.9	-177.8	-74.7	-63	0	0	0	113.8	A120 L121 L130 W131 S139 I142	A120-F124 WeakPolarHBondContact O-CD2 3.36Å; A120-F124 PolarHBondContact O-N 3.46Å; L121-F124 PolarHBondContact O-N 3.24Å; F124-L130 HydrophobicContact CD1-CB 4.39Å; F124-L130 HydrophobicContact CD1-CD1 4.01Å; F124-L130 HydrophobicContact CE1-CD1 4.4Å; F124-W131 PolarHBondContact O-NE1 3.01Å; F124-S139 WeakPolarHBondContact CB-OG 3.05Å; F124-I142 HydrophobicContact CD2-CD1 3.97Å; F124-I142 HydrophobicContact CE2-CD1 3.51Å; F124-I142 HydrophobicContact CZ-CD1 4.48Å
125	I	92	Very high	94.1	Very high	109 Å²	109	88 Å²	88	56%	0.559	44%	0.442	S	S	*	.	H	α-helix	trans	-73	-44.7	179.2	-67.4	167.2	0	0	0	111.4	L121 I123 W131	L121-I125 WeakPolarHBondContact O-CB 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.27Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.48Å; I123-I125 VanDerWaalsContact C-N 3.27Å; I123-I125 PolarHBondContact O-N 3.42Å; I125-W131 PolarHBondContact O-NE1 3.49Å
126	N	94	Very high	93.8	Very high	128 Å²	128	84.5 Å²	84.5	68%	0.684	43%	0.425	S	S	*	.	H	α-helix	trans	-72.3	-32	-174.7	-75.4	-48.8	0	0	0	113.3	A122 I123 R128	A122-N126 VanDerWaalsContact O-CB 3.29Å; A122-N126 WeakPolarHBondContact O-CB 3.46Å; A122-N126 VanDerWaalsContact O-CG 3.27Å; A122-N126 PolarHBondContact O-N 2.98Å; A122-N126 PolarHBondContact O-ND2 3.1Å; I123-N126 PolarHBondContact O-N 3.31Å; N126-R128 PolarHBondContact O-N 2.78Å
127	Y	94.2	Very high	93.6	Very high	141 Å²	141	77.4 Å²	77.4	55%	0.553	39%	0.394	S	S	*	.			trans	-92.8	92.3	-178.6	-67.3	-76.8	0	0	0	111.6	I123 S129 L130	I123-Y127 HydrophobicContact CB-CD2 4.46Å; I123-Y127 HydrophobicContact CG2-CD2 3.71Å; I123-Y127 HydrophobicContact CG2-CE2 3.93Å; I123-Y127 WeakPolarHBondContact O-CD2 3.25Å; I123-Y127 PolarHBondContact O-N 3.13Å; I123-Y127 VanDerWaalsContact O-N 3.13Å; Y127-S129 PolarHBondContact O-N 3.1Å; Y127-S129 VanDerWaalsContact O-N 3.08Å; Y127-L130 HydrophobicContact CG-CD1 4.47Å; Y127-L130 VanDerWaalsContact O-CB 3.32Å; Y127-L130 WeakPolarHBondContact O-CB 3.1Å; Y127-L130 PolarHBondContact O-N 3.28Å
128	R	90.8	Very high	93.5	Very high	201 Å²	201	78 Å²	78	76%	0.758	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-52	-32.3	178.2	-178.1	178.9	175.2	-171.1	-0.4	114	N126 L130 W131	N126-R128 PolarHBondContact O-N 2.78Å; R128-L130 PolarHBondContact O-N 3.4Å; R128-L130 VanDerWaalsContact O-N 3.17Å; R128-W131 HydrophobicContact CG-CD2 4.3Å; R128-W131 HydrophobicContact CG-CE3 4.12Å; R128-W131 HydrophobicContact CG-CZ3 4.41Å; R128-W131 WeakPolarHBondContact O-CB 3.29Å; R128-W131 PolarHBondContact O-N 2.81Å; R128-W131 VanDerWaalsContact O-N 3.1Å
129	S	91.3	Very high	93.4	Very high	105 Å²	105	75.1 Å²	75.1	73%	0.734	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-63.5	-19.3	177.7	69.1	0	0	0	0	113	Y127 W131	Y127-S129 PolarHBondContact O-N 3.1Å; Y127-S129 VanDerWaalsContact O-N 3.08Å; S129-W131 VanDerWaalsContact C-N 3.34Å
130	L	90	Very high	93.3	Very high	54 Å²	54	73.5 Å²	73.5	28%	0.283	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-86	-1	177.6	-58	-179.6	0	0	0	112.9	I123 F124 Y127 R128 C132 N135	I123-L130 HydrophobicContact CG2-CD1 4.43Å; F124-L130 HydrophobicContact CD1-CB 4.39Å; F124-L130 HydrophobicContact CD1-CD1 4.01Å; F124-L130 HydrophobicContact CE1-CD1 4.4Å; Y127-L130 HydrophobicContact CG-CD1 4.47Å; Y127-L130 VanDerWaalsContact O-CB 3.32Å; Y127-L130 WeakPolarHBondContact O-CB 3.1Å; Y127-L130 PolarHBondContact O-N 3.28Å; R128-L130 PolarHBondContact O-N 3.4Å; R128-L130 VanDerWaalsContact O-N 3.17Å; L130-C132 PolarHBondContact O-N 3.4Å; L130-N135 WeakPolarHBondContact O-CB 3.17Å; L130-N135 PolarHBondContact O-ND2 3.45Å
131	W	90.7	Very high	93.2	Very high	154 Å²	154	72.9 Å²	72.9	58%	0.583	36%	0.359	S	S	*	.			trans	-77.6	57.9	-178.4	-65.3	2.7	0	0	0	112.9	F124 I125 R128 S129	F124-W131 PolarHBondContact O-NE1 3.01Å; I125-W131 PolarHBondContact O-NE1 3.49Å; R128-W131 HydrophobicContact CG-CD2 4.3Å; R128-W131 HydrophobicContact CG-CE3 4.12Å; R128-W131 HydrophobicContact CG-CZ3 4.41Å; R128-W131 WeakPolarHBondContact O-CB 3.29Å; R128-W131 PolarHBondContact O-N 2.81Å; R128-W131 VanDerWaalsContact O-N 3.1Å; S129-W131 VanDerWaalsContact C-N 3.34Å
132	C	89.7	Confident	93.3	Very high	71 Å²	71	73.5 Å²	73.5	48%	0.48	36%	0.362	S	S	.	.			trans	-91.9	153.3	167.9	-57.5	0	0	0	0	109.9	L130 R134 N135 I136	L130-C132 PolarHBondContact O-N 3.4Å; C132-R134 PolarHBondContact O-N 3.02Å; C132-R134 VanDerWaalsContact O-N 3.16Å; C132-N135 PolarHBondContact O-N 3.01Å; C132-I136 WeakPolarHBondContact O-CG1 3.41Å; C132-I136 PolarHBondContact O-N 3.46Å
133	L	89	Confident	93.4	Very high	53 Å²	53	74.7 Å²	74.7	28%	0.277	36%	0.362	S	S	.	.	H	α-helix	trans	-51	-43.6	178.7	178.8	60.2	0	0	0	112.7	N135 I136 I137 Y199 Y215	L133-N135 PolarHBondContact O-N 3.26Å; L133-I136 PolarHBondContact O-N 3.07Å; L133-I137 HydrophobicContact CD1-CD1 4.31Å; L133-I137 HydrophobicContact CD1-CG1 4.46Å; L133-I137 HydrophobicContact CG-CD1 4.17Å; L133-I137 WeakPolarHBondContact O-CG1 3.33Å; L133-I137 PolarHBondContact O-N 2.87Å; L133-Y199 HydrophobicContact CD2-CE2 3.72Å; L133-Y199 HydrophobicContact CG-CE2 4.13Å; L133-Y215 HydrophobicContact CD1-CD2 4.41Å
134	R	91	Very high	93.5	Very high	107 Å²	107	70.4 Å²	70.4	40%	0.404	34%	0.34	S	S	.	.	H	α-helix	trans	-56	-50.5	175.3	-177.8	-177.8	-62.3	-176.9	-2.9	112.3	C132 I136 I137 H138 Y199	C132-R134 PolarHBondContact O-N 3.02Å; C132-R134 VanDerWaalsContact O-N 3.16Å; R134-I136 VanDerWaalsContact C-N 3.29Å; R134-I136 PolarHBondContact O-N 2.9Å; R134-I137 WeakPolarHBondContact O-CB 3.49Å; R134-I137 PolarHBondContact O-N 3.38Å; R134-H138 VanDerWaalsContact CG-NE2 3.35Å; R134-H138 WeakPolarHBondContact CG-NE2 3.45Å; R134-H138 PolarHBondContact O-CD2 3.33Å; R134-H138 PolarHBondContact O-N 3.45Å; R134-Y199 HydrophobicContact CB-CE1 3.86Å; R134-Y199 HydrophobicContact CG-CE1 4.13Å
135	N	93	Very high	93.6	Very high	38 Å²	38	71.2 Å²	71.2	20%	0.203	34%	0.344	C	S	.	.	H	α-helix	trans	-70.2	-28.7	-178.6	-68.4	-4.6	0	0	0	112.1	L130 C132 L133 S139	L130-N135 WeakPolarHBondContact O-CB 3.17Å; L130-N135 PolarHBondContact O-ND2 3.45Å; C132-N135 PolarHBondContact O-N 3.01Å; L133-N135 PolarHBondContact O-N 3.26Å; N135-S139 VanDerWaalsContact O-CB 3.26Å; N135-S139 WeakPolarHBondContact O-CB 3.35Å; N135-S139 PolarHBondContact O-N 2.83Å; N135-S139 PolarHBondContact O-OG 3.15Å
136	I	93.1	Very high	93.9	Very high	57 Å²	57	66.2 Å²	66.2	29%	0.292	32%	0.318	S	S	.	.	H	α-helix	trans	-65.8	-44.3	171.4	-67.6	169.1	0	0	0	110.2	C132 L133 R134 S139 N140 Y215	C132-I136 WeakPolarHBondContact O-CG1 3.41Å; C132-I136 PolarHBondContact O-N 3.46Å; L133-I136 PolarHBondContact O-N 3.07Å; R134-I136 VanDerWaalsContact C-N 3.29Å; R134-I136 PolarHBondContact O-N 2.9Å; I136-S139 PolarHBondContact O-N 2.98Å; I136-N140 PolarHBondContact O-N 3.29Å; I136-N140 PolarHBondContact O-ND2 3.08Å; I136-Y215 HydrophobicContact CG2-CD2 3.84Å; I136-Y215 HydrophobicContact CG2-CE2 3.5Å; I136-Y215 VanDerWaalsContact CG2-CE2 3.5Å
137	I	94.2	Very high	94.1	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-50.7	175	-66.8	166.5	0	0	0	110	L133 R134 S139 N140 L141 W192 V195 E196 Y199	L133-I137 HydrophobicContact CD1-CD1 4.31Å; L133-I137 HydrophobicContact CD1-CG1 4.46Å; L133-I137 HydrophobicContact CG-CD1 4.17Å; L133-I137 WeakPolarHBondContact O-CG1 3.33Å; L133-I137 PolarHBondContact O-N 2.87Å; R134-I137 WeakPolarHBondContact O-CB 3.49Å; R134-I137 PolarHBondContact O-N 3.38Å; I137-S139 VanDerWaalsContact C-N 3.3Å; I137-S139 PolarHBondContact O-N 3.42Å; I137-N140 PolarHBondContact O-N 3.38Å; I137-N140 VanDerWaalsContact O-N 3.17Å; I137-L141 PolarHBondContact O-N 2.93Å; I137-W192 HydrophobicContact CB-CZ3 4.32Å; I137-W192 HydrophobicContact CG1-CZ3 4.25Å; I137-W192 HydrophobicContact CG2-CE3 4.05Å; I137-W192 HydrophobicContact CG2-CZ3 4.05Å; I137-V195 HydrophobicContact CG2-CG1 4.25Å; I137-E196 HydrophobicContact CG2-CB 4.06Å; I137-E196 HydrophobicContact CG2-CG 4.46Å; I137-Y199 HydrophobicContact CD1-CD1 4.21Å; I137-Y199 HydrophobicContact CD1-CD2 3.83Å; I137-Y199 HydrophobicContact CD1-CE2 4.31Å; I137-Y199 HydrophobicContact CD1-CG 3.77Å
138	H	95	Very high	94.2	Very high	48 Å²	48	56.4 Å²	56.4	22%	0.222	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-38.8	176.5	-67	-61.4	0	0	0	112.5	R134 N140 L141 I142 E196	R134-H138 VanDerWaalsContact CG-NE2 3.35Å; R134-H138 WeakPolarHBondContact CG-NE2 3.45Å; R134-H138 PolarHBondContact O-CD2 3.33Å; R134-H138 PolarHBondContact O-N 3.45Å; H138-N140 VanDerWaalsContact C-N 3.34Å; H138-N140 PolarHBondContact O-N 2.77Å; H138-L141 WeakPolarHBondContact O-CB 3.37Å; H138-L141 PolarHBondContact O-N 3.22Å; H138-I142 WeakPolarHBondContact O-CG1 3.34Å; H138-I142 PolarHBondContact O-N 3.03Å; H138-E196 IonicContact CE1-OE1 2.98Å; H138-E196 PolarHBondContact CE1-OE1 3.47Å; H138-E196 IonicContact CE1-OE2 3.46Å; H138-E196 PolarHBondContact CE1-OE2 3.29Å; H138-E196 IonicContact CG-OE2 3.95Å; H138-E196 IonicContact ND1-OE1 3.21Å; H138-E196 PolarHBondContact ND1-OE1 2.95Å; H138-E196 IonicContact ND1-OE2 2.85Å; H138-E196 PolarHBondContact ND1-OE2 3.36Å
139	S	95.7	Very high	94.6	Very high	23 Å²	23	47.2 Å²	47.2	16%	0.161	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-37.9	178.1	-61.7	0	0	0	0	111.9	L121 F124 N135 I136 I137 I142 L143	L121-S139 WeakPolarHBondContact CD2-O 3.45Å; F124-S139 WeakPolarHBondContact CB-OG 3.05Å; N135-S139 VanDerWaalsContact O-CB 3.26Å; N135-S139 WeakPolarHBondContact O-CB 3.35Å; N135-S139 PolarHBondContact O-N 2.83Å; N135-S139 PolarHBondContact O-OG 3.15Å; I136-S139 PolarHBondContact O-N 2.98Å; I137-S139 VanDerWaalsContact C-N 3.3Å; I137-S139 PolarHBondContact O-N 3.42Å; S139-I142 PolarHBondContact O-N 3.31Å; S139-L143 WeakPolarHBondContact O-CB 3.3Å; S139-L143 PolarHBondContact O-N 2.85Å
140	N	96.1	Very high	94.9	Very high	19 Å²	19	44.2 Å²	44.2	10%	0.102	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-40.5	173.7	-80.1	-90.2	0	0	0	111.5	I136 I137 H138 L143 C144 W192 W223	I136-N140 PolarHBondContact O-N 3.29Å; I136-N140 PolarHBondContact O-ND2 3.08Å; I137-N140 PolarHBondContact O-N 3.38Å; I137-N140 VanDerWaalsContact O-N 3.17Å; H138-N140 VanDerWaalsContact C-N 3.34Å; H138-N140 PolarHBondContact O-N 2.77Å; N140-L143 WeakPolarHBondContact O-CB 3.3Å; N140-L143 PolarHBondContact O-N 3.49Å; N140-C144 PolarHBondContact O-N 2.86Å; N140-C144 PolarHBondContact O-SG 3.14Å; N140-C144 VanDerWaalsContact O-SG 3.33Å; N140-W192 HydrophobicContact CB-CD2 3.78Å; N140-W192 HydrophobicContact CB-CE3 3.87Å; N140-W192 HydrophobicContact CB-CH2 3.72Å; N140-W192 HydrophobicContact CB-CZ2 3.62Å; N140-W192 HydrophobicContact CB-CZ3 3.85Å; N140-W223 PolarHBondContact OD1-NE1 3Å
141	L	96.1	Very high	95.2	Very high	17 Å²	17	42.4 Å²	42.4	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-47.9	174.5	178	63.1	0	0	0	111.9	I137 H138 L143 C144 F145 G189 W192 M193 E196	I137-L141 PolarHBondContact O-N 2.93Å; H138-L141 WeakPolarHBondContact O-CB 3.37Å; H138-L141 PolarHBondContact O-N 3.22Å; L141-L143 VanDerWaalsContact C-N 3.25Å; L141-L143 PolarHBondContact O-N 3.37Å; L141-C144 WeakPolarHBondContact O-CB 3.45Å; L141-C144 PolarHBondContact O-N 2.88Å; L141-F145 HydrophobicContact CD1-CD2 4.34Å; L141-F145 HydrophobicContact CD1-CE1 4.32Å; L141-F145 HydrophobicContact CD1-CE2 3.63Å; L141-F145 HydrophobicContact CD1-CZ 3.61Å; L141-F145 HydrophobicContact CD2-CE2 4.13Å; L141-F145 HydrophobicContact CG-CD2 4.21Å; L141-F145 HydrophobicContact CG-CE2 3.66Å; L141-F145 HydrophobicContact CG-CZ 4.18Å; L141-F145 PolarHBondContact O-N 3.09Å; L141-F145 VanDerWaalsContact O-N 3.12Å; L141-G189 WeakPolarHBondContact CD1-O 3.41Å; L141-W192 HydrophobicContact CB-CB 4.18Å; L141-W192 HydrophobicContact CD1-CB 3.81Å; L141-M193 HydrophobicContact CD1-CG 3.55Å; L141-M193 HydrophobicContact CD2-CG 3.98Å; L141-M193 HydrophobicContact CG-CG 4.43Å; L141-E196 WeakPolarHBondContact CD2-OE2 3.19Å
142	I	97.7	Very high	95.5	Very high	30 Å²	30	38.1 Å²	38.1	15%	0.154	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-39	176.7	-64.8	165.3	0	0	0	110.3	L117 A120 L121 F124 H138 S139 F145 A146	L117-I142 HydrophobicContact CB-CG2 4.33Å; L117-I142 HydrophobicContact CD2-CG2 3.78Å; A120-I142 HydrophobicContact CB-CG2 4.45Å; L121-I142 HydrophobicContact CD1-CG2 4.2Å; L121-I142 HydrophobicContact CD2-CB 3.98Å; L121-I142 HydrophobicContact CD2-CG2 3.76Å; L121-I142 HydrophobicContact CG-CB 4.38Å; L121-I142 HydrophobicContact CG-CG2 3.6Å; F124-I142 HydrophobicContact CD2-CD1 3.97Å; F124-I142 HydrophobicContact CE2-CD1 3.51Å; F124-I142 HydrophobicContact CZ-CD1 4.48Å; H138-I142 WeakPolarHBondContact O-CG1 3.34Å; H138-I142 PolarHBondContact O-N 3.03Å; S139-I142 PolarHBondContact O-N 3.31Å; I142-F145 PolarHBondContact O-N 3.38Å; I142-A146 WeakPolarHBondContact O-CB 3.3Å; I142-A146 PolarHBondContact O-N 3.3Å
143	L	97.6	Very high	95.8	Very high	70 Å²	70	36.2 Å²	36.2	37%	0.366	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-43.8	175.5	179.9	63.6	0	0	0	111.9	L121 S139 N140 L141 F145 A146 C147 W223	L121-L143 HydrophobicContact CD1-CB 4.43Å; L121-L143 HydrophobicContact CD1-CD1 4.13Å; L121-L143 HydrophobicContact CD2-CB 4.21Å; S139-L143 WeakPolarHBondContact O-CB 3.3Å; S139-L143 PolarHBondContact O-N 2.85Å; N140-L143 WeakPolarHBondContact O-CB 3.3Å; N140-L143 PolarHBondContact O-N 3.49Å; L141-L143 VanDerWaalsContact C-N 3.25Å; L141-L143 PolarHBondContact O-N 3.37Å; L143-F145 VanDerWaalsContact C-N 3.31Å; L143-F145 PolarHBondContact O-N 2.87Å; L143-A146 PolarHBondContact O-N 3.29Å; L143-C147 WeakPolarHBondContact O-CB 3.28Å; L143-C147 PolarHBondContact O-N 3.25Å; L143-C147 PolarHBondContact O-SG 3.28Å; L143-C147 VanDerWaalsContact O-SG 3.39Å; L143-W223 HydrophobicContact CD2-CZ2 4.4Å
144	C	97.7	Very high	96	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-46.1	174	-66.8	0	0	0	0	111.5	N140 L141 C147 H148 W223	N140-C144 PolarHBondContact O-N 2.86Å; N140-C144 PolarHBondContact O-SG 3.14Å; N140-C144 VanDerWaalsContact O-SG 3.33Å; L141-C144 WeakPolarHBondContact O-CB 3.45Å; L141-C144 PolarHBondContact O-N 2.88Å; C144-C147 PolarHBondContact O-N 3.33Å; C144-H148 VanDerWaalsContact O-CB 3.32Å; C144-H148 WeakPolarHBondContact O-CB 3.3Å; C144-H148 PolarHBondContact O-N 3.25Å; C144-W223 WeakPolarHBondContact SG-CH2 3.26Å
145	F	97.3	Very high	96	Very high	69 Å²	69	32.4 Å²	32.4	30%	0.303	18%	0.177	S	C	.	.	H	α-helix	trans	-66.9	-37.4	178.1	-64.2	-36.7	0	0	0	112.9	L117 L141 I142 L143 H148 C149 M193	L117-F145 HydrophobicContact CD1-CB 3.95Å; L117-F145 HydrophobicContact CD2-CB 4.24Å; L141-F145 HydrophobicContact CD1-CD2 4.34Å; L141-F145 HydrophobicContact CD1-CE1 4.32Å; L141-F145 HydrophobicContact CD1-CE2 3.63Å; L141-F145 HydrophobicContact CD1-CZ 3.61Å; L141-F145 HydrophobicContact CD2-CE2 4.13Å; L141-F145 HydrophobicContact CG-CD2 4.21Å; L141-F145 HydrophobicContact CG-CE2 3.66Å; L141-F145 HydrophobicContact CG-CZ 4.18Å; L141-F145 PolarHBondContact O-N 3.09Å; L141-F145 VanDerWaalsContact O-N 3.12Å; I142-F145 PolarHBondContact O-N 3.38Å; L143-F145 VanDerWaalsContact C-N 3.31Å; L143-F145 PolarHBondContact O-N 2.87Å; F145-H148 PolarHBondContact O-N 2.85Å; F145-C149 PolarHBondContact O-N 3.23Å; F145-C149 PolarHBondContact O-SG 3.43Å; F145-M193 HydrophobicContact CZ-CE 4.39Å; F145-M193 HydrophobicContact CZ-CG 4.29Å; F145-M193 HydrophobicContact CZ-SD 3.97Å
146	A	98.1	Very high	95.9	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.033	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-47.4	175	0	0	0	0	0	111	L114 L117 L121 I142 L143 H148 C149 A150	L114-A146 HydrophobicContact CD1-CB 4.18Å; L114-A146 WeakPolarHBondContact CD1-O 3.35Å; L117-A146 HydrophobicContact CB-CB 4.06Å; L117-A146 HydrophobicContact CD1-CB 4.48Å; L121-A146 HydrophobicContact CD1-CB 4.02Å; I142-A146 WeakPolarHBondContact O-CB 3.3Å; I142-A146 PolarHBondContact O-N 3.3Å; L143-A146 PolarHBondContact O-N 3.29Å; A146-H148 VanDerWaalsContact C-N 3.34Å; A146-H148 PolarHBondContact O-N 2.95Å; A146-C149 PolarHBondContact O-N 3.27Å; A146-A150 WeakPolarHBondContact O-CB 3.5Å; A146-A150 PolarHBondContact O-N 3.41Å
147	C	97.9	Very high	95.7	Very high	34 Å²	34	30.5 Å²	30.5	23%	0.23	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-38.4	175.7	-69.4	0	0	0	0	112.2	L143 C144 A150 T151 F185	L143-C147 WeakPolarHBondContact O-CB 3.28Å; L143-C147 PolarHBondContact O-N 3.25Å; L143-C147 PolarHBondContact O-SG 3.28Å; L143-C147 VanDerWaalsContact O-SG 3.39Å; C144-C147 PolarHBondContact O-N 3.33Å; C147-A150 PolarHBondContact O-N 2.74Å; C147-T151 WeakPolarHBondContact O-CB 3.36Å; C147-T151 VanDerWaalsContact O-CG2 3.29Å; C147-T151 WeakPolarHBondContact O-CG2 3.25Å; C147-T151 PolarHBondContact O-N 3.48Å; C147-T151 PolarHBondContact O-OG1 2.99Å; C147-F185 HydrophobicContact CB-CB 4.31Å; C147-F185 HydrophobicContact CB-CD1 3.45Å; C147-F185 VanDerWaalsContact CB-CD1 3.45Å; C147-F185 HydrophobicContact CB-CD2 3.71Å; C147-F185 HydrophobicContact CB-CE1 3.53Å; C147-F185 HydrophobicContact CB-CE2 3.78Å; C147-F185 HydrophobicContact CB-CG 3.55Å; C147-F185 HydrophobicContact CB-CZ 3.7Å
148	H	97.3	Very high	95.4	Very high	30 Å²	30	32 Å²	32	14%	0.139	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-48.1	172.2	172.8	53.8	0	0	0	111.7	Y110 C144 F145 A146 A150 T151 W152 L182 F185 V186	Y110-H148 AromaticContact CE1-CD2 3.95Å; Y110-H148 AromaticContact CE1-NE2 3.61Å; Y110-H148 AromaticContact CZ-NE2 3.9Å; Y110-H148 PolarHBondContact OH-NE2 3.41Å; C144-H148 VanDerWaalsContact O-CB 3.32Å; C144-H148 WeakPolarHBondContact O-CB 3.3Å; C144-H148 PolarHBondContact O-N 3.25Å; F145-H148 PolarHBondContact O-N 2.85Å; A146-H148 VanDerWaalsContact C-N 3.34Å; A146-H148 PolarHBondContact O-N 2.95Å; H148-A150 PolarHBondContact O-N 3.44Å; H148-T151 WeakPolarHBondContact CA-OG1 3.23Å; H148-T151 PolarHBondContact O-N 2.92Å; H148-T151 PolarHBondContact O-OG1 2.91Å; H148-W152 WeakPolarHBondContact O-CB 3.31Å; H148-W152 PolarHBondContact O-N 3.49Å; H148-L182 WeakPolarHBondContact ND1-CD1 3.01Å; H148-F185 HydrophobicContact CB-CB 4.11Å; H148-V186 WeakPolarHBondContact CE1-CG2 3.5Å; H148-V186 WeakPolarHBondContact ND1-CG2 3.31Å
149	C	98	Very high	94.7	Very high	7 Å²	7	31.2 Å²	31.2	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-45.1	177.3	-63.9	0	0	0	0	111.5	Y110 L114 F145 A146 W152 I153	Y110-C149 HydrophobicContact CD1-CB 3.96Å; L114-C149 HydrophobicContact CB-CB 3.96Å; L114-C149 HydrophobicContact CD1-CB 4.24Å; F145-C149 PolarHBondContact O-N 3.23Å; F145-C149 PolarHBondContact O-SG 3.43Å; A146-C149 PolarHBondContact O-N 3.27Å; C149-W152 PolarHBondContact O-N 3.46Å; C149-I153 WeakPolarHBondContact O-CD1 3.16Å; C149-I153 VanDerWaalsContact O-CG1 3.25Å; C149-I153 WeakPolarHBondContact O-CG1 3.32Å; C149-I153 PolarHBondContact O-N 2.96Å
150	A	97.9	Very high	94	Very high	43 Å²	43	35.1 Å²	35.1	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-63.1	-43.7	179.1	0	0	0	0	0	112.3	L114 A146 C147 H148 I153 A154	L114-A150 HydrophobicContact CD1-CB 4.38Å; L114-A150 HydrophobicContact CD2-CB 4.32Å; A146-A150 WeakPolarHBondContact O-CB 3.5Å; A146-A150 PolarHBondContact O-N 3.41Å; C147-A150 PolarHBondContact O-N 2.74Å; H148-A150 PolarHBondContact O-N 3.44Å; A150-I153 PolarHBondContact O-N 3.44Å; A150-A154 WeakPolarHBondContact O-CB 3.23Å; A150-A154 PolarHBondContact O-N 2.93Å
151	T	96.3	Very high	93.1	Very high	15 Å²	15	37.1 Å²	37.1	9%	0.092	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-36.1	178.5	48.8	0	0	0	0	112.4	C147 H148 A154 Y155 L181 F185	C147-T151 WeakPolarHBondContact O-CB 3.36Å; C147-T151 VanDerWaalsContact O-CG2 3.29Å; C147-T151 WeakPolarHBondContact O-CG2 3.25Å; C147-T151 PolarHBondContact O-N 3.48Å; C147-T151 PolarHBondContact O-OG1 2.99Å; H148-T151 WeakPolarHBondContact CA-OG1 3.23Å; H148-T151 PolarHBondContact O-N 2.92Å; H148-T151 PolarHBondContact O-OG1 2.91Å; T151-A154 PolarHBondContact O-N 3.45Å; T151-Y155 VanDerWaalsContact O-CB 3.24Å; T151-Y155 WeakPolarHBondContact O-CB 3.42Å; T151-Y155 PolarHBondContact O-N 2.86Å; T151-L181 HydrophobicContact CG2-CB 3.78Å; T151-L181 HydrophobicContact CG2-CD1 4.44Å; T151-F185 HydrophobicContact CG2-CD2 3.76Å; T151-F185 HydrophobicContact CG2-CE2 3.85Å
152	W	95.9	Very high	92	Very high	64 Å²	64	38.3 Å²	38.3	24%	0.242	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-46.4	171.7	178.1	-96.9	0	0	0	111.7	Y110 H148 C149 A154 Y155 S156 L182	Y110-W152 HydrophobicContact CD1-CB 4.37Å; Y110-W152 HydrophobicContact CD1-CG 4.34Å; Y110-W152 AromaticContact CD2-CD1 3.13Å; Y110-W152 AromaticContact CD2-CG 3.96Å; Y110-W152 HydrophobicContact CD2-CG 3.96Å; Y110-W152 AromaticContact CD2-NE1 3.28Å; Y110-W152 VanDerWaalsContact CD2-NE1 3.28Å; Y110-W152 HydrophobicContact CE1-CB 4.29Å; Y110-W152 HydrophobicContact CE1-CG 4.22Å; Y110-W152 AromaticContact CE2-CD1 3.39Å; Y110-W152 HydrophobicContact CE2-CD2 4.09Å; Y110-W152 AromaticContact CE2-CE2 3.8Å; Y110-W152 AromaticContact CE2-CG 3.84Å; Y110-W152 HydrophobicContact CE2-CG 3.84Å; Y110-W152 AromaticContact CE2-NE1 3.34Å; Y110-W152 VanDerWaalsContact CE2-NE1 3.34Å; Y110-W152 AromaticContact CG-CD1 3.5Å; Y110-W152 VanDerWaalsContact CG-CD1 3.5Å; Y110-W152 HydrophobicContact CG-CG 4.21Å; Y110-W152 AromaticContact CZ-CD1 3.94Å; Y110-W152 AromaticContact CZ-CG 3.96Å; H148-W152 WeakPolarHBondContact O-CB 3.31Å; H148-W152 PolarHBondContact O-N 3.49Å; C149-W152 PolarHBondContact O-N 3.46Å; W152-A154 PolarHBondContact O-N 3.47Å; W152-Y155 HydrophobicContact CZ3-CD1 4.5Å; W152-Y155 PolarHBondContact O-N 3.23Å; W152-S156 VanDerWaalsContact O-CB 3.28Å; W152-S156 WeakPolarHBondContact O-CB 3.15Å; W152-S156 PolarHBondContact O-N 3.05Å; W152-S156 PolarHBondContact O-OG 3.33Å; W152-L182 HydrophobicContact CB-CD1 3.85Å; W152-L182 HydrophobicContact CE3-CD1 4Å; W152-L182 HydrophobicContact CE3-CD2 3.74Å; W152-L182 HydrophobicContact CZ3-CD2 4.09Å
153	I	96.2	Very high	90.7	Very high	32 Å²	32	40.1 Å²	40.1	16%	0.164	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-47.8	176.8	-68.7	160.1	0	0	0	110.1	T111 L114 C149 A150 S156 A157	T111-I153 HydrophobicContact CG2-CD1 3.65Å; T111-I153 HydrophobicContact CG2-CG1 4.21Å; L114-I153 HydrophobicContact CD2-CD1 4Å; C149-I153 WeakPolarHBondContact O-CD1 3.16Å; C149-I153 VanDerWaalsContact O-CG1 3.25Å; C149-I153 WeakPolarHBondContact O-CG1 3.32Å; C149-I153 PolarHBondContact O-N 2.96Å; A150-I153 PolarHBondContact O-N 3.44Å; I153-S156 PolarHBondContact O-N 3.25Å; I153-S156 PolarHBondContact O-OG 3.44Å; I153-A157 WeakPolarHBondContact O-CB 3.07Å; I153-A157 PolarHBondContact O-N 3.28Å
154	A	93.9	Very high	89.3	Confident	45 Å²	45	41.7 Å²	41.7	37%	0.372	23%	0.226	S	C	.	.	H	α-helix	trans	-59.9	-48.6	177.9	0	0	0	0	0	112.2	A150 T151 W152 S156 A157 I158	A150-A154 WeakPolarHBondContact O-CB 3.23Å; A150-A154 PolarHBondContact O-N 2.93Å; T151-A154 PolarHBondContact O-N 3.45Å; W152-A154 PolarHBondContact O-N 3.47Å; A154-S156 PolarHBondContact O-N 2.9Å; A154-A157 PolarHBondContact O-N 2.83Å; A154-I158 WeakPolarHBondContact O-CD1 3.46Å; A154-I158 VanDerWaalsContact O-CG1 3.26Å; A154-I158 WeakPolarHBondContact O-CG1 3.33Å; A154-I158 PolarHBondContact O-N 3Å
155	Y	92	Very high	87.6	Confident	35 Å²	35	47.4 Å²	47.4	14%	0.137	25%	0.251	C	S	.	.	H	α-helix	trans	-57.1	-48.3	174.9	170.9	-98.4	0	0	0	111.2	T151 W152 A157 I158 A159 A178 N247	T151-Y155 VanDerWaalsContact O-CB 3.24Å; T151-Y155 WeakPolarHBondContact O-CB 3.42Å; T151-Y155 PolarHBondContact O-N 2.86Å; W152-Y155 HydrophobicContact CZ3-CD1 4.5Å; W152-Y155 PolarHBondContact O-N 3.23Å; Y155-A157 VanDerWaalsContact C-N 3.32Å; Y155-A157 PolarHBondContact O-N 3.46Å; Y155-I158 PolarHBondContact O-N 3.43Å; Y155-A159 HydrophobicContact CE1-CB 4.4Å; Y155-A159 VanDerWaalsContact O-CB 3.25Å; Y155-A159 WeakPolarHBondContact O-CB 3.38Å; Y155-A159 PolarHBondContact O-N 2.93Å; Y155-A178 HydrophobicContact CD2-CB 4.46Å; Y155-N247 HydrophobicContact CE2-CB 4.07Å; Y155-N247 VanDerWaalsContact OH-CB 3.29Å; Y155-N247 WeakPolarHBondContact OH-CB 3.48Å; Y155-N247 PolarHBondContact OH-ND2 2.78Å
156	S	90.1	Very high	85.6	Confident	10 Å²	10	46.3 Å²	46.3	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-35.8	-178.6	74.2	0	0	0	0	112.9	W152 I153 A154 Y160	W152-S156 VanDerWaalsContact O-CB 3.28Å; W152-S156 WeakPolarHBondContact O-CB 3.15Å; W152-S156 PolarHBondContact O-N 3.05Å; W152-S156 PolarHBondContact O-OG 3.33Å; I153-S156 PolarHBondContact O-N 3.25Å; I153-S156 PolarHBondContact O-OG 3.44Å; A154-S156 PolarHBondContact O-N 2.9Å; S156-Y160 VanDerWaalsContact O-CB 3.26Å; S156-Y160 WeakPolarHBondContact O-CB 3.27Å; S156-Y160 PolarHBondContact O-N 2.96Å
157	A	89.6	Confident	83.3	Confident	44 Å²	44	52.8 Å²	52.8	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-70.3	-44.2	175.9	0	0	0	0	0	111.3	I153 A154 Y155 Y160 E161	I153-A157 WeakPolarHBondContact O-CB 3.07Å; I153-A157 PolarHBondContact O-N 3.28Å; A154-A157 PolarHBondContact O-N 2.83Å; Y155-A157 VanDerWaalsContact C-N 3.32Å; Y155-A157 PolarHBondContact O-N 3.46Å; A157-Y160 PolarHBondContact O-N 3.34Å; A157-E161 WeakPolarHBondContact O-CG 3.45Å; A157-E161 PolarHBondContact O-N 3.29Å
158	I	86.6	Confident	81.3	Confident	34 Å²	34	53.7 Å²	53.7	17%	0.174	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-47	176.4	-67.3	163.5	0	0	0	110.3	A154 Y155 Y160 E161 I162 H174 C175 A178	A154-I158 WeakPolarHBondContact O-CD1 3.46Å; A154-I158 VanDerWaalsContact O-CG1 3.26Å; A154-I158 WeakPolarHBondContact O-CG1 3.33Å; A154-I158 PolarHBondContact O-N 3Å; Y155-I158 PolarHBondContact O-N 3.43Å; I158-Y160 VanDerWaalsContact C-N 3.34Å; I158-Y160 PolarHBondContact O-N 2.96Å; I158-E161 PolarHBondContact O-N 2.98Å; I158-I162 HydrophobicContact CG2-CD1 3.59Å; I158-I162 HydrophobicContact CG2-CG1 4.25Å; I158-I162 VanDerWaalsContact O-CG1 3.28Å; I158-I162 WeakPolarHBondContact O-CG1 3.31Å; I158-I162 PolarHBondContact O-N 2.93Å; I158-H174 HydrophobicContact CD1-CB 4.07Å; I158-C175 HydrophobicContact CG2-CB 3.99Å; I158-A178 HydrophobicContact CD1-CB 4.28Å
159	A	81.7	Confident	79.3	Confident	30 Å²	30	58.3 Å²	58.3	25%	0.248	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-40.9	179.1	0	0	0	0	0	111.9	Y155 I162 L163	Y155-A159 HydrophobicContact CE1-CB 4.4Å; Y155-A159 VanDerWaalsContact O-CB 3.25Å; Y155-A159 WeakPolarHBondContact O-CB 3.38Å; Y155-A159 PolarHBondContact O-N 2.93Å; A159-I162 PolarHBondContact O-N 3.47Å; A159-L163 VanDerWaalsContact O-CB 3.32Å; A159-L163 WeakPolarHBondContact O-CB 3.23Å; A159-L163 PolarHBondContact O-N 3Å
160	Y	79.8	Confident	77.6	Confident	105 Å²	105	64.4 Å²	64.4	41%	0.412	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-44.5	174.4	179.5	-94.2	0	0	0	112	S156 A157 I158 L163 M164	S156-Y160 VanDerWaalsContact O-CB 3.26Å; S156-Y160 WeakPolarHBondContact O-CB 3.27Å; S156-Y160 PolarHBondContact O-N 2.96Å; A157-Y160 PolarHBondContact O-N 3.34Å; I158-Y160 VanDerWaalsContact C-N 3.34Å; I158-Y160 PolarHBondContact O-N 2.96Å; Y160-L163 PolarHBondContact O-N 2.75Å; Y160-M164 HydrophobicContact CD1-CG 4.38Å; Y160-M164 HydrophobicContact CD2-CG 4.18Å; Y160-M164 HydrophobicContact CE1-CG 4.04Å; Y160-M164 HydrophobicContact CE2-CG 3.83Å; Y160-M164 HydrophobicContact CG-CG 4.44Å; Y160-M164 VanDerWaalsContact O-CB 3.3Å; Y160-M164 WeakPolarHBondContact O-CB 3.18Å; Y160-M164 VanDerWaalsContact O-CG 3.3Å; Y160-M164 WeakPolarHBondContact O-CG 3.5Å; Y160-M164 PolarHBondContact O-N 3.31Å
161	E	77.4	Confident	76.4	Confident	61 Å²	61	66.3 Å²	66.3	29%	0.285	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-39.7	178.3	-72.4	-70.3	176.6	0	0	112.5	A157 I158 K165	A157-E161 WeakPolarHBondContact O-CG 3.45Å; A157-E161 PolarHBondContact O-N 3.29Å; I158-E161 PolarHBondContact O-N 2.98Å; E161-K165 WeakPolarHBondContact O-CB 3.21Å; E161-K165 PolarHBondContact O-N 2.95Å; E161-K165 IonicContact OE1-NZ 3.54Å; E161-K165 PolarHBondContact OE1-NZ 3.36Å; E161-K165 WeakPolarHBondContact OE2-CD 3.42Å; E161-K165 WeakPolarHBondContact OE2-CE 3.45Å; E161-K165 WeakPolarHBondContact OE2-CG 3.44Å; E161-K165 IonicContact OE2-NZ 2.88Å; E161-K165 PolarHBondContact OE2-NZ 2.71Å
162	I	73.1	Confident	75.4	Confident	43 Å²	43	67.3 Å²	67.3	22%	0.221	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-48.1	174.6	-69.9	169.4	0	0	0	110.1	I158 A159 H166 C175	I158-I162 HydrophobicContact CG2-CD1 3.59Å; I158-I162 HydrophobicContact CG2-CG1 4.25Å; I158-I162 VanDerWaalsContact O-CG1 3.28Å; I158-I162 WeakPolarHBondContact O-CG1 3.31Å; I158-I162 PolarHBondContact O-N 2.93Å; A159-I162 PolarHBondContact O-N 3.47Å; I162-H166 PolarHBondContact O-N 3.15Å; I162-C175 HydrophobicContact CD1-CB 3.92Å
163	L	70.4	Confident	74.8	Confident	67 Å²	67	72.1 Å²	72.1	35%	0.351	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-42.8	-179.5	-177.8	65.5	0	0	0	112.3	L82 L85 A159 Y160	L82-L163 WeakPolarHBondContact CD1-O 2.89Å; L85-L163 HydrophobicContact CD2-CD1 4.42Å; A159-L163 VanDerWaalsContact O-CB 3.32Å; A159-L163 WeakPolarHBondContact O-CB 3.23Å; A159-L163 PolarHBondContact O-N 3Å; Y160-L163 PolarHBondContact O-N 2.75Å
164	M	67.3	Low	74.4	Confident	103 Å²	103	74.8 Å²	74.8	51%	0.507	36%	0.363	S	S	.	.	H	α-helix	trans	-88.2	-30.8	-172.4	-68.6	-61.8	-59.9	0	0	114.3	Y160	Y160-M164 HydrophobicContact CD1-CG 4.38Å; Y160-M164 HydrophobicContact CD2-CG 4.18Å; Y160-M164 HydrophobicContact CE1-CG 4.04Å; Y160-M164 HydrophobicContact CE2-CG 3.83Å; Y160-M164 HydrophobicContact CG-CG 4.44Å; Y160-M164 VanDerWaalsContact O-CB 3.3Å; Y160-M164 WeakPolarHBondContact O-CB 3.18Å; Y160-M164 VanDerWaalsContact O-CG 3.3Å; Y160-M164 WeakPolarHBondContact O-CG 3.5Å; Y160-M164 PolarHBondContact O-N 3.31Å
165	K	62.6	Low	74	Confident	121 Å²	121	73 Å²	73	53%	0.526	35%	0.348	S	S	.	.	H	α-helix	trans	-115	-11.7	-169.9	-63.8	-163.8	-169.6	133.3	0	115.5	E161 L167	E161-K165 WeakPolarHBondContact O-CB 3.21Å; E161-K165 PolarHBondContact O-N 2.95Å; E161-K165 IonicContact OE1-NZ 3.54Å; E161-K165 PolarHBondContact OE1-NZ 3.36Å; E161-K165 WeakPolarHBondContact OE2-CD 3.42Å; E161-K165 WeakPolarHBondContact OE2-CE 3.45Å; E161-K165 WeakPolarHBondContact OE2-CG 3.44Å; E161-K165 IonicContact OE2-NZ 2.88Å; E161-K165 PolarHBondContact OE2-NZ 2.71Å; K165-L167 WeakPolarHBondContact O-CB 3.29Å; K165-L167 PolarHBondContact O-N 2.86Å
166	H	54.5	Low	73.9	Confident	45 Å²	45	73.1 Å²	73.1	21%	0.208	35%	0.349	C	S	.	.			trans	48.1	-8.2	174.3	-125.9	-63.4	0	0	0	119.2	F53 Y78 L82 I162	F53-H166 AromaticContact CE1-CD2 3.82Å; F53-H166 AromaticContact CE1-CE1 3.98Å; F53-H166 AromaticContact CE1-NE2 3.03Å; F53-H166 WeakPolarHBondContact CE1-NE2 3.42Å; F53-H166 AromaticContact CE2-NE2 3.74Å; F53-H166 AromaticContact CZ-CD2 3.99Å; F53-H166 AromaticContact CZ-CE1 3.35Å; F53-H166 WeakPolarHBondContact CZ-CE1 3.32Å; F53-H166 AromaticContact CZ-NE2 2.85Å; F53-H166 WeakPolarHBondContact CZ-NE2 3.47Å; Y78-H166 AromaticContact CD2-CE1 3.86Å; Y78-H166 AromaticContact CG-CE1 3.82Å; L82-H166 HydrophobicContact CD2-CB 4.23Å; I162-H166 PolarHBondContact O-N 3.15Å
167	L	51.6	Low	74	Confident	141 Å²	141	77.3 Å²	77.3	74%	0.738	37%	0.37	S	S	*	.			trans	-95.1	-1.9	-166	-159.2	68.1	0	0	0	112.8	K165	K165-L167 WeakPolarHBondContact O-CB 3.29Å; K165-L167 PolarHBondContact O-N 2.86Å
168	L	55.2	Low	74.2	Confident	52 Å²	52	75.6 Å²	75.6	27%	0.272	36%	0.355	S	S	.	.			trans	-112	60.2	-171.2	-73.8	147.8	0	0	0	111.5	E170 F171	L168-E170 HydrophobicContact CD2-CB 4.47Å; L168-E170 PolarHBondContact O-N 3.48Å; L168-E170 VanDerWaalsContact O-N 3.1Å; L168-F171 HydrophobicContact CB-CB 4.3Å; L168-F171 HydrophobicContact CB-CD2 3.42Å; L168-F171 VanDerWaalsContact CB-CD2 3.42Å; L168-F171 HydrophobicContact CB-CE2 4.1Å; L168-F171 HydrophobicContact CB-CG 4.22Å; L168-F171 HydrophobicContact CD1-CD2 3.64Å; L168-F171 HydrophobicContact CD1-CE2 3.61Å; L168-F171 HydrophobicContact CD2-CD2 3.43Å; L168-F171 VanDerWaalsContact CD2-CD2 3.43Å; L168-F171 HydrophobicContact CD2-CE2 3.18Å; L168-F171 HydrophobicContact CD2-CG 4.43Å; L168-F171 HydrophobicContact CD2-CZ 4.07Å; L168-F171 HydrophobicContact CG-CD2 3.62Å; L168-F171 HydrophobicContact CG-CE2 3.75Å; L168-F171 PolarHBondContact O-N 3.47Å
169	Y	54.4	Low	74.4	Confident	128 Å²	128	74 Å²	74	50%	0.502	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-46.4	-31.8	156.4	178.6	-102.4	0	0	0	111.2	D31 F171 V172	D31-Y169 VanDerWaalsContact O-CE2 3.22Å; D31-Y169 WeakPolarHBondContact O-CE2 3.17Å; Y169-F171 PolarHBondContact O-N 3.43Å; Y169-V172 HydrophobicContact CD2-CG2 4.42Å; Y169-V172 WeakPolarHBondContact O-CB 3.26Å; Y169-V172 PolarHBondContact O-N 3.04Å
170	E	63.5	Low	75	Confident	135 Å²	135	75.1 Å²	75.1	63%	0.631	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-58.1	-29	174.2	-67.1	-154.6	151.4	0	0	114.5	L168 H174	L168-E170 HydrophobicContact CD2-CB 4.47Å; L168-E170 PolarHBondContact O-N 3.48Å; L168-E170 VanDerWaalsContact O-N 3.1Å; E170-H174 PolarHBondContact O-ND1 3.4Å
171	F	71.4	Confident	75.8	Confident	82 Å²	82	73.3 Å²	73.3	36%	0.36	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-94.5	-3	-179.6	-66.1	-51.3	0	0	0	114.4	L168 Y169 R173 H174 C175	L168-F171 HydrophobicContact CB-CB 4.3Å; L168-F171 HydrophobicContact CB-CD2 3.42Å; L168-F171 VanDerWaalsContact CB-CD2 3.42Å; L168-F171 HydrophobicContact CB-CE2 4.1Å; L168-F171 HydrophobicContact CB-CG 4.22Å; L168-F171 HydrophobicContact CD1-CD2 3.64Å; L168-F171 HydrophobicContact CD1-CE2 3.61Å; L168-F171 HydrophobicContact CD2-CD2 3.43Å; L168-F171 VanDerWaalsContact CD2-CD2 3.43Å; L168-F171 HydrophobicContact CD2-CE2 3.18Å; L168-F171 HydrophobicContact CD2-CG 4.43Å; L168-F171 HydrophobicContact CD2-CZ 4.07Å; L168-F171 HydrophobicContact CG-CD2 3.62Å; L168-F171 HydrophobicContact CG-CE2 3.75Å; L168-F171 PolarHBondContact O-N 3.47Å; Y169-F171 PolarHBondContact O-N 3.43Å; F171-R173 VanDerWaalsContact C-N 3.28Å; F171-R173 PolarHBondContact O-N 3.18Å; F171-H174 HydrophobicContact CB-CB 4.49Å; F171-H174 HydrophobicContact CD1-CB 4.43Å; F171-H174 AromaticContact CD1-CE1 3.97Å; F171-H174 AromaticContact CD1-CG 3.99Å; F171-H174 AromaticContact CD1-ND1 3.59Å; F171-H174 CarbonylContact O-C 3.47Å; F171-H174 WeakPolarHBondContact O-CA 3.25Å; F171-H174 VanDerWaalsContact O-CB 3.31Å; F171-H174 WeakPolarHBondContact O-CB 3.32Å; F171-H174 PolarHBondContact O-N 3.01Å; F171-C175 PolarHBondContact O-N 3.07Å
172	V	75.9	Confident	76.7	Confident	36 Å²	36	70.8 Å²	70.8	22%	0.218	33%	0.334	C	S	.	.	H	α-helix	trans	-56.4	-44.5	177.2	171.8	0	0	0	0	111	Y169 H174 C175 F176	Y169-V172 HydrophobicContact CD2-CG2 4.42Å; Y169-V172 WeakPolarHBondContact O-CB 3.26Å; Y169-V172 PolarHBondContact O-N 3.04Å; V172-H174 VanDerWaalsContact C-N 3.25Å; V172-H174 PolarHBondContact O-N 3.5Å; V172-C175 VanDerWaalsContact O-CB 3.28Å; V172-C175 WeakPolarHBondContact O-CB 3.29Å; V172-C175 PolarHBondContact O-N 2.64Å; V172-C175 VanDerWaalsContact O-N 3.09Å; V172-F176 HydrophobicContact CG1-CD2 3.9Å; V172-F176 HydrophobicContact CG1-CE2 3.46Å; V172-F176 VanDerWaalsContact CG1-CE2 3.46Å; V172-F176 WeakPolarHBondContact O-CD2 3.47Å; V172-F176 PolarHBondContact O-N 3.13Å; V172-F176 VanDerWaalsContact O-N 3.12Å
173	R	83.3	Confident	77.7	Confident	165 Å²	165	70.2 Å²	70.2	62%	0.623	33%	0.33	S	S	*	.	H	α-helix	trans	-58	-37.4	173.5	-67.5	-168.7	-61.6	-96.5	-3	112.7	F171 F176 I177	F171-R173 VanDerWaalsContact C-N 3.28Å; F171-R173 PolarHBondContact O-N 3.18Å; R173-F176 PolarHBondContact O-N 3.22Å; R173-I177 WeakPolarHBondContact O-CD1 3.47Å; R173-I177 VanDerWaalsContact O-CG1 3.28Å; R173-I177 WeakPolarHBondContact O-CG1 3.26Å; R173-I177 PolarHBondContact O-N 2.91Å
174	H	87.1	Confident	79	Confident	88 Å²	88	68.9 Å²	68.9	41%	0.407	32%	0.321	S	S	.	.	H	α-helix	trans	-70.3	-34	178.3	-63	82.9	0	0	0	111.6	I158 E170 F171 V172 I177 A178	I158-H174 HydrophobicContact CD1-CB 4.07Å; E170-H174 PolarHBondContact O-ND1 3.4Å; F171-H174 HydrophobicContact CB-CB 4.49Å; F171-H174 HydrophobicContact CD1-CB 4.43Å; F171-H174 AromaticContact CD1-CE1 3.97Å; F171-H174 AromaticContact CD1-CG 3.99Å; F171-H174 AromaticContact CD1-ND1 3.59Å; F171-H174 CarbonylContact O-C 3.47Å; F171-H174 WeakPolarHBondContact O-CA 3.25Å; F171-H174 VanDerWaalsContact O-CB 3.31Å; F171-H174 WeakPolarHBondContact O-CB 3.32Å; F171-H174 PolarHBondContact O-N 3.01Å; V172-H174 VanDerWaalsContact C-N 3.25Å; V172-H174 PolarHBondContact O-N 3.5Å; H174-I177 PolarHBondContact O-N 3.11Å; H174-A178 VanDerWaalsContact O-CB 3.23Å; H174-A178 WeakPolarHBondContact O-CB 3.33Å; H174-A178 PolarHBondContact O-N 2.93Å
175	C	87.1	Confident	80.4	Confident	7 Å²	7	65.4 Å²	65.4	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-50.3	172.6	-156.4	0	0	0	0	110.7	I158 I162 F171 V172 I177 A178 T179 C245	I158-C175 HydrophobicContact CG2-CB 3.99Å; I162-C175 HydrophobicContact CD1-CB 3.92Å; F171-C175 PolarHBondContact O-N 3.07Å; V172-C175 VanDerWaalsContact O-CB 3.28Å; V172-C175 WeakPolarHBondContact O-CB 3.29Å; V172-C175 PolarHBondContact O-N 2.64Å; V172-C175 VanDerWaalsContact O-N 3.09Å; C175-I177 PolarHBondContact O-N 3Å; C175-A178 PolarHBondContact O-N 2.97Å; C175-T179 PolarHBondContact O-N 3.39Å; C175-T179 PolarHBondContact O-OG1 2.87Å; C175-T179 VanDerWaalsContact O-OG1 3.06Å; C175-C245 HydrophobicContact CB-CB 3.44Å; C175-C245 VanDerWaalsContact CB-CB 3.44Å; C175-C245 WeakPolarHBondContact CB-SG 3.12Å; C175-C245 WeakPolarHBondContact SG-CB 3.33Å; C175-C245 CovalentContact SG-SG 2.04Å; C175-C245 PolarHBondContact SG-SG 3.35Å
176	F	89.6	Confident	82	Confident	39 Å²	39	62 Å²	62	17%	0.171	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-47.4	176.6	-74.7	-69.1	0	0	0	112.4	V172 R173 A178 T179 I180 H242 G244 C245 W246	V172-F176 HydrophobicContact CG1-CD2 3.9Å; V172-F176 HydrophobicContact CG1-CE2 3.46Å; V172-F176 VanDerWaalsContact CG1-CE2 3.46Å; V172-F176 WeakPolarHBondContact O-CD2 3.47Å; V172-F176 PolarHBondContact O-N 3.13Å; V172-F176 VanDerWaalsContact O-N 3.12Å; R173-F176 PolarHBondContact O-N 3.22Å; F176-A178 VanDerWaalsContact C-N 3.35Å; F176-A178 PolarHBondContact O-N 2.99Å; F176-T179 PolarHBondContact O-N 2.75Å; F176-I180 VanDerWaalsContact O-CG1 3.24Å; F176-I180 WeakPolarHBondContact O-CG1 3.32Å; F176-I180 PolarHBondContact O-N 3.3Å; F176-H242 AromaticContact CZ-CE1 3.88Å; F176-G244 WeakPolarHBondContact CZ-O 3.41Å; F176-C245 HydrophobicContact CD1-CB 4.15Å; F176-C245 HydrophobicContact CE1-CB 4.21Å; F176-C245 HydrophobicContact CG-CB 4.35Å; F176-C245 HydrophobicContact CZ-CB 4.47Å; F176-W246 AromaticContact CD1-CD2 3.67Å; F176-W246 HydrophobicContact CD1-CD2 3.67Å; F176-W246 AromaticContact CD1-CE2 3.76Å; F176-W246 HydrophobicContact CD1-CE3 4.03Å; F176-W246 AromaticContact CD1-CG 3.96Å; F176-W246 HydrophobicContact CD1-CG 3.96Å; F176-W246 HydrophobicContact CD1-CZ2 4.16Å; F176-W246 HydrophobicContact CD1-CZ3 4.45Å; F176-W246 AromaticContact CE1-CD1 3.65Å; F176-W246 AromaticContact CE1-CD2 3.83Å; F176-W246 HydrophobicContact CE1-CD2 3.83Å; F176-W246 AromaticContact CE1-CE2 3.56Å; F176-W246 AromaticContact CE1-CG 3.86Å; F176-W246 HydrophobicContact CE1-CG 3.86Å; F176-W246 HydrophobicContact CE1-CZ2 4.11Å; F176-W246 AromaticContact CE1-NE1 3.44Å
177	I	92.2	Very high	84	Confident	97 Å²	97	60 Å²	60	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-45.5	177.5	-67.3	165.3	0	0	0	110.5	R173 H174 C175 T179 I180 L181	R173-I177 WeakPolarHBondContact O-CD1 3.47Å; R173-I177 VanDerWaalsContact O-CG1 3.28Å; R173-I177 WeakPolarHBondContact O-CG1 3.26Å; R173-I177 PolarHBondContact O-N 2.91Å; H174-I177 PolarHBondContact O-N 3.11Å; C175-I177 PolarHBondContact O-N 3Å; I177-T179 VanDerWaalsContact C-N 3.34Å; I177-T179 PolarHBondContact O-N 2.84Å; I177-I180 PolarHBondContact O-N 2.96Å; I177-L181 HydrophobicContact CG2-CD1 3.82Å; I177-L181 HydrophobicContact CG2-CG 4.27Å; I177-L181 WeakPolarHBondContact O-CB 3.5Å; I177-L181 VanDerWaalsContact O-CG 3.27Å; I177-L181 WeakPolarHBondContact O-CG 3.33Å; I177-L181 PolarHBondContact O-N 2.04Å
178	A	93.1	Very high	86.1	Confident	8 Å²	8	53.2 Å²	53.2	7%	0.066	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-43	179	0	0	0	0	0	111.6	Y155 I158 H174 C175 F176 L181 L182	Y155-A178 HydrophobicContact CD2-CB 4.46Å; I158-A178 HydrophobicContact CD1-CB 4.28Å; H174-A178 VanDerWaalsContact O-CB 3.23Å; H174-A178 WeakPolarHBondContact O-CB 3.33Å; H174-A178 PolarHBondContact O-N 2.93Å; C175-A178 PolarHBondContact O-N 2.97Å; F176-A178 VanDerWaalsContact C-N 3.35Å; F176-A178 PolarHBondContact O-N 2.99Å; A178-L181 PolarHBondContact O-N 3.44Å; A178-L182 VanDerWaalsContact O-CB 3.23Å; A178-L182 WeakPolarHBondContact O-CB 3.35Å; A178-L182 PolarHBondContact O-N 3.2Å
179	T	92	Very high	88.1	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-44.7	176.7	-56.4	0	0	0	0	112.4	C175 F176 I177 L181 L182 K183 C245 W246 N247	C175-T179 PolarHBondContact O-N 3.39Å; C175-T179 PolarHBondContact O-OG1 2.87Å; C175-T179 VanDerWaalsContact O-OG1 3.06Å; F176-T179 PolarHBondContact O-N 2.75Å; I177-T179 VanDerWaalsContact C-N 3.34Å; I177-T179 PolarHBondContact O-N 2.84Å; T179-L181 VanDerWaalsContact C-N 3.33Å; T179-L181 PolarHBondContact O-N 2.75Å; T179-L182 WeakPolarHBondContact O-CB 3.41Å; T179-L182 PolarHBondContact O-N 2.82Å; T179-K183 HydrophobicContact CG2-CD 4.47Å; T179-K183 WeakPolarHBondContact O-CG 3.17Å; T179-K183 PolarHBondContact O-N 3.49Å; T179-C245 WeakPolarHBondContact CB-O 3.37Å; T179-C245 WeakPolarHBondContact CG2-O 3.3Å; T179-C245 PolarHBondContact OG1-O 2.65Å; T179-C245 PolarHBondContact OG1-SG 2.97Å; T179-W246 HydrophobicContact CG2-CB 4.22Å; T179-W246 VanDerWaalsContact CG2-O 3.32Å; T179-W246 WeakPolarHBondContact CG2-O 3.05Å; T179-N247 HydrophobicContact CG2-CB 4.01Å
180	I	94.4	Very high	90.1	Very high	53 Å²	53	48.1 Å²	48.1	27%	0.272	23%	0.226	S	C	.	.	H	α-helix	trans	-60	-46.9	177.1	-67.6	164.9	0	0	0	110.1	F176 I177 K183 Y184 I230 W246	F176-I180 VanDerWaalsContact O-CG1 3.24Å; F176-I180 WeakPolarHBondContact O-CG1 3.32Å; F176-I180 PolarHBondContact O-N 3.3Å; I177-I180 PolarHBondContact O-N 2.96Å; I180-K183 PolarHBondContact O-N 3.02Å; I180-Y184 VanDerWaalsContact O-CB 3.31Å; I180-Y184 WeakPolarHBondContact O-CB 3.25Å; I180-Y184 PolarHBondContact O-N 3.47Å; I180-I230 HydrophobicContact CG2-CG2 3.91Å; I180-W246 HydrophobicContact CD1-CE3 4.27Å; I180-W246 HydrophobicContact CD1-CZ3 3.83Å; I180-W246 HydrophobicContact CG1-CE3 4.14Å; I180-W246 HydrophobicContact CG1-CZ3 4.16Å
181	L	96.3	Very high	91.6	Very high	67 Å²	67	42.2 Å²	42.2	35%	0.351	20%	0.198	S	C	.	.	H	α-helix	trans	-63.6	-41.9	177.9	-70.5	174.8	0	0	0	111.8	T151 I177 A178 T179 Y184 F185	T151-L181 HydrophobicContact CG2-CB 3.78Å; T151-L181 HydrophobicContact CG2-CD1 4.44Å; I177-L181 HydrophobicContact CG2-CD1 3.82Å; I177-L181 HydrophobicContact CG2-CG 4.27Å; I177-L181 WeakPolarHBondContact O-CB 3.5Å; I177-L181 VanDerWaalsContact O-CG 3.27Å; I177-L181 WeakPolarHBondContact O-CG 3.33Å; I177-L181 PolarHBondContact O-N 2.04Å; A178-L181 PolarHBondContact O-N 3.44Å; T179-L181 VanDerWaalsContact C-N 3.33Å; T179-L181 PolarHBondContact O-N 2.75Å; L181-Y184 PolarHBondContact O-N 3.06Å; L181-F185 HydrophobicContact CB-CD2 4.28Å; L181-F185 HydrophobicContact CB-CE2 4.09Å; L181-F185 HydrophobicContact CD2-CE2 4.05Å; L181-F185 WeakPolarHBondContact O-CD2 3.23Å; L181-F185 PolarHBondContact O-N 3.42Å
182	L	95.1	Very high	92.8	Very high	8 Å²	8	38.3 Å²	38.3	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-51.9	177.3	-178.8	70.9	0	0	0	111	H148 W152 A178 T179 Y184 F185 V186	H148-L182 WeakPolarHBondContact ND1-CD1 3.01Å; W152-L182 HydrophobicContact CB-CD1 3.85Å; W152-L182 HydrophobicContact CE3-CD1 4Å; W152-L182 HydrophobicContact CE3-CD2 3.74Å; W152-L182 HydrophobicContact CZ3-CD2 4.09Å; A178-L182 VanDerWaalsContact O-CB 3.23Å; A178-L182 WeakPolarHBondContact O-CB 3.35Å; A178-L182 PolarHBondContact O-N 3.2Å; T179-L182 WeakPolarHBondContact O-CB 3.41Å; T179-L182 PolarHBondContact O-N 2.82Å; L182-Y184 VanDerWaalsContact C-N 3.31Å; L182-Y184 PolarHBondContact O-N 2.9Å; L182-F185 PolarHBondContact O-N 3.41Å; L182-V186 WeakPolarHBondContact O-CG2 3.28Å; L182-V186 PolarHBondContact O-N 3.46Å
183	K	94.8	Very high	93.7	Very high	32 Å²	32	39.8 Å²	39.8	14%	0.139	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-39.2	177.6	-69.7	-172.4	175.7	-173.2	0	111.6	T179 I180 T187 I230 W246 D253 F256	T179-K183 HydrophobicContact CG2-CD 4.47Å; T179-K183 WeakPolarHBondContact O-CG 3.17Å; T179-K183 PolarHBondContact O-N 3.49Å; I180-K183 PolarHBondContact O-N 3.02Å; K183-T187 VanDerWaalsContact O-CB 3.3Å; K183-T187 WeakPolarHBondContact O-CB 3.18Å; K183-T187 PolarHBondContact O-N 3.21Å; K183-T187 PolarHBondContact O-OG1 2.89Å; K183-I230 HydrophobicContact CB-CD1 3.91Å; K183-W246 VanDerWaalsContact CE-O 3.25Å; K183-W246 WeakPolarHBondContact CE-O 3.19Å; K183-W246 PolarHBondContact NZ-O 2.92Å; K183-D253 IonicContact NZ-OD1 2.66Å; K183-D253 PolarHBondContact NZ-OD1 2.96Å; K183-D253 IonicContact NZ-OD2 3.66Å; K183-F256 HydrophobicContact CD-CE1 4.13Å; K183-F256 HydrophobicContact CD-CZ 3.98Å
184	Y	97.3	Very high	94.2	Very high	38 Å²	38	33.7 Å²	33.7	15%	0.149	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-51.8	175.5	173.8	-105.6	0	0	0	113.1	I180 L181 L182 V186 T187 A188 W223 P226 L227 I230	I180-Y184 VanDerWaalsContact O-CB 3.31Å; I180-Y184 WeakPolarHBondContact O-CB 3.25Å; I180-Y184 PolarHBondContact O-N 3.47Å; L181-Y184 PolarHBondContact O-N 3.06Å; L182-Y184 VanDerWaalsContact C-N 3.31Å; L182-Y184 PolarHBondContact O-N 2.9Å; Y184-V186 PolarHBondContact O-N 2.93Å; Y184-T187 PolarHBondContact O-N 3.29Å; Y184-A188 VanDerWaalsContact O-CB 3.25Å; Y184-A188 WeakPolarHBondContact O-CB 3.34Å; Y184-A188 PolarHBondContact O-N 2.94Å; Y184-W223 HydrophobicContact CE1-CE3 4.15Å; Y184-W223 AromaticContact CE1-CZ3 4Å; Y184-W223 HydrophobicContact CE1-CZ3 4Å; Y184-W223 AromaticContact CZ-CE3 3.81Å; Y184-P226 HydrophobicContact CD2-CB 4.17Å; Y184-P226 HydrophobicContact CE2-CB 4Å; Y184-L227 HydrophobicContact CE2-CB 3.87Å; Y184-L227 HydrophobicContact CE2-CD1 4.15Å; Y184-I230 HydrophobicContact CD2-CG1 4.42Å
185	F	97.7	Very high	94.6	Very high	31 Å²	31	29.8 Å²	29.8	14%	0.136	15%	0.147	C	C	.	.	H	α-helix	trans	-70	-32	-177.2	-70	-60.1	0	0	0	113.1	C147 H148 T151 L181 L182 G189 W223	C147-F185 HydrophobicContact CB-CB 4.31Å; C147-F185 HydrophobicContact CB-CD1 3.45Å; C147-F185 VanDerWaalsContact CB-CD1 3.45Å; C147-F185 HydrophobicContact CB-CD2 3.71Å; C147-F185 HydrophobicContact CB-CE1 3.53Å; C147-F185 HydrophobicContact CB-CE2 3.78Å; C147-F185 HydrophobicContact CB-CG 3.55Å; C147-F185 HydrophobicContact CB-CZ 3.7Å; H148-F185 HydrophobicContact CB-CB 4.11Å; T151-F185 HydrophobicContact CG2-CD2 3.76Å; T151-F185 HydrophobicContact CG2-CE2 3.85Å; L181-F185 HydrophobicContact CB-CD2 4.28Å; L181-F185 HydrophobicContact CB-CE2 4.09Å; L181-F185 HydrophobicContact CD2-CE2 4.05Å; L181-F185 WeakPolarHBondContact O-CD2 3.23Å; L181-F185 PolarHBondContact O-N 3.42Å; L182-F185 PolarHBondContact O-N 3.41Å; F185-G189 PolarHBondContact O-N 3.44Å; F185-W223 HydrophobicContact CD1-CZ3 4.25Å; F185-W223 HydrophobicContact CE1-CZ3 4.23Å
186	V	95.5	Very high	94.9	Very high	49 Å²	49	31.4 Å²	31.4	30%	0.297	15%	0.153	S	C	.	.	H	α-helix	trans	-60.1	-54.3	168.7	166.2	0	0	0	0	110.4	H148 L182 Y184 A188 G189 F190	H148-V186 WeakPolarHBondContact CE1-CG2 3.5Å; H148-V186 WeakPolarHBondContact ND1-CG2 3.31Å; L182-V186 WeakPolarHBondContact O-CG2 3.28Å; L182-V186 PolarHBondContact O-N 3.46Å; Y184-V186 PolarHBondContact O-N 2.93Å; V186-A188 PolarHBondContact O-N 2.91Å; V186-G189 PolarHBondContact O-N 2.64Å; V186-G189 VanDerWaalsContact O-N 3.15Å; V186-F190 HydrophobicContact CG1-CD2 3.94Å; V186-F190 HydrophobicContact CG1-CE2 3.68Å; V186-F190 VanDerWaalsContact O-CD2 3.24Å; V186-F190 WeakPolarHBondContact O-CD2 3.28Å; V186-F190 PolarHBondContact O-N 3.12Å; V186-F190 VanDerWaalsContact O-N 3.1Å
187	T	95.8	Very high	95	Very high	2 Å²	2	31 Å²	31	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-46.4	-177.6	-56.7	0	0	0	0	110.6	K183 Y184 G189 F190 F191 P226 F256 V260	K183-T187 VanDerWaalsContact O-CB 3.3Å; K183-T187 WeakPolarHBondContact O-CB 3.18Å; K183-T187 PolarHBondContact O-N 3.21Å; K183-T187 PolarHBondContact O-OG1 2.89Å; Y184-T187 PolarHBondContact O-N 3.29Å; T187-G189 VanDerWaalsContact C-N 3.31Å; T187-G189 PolarHBondContact O-N 3.07Å; T187-F190 PolarHBondContact O-N 3.09Å; T187-F190 VanDerWaalsContact O-N 3.13Å; T187-F191 HydrophobicContact CG2-CD2 3.86Å; T187-F191 HydrophobicContact CG2-CE2 3.81Å; T187-F191 WeakPolarHBondContact O-CD2 3.41Å; T187-F191 PolarHBondContact O-N 3.1Å; T187-P226 HydrophobicContact CG2-CB 3.97Å; T187-P226 HydrophobicContact CG2-CG 4.35Å; T187-F256 HydrophobicContact CG2-CB 4.22Å; T187-V260 HydrophobicContact CG2-CG2 4.03Å
188	A	97.4	Very high	94.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.5	-40.4	175.4	0	0	0	0	0	112.2	Y184 V186 F190 F191 W192 W223 P226	Y184-A188 VanDerWaalsContact O-CB 3.25Å; Y184-A188 WeakPolarHBondContact O-CB 3.34Å; Y184-A188 PolarHBondContact O-N 2.94Å; V186-A188 PolarHBondContact O-N 2.91Å; A188-F190 VanDerWaalsContact C-N 3.34Å; A188-F190 PolarHBondContact O-N 3.29Å; A188-F191 PolarHBondContact O-N 2.9Å; A188-W192 WeakPolarHBondContact O-CB 3.5Å; A188-W192 VanDerWaalsContact O-CD1 3.25Å; A188-W192 PolarHBondContact O-N 3.21Å; A188-W223 HydrophobicContact CB-CE3 3.9Å; A188-W223 HydrophobicContact CB-CZ3 3.84Å; A188-P226 HydrophobicContact CB-CB 4.05Å; A188-P226 HydrophobicContact CB-CG 4.08Å
189	G	96.5	Very high	94.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-55.7	-46.8	172.9	0	0	0	0	0	112.3	L141 F185 V186 T187 W192 M193	L141-G189 WeakPolarHBondContact CD1-O 3.41Å; F185-G189 PolarHBondContact O-N 3.44Å; V186-G189 PolarHBondContact O-N 2.64Å; V186-G189 VanDerWaalsContact O-N 3.15Å; T187-G189 VanDerWaalsContact C-N 3.31Å; T187-G189 PolarHBondContact O-N 3.07Å; G189-W192 PolarHBondContact O-N 3.47Å; G189-M193 WeakPolarHBondContact O-CG 3.2Å; G189-M193 PolarHBondContact O-N 3.07Å
190	F	95.6	Very high	94.5	Very high	72 Å²	72	33.1 Å²	33.1	32%	0.316	17%	0.17	S	C	.	.	H	α-helix	trans	-62.5	-43.7	175.5	-76.3	-71.4	0	0	0	113.4	V186 T187 A188 W192 M193 F194 V260 L264	V186-F190 HydrophobicContact CG1-CD2 3.94Å; V186-F190 HydrophobicContact CG1-CE2 3.68Å; V186-F190 VanDerWaalsContact O-CD2 3.24Å; V186-F190 WeakPolarHBondContact O-CD2 3.28Å; V186-F190 PolarHBondContact O-N 3.12Å; V186-F190 VanDerWaalsContact O-N 3.1Å; T187-F190 PolarHBondContact O-N 3.09Å; T187-F190 VanDerWaalsContact O-N 3.13Å; A188-F190 VanDerWaalsContact C-N 3.34Å; A188-F190 PolarHBondContact O-N 3.29Å; F190-W192 VanDerWaalsContact C-N 3.34Å; F190-W192 PolarHBondContact O-N 2.98Å; F190-M193 HydrophobicContact CB-CE 4.32Å; F190-M193 HydrophobicContact CD1-CE 3.22Å; F190-M193 HydrophobicContact CE1-CE 3.62Å; F190-M193 HydrophobicContact CG-CE 3.9Å; F190-M193 WeakPolarHBondContact O-CB 3.28Å; F190-M193 PolarHBondContact O-N 3.14Å; F190-F194 PolarHBondContact O-N 3.46Å; F190-V260 HydrophobicContact CB-CB 4.46Å; F190-V260 HydrophobicContact CB-CG1 3.77Å; F190-V260 HydrophobicContact CB-CG2 3.96Å; F190-V260 HydrophobicContact CD1-CG1 3.82Å; F190-V260 HydrophobicContact CD2-CG1 3.76Å; F190-V260 HydrophobicContact CD2-CG2 4.43Å; F190-V260 HydrophobicContact CE1-CG1 4.37Å; F190-V260 HydrophobicContact CE2-CG1 4.29Å; F190-V260 HydrophobicContact CG-CG1 3.51Å; F190-V260 HydrophobicContact CG-CG2 4.39Å; F190-L264 HydrophobicContact CD1-CD1 4.24Å; F190-L264 HydrophobicContact CD1-CD2 4.21Å; F190-L264 HydrophobicContact CD1-CG 4.48Å; F190-L264 HydrophobicContact CE1-CD1 4.14Å
191	F	96	Very high	94.2	Very high	11 Å²	11	34.4 Å²	34.4	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-67.9	-32.7	177.2	-84.7	-89.3	0	0	0	112.7	T187 A188 F194 V195 I221 I225 P226 L229 P259 V260	T187-F191 HydrophobicContact CG2-CD2 3.86Å; T187-F191 HydrophobicContact CG2-CE2 3.81Å; T187-F191 WeakPolarHBondContact O-CD2 3.41Å; T187-F191 PolarHBondContact O-N 3.1Å; A188-F191 PolarHBondContact O-N 2.9Å; F191-F194 WeakPolarHBondContact O-CB 3.24Å; F191-F194 PolarHBondContact O-N 2.76Å; F191-V195 VanDerWaalsContact O-CG2 3.29Å; F191-V195 WeakPolarHBondContact O-CG2 3.47Å; F191-V195 PolarHBondContact O-N 3.44Å; F191-I221 HydrophobicContact CD1-CG2 4.4Å; F191-I225 HydrophobicContact CD1-CB 4.36Å; F191-I225 HydrophobicContact CD1-CG2 4.25Å; F191-I225 HydrophobicContact CE1-CB 4.1Å; F191-I225 HydrophobicContact CE1-CD1 4.31Å; F191-I225 HydrophobicContact CE1-CG2 3.53Å; F191-I225 HydrophobicContact CE2-CG2 4.32Å; F191-I225 HydrophobicContact CZ-CB 4.49Å; F191-I225 HydrophobicContact CZ-CG2 3.56Å; F191-P226 HydrophobicContact CB-CG 3.8Å; F191-P226 HydrophobicContact CD2-CG 3.65Å; F191-P226 HydrophobicContact CE2-CG 4.4Å; F191-P226 HydrophobicContact CG-CG 3.8Å; F191-L229 HydrophobicContact CE2-CD1 3.86Å; F191-L229 HydrophobicContact CZ-CD1 3.84Å; F191-P259 HydrophobicContact CE2-CB 4.44Å; F191-P259 HydrophobicContact CZ-CB 3.8Å; F191-V260 HydrophobicContact CD2-CG2 4.33Å; F191-V260 HydrophobicContact CE2-CG2 3.96Å
192	W	96.5	Very high	93.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.4	-36.7	171.9	-85.8	105.4	0	0	0	112.6	I137 N140 L141 A188 G189 F190 F194 V195 E196 G222 W223	I137-W192 HydrophobicContact CB-CZ3 4.32Å; I137-W192 HydrophobicContact CG1-CZ3 4.25Å; I137-W192 HydrophobicContact CG2-CE3 4.05Å; I137-W192 HydrophobicContact CG2-CZ3 4.05Å; N140-W192 HydrophobicContact CB-CD2 3.78Å; N140-W192 HydrophobicContact CB-CE3 3.87Å; N140-W192 HydrophobicContact CB-CH2 3.72Å; N140-W192 HydrophobicContact CB-CZ2 3.62Å; N140-W192 HydrophobicContact CB-CZ3 3.85Å; L141-W192 HydrophobicContact CB-CB 4.18Å; L141-W192 HydrophobicContact CD1-CB 3.81Å; A188-W192 WeakPolarHBondContact O-CB 3.5Å; A188-W192 VanDerWaalsContact O-CD1 3.25Å; A188-W192 PolarHBondContact O-N 3.21Å; G189-W192 PolarHBondContact O-N 3.47Å; F190-W192 VanDerWaalsContact C-N 3.34Å; F190-W192 PolarHBondContact O-N 2.98Å; W192-F194 VanDerWaalsContact C-N 3.31Å; W192-F194 PolarHBondContact O-N 3.27Å; W192-V195 HydrophobicContact CE3-CB 4.31Å; W192-V195 HydrophobicContact CE3-CG1 4.13Å; W192-V195 HydrophobicContact CZ3-CG1 4.06Å; W192-V195 PolarHBondContact O-N 3.42Å; W192-E196 WeakPolarHBondContact O-CB 3.34Å; W192-E196 PolarHBondContact O-N 2.83Å; W192-G222 PolarHBondContact NE1-O 3.28Å; W192-W223 AromaticContact CE2-CD1 3.92Å; W192-W223 AromaticContact CE2-CE2 3.94Å; W192-W223 AromaticContact CE2-NE1 3.6Å; W192-W223 AromaticContact CZ2-CD1 3.47Å; W192-W223 VanDerWaalsContact CZ2-CD1 3.47Å; W192-W223 HydrophobicContact CZ2-CG 4.29Å; W192-W223 AromaticContact CZ2-NE1 3.28Å; W192-W223 VanDerWaalsContact CZ2-NE1 3.28Å; W192-W223 AromaticContact NE1-CD1 3.75Å; W192-W223 AromaticContact NE1-CD2 3.48Å; W192-W223 AromaticContact NE1-CE2 3.29Å; W192-W223 VanDerWaalsContact NE1-CE2 3.29Å; W192-W223 AromaticContact NE1-CG 3.8Å; W192-W223 AromaticContact NE1-CZ2 3.76Å; W192-W223 AromaticContact NE1-NE1 3.42Å
193	M	94.7	Very high	93.4	Very high	68 Å²	68	33 Å²	33	34%	0.335	17%	0.171	S	C	.	.	H	α-helix	trans	-61.1	-42.2	169.7	-70.8	-170.7	-70.8	0	0	111.3	L141 F145 G189 F190 E196 G197	L141-M193 HydrophobicContact CD1-CG 3.55Å; L141-M193 HydrophobicContact CD2-CG 3.98Å; L141-M193 HydrophobicContact CG-CG 4.43Å; F145-M193 HydrophobicContact CZ-CE 4.39Å; F145-M193 HydrophobicContact CZ-CG 4.29Å; F145-M193 HydrophobicContact CZ-SD 3.97Å; G189-M193 WeakPolarHBondContact O-CG 3.2Å; G189-M193 PolarHBondContact O-N 3.07Å; F190-M193 HydrophobicContact CB-CE 4.32Å; F190-M193 HydrophobicContact CD1-CE 3.22Å; F190-M193 HydrophobicContact CE1-CE 3.62Å; F190-M193 HydrophobicContact CG-CE 3.9Å; F190-M193 WeakPolarHBondContact O-CB 3.28Å; F190-M193 PolarHBondContact O-N 3.14Å; M193-E196 WeakPolarHBondContact O-CB 3.43Å; M193-E196 PolarHBondContact O-N 2.91Å; M193-G197 PolarHBondContact O-N 3.32Å
194	F	94.2	Very high	93	Very high	37 Å²	37	36.8 Å²	36.8	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-45.2	174.6	177.8	-113.5	0	0	0	112.2	F190 F191 W192 E196 G197 L198 I221 A263 V266 S267	F190-F194 PolarHBondContact O-N 3.46Å; F191-F194 WeakPolarHBondContact O-CB 3.24Å; F191-F194 PolarHBondContact O-N 2.76Å; W192-F194 VanDerWaalsContact C-N 3.31Å; W192-F194 PolarHBondContact O-N 3.27Å; F194-E196 VanDerWaalsContact C-N 3.31Å; F194-E196 PolarHBondContact O-N 3.26Å; F194-G197 PolarHBondContact O-N 2.89Å; F194-L198 HydrophobicContact CD1-CD1 3.87Å; F194-L198 HydrophobicContact CD1-CG 4.36Å; F194-L198 HydrophobicContact CD2-CG 4.3Å; F194-L198 HydrophobicContact CE1-CD1 3.29Å; F194-L198 HydrophobicContact CE1-CG 4Å; F194-L198 HydrophobicContact CE2-CD1 4.12Å; F194-L198 HydrophobicContact CE2-CD2 4.06Å; F194-L198 HydrophobicContact CE2-CG 3.93Å; F194-L198 HydrophobicContact CZ-CD1 3.44Å; F194-L198 VanDerWaalsContact CZ-CD1 3.44Å; F194-L198 HydrophobicContact CZ-CD2 3.98Å; F194-L198 HydrophobicContact CZ-CG 3.78Å; F194-L198 WeakPolarHBondContact O-CB 3.45Å; F194-L198 WeakPolarHBondContact O-CG 3.34Å; F194-L198 PolarHBondContact O-N 2.85Å; F194-I221 HydrophobicContact CD1-CG2 4.45Å; F194-A263 HydrophobicContact CB-CB 4.11Å; F194-A263 HydrophobicContact CD1-CB 4.42Å; F194-A263 HydrophobicContact CD2-CB 3.75Å; F194-A263 HydrophobicContact CE2-CB 4.23Å; F194-A263 HydrophobicContact CG-CB 3.85Å; F194-V266 HydrophobicContact CE2-CB 4.24Å; F194-V266 HydrophobicContact CE2-CG1 3.99Å; F194-S267 WeakPolarHBondContact CD2-OG 3.32Å
195	V	94.2	Very high	92.5	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.03	23%	0.226	C	C	.	.	H	α-helix	trans	-60.2	-41.2	175.5	167.4	0	0	0	0	111.5	I137 F191 W192 Y199 C218 I221	I137-V195 HydrophobicContact CG2-CG1 4.25Å; F191-V195 VanDerWaalsContact O-CG2 3.29Å; F191-V195 WeakPolarHBondContact O-CG2 3.47Å; F191-V195 PolarHBondContact O-N 3.44Å; W192-V195 HydrophobicContact CE3-CB 4.31Å; W192-V195 HydrophobicContact CE3-CG1 4.13Å; W192-V195 HydrophobicContact CZ3-CG1 4.06Å; W192-V195 PolarHBondContact O-N 3.42Å; V195-Y199 VanDerWaalsContact O-CB 3.24Å; V195-Y199 WeakPolarHBondContact O-CB 3.46Å; V195-Y199 PolarHBondContact O-N 3.38Å; V195-C218 HydrophobicContact CG1-CB 3.74Å; V195-I221 HydrophobicContact CG2-CB 3.89Å; V195-I221 HydrophobicContact CG2-CG2 3.55Å
196	E	93.1	Very high	91.7	Very high	41 Å²	41	48.8 Å²	48.8	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-46.1	175.3	-173	179.8	139.6	0	0	111.7	I137 H138 L141 W192 M193 F194 Y199 L200	I137-E196 HydrophobicContact CG2-CB 4.06Å; I137-E196 HydrophobicContact CG2-CG 4.46Å; H138-E196 IonicContact CE1-OE1 2.98Å; H138-E196 PolarHBondContact CE1-OE1 3.47Å; H138-E196 IonicContact CE1-OE2 3.46Å; H138-E196 PolarHBondContact CE1-OE2 3.29Å; H138-E196 IonicContact CG-OE2 3.95Å; H138-E196 IonicContact ND1-OE1 3.21Å; H138-E196 PolarHBondContact ND1-OE1 2.95Å; H138-E196 IonicContact ND1-OE2 2.85Å; H138-E196 PolarHBondContact ND1-OE2 3.36Å; L141-E196 WeakPolarHBondContact CD2-OE2 3.19Å; W192-E196 WeakPolarHBondContact O-CB 3.34Å; W192-E196 PolarHBondContact O-N 2.83Å; M193-E196 WeakPolarHBondContact O-CB 3.43Å; M193-E196 PolarHBondContact O-N 2.91Å; F194-E196 VanDerWaalsContact C-N 3.31Å; F194-E196 PolarHBondContact O-N 3.26Å; E196-Y199 WeakPolarHBondContact O-CB 3.25Å; E196-Y199 PolarHBondContact O-N 3.34Å; E196-L200 WeakPolarHBondContact O-CG 3.35Å; E196-L200 PolarHBondContact O-N 3.35Å
197	G	91.6	Very high	90.8	Very high	31 Å²	31	49.9 Å²	49.9	32%	0.32	25%	0.254	S	S	.	.	H	α-helix	trans	-60.7	-49.2	175.8	0	0	0	0	0	112.7	M193 F194 Y199 L200 L201	M193-G197 PolarHBondContact O-N 3.32Å; F194-G197 PolarHBondContact O-N 2.89Å; G197-Y199 VanDerWaalsContact C-N 3.32Å; G197-Y199 PolarHBondContact O-N 3.07Å; G197-L200 PolarHBondContact O-N 3.24Å; G197-L201 WeakPolarHBondContact O-CB 3.5Å; G197-L201 PolarHBondContact O-N 3.12Å
198	L	90.3	Very high	89.8	Confident	61 Å²	61	59.5 Å²	59.5	32%	0.319	30%	0.296	S	S	.	.	H	α-helix	trans	-59.5	-42.4	175.7	-74.3	-175.3	0	0	0	112.1	F194 L200 L201 V202	F194-L198 HydrophobicContact CD1-CD1 3.87Å; F194-L198 HydrophobicContact CD1-CG 4.36Å; F194-L198 HydrophobicContact CD2-CG 4.3Å; F194-L198 HydrophobicContact CE1-CD1 3.29Å; F194-L198 HydrophobicContact CE1-CG 4Å; F194-L198 HydrophobicContact CE2-CD1 4.12Å; F194-L198 HydrophobicContact CE2-CD2 4.06Å; F194-L198 HydrophobicContact CE2-CG 3.93Å; F194-L198 HydrophobicContact CZ-CD1 3.44Å; F194-L198 VanDerWaalsContact CZ-CD1 3.44Å; F194-L198 HydrophobicContact CZ-CD2 3.98Å; F194-L198 HydrophobicContact CZ-CG 3.78Å; F194-L198 WeakPolarHBondContact O-CB 3.45Å; F194-L198 WeakPolarHBondContact O-CG 3.34Å; F194-L198 PolarHBondContact O-N 2.85Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L198-L200 PolarHBondContact O-N 2.76Å; L198-L201 PolarHBondContact O-N 2.66Å; L198-V202 WeakPolarHBondContact O-CG2 3.16Å; L198-V202 PolarHBondContact O-N 3.46Å
199	Y	89.9	Confident	88.6	Confident	22 Å²	22	66.7 Å²	66.7	9%	0.086	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-45.6	177.1	174.9	-101.5	0	0	0	111.2	L133 R134 I137 V195 E196 G197 S203 I213	L133-Y199 HydrophobicContact CD2-CE2 3.72Å; L133-Y199 HydrophobicContact CG-CE2 4.13Å; R134-Y199 HydrophobicContact CB-CE1 3.86Å; R134-Y199 HydrophobicContact CG-CE1 4.13Å; I137-Y199 HydrophobicContact CD1-CD1 4.21Å; I137-Y199 HydrophobicContact CD1-CD2 3.83Å; I137-Y199 HydrophobicContact CD1-CE2 4.31Å; I137-Y199 HydrophobicContact CD1-CG 3.77Å; V195-Y199 VanDerWaalsContact O-CB 3.24Å; V195-Y199 WeakPolarHBondContact O-CB 3.46Å; V195-Y199 PolarHBondContact O-N 3.38Å; E196-Y199 WeakPolarHBondContact O-CB 3.25Å; E196-Y199 PolarHBondContact O-N 3.34Å; G197-Y199 VanDerWaalsContact C-N 3.32Å; G197-Y199 PolarHBondContact O-N 3.07Å; Y199-S203 WeakPolarHBondContact O-CB 2.85Å; Y199-S203 PolarHBondContact O-N 3.28Å; Y199-S203 PolarHBondContact O-OG 3.28Å; Y199-I213 HydrophobicContact CD2-CD1 4.13Å; Y199-I213 HydrophobicContact CD2-CG2 4.16Å
200	L	88.4	Confident	87.2	Confident	68 Å²	68	72.8 Å²	72.8	36%	0.356	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-49.1	176.7	-70.2	176.5	0	0	0	111.5	E196 G197 L198 V202 S203 V204	E196-L200 WeakPolarHBondContact O-CG 3.35Å; E196-L200 PolarHBondContact O-N 3.35Å; G197-L200 PolarHBondContact O-N 3.24Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L198-L200 PolarHBondContact O-N 2.76Å; L200-V202 PolarHBondContact O-N 3.38Å; L200-S203 WeakPolarHBondContact CA-OG 3.31Å; L200-S203 PolarHBondContact O-N 2.95Å; L200-S203 VanDerWaalsContact O-N 3.16Å; L200-S203 PolarHBondContact O-OG 2.97Å; L200-V204 WeakPolarHBondContact O-CB 3.35Å; L200-V204 VanDerWaalsContact O-CG2 3.29Å; L200-V204 WeakPolarHBondContact O-CG2 3.5Å; L200-V204 PolarHBondContact O-N 2.84Å
201	L	87.7	Confident	86	Confident	79 Å²	79	76.9 Å²	76.9	41%	0.414	37%	0.372	S	S	.	.	H	α-helix	trans	-57.2	-48.6	-179.6	-177.2	140.1	0	0	0	111.9	G197 L198 V204 R205	G197-L201 WeakPolarHBondContact O-CB 3.5Å; G197-L201 PolarHBondContact O-N 3.12Å; L198-L201 PolarHBondContact O-N 2.66Å; L201-V204 PolarHBondContact O-N 3.33Å; L201-R205 HydrophobicContact CG-CG 4.46Å; L201-R205 VanDerWaalsContact O-CB 3.25Å; L201-R205 WeakPolarHBondContact O-CB 3.33Å; L201-R205 WeakPolarHBondContact O-CG 3.35Å; L201-R205 PolarHBondContact O-N 3.11Å
202	V	87.6	Confident	84.9	Confident	35 Å²	35	81.7 Å²	81.7	21%	0.212	40%	0.397	C	S	.	.	H	α-helix	trans	-66.6	-41.1	177.7	176.1	0	0	0	0	111	L198 L200 V204 F206 R209 I213	L198-V202 WeakPolarHBondContact O-CG2 3.16Å; L198-V202 PolarHBondContact O-N 3.46Å; L200-V202 PolarHBondContact O-N 3.38Å; V202-V204 VanDerWaalsContact C-N 3.28Å; V202-V204 PolarHBondContact O-N 3.03Å; V202-F206 HydrophobicContact CG1-CB 4.29Å; V202-F206 CarbonylContact O-C 3.11Å; V202-F206 VanDerWaalsContact O-CA 3.27Å; V202-F206 WeakPolarHBondContact O-CA 3.03Å; V202-F206 PolarHBondContact O-N 3.2Å; V202-R209 HydrophobicContact CG1-CB 4.46Å; V202-I213 HydrophobicContact CB-CD1 3.71Å; V202-I213 HydrophobicContact CG1-CD1 3.55Å; V202-I213 HydrophobicContact CG1-CG1 4.31Å; V202-I213 HydrophobicContact CG2-CD1 4.3Å
203	S	85.7	Confident	84.1	Confident	11 Å²	11	83.1 Å²	83.1	8%	0.077	41%	0.405	C	S	.	.	H	α-helix	trans	-64.2	-33	-179.4	76.8	0	0	0	0	113.4	Y199 L200	Y199-S203 WeakPolarHBondContact O-CB 2.85Å; Y199-S203 PolarHBondContact O-N 3.28Å; Y199-S203 PolarHBondContact O-OG 3.28Å; L200-S203 WeakPolarHBondContact CA-OG 3.31Å; L200-S203 PolarHBondContact O-N 2.95Å; L200-S203 VanDerWaalsContact O-N 3.16Å; L200-S203 PolarHBondContact O-OG 2.97Å
204	V	87.8	Confident	83.7	Confident	112 Å²	112	82.7 Å²	82.7	68%	0.679	41%	0.409	S	S	*	.	H	α-helix	trans	-86	-49.3	-179.1	173.6	0	0	0	0	110.8	L200 L201 V202	L200-V204 WeakPolarHBondContact O-CB 3.35Å; L200-V204 VanDerWaalsContact O-CG2 3.29Å; L200-V204 WeakPolarHBondContact O-CG2 3.5Å; L200-V204 PolarHBondContact O-N 2.84Å; L201-V204 PolarHBondContact O-N 3.33Å; V202-V204 VanDerWaalsContact C-N 3.28Å; V202-V204 PolarHBondContact O-N 3.03Å
205	R	85.5	Confident	83.4	Confident	198 Å²	198	85.7 Å²	85.7	75%	0.747	42%	0.419	S	S	*	.	H	α-helix	trans	-79.8	-35.9	-175.1	-65.5	-64.2	-168	145.5	3.2	113.2	L201	L201-R205 HydrophobicContact CG-CG 4.46Å; L201-R205 VanDerWaalsContact O-CB 3.25Å; L201-R205 WeakPolarHBondContact O-CB 3.33Å; L201-R205 WeakPolarHBondContact O-CG 3.35Å; L201-R205 PolarHBondContact O-N 3.11Å
206	F	80.8	Confident	83.2	Confident	123 Å²	123	90.3 Å²	90.3	54%	0.539	45%	0.448	S	S	.	.			trans	-126.8	57.4	-174.5	-59	-74.7	0	0	0	110.3	V202 F208 R209	V202-F206 HydrophobicContact CG1-CB 4.29Å; V202-F206 CarbonylContact O-C 3.11Å; V202-F206 VanDerWaalsContact O-CA 3.27Å; V202-F206 WeakPolarHBondContact O-CA 3.03Å; V202-F206 PolarHBondContact O-N 3.2Å; F206-F208 PolarHBondContact O-N 3.39Å; F206-R209 HydrophobicContact CB-CB 4.01Å; F206-R209 HydrophobicContact CB-CG 3.94Å; F206-R209 WeakPolarHBondContact O-CB 3.19Å; F206-R209 PolarHBondContact O-N 3.09Å
207	S	76.5	Confident	83.1	Confident	71 Å²	71	92.6 Å²	92.6	50%	0.497	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-53.5	-25.1	-177.3	-174.5	0	0	0	0	114	R210	S207-R210 VanDerWaalsContact O-CG 3.25Å; S207-R210 WeakPolarHBondContact O-CG 3.4Å
208	F	76.1	Confident	83.1	Confident	204 Å²	204	91.5 Å²	91.5	90%	0.895	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-79.3	-12	176.1	-71.4	-77.6	0	0	0	114.5	F206	F206-F208 PolarHBondContact O-N 3.39Å
209	R	71	Confident	83.3	Confident	151 Å²	151	89.6 Å²	89.6	57%	0.57	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-97.2	16.3	-176.9	-65.3	-68.6	-127.6	-164.6	-0.6	113.5	V202 F206 D211 L212	V202-R209 HydrophobicContact CG1-CB 4.46Å; F206-R209 HydrophobicContact CB-CB 4.01Å; F206-R209 HydrophobicContact CB-CG 3.94Å; F206-R209 WeakPolarHBondContact O-CB 3.19Å; F206-R209 PolarHBondContact O-N 3.09Å; R209-D211 PolarHBondContact O-N 2.87Å; R209-L212 HydrophobicContact CB-CD1 4.12Å; R209-L212 HydrophobicContact CG-CD1 4.29Å; R209-L212 WeakPolarHBondContact O-CB 3.48Å; R209-L212 PolarHBondContact O-N 3.31Å
210	R	67.1	Low	83.5	Confident	128 Å²	128	91.5 Å²	91.5	48%	0.483	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-57.5	-33.8	-178.8	-67.4	-109.7	-91.5	-126.7	-7.2	112.6	S207 L212 I213	S207-R210 VanDerWaalsContact O-CG 3.25Å; S207-R210 WeakPolarHBondContact O-CG 3.4Å; R210-L212 PolarHBondContact O-N 3.45Å; R210-I213 PolarHBondContact O-N 2.95Å; R210-I213 VanDerWaalsContact O-N 3.14Å
211	D	71.6	Confident	83.8	Confident	158 Å²	158	90.1 Å²	90.1	85%	0.845	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-67.9	-17	-179.9	-56.7	-30.6	0	0	0	113.6	R209	R209-D211 PolarHBondContact O-N 2.87Å
212	L	72.5	Confident	84.1	Confident	112 Å²	112	86.3 Å²	86.3	59%	0.586	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-78.1	-22.7	175.2	-62.6	-179.1	0	0	0	112.5	R209 R210 S214	R209-L212 HydrophobicContact CB-CD1 4.12Å; R209-L212 HydrophobicContact CG-CD1 4.29Å; R209-L212 WeakPolarHBondContact O-CB 3.48Å; R209-L212 PolarHBondContact O-N 3.31Å; R210-L212 PolarHBondContact O-N 3.45Å; L212-S214 PolarHBondContact O-N 2.58Å
213	I	79.6	Confident	84.6	Confident	31 Å²	31	87.2 Å²	87.2	16%	0.159	43%	0.43	C	S	.	.			trans	-91	89	-178.3	-55.7	179.7	0	0	0	108.9	Y199 V202 R210 C218	Y199-I213 HydrophobicContact CD2-CD1 4.13Å; Y199-I213 HydrophobicContact CD2-CG2 4.16Å; V202-I213 HydrophobicContact CB-CD1 3.71Å; V202-I213 HydrophobicContact CG1-CD1 3.55Å; V202-I213 HydrophobicContact CG1-CG1 4.31Å; V202-I213 HydrophobicContact CG2-CD1 4.3Å; R210-I213 PolarHBondContact O-N 2.95Å; R210-I213 VanDerWaalsContact O-N 3.14Å; I213-C218 VanDerWaalsContact CG2-SG 3.58Å
214	S	85.7	Confident	85.1	Confident	59 Å²	59	88.3 Å²	88.3	41%	0.413	44%	0.443	S	S	.	.			trans	-80.5	143.5	167.3	178.3	0	0	0	0	110.7	L212 T216 L217 C218	L212-S214 PolarHBondContact O-N 2.58Å; S214-T216 PolarHBondContact O-N 2.64Å; S214-T216 PolarHBondContact OG-N 2.9Å; S214-L217 WeakPolarHBondContact O-CB 3.25Å; S214-L217 PolarHBondContact O-N 3.26Å; S214-C218 PolarHBondContact O-N 3.14Å
215	Y	88.8	Confident	85.4	Confident	99 Å²	99	86.1 Å²	86.1	39%	0.388	43%	0.427	S	S	.	.	H	α-helix	trans	-52	-36.4	169.1	172.2	-102.7	0	0	0	111.9	L133 I136 L217 C218 A219	L133-Y215 HydrophobicContact CD1-CD2 4.41Å; I136-Y215 HydrophobicContact CG2-CD2 3.84Å; I136-Y215 HydrophobicContact CG2-CE2 3.5Å; I136-Y215 VanDerWaalsContact CG2-CE2 3.5Å; Y215-L217 VanDerWaalsContact C-N 3.3Å; Y215-L217 PolarHBondContact O-N 2.98Å; Y215-C218 WeakPolarHBondContact O-CB 3.15Å; Y215-C218 PolarHBondContact O-N 2.93Å; Y215-A219 HydrophobicContact CE1-CB 4.29Å; Y215-A219 WeakPolarHBondContact O-CB 2.98Å; Y215-A219 PolarHBondContact O-N 3.35Å
216	T	89.4	Confident	86	Confident	102 Å²	102	76.7 Å²	76.7	63%	0.626	39%	0.391	S	S	*	.	H	α-helix	trans	-61.1	-38.9	178.3	-49.7	0	0	0	0	112.2	S214 S220	S214-T216 PolarHBondContact O-N 2.64Å; S214-T216 PolarHBondContact OG-N 2.9Å; T216-S220 WeakPolarHBondContact O-CB 3.22Å; T216-S220 PolarHBondContact O-N 3.12Å; T216-S220 PolarHBondContact O-OG 3.12Å
217	L	90.9	Very high	86.7	Confident	90 Å²	90	75.2 Å²	75.2	47%	0.471	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-47.4	176.5	-179.5	63	0	0	0	110.3	S214 Y215 A219 S220 I221	S214-L217 WeakPolarHBondContact O-CB 3.25Å; S214-L217 PolarHBondContact O-N 3.26Å; Y215-L217 VanDerWaalsContact C-N 3.3Å; Y215-L217 PolarHBondContact O-N 2.98Å; L217-A219 VanDerWaalsContact C-N 3.34Å; L217-A219 PolarHBondContact O-N 3.39Å; L217-S220 PolarHBondContact O-N 3.27Å; L217-S220 PolarHBondContact O-OG 3.27Å; L217-I221 HydrophobicContact CD1-CD1 4.22Å; L217-I221 HydrophobicContact CG-CD1 4.18Å; L217-I221 WeakPolarHBondContact O-CG1 3.41Å; L217-I221 PolarHBondContact O-N 2.99Å
218	C	92.9	Very high	87.7	Confident	8 Å²	8	77.1 Å²	77.1	5%	0.054	39%	0.393	C	S	.	.	H	α-helix	trans	-56.9	-46.1	175.3	-66.9	0	0	0	0	112.1	V195 I213 S214 Y215 S220 I221 G222	V195-C218 HydrophobicContact CG1-CB 3.74Å; I213-C218 VanDerWaalsContact CG2-SG 3.58Å; S214-C218 PolarHBondContact O-N 3.14Å; Y215-C218 WeakPolarHBondContact O-CB 3.15Å; Y215-C218 PolarHBondContact O-N 2.93Å; C218-S220 VanDerWaalsContact C-N 3.35Å; C218-S220 PolarHBondContact O-N 3.29Å; C218-I221 PolarHBondContact O-N 2.93Å; C218-G222 PolarHBondContact O-N 3.06Å
219	A	93.8	Very high	88.6	Confident	21 Å²	21	68.7 Å²	68.7	17%	0.174	36%	0.357	C	S	.	.	H	α-helix	trans	-64.7	-37.5	178.2	0	0	0	0	0	112.2	Y215 L217 I221 W223	Y215-A219 HydrophobicContact CE1-CB 4.29Å; Y215-A219 WeakPolarHBondContact O-CB 2.98Å; Y215-A219 PolarHBondContact O-N 3.35Å; L217-A219 VanDerWaalsContact C-N 3.34Å; L217-A219 PolarHBondContact O-N 3.39Å; A219-I221 VanDerWaalsContact C-N 3.35Å; A219-W223 WeakPolarHBondContact O-CB 3.34Å; A219-W223 PolarHBondContact O-N 3.33Å
220	S	93.9	Very high	89.8	Confident	61 Å²	61	61.9 Å²	61.9	43%	0.427	33%	0.332	S	S	.	.	I	π-helix	trans	-65.6	-36.8	176.6	73	0	0	0	0	112.7	T216 L217 C218 G224 I225	T216-S220 WeakPolarHBondContact O-CB 3.22Å; T216-S220 PolarHBondContact O-N 3.12Å; T216-S220 PolarHBondContact O-OG 3.12Å; L217-S220 PolarHBondContact O-N 3.27Å; L217-S220 PolarHBondContact O-OG 3.27Å; C218-S220 VanDerWaalsContact C-N 3.35Å; C218-S220 PolarHBondContact O-N 3.29Å; S220-G224 CarbonylContact O-C 3.58Å; S220-G224 WeakPolarHBondContact O-CA 2.95Å; S220-G224 PolarHBondContact O-N 3.41Å; S220-I225 PolarHBondContact O-N 3.3Å
221	I	94.1	Very high	91.1	Very high	39 Å²	39	59 Å²	59	20%	0.2	33%	0.328	C	S	.	.	I	π-helix	trans	-75.2	-50.1	176.2	-64.3	169.6	0	0	0	110.1	F191 F194 V195 L217 C218 A219 I225 P226	F191-I221 HydrophobicContact CD1-CG2 4.4Å; F194-I221 HydrophobicContact CD1-CG2 4.45Å; V195-I221 HydrophobicContact CG2-CB 3.89Å; V195-I221 HydrophobicContact CG2-CG2 3.55Å; L217-I221 HydrophobicContact CD1-CD1 4.22Å; L217-I221 HydrophobicContact CG-CD1 4.18Å; L217-I221 WeakPolarHBondContact O-CG1 3.41Å; L217-I221 PolarHBondContact O-N 2.99Å; C218-I221 PolarHBondContact O-N 2.93Å; A219-I221 VanDerWaalsContact C-N 3.35Å; I221-I225 HydrophobicContact CB-CD1 4.41Å; I221-I225 HydrophobicContact CG1-CD1 4.44Å; I221-I225 HydrophobicContact CG2-CD1 4.12Å; I221-P226 VanDerWaalsContact O-CD 3.31Å; I221-P226 WeakPolarHBondContact O-CD 3.43Å
222	G	95.1	Very high	92.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.306	C	S	.	.	I	π-helix	trans	-71	-32.3	-173.1	0	0	0	0	0	114.7	W192 C218 P226	W192-G222 PolarHBondContact NE1-O 3.28Å; C218-G222 PolarHBondContact O-N 3.06Å; G222-P226 WeakPolarHBondContact O-CG 3.48Å
223	W	97.3	Very high	93.2	Very high	53 Å²	53	49.6 Å²	49.6	20%	0.201	28%	0.282	C	S	.	.	I	π-helix	trans	-111.3	-41.3	177.9	-65.4	119.4	0	0	0	112.9	N140 L143 C144 Y184 F185 A188 W192 A219 L227	N140-W223 PolarHBondContact OD1-NE1 3Å; L143-W223 HydrophobicContact CD2-CZ2 4.4Å; C144-W223 WeakPolarHBondContact SG-CH2 3.26Å; Y184-W223 HydrophobicContact CE1-CE3 4.15Å; Y184-W223 AromaticContact CE1-CZ3 4Å; Y184-W223 HydrophobicContact CE1-CZ3 4Å; Y184-W223 AromaticContact CZ-CE3 3.81Å; F185-W223 HydrophobicContact CD1-CZ3 4.25Å; F185-W223 HydrophobicContact CE1-CZ3 4.23Å; A188-W223 HydrophobicContact CB-CE3 3.9Å; A188-W223 HydrophobicContact CB-CZ3 3.84Å; W192-W223 AromaticContact CE2-CD1 3.92Å; W192-W223 AromaticContact CE2-CE2 3.94Å; W192-W223 AromaticContact CE2-NE1 3.6Å; W192-W223 AromaticContact CZ2-CD1 3.47Å; W192-W223 VanDerWaalsContact CZ2-CD1 3.47Å; W192-W223 HydrophobicContact CZ2-CG 4.29Å; W192-W223 AromaticContact CZ2-NE1 3.28Å; W192-W223 VanDerWaalsContact CZ2-NE1 3.28Å; W192-W223 AromaticContact NE1-CD1 3.75Å; W192-W223 AromaticContact NE1-CD2 3.48Å; W192-W223 AromaticContact NE1-CE2 3.29Å; W192-W223 VanDerWaalsContact NE1-CE2 3.29Å; W192-W223 AromaticContact NE1-CG 3.8Å; W192-W223 AromaticContact NE1-CZ2 3.76Å; W192-W223 AromaticContact NE1-NE1 3.42Å; A219-W223 WeakPolarHBondContact O-CB 3.34Å; A219-W223 PolarHBondContact O-N 3.33Å; W223-L227 VanDerWaalsContact O-CB 3.29Å; W223-L227 WeakPolarHBondContact O-CB 3.46Å; W223-L227 PolarHBondContact O-N 3.23Å; W223-L227 VanDerWaalsContact O-N 3.08Å
224	G	96.3	Very high	93.8	Very high	34 Å²	34	49.5 Å²	49.5	35%	0.351	28%	0.283	S	S	.	.	I	π-helix	trans	-68	-48.5	-173.2	0	0	0	0	0	113.6	S220 L227 L228	S220-G224 CarbonylContact O-C 3.58Å; S220-G224 WeakPolarHBondContact O-CA 2.95Å; S220-G224 PolarHBondContact O-N 3.41Å; G224-L227 PolarHBondContact O-N 3.32Å; G224-L228 PolarHBondContact O-N 2.89Å
225	I	95.3	Very high	94.1	Very high	67 Å²	67	49.2 Å²	49.2	34%	0.344	29%	0.285	S	S	.	.	H	α-helix	trans	-61.9	-50.7	178.8	-62	175.4	0	0	0	111.3	F191 S220 I221 L227 L228 L229	F191-I225 HydrophobicContact CD1-CB 4.36Å; F191-I225 HydrophobicContact CD1-CG2 4.25Å; F191-I225 HydrophobicContact CE1-CB 4.1Å; F191-I225 HydrophobicContact CE1-CD1 4.31Å; F191-I225 HydrophobicContact CE1-CG2 3.53Å; F191-I225 HydrophobicContact CE2-CG2 4.32Å; F191-I225 HydrophobicContact CZ-CB 4.49Å; F191-I225 HydrophobicContact CZ-CG2 3.56Å; S220-I225 PolarHBondContact O-N 3.3Å; I221-I225 HydrophobicContact CB-CD1 4.41Å; I221-I225 HydrophobicContact CG1-CD1 4.44Å; I221-I225 HydrophobicContact CG2-CD1 4.12Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 2.98Å; I225-L228 WeakPolarHBondContact O-CB 3.44Å; I225-L228 PolarHBondContact O-N 2.95Å; I225-L228 VanDerWaalsContact O-N 3.15Å; I225-L229 HydrophobicContact CG2-CD1 3.79Å; I225-L229 HydrophobicContact CG2-CG 4.15Å; I225-L229 WeakPolarHBondContact O-CG 3.45Å; I225-L229 PolarHBondContact O-N 2.95Å
226	P	97	Very high	94.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-54.9	-41.4	174	-28.2	34.6	0	0	0	113.9	Y184 T187 A188 F191 I221 G222 L228 L229 I230	Y184-P226 HydrophobicContact CD2-CB 4.17Å; Y184-P226 HydrophobicContact CE2-CB 4Å; T187-P226 HydrophobicContact CG2-CB 3.97Å; T187-P226 HydrophobicContact CG2-CG 4.35Å; A188-P226 HydrophobicContact CB-CB 4.05Å; A188-P226 HydrophobicContact CB-CG 4.08Å; F191-P226 HydrophobicContact CB-CG 3.8Å; F191-P226 HydrophobicContact CD2-CG 3.65Å; F191-P226 HydrophobicContact CE2-CG 4.4Å; F191-P226 HydrophobicContact CG-CG 3.8Å; I221-P226 VanDerWaalsContact O-CD 3.31Å; I221-P226 WeakPolarHBondContact O-CD 3.43Å; G222-P226 WeakPolarHBondContact O-CG 3.48Å; P226-L228 VanDerWaalsContact C-N 3.33Å; P226-L228 PolarHBondContact O-N 3.21Å; P226-L229 PolarHBondContact O-N 3.41Å; P226-I230 WeakPolarHBondContact O-CB 3.37Å; P226-I230 VanDerWaalsContact O-CG1 3.32Å; P226-I230 WeakPolarHBondContact O-CG1 3.44Å; P226-I230 PolarHBondContact O-N 3.19Å
227	L	96.7	Very high	94	Very high	92 Å²	92	44.4 Å²	44.4	48%	0.482	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-44.4	178.6	-176.9	65.2	0	0	0	110.7	Y184 W223 G224 I225 T231	Y184-L227 HydrophobicContact CE2-CB 3.87Å; Y184-L227 HydrophobicContact CE2-CD1 4.15Å; W223-L227 VanDerWaalsContact O-CB 3.29Å; W223-L227 WeakPolarHBondContact O-CB 3.46Å; W223-L227 PolarHBondContact O-N 3.23Å; W223-L227 VanDerWaalsContact O-N 3.08Å; G224-L227 PolarHBondContact O-N 3.32Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 2.98Å; L227-T231 HydrophobicContact CD1-CG2 4.21Å; L227-T231 HydrophobicContact CG-CG2 4.45Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 WeakPolarHBondContact O-CG2 3.33Å; L227-T231 PolarHBondContact O-N 3.28Å; L227-T231 PolarHBondContact O-OG1 2.97Å
228	L	96.3	Very high	93.8	Very high	111 Å²	111	42.9 Å²	42.9	58%	0.581	26%	0.259	S	S	*	.	H	α-helix	trans	-62.4	-47.8	176.6	-174.5	75.8	0	0	0	111.6	G224 I225 P226 I230 T231 V232	G224-L228 PolarHBondContact O-N 2.89Å; I225-L228 WeakPolarHBondContact O-CB 3.44Å; I225-L228 PolarHBondContact O-N 2.95Å; I225-L228 VanDerWaalsContact O-N 3.15Å; P226-L228 VanDerWaalsContact C-N 3.33Å; P226-L228 PolarHBondContact O-N 3.21Å; L228-I230 PolarHBondContact O-N 3.42Å; L228-T231 WeakPolarHBondContact CA-OG1 3.38Å; L228-T231 PolarHBondContact O-N 3.32Å; L228-T231 PolarHBondContact O-OG1 2.78Å; L228-V232 WeakPolarHBondContact O-CB 3.4Å; L228-V232 VanDerWaalsContact O-CG2 3.28Å; L228-V232 WeakPolarHBondContact O-CG2 3.46Å; L228-V232 PolarHBondContact O-N 3.41Å
229	L	95.7	Very high	93.5	Very high	26 Å²	26	50.7 Å²	50.7	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-44.2	-177.6	-65.4	174.3	0	0	0	112	F191 I225 P226 S233 I255 F256 P259	F191-L229 HydrophobicContact CE2-CD1 3.86Å; F191-L229 HydrophobicContact CZ-CD1 3.84Å; I225-L229 HydrophobicContact CG2-CD1 3.79Å; I225-L229 HydrophobicContact CG2-CG 4.15Å; I225-L229 WeakPolarHBondContact O-CG 3.45Å; I225-L229 PolarHBondContact O-N 2.95Å; P226-L229 PolarHBondContact O-N 3.41Å; L229-S233 VanDerWaalsContact O-CB 3.31Å; L229-S233 WeakPolarHBondContact O-CB 2.96Å; L229-S233 PolarHBondContact O-N 2.62Å; L229-I255 HydrophobicContact CD2-CG2 4.49Å; L229-F256 HydrophobicContact CB-CB 4.08Å; L229-P259 HydrophobicContact CD1-CB 3.96Å; L229-P259 HydrophobicContact CD1-CG 3.96Å; L229-P259 HydrophobicContact CD2-CG 4.24Å
230	I	95.7	Very high	92.9	Very high	9 Å²	9	52 Å²	52	5%	0.046	30%	0.301	C	S	.	.	H	α-helix	trans	-72.5	-38.5	-179.9	-63.2	-59.7	0	0	0	111.8	I180 K183 Y184 P226 L228 V232 S233 S234 F256	I180-I230 HydrophobicContact CG2-CG2 3.91Å; K183-I230 HydrophobicContact CB-CD1 3.91Å; Y184-I230 HydrophobicContact CD2-CG1 4.42Å; P226-I230 WeakPolarHBondContact O-CB 3.37Å; P226-I230 VanDerWaalsContact O-CG1 3.32Å; P226-I230 WeakPolarHBondContact O-CG1 3.44Å; P226-I230 PolarHBondContact O-N 3.19Å; L228-I230 PolarHBondContact O-N 3.42Å; I230-V232 PolarHBondContact O-N 2.82Å; I230-S233 PolarHBondContact O-N 2.86Å; I230-S234 VanDerWaalsContact O-CB 3.23Å; I230-S234 WeakPolarHBondContact O-CB 3.5Å; I230-S234 PolarHBondContact O-N 2.84Å; I230-S234 PolarHBondContact O-OG 2.94Å; I230-F256 HydrophobicContact CD1-CB 4.11Å; I230-F256 HydrophobicContact CD1-CD1 3.76Å; I230-F256 HydrophobicContact CD1-CE1 4.31Å; I230-F256 HydrophobicContact CD1-CG 3.89Å
231	T	94.6	Very high	91.9	Very high	66 Å²	66	54.8 Å²	54.8	41%	0.405	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-43.9	175.5	50.1	0	0	0	0	111.3	L227 L228 S234 A235	L227-T231 HydrophobicContact CD1-CG2 4.21Å; L227-T231 HydrophobicContact CG-CG2 4.45Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 WeakPolarHBondContact O-CG2 3.33Å; L227-T231 PolarHBondContact O-N 3.28Å; L227-T231 PolarHBondContact O-OG1 2.97Å; L228-T231 WeakPolarHBondContact CA-OG1 3.38Å; L228-T231 PolarHBondContact O-N 3.32Å; L228-T231 PolarHBondContact O-OG1 2.78Å; T231-S234 PolarHBondContact O-OG 3.01Å; T231-A235 VanDerWaalsContact O-CB 3.25Å; T231-A235 WeakPolarHBondContact O-CB 3.31Å; T231-A235 PolarHBondContact O-N 2.74Å
232	V	95.3	Very high	90.8	Very high	65 Å²	65	56 Å²	56	39%	0.394	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-49.1	174.9	173.4	0	0	0	0	111.6	L228 I230 S234 A235 I236	L228-V232 WeakPolarHBondContact O-CB 3.4Å; L228-V232 VanDerWaalsContact O-CG2 3.28Å; L228-V232 WeakPolarHBondContact O-CG2 3.46Å; L228-V232 PolarHBondContact O-N 3.41Å; I230-V232 PolarHBondContact O-N 2.82Å; V232-S234 PolarHBondContact O-N 2.02Å; V232-A235 PolarHBondContact O-N 3.28Å; V232-I236 HydrophobicContact CG1-CD1 3.9Å; V232-I236 WeakPolarHBondContact O-CG1 3.07Å; V232-I236 PolarHBondContact O-N 2.85Å; V232-I236 VanDerWaalsContact O-N 3.09Å
233	S	92.9	Very high	89.3	Confident	9 Å²	9	61.9 Å²	61.9	6%	0.063	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-45.9	179.5	-178.8	0	0	0	0	111.8	L229 I230 I236 R237 L252	L229-S233 VanDerWaalsContact O-CB 3.31Å; L229-S233 WeakPolarHBondContact O-CB 2.96Å; L229-S233 PolarHBondContact O-N 2.62Å; I230-S233 PolarHBondContact O-N 2.86Å; S233-I236 PolarHBondContact O-N 2.9Å; S233-R237 WeakPolarHBondContact O-CB 3.5Å; S233-R237 PolarHBondContact O-N 3.14Å; S233-L252 PolarHBondContact OG-O 3.47Å
234	S	91.8	Very high	88	Confident	28 Å²	28	61.2 Å²	61.2	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-37.2	177.8	66.8	0	0	0	0	113.3	I230 T231 V232 I236 R237 A238	I230-S234 VanDerWaalsContact O-CB 3.23Å; I230-S234 WeakPolarHBondContact O-CB 3.5Å; I230-S234 PolarHBondContact O-N 2.84Å; I230-S234 PolarHBondContact O-OG 2.94Å; T231-S234 PolarHBondContact O-OG 3.01Å; V232-S234 PolarHBondContact O-N 2.02Å; S234-I236 VanDerWaalsContact C-N 3.35Å; S234-R237 PolarHBondContact O-N 2.86Å; S234-A238 WeakPolarHBondContact O-CB 3.26Å; S234-A238 PolarHBondContact O-N 2.82Å
235	A	91.7	Very high	87.3	Confident	53 Å²	53	60.2 Å²	60.2	44%	0.438	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-37.4	177.2	0	0	0	0	0	112.2	T231 V232	T231-A235 VanDerWaalsContact O-CB 3.25Å; T231-A235 WeakPolarHBondContact O-CB 3.31Å; T231-A235 PolarHBondContact O-N 2.74Å; V232-A235 PolarHBondContact O-N 3.28Å
236	I	90.8	Very high	86.7	Confident	68 Å²	68	58.4 Å²	58.4	35%	0.349	33%	0.329	S	S	.	.	H	α-helix	trans	-71.2	-44.1	173.4	-61.5	165.6	0	0	0	109.8	V232 S233 S234 A238 Q239 T240 L252 I255	V232-I236 HydrophobicContact CG1-CD1 3.9Å; V232-I236 WeakPolarHBondContact O-CG1 3.07Å; V232-I236 PolarHBondContact O-N 2.85Å; V232-I236 VanDerWaalsContact O-N 3.09Å; S233-I236 PolarHBondContact O-N 2.9Å; S234-I236 VanDerWaalsContact C-N 3.35Å; I236-A238 PolarHBondContact O-N 3.42Å; I236-Q239 PolarHBondContact O-N 3.44Å; I236-T240 PolarHBondContact O-N 2.79Å; I236-L252 HydrophobicContact CG2-CD1 3.87Å; I236-L252 HydrophobicContact CG2-CD2 3.68Å; I236-L252 HydrophobicContact CG2-CG 4.44Å; I236-I255 HydrophobicContact CD1-CD1 3.82Å
237	R	86.6	Confident	86	Confident	32 Å²	32	61.2 Å²	61.2	12%	0.121	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-33.4	179.8	-165.7	69.4	179.1	153.2	-7.3	112.6	S233 S234 Q239 T240 W246 E248 S250 L252	S233-R237 WeakPolarHBondContact O-CB 3.5Å; S233-R237 PolarHBondContact O-N 3.14Å; S234-R237 PolarHBondContact O-N 2.86Å; R237-Q239 PolarHBondContact O-N 2.87Å; R237-T240 WeakPolarHBondContact CA-OG1 3.44Å; R237-T240 PolarHBondContact NH1-OG1 2.8Å; R237-T240 PolarHBondContact O-N 3.19Å; R237-T240 PolarHBondContact O-OG1 2.83Å; R237-W246 HydrophobicContact CB-CD2 4.18Å; R237-W246 HydrophobicContact CB-CE3 4.43Å; R237-W246 HydrophobicContact CG-CB 4.24Å; R237-W246 HydrophobicContact CG-CD2 3.56Å; R237-W246 HydrophobicContact CG-CE3 4.23Å; R237-W246 HydrophobicContact CG-CG 3.53Å; R237-W246 HydrophobicContact CG-CZ2 4.41Å; R237-E248 IonicContact CZ-OE1 3.25Å; R237-E248 IonicContact NE-OE1 2.79Å; R237-E248 IonicContact NH2-OE1 2.8Å; R237-E248 PolarHBondContact NH2-OE1 2.83Å; R237-S250 PolarHBondContact NH1-OG 3.06Å; R237-L252 HydrophobicContact CB-CD1 4.29Å
238	A	87	Confident	85.1	Confident	59 Å²	59	59 Å²	59	49%	0.488	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.2	174.5	0	0	0	0	0	114.4	S234 I236 W246	S234-A238 WeakPolarHBondContact O-CB 3.26Å; S234-A238 PolarHBondContact O-N 2.82Å; I236-A238 PolarHBondContact O-N 3.42Å; A238-W246 HydrophobicContact CB-CH2 3.82Å; A238-W246 HydrophobicContact CB-CZ2 3.99Å
239	Q	86	Confident	84.3	Confident	172 Å²	172	59.8 Å²	59.8	80%	0.804	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-9.7	179.7	-59.3	176.5	26.7	0	0	112.8	I236 R237	I236-Q239 PolarHBondContact O-N 3.44Å; R237-Q239 PolarHBondContact O-N 2.87Å
240	T	80.3	Confident	83.7	Confident	49 Å²	49	59.2 Å²	59.2	30%	0.301	34%	0.341	S	S	.	.	S	Bend	trans	-96.7	145.2	177.9	58.5	0	0	0	0	110.6	I236 R237 H242 L252	I236-T240 PolarHBondContact O-N 2.79Å; R237-T240 WeakPolarHBondContact CA-OG1 3.44Å; R237-T240 PolarHBondContact NH1-OG1 2.8Å; R237-T240 PolarHBondContact O-N 3.19Å; R237-T240 PolarHBondContact O-OG1 2.83Å; T240-H242 PolarHBondContact O-CD2 3.06Å; T240-H242 VanDerWaalsContact O-CD2 3.23Å; T240-H242 PolarHBondContact O-N 3.24Å; T240-L252 HydrophobicContact CG2-CD1 4.05Å
241	D	74.4	Confident	83.2	Confident	119 Å²	119	64 Å²	64	64%	0.636	37%	0.373	S	S	*	.			trans	-55.6	135.9	169.5	-64.8	-43.1	0	0	0	110
242	H	69.5	Low	82.8	Confident	65 Å²	65	62.6 Å²	62.6	30%	0.301	36%	0.362	S	S	.	.			trans	-141.7	132.1	-172.3	53.9	64.2	0	0	0	111.4	F176 T240 W246	F176-H242 AromaticContact CZ-CE1 3.88Å; T240-H242 PolarHBondContact O-CD2 3.06Å; T240-H242 VanDerWaalsContact O-CD2 3.23Å; T240-H242 PolarHBondContact O-N 3.24Å; H242-W246 AromaticContact CD2-NE1 3.11Å; H242-W246 PolarHBondContact CD2-NE1 2.87Å; H242-W246 AromaticContact CG-CD1 3.79Å; H242-W246 AromaticContact CG-NE1 3.27Å; H242-W246 VanDerWaalsContact CG-NE1 3.27Å; H242-W246 AromaticContact ND1-NE1 3.94Å; H242-W246 AromaticContact NE2-NE1 3.71Å
243	E	64	Low	82.5	Confident	123 Å²	123	60.8 Å²	60.8	58%	0.575	35%	0.351	S	S	*	.	S	Bend	trans	-96.7	107.9	176	-65.2	178.4	-176	0	0	107.4	E52 E248	E52-E243 HydrophobicContact CG-CB 3.91Å; E52-E243 HydrophobicContact CG-CG 4.38Å; E243-E248 VanDerWaalsContact O-CD 3.22Å
244	G	70.9	Confident	82.4	Confident	39 Å²	39	68.1 Å²	68.1	40%	0.402	38%	0.378	S	S	.	.	S	Bend	trans	81.2	-152	-176.8	0	0	0	0	0	114.9	F176	F176-G244 WeakPolarHBondContact CZ-O 3.41Å
245	C	80.7	Confident	82.5	Confident	13 Å²	13	69.1 Å²	69.1	9%	0.088	38%	0.381	C	S	.	.	S	Bend	trans	-104.4	40.8	-166.8	81	0	0	0	0	115.3	C175 F176 T179 N247	C175-C245 HydrophobicContact CB-CB 3.44Å; C175-C245 VanDerWaalsContact CB-CB 3.44Å; C175-C245 WeakPolarHBondContact CB-SG 3.12Å; C175-C245 WeakPolarHBondContact SG-CB 3.33Å; C175-C245 CovalentContact SG-SG 2.04Å; C175-C245 PolarHBondContact SG-SG 3.35Å; F176-C245 HydrophobicContact CD1-CB 4.15Å; F176-C245 HydrophobicContact CE1-CB 4.21Å; F176-C245 HydrophobicContact CG-CB 4.35Å; F176-C245 HydrophobicContact CZ-CB 4.47Å; T179-C245 WeakPolarHBondContact CB-O 3.37Å; T179-C245 WeakPolarHBondContact CG2-O 3.3Å; T179-C245 PolarHBondContact OG1-O 2.65Å; T179-C245 PolarHBondContact OG1-SG 2.97Å; C245-N247 VanDerWaalsContact C-N 3.34Å; C245-N247 PolarHBondContact O-N 2.91Å
246	W	82.5	Confident	82.5	Confident	29 Å²	29	67.7 Å²	67.7	11%	0.11	37%	0.365	C	S	.	.	S	Bend	trans	66.2	20.7	174.1	-57.9	-16	0	0	0	116.6	F176 T179 I180 K183 R237 A238 H242 E248	F176-W246 AromaticContact CD1-CD2 3.67Å; F176-W246 HydrophobicContact CD1-CD2 3.67Å; F176-W246 AromaticContact CD1-CE2 3.76Å; F176-W246 HydrophobicContact CD1-CE3 4.03Å; F176-W246 AromaticContact CD1-CG 3.96Å; F176-W246 HydrophobicContact CD1-CG 3.96Å; F176-W246 HydrophobicContact CD1-CZ2 4.16Å; F176-W246 HydrophobicContact CD1-CZ3 4.45Å; F176-W246 AromaticContact CE1-CD1 3.65Å; F176-W246 AromaticContact CE1-CD2 3.83Å; F176-W246 HydrophobicContact CE1-CD2 3.83Å; F176-W246 AromaticContact CE1-CE2 3.56Å; F176-W246 AromaticContact CE1-CG 3.86Å; F176-W246 HydrophobicContact CE1-CG 3.86Å; F176-W246 HydrophobicContact CE1-CZ2 4.11Å; F176-W246 AromaticContact CE1-NE1 3.44Å; T179-W246 HydrophobicContact CG2-CB 4.22Å; T179-W246 VanDerWaalsContact CG2-O 3.32Å; T179-W246 WeakPolarHBondContact CG2-O 3.05Å; I180-W246 HydrophobicContact CD1-CE3 4.27Å; I180-W246 HydrophobicContact CD1-CZ3 3.83Å; I180-W246 HydrophobicContact CG1-CE3 4.14Å; I180-W246 HydrophobicContact CG1-CZ3 4.16Å; K183-W246 VanDerWaalsContact CE-O 3.25Å; K183-W246 WeakPolarHBondContact CE-O 3.19Å; K183-W246 PolarHBondContact NZ-O 2.92Å; R237-W246 HydrophobicContact CB-CD2 4.18Å; R237-W246 HydrophobicContact CB-CE3 4.43Å; R237-W246 HydrophobicContact CG-CB 4.24Å; R237-W246 HydrophobicContact CG-CD2 3.56Å; R237-W246 HydrophobicContact CG-CE3 4.23Å; R237-W246 HydrophobicContact CG-CG 3.53Å; R237-W246 HydrophobicContact CG-CZ2 4.41Å; A238-W246 HydrophobicContact CB-CH2 3.82Å; A238-W246 HydrophobicContact CB-CZ2 3.99Å; H242-W246 AromaticContact CD2-NE1 3.11Å; H242-W246 PolarHBondContact CD2-NE1 2.87Å; H242-W246 AromaticContact CG-CD1 3.79Å; H242-W246 AromaticContact CG-NE1 3.27Å; H242-W246 VanDerWaalsContact CG-NE1 3.27Å; H242-W246 AromaticContact ND1-NE1 3.94Å; H242-W246 AromaticContact NE2-NE1 3.71Å; W246-E248 VanDerWaalsContact C-OE2 3.24Å; W246-E248 WeakPolarHBondContact CA-OE1 3.04Å; W246-E248 WeakPolarHBondContact CA-OE2 3.3Å; W246-E248 PolarHBondContact N-OE2 2.03Å; W246-E248 VanDerWaalsContact N-OE2 3.12Å
247	N	82.2	Confident	82.5	Confident	58 Å²	58	68 Å²	68	31%	0.31	37%	0.366	S	S	.	.			trans	-95.6	-9.6	177.3	-164.4	48	0	0	0	112.6	Y155 T179 C245	Y155-N247 HydrophobicContact CE2-CB 4.07Å; Y155-N247 VanDerWaalsContact OH-CB 3.29Å; Y155-N247 WeakPolarHBondContact OH-CB 3.48Å; Y155-N247 PolarHBondContact OH-ND2 2.78Å; T179-N247 HydrophobicContact CG2-CB 4.01Å; C245-N247 VanDerWaalsContact C-N 3.34Å; C245-N247 PolarHBondContact O-N 2.91Å
248	E	78.5	Confident	82.8	Confident	47 Å²	47	67.9 Å²	67.9	22%	0.22	38%	0.376	C	S	.	.	S	Bend	trans	-63	142.2	171.8	64	-75.6	174.7	0	0	111.3	R237 E243 W246 S250	R237-E248 IonicContact CZ-OE1 3.25Å; R237-E248 IonicContact NE-OE1 2.79Å; R237-E248 IonicContact NH2-OE1 2.8Å; R237-E248 PolarHBondContact NH2-OE1 2.83Å; E243-E248 VanDerWaalsContact O-CD 3.22Å; W246-E248 VanDerWaalsContact C-OE2 3.24Å; W246-E248 WeakPolarHBondContact CA-OE1 3.04Å; W246-E248 WeakPolarHBondContact CA-OE2 3.3Å; W246-E248 PolarHBondContact N-OE2 2.03Å; W246-E248 VanDerWaalsContact N-OE2 3.12Å; E248-S250 PolarHBondContact O-N 3.29Å
249	P	80.3	Confident	83.2	Confident	127 Å²	127	67.3 Å²	67.3	83%	0.825	37%	0.367	S	S	*	.			trans	-59.3	125.2	174.8	-22.2	33	0	0	0	110.7
250	S	82.7	Confident	83.5	Confident	13 Å²	13	59.4 Å²	59.4	9%	0.091	33%	0.331	C	S	.	.			trans	-126.6	146.4	179.3	179.8	0	0	0	0	110.7	R237 E248 L252 D253	R237-S250 PolarHBondContact NH1-OG 3.06Å; E248-S250 PolarHBondContact O-N 3.29Å; S250-L252 PolarHBondContact O-N 3.5Å; S250-L252 VanDerWaalsContact O-N 3.07Å; S250-L252 PolarHBondContact OG-N 3.05Å; S250-D253 PolarHBondContact N-OD2 3.15Å; S250-D253 VanDerWaalsContact O-CB 3.25Å; S250-D253 WeakPolarHBondContact O-CB 3.47Å; S250-D253 PolarHBondContact O-N 3.12Å
251	P	84.9	Confident	84.1	Confident	110 Å²	110	59.8 Å²	59.8	71%	0.714	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-54.6	-24.6	166.9	-25	34.6	0	0	0	113.1	D253 Y254	P251-D253 PolarHBondContact O-N 3.39Å; P251-Y254 WeakPolarHBondContact O-CD2 3.41Å; P251-Y254 PolarHBondContact O-N 3.3Å
252	L	85.6	Confident	85	Confident	36 Å²	36	56.6 Å²	56.6	19%	0.188	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-68.5	-16.2	174.9	-62.1	176.5	0	0	0	113.3	S233 I236 R237 T240 S250 Y254 I255	S233-L252 PolarHBondContact OG-O 3.47Å; I236-L252 HydrophobicContact CG2-CD1 3.87Å; I236-L252 HydrophobicContact CG2-CD2 3.68Å; I236-L252 HydrophobicContact CG2-CG 4.44Å; R237-L252 HydrophobicContact CB-CD1 4.29Å; T240-L252 HydrophobicContact CG2-CD1 4.05Å; S250-L252 PolarHBondContact O-N 3.5Å; S250-L252 VanDerWaalsContact O-N 3.07Å; S250-L252 PolarHBondContact OG-N 3.05Å; L252-Y254 PolarHBondContact O-N 3.4Å; L252-I255 HydrophobicContact CB-CD1 4.49Å; L252-I255 HydrophobicContact CD2-CD1 4.29Å; L252-I255 WeakPolarHBondContact O-CB 3.1Å; L252-I255 VanDerWaalsContact O-CG1 3.31Å; L252-I255 WeakPolarHBondContact O-CG1 3.39Å; L252-I255 PolarHBondContact O-N 2.97Å
253	D	88.9	Confident	86	Confident	27 Å²	27	54 Å²	54	14%	0.144	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-68.8	-21.8	176.8	-65.6	-34.9	0	0	0	112	K183 S250 P251 I255 F256 L257	K183-D253 IonicContact NZ-OD1 2.66Å; K183-D253 PolarHBondContact NZ-OD1 2.96Å; K183-D253 IonicContact NZ-OD2 3.66Å; S250-D253 PolarHBondContact N-OD2 3.15Å; S250-D253 VanDerWaalsContact O-CB 3.25Å; S250-D253 WeakPolarHBondContact O-CB 3.47Å; S250-D253 PolarHBondContact O-N 3.12Å; P251-D253 PolarHBondContact O-N 3.39Å; D253-I255 PolarHBondContact O-N 3.06Å; D253-I255 VanDerWaalsContact O-N 3.13Å; D253-F256 VanDerWaalsContact CA-CE1 3.47Å; D253-F256 HydrophobicContact CB-CE1 3.86Å; D253-F256 HydrophobicContact CB-CE2 4.36Å; D253-F256 HydrophobicContact CB-CZ 3.56Å; D253-F256 PolarHBondContact O-N 3.26Å; D253-F256 WeakPolarHBondContact OD1-CE1 3.46Å; D253-F256 WeakPolarHBondContact OD1-CZ 3.32Å; D253-L257 VanDerWaalsContact O-CB 3.26Å; D253-L257 WeakPolarHBondContact O-CB 3.28Å; D253-L257 PolarHBondContact O-N 2.84Å
254	Y	91.7	Very high	87.2	Confident	163 Å²	163	51.8 Å²	51.8	64%	0.639	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-21.1	173.5	-78.2	-75.5	0	0	0	113.6	P251 L252 F256 L257 G258	P251-Y254 WeakPolarHBondContact O-CD2 3.41Å; P251-Y254 PolarHBondContact O-N 3.3Å; L252-Y254 PolarHBondContact O-N 3.4Å; Y254-F256 VanDerWaalsContact C-N 3.29Å; Y254-F256 PolarHBondContact O-N 2.67Å; Y254-L257 HydrophobicContact CD1-CD2 4.42Å; Y254-L257 HydrophobicContact CE1-CD2 4.34Å; Y254-G258 PolarHBondContact O-N 2.93Å
255	I	92.6	Very high	88.1	Confident	49 Å²	49	56.8 Å²	56.8	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-58.8	-41.8	177.1	-65.6	172.3	0	0	0	111	L229 I236 L252 D253 P259	L229-I255 HydrophobicContact CD2-CG2 4.49Å; I236-I255 HydrophobicContact CD1-CD1 3.82Å; L252-I255 HydrophobicContact CB-CD1 4.49Å; L252-I255 HydrophobicContact CD2-CD1 4.29Å; L252-I255 WeakPolarHBondContact O-CB 3.1Å; L252-I255 VanDerWaalsContact O-CG1 3.31Å; L252-I255 WeakPolarHBondContact O-CG1 3.39Å; L252-I255 PolarHBondContact O-N 2.97Å; D253-I255 PolarHBondContact O-N 3.06Å; D253-I255 VanDerWaalsContact O-N 3.13Å; I255-P259 VanDerWaalsContact O-CD 3.26Å; I255-P259 WeakPolarHBondContact O-CD 3.36Å; I255-P259 WeakPolarHBondContact O-CG 3.31Å
256	F	92	Very high	88.4	Confident	23 Å²	23	59.9 Å²	59.9	10%	0.101	33%	0.334	C	S	.	.	H	α-helix	trans	-99.9	-31.6	177.1	60.3	-97.2	0	0	0	112.6	K183 T187 L229 I230 D253 Y254 P259 V260	K183-F256 HydrophobicContact CD-CE1 4.13Å; K183-F256 HydrophobicContact CD-CZ 3.98Å; T187-F256 HydrophobicContact CG2-CB 4.22Å; L229-F256 HydrophobicContact CB-CB 4.08Å; I230-F256 HydrophobicContact CD1-CB 4.11Å; I230-F256 HydrophobicContact CD1-CD1 3.76Å; I230-F256 HydrophobicContact CD1-CE1 4.31Å; I230-F256 HydrophobicContact CD1-CG 3.89Å; D253-F256 VanDerWaalsContact CA-CE1 3.47Å; D253-F256 HydrophobicContact CB-CE1 3.86Å; D253-F256 HydrophobicContact CB-CE2 4.36Å; D253-F256 HydrophobicContact CB-CZ 3.56Å; D253-F256 PolarHBondContact O-N 3.26Å; D253-F256 WeakPolarHBondContact OD1-CE1 3.46Å; D253-F256 WeakPolarHBondContact OD1-CZ 3.32Å; Y254-F256 VanDerWaalsContact C-N 3.29Å; Y254-F256 PolarHBondContact O-N 2.67Å; F256-P259 WeakPolarHBondContact O-CD 3.42Å; F256-V260 VanDerWaalsContact O-CG2 3.3Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.44Å
257	L	92.3	Very high	88.3	Confident	74 Å²	74	61.5 Å²	61.5	39%	0.387	35%	0.349	S	S	.	.	H	α-helix	trans	-67.3	-39.1	179.6	-175.6	66.4	0	0	0	112.2	D253 Y254 V260 V261	D253-L257 VanDerWaalsContact O-CB 3.26Å; D253-L257 WeakPolarHBondContact O-CB 3.28Å; D253-L257 PolarHBondContact O-N 2.84Å; Y254-L257 HydrophobicContact CD1-CD2 4.42Å; Y254-L257 HydrophobicContact CE1-CD2 4.34Å; L257-V260 PolarHBondContact O-N 2.04Å; L257-V261 HydrophobicContact CD1-CG2 4.09Å; L257-V261 HydrophobicContact CG-CG2 4.12Å; L257-V261 WeakPolarHBondContact O-CB 3.03Å; L257-V261 VanDerWaalsContact O-CG2 3.29Å; L257-V261 WeakPolarHBondContact O-CG2 3.05Å; L257-V261 PolarHBondContact O-N 2.84Å
258	G	92.7	Very high	88.1	Confident	31 Å²	31	64.2 Å²	64.2	32%	0.32	37%	0.371	S	S	.	.	H	α-helix	trans	-56.9	-54.8	178.9	0	0	0	0	0	112.8	Y254 V260 V261 A262	Y254-G258 PolarHBondContact O-N 2.93Å; G258-V260 VanDerWaalsContact C-N 3.32Å; G258-V260 PolarHBondContact O-N 3.23Å; G258-V261 PolarHBondContact O-N 2.78Å; G258-A262 WeakPolarHBondContact O-CB 3.45Å; G258-A262 PolarHBondContact O-N 2.96Å
259	P	93.8	Very high	87.7	Confident	46 Å²	46	72.1 Å²	72.1	30%	0.299	41%	0.409	S	S	.	.	H	α-helix	trans	-58.6	-37.8	173.7	-28.5	36.7	0	0	0	114.3	F191 L229 I255 F256 A262 A263	F191-P259 HydrophobicContact CE2-CB 4.44Å; F191-P259 HydrophobicContact CZ-CB 3.8Å; L229-P259 HydrophobicContact CD1-CB 3.96Å; L229-P259 HydrophobicContact CD1-CG 3.96Å; L229-P259 HydrophobicContact CD2-CG 4.24Å; I255-P259 VanDerWaalsContact O-CD 3.26Å; I255-P259 WeakPolarHBondContact O-CD 3.36Å; I255-P259 WeakPolarHBondContact O-CG 3.31Å; F256-P259 WeakPolarHBondContact O-CD 3.42Å; P259-A262 PolarHBondContact O-N 2.96Å; P259-A263 WeakPolarHBondContact O-CB 3.24Å; P259-A263 PolarHBondContact O-N 3.32Å
260	V	93.5	Very high	88	Confident	7 Å²	7	69.4 Å²	69.4	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-62.8	-48.6	175.6	165.6	0	0	0	0	110.9	T187 F190 F191 F256 L257 G258 A262 A263 L264	T187-V260 HydrophobicContact CG2-CG2 4.03Å; F190-V260 HydrophobicContact CB-CB 4.46Å; F190-V260 HydrophobicContact CB-CG1 3.77Å; F190-V260 HydrophobicContact CB-CG2 3.96Å; F190-V260 HydrophobicContact CD1-CG1 3.82Å; F190-V260 HydrophobicContact CD2-CG1 3.76Å; F190-V260 HydrophobicContact CD2-CG2 4.43Å; F190-V260 HydrophobicContact CE1-CG1 4.37Å; F190-V260 HydrophobicContact CE2-CG1 4.29Å; F190-V260 HydrophobicContact CG-CG1 3.51Å; F190-V260 HydrophobicContact CG-CG2 4.39Å; F191-V260 HydrophobicContact CD2-CG2 4.33Å; F191-V260 HydrophobicContact CE2-CG2 3.96Å; F256-V260 VanDerWaalsContact O-CG2 3.3Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.44Å; L257-V260 PolarHBondContact O-N 2.04Å; G258-V260 VanDerWaalsContact C-N 3.32Å; G258-V260 PolarHBondContact O-N 3.23Å; V260-A262 PolarHBondContact O-N 3.21Å; V260-A263 PolarHBondContact O-N 3.38Å; V260-L264 HydrophobicContact CG1-CD1 4.23Å; V260-L264 WeakPolarHBondContact O-CG 3.27Å; V260-L264 PolarHBondContact O-N 3.2Å
261	V	93.4	Very high	88.3	Confident	57 Å²	57	72.4 Å²	72.4	35%	0.345	40%	0.403	S	S	.	.	H	α-helix	trans	-62.6	-44	178.9	169.6	0	0	0	0	110.6	L257 G258 A263 L264 F265	L257-V261 HydrophobicContact CD1-CG2 4.09Å; L257-V261 HydrophobicContact CG-CG2 4.12Å; L257-V261 WeakPolarHBondContact O-CB 3.03Å; L257-V261 VanDerWaalsContact O-CG2 3.29Å; L257-V261 WeakPolarHBondContact O-CG2 3.05Å; L257-V261 PolarHBondContact O-N 2.84Å; G258-V261 PolarHBondContact O-N 2.78Å; V261-A263 VanDerWaalsContact C-N 3.35Å; V261-A263 PolarHBondContact O-N 3.08Å; V261-L264 PolarHBondContact O-N 3.46Å; V261-F265 HydrophobicContact CG1-CD2 3.6Å; V261-F265 HydrophobicContact CG1-CE2 3.36Å; V261-F265 WeakPolarHBondContact O-CD2 3.33Å; V261-F265 PolarHBondContact O-N 3.32Å
262	A	91.9	Very high	88.5	Confident	52 Å²	52	70.3 Å²	70.3	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-59.9	-43.1	175.2	0	0	0	0	0	112.2	G258 P259 V260 L264 F265 V266	G258-A262 WeakPolarHBondContact O-CB 3.45Å; G258-A262 PolarHBondContact O-N 2.96Å; P259-A262 PolarHBondContact O-N 2.96Å; V260-A262 PolarHBondContact O-N 3.21Å; A262-L264 VanDerWaalsContact C-N 3.33Å; A262-L264 PolarHBondContact O-N 3.31Å; A262-F265 PolarHBondContact O-N 3.2Å; A262-V266 WeakPolarHBondContact O-CG2 3.46Å; A262-V266 PolarHBondContact O-N 3.4Å
263	A	90.2	Very high	88.7	Confident	10 Å²	10	72.3 Å²	72.3	8%	0.083	40%	0.398	C	S	.	.	H	α-helix	trans	-62.8	-39.2	176.7	0	0	0	0	0	112.3	F194 P259 V260 V261 S267	F194-A263 HydrophobicContact CB-CB 4.11Å; F194-A263 HydrophobicContact CD1-CB 4.42Å; F194-A263 HydrophobicContact CD2-CB 3.75Å; F194-A263 HydrophobicContact CE2-CB 4.23Å; F194-A263 HydrophobicContact CG-CB 3.85Å; P259-A263 WeakPolarHBondContact O-CB 3.24Å; P259-A263 PolarHBondContact O-N 3.32Å; V260-A263 PolarHBondContact O-N 3.38Å; V261-A263 VanDerWaalsContact C-N 3.35Å; V261-A263 PolarHBondContact O-N 3.08Å; A263-S267 WeakPolarHBondContact O-CB 3.44Å; A263-S267 PolarHBondContact O-N 3.19Å; A263-S267 PolarHBondContact O-OG 3.41Å
264	L	89.3	Confident	88.7	Confident	76 Å²	76	75.1 Å²	75.1	40%	0.398	41%	0.414	S	S	.	.	H	α-helix	trans	-65.4	-43.1	174.5	-69.5	173.3	0	0	0	111.7	F190 V260 V261 A262 S267 C268	F190-L264 HydrophobicContact CD1-CD1 4.24Å; F190-L264 HydrophobicContact CD1-CD2 4.21Å; F190-L264 HydrophobicContact CD1-CG 4.48Å; F190-L264 HydrophobicContact CE1-CD1 4.14Å; V260-L264 HydrophobicContact CG1-CD1 4.23Å; V260-L264 WeakPolarHBondContact O-CG 3.27Å; V260-L264 PolarHBondContact O-N 3.2Å; V261-L264 PolarHBondContact O-N 3.46Å; A262-L264 VanDerWaalsContact C-N 3.33Å; A262-L264 PolarHBondContact O-N 3.31Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 VanDerWaalsContact O-N 3.17Å; L264-C268 PolarHBondContact O-N 3.04Å
265	F	90.4	Very high	88.5	Confident	144 Å²	144	69.3 Å²	69.3	63%	0.632	40%	0.398	S	S	*	.	H	α-helix	trans	-60.1	-46.6	175.6	-84.4	-66.8	0	0	0	112.2	V261 A262 S267 C268	V261-F265 HydrophobicContact CG1-CD2 3.6Å; V261-F265 HydrophobicContact CG1-CE2 3.36Å; V261-F265 WeakPolarHBondContact O-CD2 3.33Å; V261-F265 PolarHBondContact O-N 3.32Å; A262-F265 PolarHBondContact O-N 3.2Å; F265-S267 PolarHBondContact O-N 2.89Å; F265-C268 WeakPolarHBondContact O-CB 3.08Å; F265-C268 PolarHBondContact O-N 3.15Å; F265-C268 VanDerWaalsContact O-N 3.11Å
266	V	87.4	Confident	88.2	Confident	79 Å²	79	70.7 Å²	70.7	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-31.8	176.4	173	0	0	0	0	111.8	F194 A262 C268	F194-V266 HydrophobicContact CE2-CB 4.24Å; F194-V266 HydrophobicContact CE2-CG1 3.99Å; A262-V266 WeakPolarHBondContact O-CG2 3.46Å; A262-V266 PolarHBondContact O-N 3.4Å; V266-C268 VanDerWaalsContact C-N 3.27Å; V266-C268 PolarHBondContact O-N 3.19Å
267	S	80.8	Confident	87.9	Confident	62 Å²	62	74.4 Å²	74.4	43%	0.434	43%	0.433	S	S	.	.	H	α-helix	trans	-75.1	-16.8	178.4	-55.2	0	0	0	0	113.4	F194 A263 L264 F265	F194-S267 WeakPolarHBondContact CD2-OG 3.32Å; A263-S267 WeakPolarHBondContact O-CB 3.44Å; A263-S267 PolarHBondContact O-N 3.19Å; A263-S267 PolarHBondContact O-OG 3.41Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 VanDerWaalsContact O-N 3.17Å; F265-S267 PolarHBondContact O-N 2.89Å
268	C	77.7	Confident	87.5	Confident	115 Å²	115	74.4 Å²	74.4	78%	0.777	44%	0.436	S	S	*	.	H	α-helix	trans	-85.5	-17	177.1	-77.5	0	0	0	0	113.5	L264 F265 V266	L264-C268 PolarHBondContact O-N 3.04Å; F265-C268 WeakPolarHBondContact O-CB 3.08Å; F265-C268 PolarHBondContact O-N 3.15Å; F265-C268 VanDerWaalsContact O-N 3.11Å; V266-C268 VanDerWaalsContact C-N 3.27Å; V266-C268 PolarHBondContact O-N 3.19Å
269	E	68.8	Low	87	Confident	214 Å²	214	78.4 Å²	78.4	100%	1	45%	0.447	S	S	*	.			trans	-89.3	0	177.2	-67.4	-173.3	166.4	0	0	112.6

Retrieved 269 of 269 residues in 79.3 ms (Link to these results)

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