A0A087YEJ6_POEFO Loading...

Prosaposin

Prosaposin: Behaves as a myelinotrophic and neurotrophic factor, these effects are mediated by its G-protein-coupled receptors, GPR37 and GPR37L1, undergoing ligand-mediated internalization followed by ERK phosphorylation signaling. Saposins are specific low-molecular mass non-enzymic proteins, they participate in the lysosomal degradation of sphingolipids, which takes place by the sequential action of specific hydrolases.

AlphaFold DB , UniProt , Accession A0A087YEJ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 536 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	47	Very low	41.1	Very low	238 Å²	238	153.8 Å²	153.8	100%	1.172	84%	0.84	S	S	*	*				0	73.1	0	-70.8	-174.1	84.5	0	0	110
2	L	41	Very low	40.7	Very low	161 Å²	161	149.1 Å²	149.1	84%	0.843	84%	0.837	S	S	*	*			trans	-159.6	18.7	174.2	-118.4	133.4	0	0	0	112.9
3	L	38.3	Very low	40.4	Very low	164 Å²	164	146.9 Å²	146.9	86%	0.859	83%	0.829	S	S	*	*	S	Bend	trans	-126.8	8.1	-177	-88.6	156.8	0	0	0	113.2
4	L	38.2	Very low	40.2	Very low	150 Å²	150	143.3 Å²	143.3	79%	0.785	83%	0.826	S	S	*	*	S	Bend	trans	-110	3.9	-177.1	-94.9	150.9	0	0	0	113.9
5	T	44.8	Very low	40.1	Very low	124 Å²	124	140.7 Å²	140.7	76%	0.761	81%	0.814	S	S	*	*	S	Bend	trans	-106.3	8.8	-175.8	49.3	0	0	0	0	114.7
6	L	40.4	Very low	40	Very low	158 Å²	158	138.4 Å²	138.4	83%	0.827	81%	0.806	S	S	*	*	S	Bend	trans	-103.1	10	179.8	-82.9	165.2	0	0	0	114.8
7	L	38.8	Very low	40.2	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	80%	0.796	S	S	*	*	S	Bend	trans	-106.2	19.5	-175	-78.8	170.8	0	0	0	115.6
8	F	38.1	Very low	40.1	Very low	192 Å²	192	139.3 Å²	139.3	84%	0.842	80%	0.801	S	S	*	*			trans	-132.5	39.4	-176.6	-77.9	-71.9	0	0	0	116.2
9	V	47.1	Very low	40.4	Very low	136 Å²	136	134.8 Å²	134.8	82%	0.824	79%	0.789	S	S	*	*	S	Bend	trans	-137.7	127.9	161.1	-169.6	0	0	0	0	109.9
10	S	42.1	Very low	41.2	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	77%	0.766	S	S	*	*			trans	97.7	48.9	176.1	-36.6	0	0	0	0	117.3
11	S	36	Very low	42.3	Very low	110 Å²	110	132.5 Å²	132.5	77%	0.769	77%	0.766	S	S	*	*			trans	-88.1	85.5	141.7	54.6	0	0	0	0	108	V13	S11-V13 PolarHBondContact O-N 2.82Å; S11-V13 VanDerWaalsContact O-N 3.08Å
12	A	36	Very low	43.4	Very low	97 Å²	97	125.7 Å²	125.7	80%	0.802	73%	0.732	S	S	*	*			trans	-61.5	108.9	158.2	0	0	0	0	0	106.2	A14	A12-A14 VanDerWaalsContact C-N 3.29Å; A12-A14 PolarHBondContact O-N 2.86Å
13	V	37.9	Very low	45.2	Very low	121 Å²	121	119.3 Å²	119.3	73%	0.733	70%	0.7	S	S	*	*			trans	-65.8	95.2	174.6	-176.7	0	0	0	0	106.5	S11 T15	S11-V13 PolarHBondContact O-N 2.82Å; S11-V13 VanDerWaalsContact O-N 3.08Å; V13-T15 HydrophobicContact CG1-CG2 4.44Å; V13-T15 PolarHBondContact O-N 3.45Å
14	A	36.7	Very low	47.3	Very low	96 Å²	96	115.7 Å²	115.7	79%	0.793	69%	0.694	S	S	*	*			trans	-71.1	88.6	162.7	0	0	0	0	0	106.9	A12	A12-A14 VanDerWaalsContact C-N 3.29Å; A12-A14 PolarHBondContact O-N 2.86Å
15	T	39.8	Very low	49.2	Very low	104 Å²	104	116.3 Å²	116.3	64%	0.638	69%	0.686	S	S	*	*			trans	-57.5	132.9	162.2	23.7	0	0	0	0	108.7	V13 L17	V13-T15 HydrophobicContact CG1-CG2 4.44Å; V13-T15 PolarHBondContact O-N 3.45Å; T15-L17 PolarHBondContact O-N 2.88Å; T15-L17 VanDerWaalsContact O-N 3.15Å
16	P	38.5	Very low	50.9	Low	105 Å²	105	111.3 Å²	111.3	68%	0.682	66%	0.659	S	S	*	*			trans	-67	115.6	176.6	27.2	-30.8	0	0	0	109	L18	P16-L18 HydrophobicContact CB-CD1 4.37Å; P16-L18 PolarHBondContact O-N 3.19Å
17	L	41.8	Very low	52.8	Low	123 Å²	123	107 Å²	107	64%	0.644	64%	0.64	S	S	*	*			trans	-73.7	72.2	173.2	-77.9	163.1	0	0	0	109.9	T15 G19 T20	T15-L17 PolarHBondContact O-N 2.88Å; T15-L17 VanDerWaalsContact O-N 3.15Å; L17-G19 PolarHBondContact O-N 3.03Å; L17-T20 HydrophobicContact CB-CG2 3.92Å; L17-T20 HydrophobicContact CD1-CG2 4.13Å; L17-T20 HydrophobicContact CD2-CG2 3.84Å; L17-T20 HydrophobicContact CG-CG2 4.18Å; L17-T20 PolarHBondContact O-OG1 3.34Å
18	L	40	Very low	54.9	Low	169 Å²	169	103.6 Å²	103.6	89%	0.885	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	45.6	171.1	-98.6	142.5	0	0	0	111.9	P16	P16-L18 HydrophobicContact CB-CD1 4.37Å; P16-L18 PolarHBondContact O-N 3.19Å
19	G	46	Very low	57	Low	55 Å²	55	96.8 Å²	96.8	57%	0.567	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.8	4.3	-179.9	0	0	0	0	0	116.4	L17	L17-G19 PolarHBondContact O-N 3.03Å
20	T	55.1	Low	58.9	Low	54 Å²	54	93.3 Å²	93.3	33%	0.331	57%	0.568	S	S	.	*			trans	-104.2	-3.5	-168.5	49.2	0	0	0	0	116.6	L17 Q22 C23	L17-T20 HydrophobicContact CB-CG2 3.92Å; L17-T20 HydrophobicContact CD1-CG2 4.13Å; L17-T20 HydrophobicContact CD2-CG2 3.84Å; L17-T20 HydrophobicContact CG-CG2 4.18Å; L17-T20 PolarHBondContact O-OG1 3.34Å; T20-Q22 PolarHBondContact O-N 3.24Å; T20-Q22 VanDerWaalsContact O-N 3.11Å; T20-C23 WeakPolarHBondContact O-CB 3.46Å; T20-C23 PolarHBondContact O-N 3.09Å
21	E	64	Low	61.1	Low	166 Å²	166	88.2 Å²	88.2	78%	0.776	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-35.9	175.9	-72.1	-61.1	138	0	0	112.1	A24	E21-A24 WeakPolarHBondContact O-CB 3.38Å; E21-A24 PolarHBondContact O-N 3.35Å
22	Q	69.8	Low	63.3	Low	95 Å²	95	88.2 Å²	88.2	44%	0.444	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-28.6	-177.8	-56.2	167.8	-4	0	0	111.9	T20 A24 R25 Y29	T20-Q22 PolarHBondContact O-N 3.24Å; T20-Q22 VanDerWaalsContact O-N 3.11Å; Q22-A24 PolarHBondContact O-N 2.97Å; Q22-R25 VanDerWaalsContact O-CB 3.23Å; Q22-R25 WeakPolarHBondContact O-CB 3.49Å; Q22-R25 VanDerWaalsContact O-CG 3.3Å; Q22-R25 WeakPolarHBondContact O-CG 3.28Å; Q22-R25 PolarHBondContact O-N 2.79Å; Q22-R25 VanDerWaalsContact O-N 3.12Å; Q22-Y29 HydrophobicContact CB-CD1 4.24Å; Q22-Y29 HydrophobicContact CB-CE1 3.4Å; Q22-Y29 VanDerWaalsContact CB-CE1 3.4Å; Q22-Y29 HydrophobicContact CB-CE2 4.29Å; Q22-Y29 VanDerWaalsContact CB-CZ 3.46Å; Q22-Y29 WeakPolarHBondContact CB-OH 3.48Å; Q22-Y29 WeakPolarHBondContact O-CD1 3.46Å; Q22-Y29 WeakPolarHBondContact O-CE1 3.44Å; Q22-Y29 PolarHBondContact OE1-OH 2.84Å
23	C	80.5	Confident	65.5	Low	27 Å²	27	85.8 Å²	85.8	18%	0.182	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-68.2	-22.3	177.5	-58.9	0	0	0	0	112.6	T20 R25 G26 C40	T20-C23 WeakPolarHBondContact O-CB 3.46Å; T20-C23 PolarHBondContact O-N 3.09Å; C23-R25 PolarHBondContact O-N 3.05Å; C23-G26 PolarHBondContact O-N 3.42Å; C23-C40 VanDerWaalsContact CA-SG 3.53Å; C23-C40 HydrophobicContact CB-CB 3.69Å; C23-C40 WeakPolarHBondContact CB-SG 3.31Å; C23-C40 WeakPolarHBondContact SG-CA 3.43Å; C23-C40 WeakPolarHBondContact SG-CB 3.39Å; C23-C40 CovalentContact SG-SG 2.04Å; C23-C40 PolarHBondContact SG-SG 2.05Å
24	A	81.7	Confident	67.7	Low	89 Å²	89	83.2 Å²	83.2	74%	0.736	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-66.6	-12.1	173.1	0	0	0	0	0	113.4	E21 Q22 G26	E21-A24 WeakPolarHBondContact O-CB 3.38Å; E21-A24 PolarHBondContact O-N 3.35Å; Q22-A24 PolarHBondContact O-N 2.97Å; A24-G26 PolarHBondContact O-N 3.41Å
25	R	78.3	Confident	69.8	Low	162 Å²	162	86.2 Å²	86.2	61%	0.611	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-73.1	-5	176.1	-62.1	174.6	178.4	161.5	-2.7	113.9	Q22 C23 Y29	Q22-R25 VanDerWaalsContact O-CB 3.23Å; Q22-R25 WeakPolarHBondContact O-CB 3.49Å; Q22-R25 VanDerWaalsContact O-CG 3.3Å; Q22-R25 WeakPolarHBondContact O-CG 3.28Å; Q22-R25 PolarHBondContact O-N 2.79Å; Q22-R25 VanDerWaalsContact O-N 3.12Å; C23-R25 PolarHBondContact O-N 3.05Å; R25-Y29 HydrophobicContact CB-CG 3.97Å
26	G	81.4	Confident	71.8	Confident	19 Å²	19	81.9 Å²	81.9	20%	0.196	45%	0.447	C	S	.	.			trans	76.4	-169.8	169.8	0	0	0	0	0	115.9	C23 A24 P28 Y29 W30	C23-G26 PolarHBondContact O-N 3.42Å; A24-G26 PolarHBondContact O-N 3.41Å; G26-P28 VanDerWaalsContact C-N 3.33Å; G26-P28 VanDerWaalsContact O-N 3.12Å; G26-Y29 PolarHBondContact O-N 3.44Å; G26-W30 PolarHBondContact O-N 2.82Å; G26-W30 PolarHBondContact O-NE1 2.96Å
27	P	80	Confident	73.9	Confident	67 Å²	67	76.9 Å²	76.9	44%	0.435	42%	0.415	S	S	.	.	H	α-helix	trans	-37.6	-47.2	-177.8	-31.6	37.8	0	0	0	116.6	Y29 W30 C31	P27-Y29 PolarHBondContact O-N 3.06Å; P27-W30 VanDerWaalsContact N-CD1 3.34Å; P27-C31 WeakPolarHBondContact O-CB 3.43Å; P27-C31 PolarHBondContact O-N 3.34Å
28	P	81.8	Confident	75.9	Confident	74 Å²	74	74.7 Å²	74.7	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-29	179.7	-27.3	39.1	0	0	0	114.5	G26 M141	G26-P28 VanDerWaalsContact C-N 3.33Å; G26-P28 VanDerWaalsContact O-N 3.12Å; P28-M141 HydrophobicContact CB-CE 3.61Å; P28-M141 HydrophobicContact CG-CE 3.75Å; P28-M141 HydrophobicContact CG-SD 4.42Å
29	Y	82.9	Confident	78	Confident	49 Å²	49	72.3 Å²	72.3	19%	0.192	40%	0.397	C	S	.	.	H	α-helix	trans	-91.7	-60.6	-176.9	-179.5	-97.4	0	0	0	112.2	Q22 R25 G26 P27 C31 Q32 T36	Q22-Y29 HydrophobicContact CB-CD1 4.24Å; Q22-Y29 HydrophobicContact CB-CE1 3.4Å; Q22-Y29 VanDerWaalsContact CB-CE1 3.4Å; Q22-Y29 HydrophobicContact CB-CE2 4.29Å; Q22-Y29 VanDerWaalsContact CB-CZ 3.46Å; Q22-Y29 WeakPolarHBondContact CB-OH 3.48Å; Q22-Y29 WeakPolarHBondContact O-CD1 3.46Å; Q22-Y29 WeakPolarHBondContact O-CE1 3.44Å; Q22-Y29 PolarHBondContact OE1-OH 2.84Å; R25-Y29 HydrophobicContact CB-CG 3.97Å; G26-Y29 PolarHBondContact O-N 3.44Å; P27-Y29 PolarHBondContact O-N 3.06Å; Y29-C31 VanDerWaalsContact C-N 3.32Å; Y29-C31 PolarHBondContact O-N 3.34Å; Y29-Q32 VanDerWaalsContact O-CB 3.3Å; Y29-Q32 WeakPolarHBondContact O-CB 3.29Å; Y29-Q32 PolarHBondContact O-N 2.99Å; Y29-T36 PolarHBondContact O-OG1 2.97Å
30	W	87.3	Confident	79.9	Confident	62 Å²	62	70.5 Å²	70.5	24%	0.235	38%	0.376	C	S	.	.	H	α-helix	trans	-66.7	-29.1	-175.7	58.7	-9.5	0	0	0	113.2	G26 P27 Q32 T36 A37 C40 A42 H45	G26-W30 PolarHBondContact O-N 2.82Å; G26-W30 PolarHBondContact O-NE1 2.96Å; P27-W30 VanDerWaalsContact N-CD1 3.34Å; W30-Q32 VanDerWaalsContact C-N 3.33Å; W30-Q32 PolarHBondContact O-N 3.13Å; W30-T36 CarbonylContact O-C 3.56Å; W30-T36 PolarHBondContact O-OG1 3.2Å; W30-A37 WeakPolarHBondContact O-CA 3.17Å; W30-A37 WeakPolarHBondContact O-CB 3.3Å; W30-A37 PolarHBondContact O-N 3.25Å; W30-C40 HydrophobicContact CB-CB 3.6Å; W30-C40 HydrophobicContact CD2-CB 4.37Å; W30-C40 HydrophobicContact CE3-CB 3.79Å; W30-C40 HydrophobicContact CG-CB 4.36Å; W30-A42 HydrophobicContact CB-CB 4.13Å; W30-A42 HydrophobicContact CD2-CB 3.38Å; W30-A42 HydrophobicContact CE3-CB 3.06Å; W30-A42 HydrophobicContact CG-CB 3.87Å; W30-A42 HydrophobicContact CH2-CB 4.25Å; W30-A42 HydrophobicContact CZ3-CB 3.51Å; W30-H45 AromaticContact CZ2-CD2 3.95Å
31	C	87.1	Confident	81.4	Confident	8 Å²	8	77 Å²	77	5%	0.054	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	14.7	177.7	-59.5	0	0	0	0	114.5	P27 Y29 C46 V50 W51	P27-C31 WeakPolarHBondContact O-CB 3.43Å; P27-C31 PolarHBondContact O-N 3.34Å; Y29-C31 VanDerWaalsContact C-N 3.32Å; Y29-C31 PolarHBondContact O-N 3.34Å; C31-C46 WeakPolarHBondContact CA-SG 3.31Å; C31-C46 HydrophobicContact CB-CB 3.65Å; C31-C46 WeakPolarHBondContact CB-SG 3.44Å; C31-C46 WeakPolarHBondContact SG-CA 3.4Å; C31-C46 WeakPolarHBondContact SG-CB 3.26Å; C31-C46 CovalentContact SG-SG 2.04Å; C31-C46 PolarHBondContact SG-SG 2.9Å; C31-V50 HydrophobicContact CB-CB 4.17Å; C31-V50 HydrophobicContact CB-CG1 4.11Å; C31-V50 HydrophobicContact CB-CG2 3.97Å; C31-W51 PolarHBondContact O-NE1 2.63Å
32	Q	83.6	Confident	82.5	Confident	111 Å²	111	69.2 Å²	69.2	52%	0.519	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-38.3	177.1	-172.3	178.5	10.2	0	0	112.2	Y29 W30 G134	Y29-Q32 VanDerWaalsContact O-CB 3.3Å; Y29-Q32 WeakPolarHBondContact O-CB 3.29Å; Y29-Q32 PolarHBondContact O-N 2.99Å; W30-Q32 VanDerWaalsContact C-N 3.33Å; W30-Q32 PolarHBondContact O-N 3.13Å; Q32-G134 WeakPolarHBondContact O-CA 3.43Å
33	N	82	Confident	83.1	Confident	45 Å²	45	68.2 Å²	68.2	24%	0.241	36%	0.361	C	S	.	.	S	Bend	trans	-160.2	174	174.3	54	59.6	0	0	0	111.6	K35 T36 A37 A132	N33-K35 VanDerWaalsContact C-N 3.25Å; N33-K35 PolarHBondContact O-N 3.09Å; N33-K35 WeakPolarHBondContact OD1-CB 3.05Å; N33-K35 PolarHBondContact OD1-N 3.02Å; N33-K35 VanDerWaalsContact OD1-N 3.13Å; N33-T36 PolarHBondContact N-OG1 3.24Å; N33-T36 PolarHBondContact O-N 3.47Å; N33-T36 PolarHBondContact O-OG1 3.3Å; N33-T36 PolarHBondContact OD1-N 3.39Å; N33-T36 PolarHBondContact OD1-OG1 3.16Å; N33-A37 WeakPolarHBondContact O-CB 3.42Å; N33-A37 PolarHBondContact O-N 3.22Å; N33-A132 CarbonylContact C-O 3.6Å; N33-A132 WeakPolarHBondContact CA-O 3.35Å; N33-A132 WeakPolarHBondContact CB-O 3.12Å
34	V	83.6	Confident	83.2	Confident	68 Å²	68	70.6 Å²	70.6	41%	0.412	38%	0.378	S	S	.	.	H	α-helix	trans	-56	-38.5	178.2	179.1	0	0	0	0	112.4	A37 S38 L43 W51 A132	V34-A37 PolarHBondContact O-N 3.2Å; V34-S38 WeakPolarHBondContact O-CB 3.31Å; V34-S38 PolarHBondContact O-N 3.3Å; V34-L43 HydrophobicContact CG1-CD1 4.15Å; V34-W51 HydrophobicContact CG2-CH2 4.2Å; V34-W51 HydrophobicContact CG2-CZ3 4.45Å; V34-A132 HydrophobicContact CG2-CB 3.52Å; V34-A132 WeakPolarHBondContact CG2-O 3.07Å; V34-A132 PolarHBondContact N-O 2.05Å
35	K	80.7	Confident	83.4	Confident	158 Å²	158	69.9 Å²	69.9	69%	0.687	36%	0.359	S	S	*	.	H	α-helix	trans	-62.7	-50.5	-177.2	-177.9	-178.6	179.7	179.6	0	110.7	N33 L39	N33-K35 VanDerWaalsContact C-N 3.25Å; N33-K35 PolarHBondContact O-N 3.09Å; N33-K35 WeakPolarHBondContact OD1-CB 3.05Å; N33-K35 PolarHBondContact OD1-N 3.02Å; N33-K35 VanDerWaalsContact OD1-N 3.13Å; K35-L39 HydrophobicContact CG-CD1 4.16Å; K35-L39 WeakPolarHBondContact O-CB 3.31Å; K35-L39 WeakPolarHBondContact O-CD1 3.4Å; K35-L39 VanDerWaalsContact O-CG 3.23Å; K35-L39 WeakPolarHBondContact O-CG 3.48Å; K35-L39 PolarHBondContact O-N 2.97Å; K35-L39 VanDerWaalsContact O-N 3.09Å
36	T	82.6	Confident	83.8	Confident	14 Å²	14	62.2 Å²	62.2	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-68.2	-37.3	177.8	54.3	0	0	0	0	111.9	Y29 W30 N33 L39 C40	Y29-T36 PolarHBondContact O-OG1 2.97Å; W30-T36 CarbonylContact O-C 3.56Å; W30-T36 PolarHBondContact O-OG1 3.2Å; N33-T36 PolarHBondContact N-OG1 3.24Å; N33-T36 PolarHBondContact O-N 3.47Å; N33-T36 PolarHBondContact O-OG1 3.3Å; N33-T36 PolarHBondContact OD1-N 3.39Å; N33-T36 PolarHBondContact OD1-OG1 3.16Å; T36-L39 PolarHBondContact O-N 3.3Å; T36-C40 WeakPolarHBondContact O-CB 3.49Å; T36-C40 PolarHBondContact O-N 3.22Å; T36-C40 PolarHBondContact O-SG 3.43Å; T36-C40 VanDerWaalsContact O-SG 3.37Å
37	A	82.5	Confident	83.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-40	-179.6	0	0	0	0	0	111.6	W30 N33 V34 K41 A42 L43 C46 W51	W30-A37 WeakPolarHBondContact O-CA 3.17Å; W30-A37 WeakPolarHBondContact O-CB 3.3Å; W30-A37 PolarHBondContact O-N 3.25Å; N33-A37 WeakPolarHBondContact O-CB 3.42Å; N33-A37 PolarHBondContact O-N 3.22Å; V34-A37 PolarHBondContact O-N 3.2Å; A37-K41 PolarHBondContact O-N 3.37Å; A37-K41 VanDerWaalsContact O-N 3.11Å; A37-A42 HydrophobicContact CB-CB 4.4Å; A37-A42 PolarHBondContact O-N 3.29Å; A37-L43 HydrophobicContact CB-CD1 4.04Å; A37-C46 HydrophobicContact CB-CB 4.38Å; A37-W51 HydrophobicContact CB-CH2 3.71Å; A37-W51 HydrophobicContact CB-CZ2 4.11Å
38	S	83.8	Confident	84	Confident	76 Å²	76	66.7 Å²	66.7	53%	0.531	34%	0.34	S	S	.	.	H	α-helix	trans	-66	-48.6	175	-178.8	0	0	0	0	111.5	V34 C40 K41	V34-S38 WeakPolarHBondContact O-CB 3.31Å; V34-S38 PolarHBondContact O-N 3.3Å; S38-C40 PolarHBondContact O-N 2.79Å; S38-K41 PolarHBondContact O-N 3.49Å
39	L	84	Confident	84	Confident	120 Å²	120	66.7 Å²	66.7	63%	0.628	34%	0.336	S	S	*	.	H	α-helix	trans	-57.5	-38	177.9	-74.8	168.7	0	0	0	112.6	K35 T36	K35-L39 HydrophobicContact CG-CD1 4.16Å; K35-L39 WeakPolarHBondContact O-CB 3.31Å; K35-L39 WeakPolarHBondContact O-CD1 3.4Å; K35-L39 VanDerWaalsContact O-CG 3.23Å; K35-L39 WeakPolarHBondContact O-CG 3.48Å; K35-L39 PolarHBondContact O-N 2.97Å; K35-L39 VanDerWaalsContact O-N 3.09Å; T36-L39 PolarHBondContact O-N 3.3Å
40	C	85.6	Confident	84	Confident	17 Å²	17	66 Å²	66	12%	0.115	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	9.2	179.4	-58.2	0	0	0	0	114.1	C23 W30 T36 S38 A42	C23-C40 VanDerWaalsContact CA-SG 3.53Å; C23-C40 HydrophobicContact CB-CB 3.69Å; C23-C40 WeakPolarHBondContact CB-SG 3.31Å; C23-C40 WeakPolarHBondContact SG-CA 3.43Å; C23-C40 WeakPolarHBondContact SG-CB 3.39Å; C23-C40 CovalentContact SG-SG 2.04Å; C23-C40 PolarHBondContact SG-SG 2.05Å; W30-C40 HydrophobicContact CB-CB 3.6Å; W30-C40 HydrophobicContact CD2-CB 4.37Å; W30-C40 HydrophobicContact CE3-CB 3.79Å; W30-C40 HydrophobicContact CG-CB 4.36Å; T36-C40 WeakPolarHBondContact O-CB 3.49Å; T36-C40 PolarHBondContact O-N 3.22Å; T36-C40 PolarHBondContact O-SG 3.43Å; T36-C40 VanDerWaalsContact O-SG 3.37Å; S38-C40 PolarHBondContact O-N 2.79Å; C40-A42 HydrophobicContact CB-CB 4.46Å; C40-A42 PolarHBondContact O-N 3.49Å
41	K	86.6	Confident	84	Confident	190 Å²	190	63.5 Å²	63.5	83%	0.826	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	36.3	-177.8	-58.5	-178.7	179.7	179	0	113.6	A37 S38	A37-K41 PolarHBondContact O-N 3.37Å; A37-K41 VanDerWaalsContact O-N 3.11Å; S38-K41 PolarHBondContact O-N 3.49Å
42	A	87.4	Confident	83.8	Confident	3 Å²	3	66.4 Å²	66.4	3%	0.025	34%	0.342	C	S	.	.			trans	-104.5	-1.4	-173.2	0	0	0	0	0	114	W30 A37 C40 S44 H45 C46	W30-A42 HydrophobicContact CB-CB 4.13Å; W30-A42 HydrophobicContact CD2-CB 3.38Å; W30-A42 HydrophobicContact CE3-CB 3.06Å; W30-A42 HydrophobicContact CG-CB 3.87Å; W30-A42 HydrophobicContact CH2-CB 4.25Å; W30-A42 HydrophobicContact CZ3-CB 3.51Å; A37-A42 HydrophobicContact CB-CB 4.4Å; A37-A42 PolarHBondContact O-N 3.29Å; C40-A42 HydrophobicContact CB-CB 4.46Å; C40-A42 PolarHBondContact O-N 3.49Å; A42-S44 PolarHBondContact O-N 2.77Å; A42-H45 WeakPolarHBondContact O-CA 2.97Å; A42-H45 WeakPolarHBondContact O-CB 3.25Å; A42-H45 PolarHBondContact O-N 3.31Å; A42-C46 PolarHBondContact O-N 3.47Å; A42-C46 PolarHBondContact O-SG 3.1Å; A42-C46 VanDerWaalsContact O-SG 3.34Å
43	L	81.9	Confident	83.7	Confident	73 Å²	73	64.7 Å²	64.7	38%	0.382	33%	0.333	S	S	.	.	H	α-helix	trans	-53.9	-48.8	-163.5	-167.8	69.7	0	0	0	112.9	V34 A37 H45 C46 Q47 W51	V34-L43 HydrophobicContact CG1-CD1 4.15Å; A37-L43 HydrophobicContact CB-CD1 4.04Å; L43-H45 VanDerWaalsContact C-N 3.31Å; L43-H45 PolarHBondContact O-N 3.3Å; L43-C46 PolarHBondContact O-N 3.41Å; L43-Q47 WeakPolarHBondContact O-CB 3.39Å; L43-Q47 PolarHBondContact O-N 2.93Å; L43-W51 HydrophobicContact CD1-CH2 3.92Å; L43-W51 HydrophobicContact CD1-CZ3 3.85Å
44	S	82.6	Confident	83.7	Confident	78 Å²	78	67.1 Å²	67.1	55%	0.545	35%	0.351	S	S	.	.	H	α-helix	trans	-62.8	-37.2	177.7	-49.5	0	0	0	0	112.5	A42 Q48	A42-S44 PolarHBondContact O-N 2.77Å; S44-Q48 WeakPolarHBondContact O-CB 3.49Å; S44-Q48 VanDerWaalsContact O-CG 3.25Å; S44-Q48 WeakPolarHBondContact O-CG 3.11Å; S44-Q48 PolarHBondContact O-N 3.24Å; S44-Q48 VanDerWaalsContact O-N 3.15Å
45	H	86.4	Confident	83.6	Confident	74 Å²	74	65 Å²	65	34%	0.343	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-46.3	176.4	177.4	81.5	0	0	0	111	W30 A42 L43 Q48 N49	W30-H45 AromaticContact CZ2-CD2 3.95Å; A42-H45 WeakPolarHBondContact O-CA 2.97Å; A42-H45 WeakPolarHBondContact O-CB 3.25Å; A42-H45 PolarHBondContact O-N 3.31Å; L43-H45 VanDerWaalsContact C-N 3.31Å; L43-H45 PolarHBondContact O-N 3.3Å; H45-Q48 PolarHBondContact O-N 3.35Å; H45-N49 PolarHBondContact ND1-ND2 3.41Å; H45-N49 VanDerWaalsContact O-CB 3.26Å; H45-N49 WeakPolarHBondContact O-CB 3.49Å; H45-N49 PolarHBondContact O-N 3.29Å; H45-N49 PolarHBondContact O-ND2 3.16Å
46	C	85.1	Confident	83.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-42.2	-178.9	-58	0	0	0	0	112.2	C31 A37 A42 L43 Q48 V50 W51	C31-C46 WeakPolarHBondContact CA-SG 3.31Å; C31-C46 HydrophobicContact CB-CB 3.65Å; C31-C46 WeakPolarHBondContact CB-SG 3.44Å; C31-C46 WeakPolarHBondContact SG-CA 3.4Å; C31-C46 WeakPolarHBondContact SG-CB 3.26Å; C31-C46 CovalentContact SG-SG 2.04Å; C31-C46 PolarHBondContact SG-SG 2.9Å; A37-C46 HydrophobicContact CB-CB 4.38Å; A42-C46 PolarHBondContact O-N 3.47Å; A42-C46 PolarHBondContact O-SG 3.1Å; A42-C46 VanDerWaalsContact O-SG 3.34Å; L43-C46 PolarHBondContact O-N 3.41Å; C46-Q48 PolarHBondContact O-N 2.78Å; C46-V50 WeakPolarHBondContact O-CA 3.45Å; C46-V50 WeakPolarHBondContact O-CB 3.34Å; C46-V50 PolarHBondContact O-N 3.39Å; C46-W51 HydrophobicContact CB-CD2 4.01Å; C46-W51 HydrophobicContact CB-CE3 4.09Å; C46-W51 HydrophobicContact CB-CH2 3.77Å; C46-W51 HydrophobicContact CB-CZ2 3.67Å; C46-W51 HydrophobicContact CB-CZ3 3.98Å; C46-W51 PolarHBondContact O-N 3.17Å
47	Q	84.1	Confident	82.9	Confident	61 Å²	61	68.4 Å²	68.4	29%	0.285	35%	0.352	S	S	.	.	I	π-helix	trans	-61	-45.7	176.5	-164.7	179.8	10.9	0	0	111.5	L43 W51 N52 E122 V128	L43-Q47 WeakPolarHBondContact O-CB 3.39Å; L43-Q47 PolarHBondContact O-N 2.93Å; Q47-W51 HydrophobicContact CB-CE3 4.27Å; Q47-N52 WeakPolarHBondContact O-CB 3.31Å; Q47-N52 VanDerWaalsContact O-CG 3.28Å; Q47-N52 PolarHBondContact O-N 2.98Å; Q47-E122 PolarHBondContact NE2-OE1 3.41Å; Q47-E122 VanDerWaalsContact NE2-OE1 3.11Å; Q47-E122 PolarHBondContact NE2-OE2 3.41Å; Q47-V128 HydrophobicContact CG-CG1 3.77Å
48	Q	82.3	Confident	82.7	Confident	120 Å²	120	70.8 Å²	70.8	56%	0.561	37%	0.367	S	S	*	.	I	π-helix	trans	-84.6	-22.9	-173.3	-66.7	174.9	8.5	0	0	115.1	S44 H45 C46 N52	S44-Q48 WeakPolarHBondContact O-CB 3.49Å; S44-Q48 VanDerWaalsContact O-CG 3.25Å; S44-Q48 WeakPolarHBondContact O-CG 3.11Å; S44-Q48 PolarHBondContact O-N 3.24Å; S44-Q48 VanDerWaalsContact O-N 3.15Å; H45-Q48 PolarHBondContact O-N 3.35Å; C46-Q48 PolarHBondContact O-N 2.78Å; Q48-N52 VanDerWaalsContact C-ND2 3.28Å; Q48-N52 VanDerWaalsContact O-CG 3.25Å; Q48-N52 PolarHBondContact O-ND2 3.37Å; Q48-N52 PolarHBondContact O-OD1 3.26Å
49	N	82.3	Confident	82.5	Confident	74 Å²	74	72.8 Å²	72.8	40%	0.396	38%	0.376	S	S	.	.	I	π-helix	trans	-120.9	-15.4	-170.5	-58.2	-77.2	0	0	0	113.9	H45 K53	H45-N49 PolarHBondContact ND1-ND2 3.41Å; H45-N49 VanDerWaalsContact O-CB 3.26Å; H45-N49 WeakPolarHBondContact O-CB 3.49Å; H45-N49 PolarHBondContact O-N 3.29Å; H45-N49 PolarHBondContact O-ND2 3.16Å; N49-K53 WeakPolarHBondContact O-CE 3.5Å; N49-K53 VanDerWaalsContact O-CG 3.26Å; N49-K53 WeakPolarHBondContact O-CG 3.44Å
50	V	83.3	Confident	82.3	Confident	34 Å²	34	70.6 Å²	70.6	21%	0.206	37%	0.369	C	S	.	.	I	π-helix	trans	-125.3	-57.6	-174.3	-174.1	0	0	0	0	112	C31 C46 K53 Q55	C31-V50 HydrophobicContact CB-CB 4.17Å; C31-V50 HydrophobicContact CB-CG1 4.11Å; C31-V50 HydrophobicContact CB-CG2 3.97Å; C46-V50 WeakPolarHBondContact O-CA 3.45Å; C46-V50 WeakPolarHBondContact O-CB 3.34Å; C46-V50 PolarHBondContact O-N 3.39Å; V50-K53 WeakPolarHBondContact O-CB 3.31Å; V50-K53 PolarHBondContact O-N 3.09Å; V50-Q55 PolarHBondContact O-NE2 3.31Å
51	W	86.1	Confident	82.2	Confident	10 Å²	10	69.8 Å²	69.8	4%	0.038	36%	0.363	C	S	.	.	I	π-helix	trans	-75.7	-26.2	-173	-57.1	-31.8	0	0	0	113.2	C31 V34 A37 L43 C46 Q47 K53 Q55 V128 G131 A132	C31-W51 PolarHBondContact O-NE1 2.63Å; V34-W51 HydrophobicContact CG2-CH2 4.2Å; V34-W51 HydrophobicContact CG2-CZ3 4.45Å; A37-W51 HydrophobicContact CB-CH2 3.71Å; A37-W51 HydrophobicContact CB-CZ2 4.11Å; L43-W51 HydrophobicContact CD1-CH2 3.92Å; L43-W51 HydrophobicContact CD1-CZ3 3.85Å; C46-W51 HydrophobicContact CB-CD2 4.01Å; C46-W51 HydrophobicContact CB-CE3 4.09Å; C46-W51 HydrophobicContact CB-CH2 3.77Å; C46-W51 HydrophobicContact CB-CZ2 3.67Å; C46-W51 HydrophobicContact CB-CZ3 3.98Å; C46-W51 PolarHBondContact O-N 3.17Å; Q47-W51 HydrophobicContact CB-CE3 4.27Å; W51-K53 VanDerWaalsContact C-N 3.29Å; W51-K53 PolarHBondContact O-N 3Å; W51-Q55 PolarHBondContact O-NE2 3.29Å; W51-V128 HydrophobicContact CB-CG1 4.18Å; W51-G131 PolarHBondContact NE1-O 3.2Å; W51-A132 HydrophobicContact CD2-CB 3.83Å; W51-A132 HydrophobicContact CE3-CB 3.51Å; W51-A132 HydrophobicContact CH2-CB 3.97Å; W51-A132 HydrophobicContact CZ2-CB 4.26Å; W51-A132 HydrophobicContact CZ3-CB 3.58Å
52	N	82.7	Confident	82.3	Confident	68 Å²	68	63.2 Å²	63.2	36%	0.364	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	1.6	173.6	73	-7.2	0	0	0	114.9	Q47 Q48 V128	Q47-N52 WeakPolarHBondContact O-CB 3.31Å; Q47-N52 VanDerWaalsContact O-CG 3.28Å; Q47-N52 PolarHBondContact O-N 2.98Å; Q48-N52 VanDerWaalsContact C-ND2 3.28Å; Q48-N52 VanDerWaalsContact O-CG 3.25Å; Q48-N52 PolarHBondContact O-ND2 3.37Å; Q48-N52 PolarHBondContact O-OD1 3.26Å; N52-V128 HydrophobicContact CB-CG2 3.83Å
53	K	82.9	Confident	82.2	Confident	76 Å²	76	68 Å²	68	33%	0.33	36%	0.361	S	S	.	.	S	Bend	trans	-81.6	160.9	179.2	-59.9	-57.3	179.4	-169.5	0	110.8	N49 V50 W51 Q55	N49-K53 WeakPolarHBondContact O-CE 3.5Å; N49-K53 VanDerWaalsContact O-CG 3.26Å; N49-K53 WeakPolarHBondContact O-CG 3.44Å; V50-K53 WeakPolarHBondContact O-CB 3.31Å; V50-K53 PolarHBondContact O-N 3.09Å; W51-K53 VanDerWaalsContact C-N 3.29Å; W51-K53 PolarHBondContact O-N 3Å; K53-Q55 WeakPolarHBondContact O-CG 3.38Å; K53-Q55 PolarHBondContact O-N 2.91Å; K53-Q55 PolarHBondContact O-NE2 3.23Å
54	P	81.1	Confident	82.6	Confident	95 Å²	95	65.1 Å²	65.1	62%	0.617	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-53.9	124.7	171.9	-25.6	34.8	0	0	0	110.9	M139	P54-M139 WeakPolarHBondContact O-CB 3.35Å; P54-M139 PolarHBondContact O-N 3.5Å
55	Q	81.8	Confident	82.8	Confident	24 Å²	24	63.6 Å²	63.6	11%	0.112	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-96.9	151.3	-176.1	-55.3	-64.2	-40	0	0	110.3	V50 W51 K53 C136 N137	V50-Q55 PolarHBondContact O-NE2 3.31Å; W51-Q55 PolarHBondContact O-NE2 3.29Å; K53-Q55 WeakPolarHBondContact O-CG 3.38Å; K53-Q55 PolarHBondContact O-N 2.91Å; K53-Q55 PolarHBondContact O-NE2 3.23Å; Q55-C136 HydrophobicContact CB-CB 4.06Å; Q55-C136 HydrophobicContact CG-CB 3.85Å; Q55-C136 VanDerWaalsContact OE1-C 3.27Å; Q55-C136 PolarHBondContact OE1-O 3.23Å; Q55-N137 WeakPolarHBondContact CA-O 3.45Å; Q55-N137 PolarHBondContact OE1-O 3.27Å
56	M	74.7	Confident	82.9	Confident	59 Å²	59	65.5 Å²	65.5	29%	0.291	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-60.7	144.9	169.9	-73.5	-72	-77.6	0	0	110.5	T58 N137 M139 S142	M56-T58 HydrophobicContact CB-CG2 4.01Å; M56-T58 PolarHBondContact O-N 2.95Å; M56-N137 PolarHBondContact N-O 3.28Å; M56-M139 HydrophobicContact SD-CB 4.39Å; M56-M139 HydrophobicContact SD-CG 3.97Å; M56-S142 VanDerWaalsContact CG-OG 3.32Å; M56-S142 WeakPolarHBondContact CG-OG 3.27Å
57	K	73.8	Confident	82.9	Confident	184 Å²	184	69.2 Å²	69.2	80%	0.8	36%	0.362	S	S	*	.			trans	-77.8	106.8	166.3	-70	-172	177.1	-173.6	0	108.4
58	T	79.3	Confident	82.9	Confident	50 Å²	50	67.4 Å²	67.4	31%	0.307	36%	0.355	S	S	.	.			trans	-135.5	147.9	175.1	65.7	0	0	0	0	107.8	M56 P60 C61 D62	M56-T58 HydrophobicContact CB-CG2 4.01Å; M56-T58 PolarHBondContact O-N 2.95Å; T58-P60 VanDerWaalsContact C-N 3.33Å; T58-C61 WeakPolarHBondContact O-CB 3.2Å; T58-C61 PolarHBondContact O-N 3.11Å; T58-C61 WeakPolarHBondContact OG1-CB 3.46Å; T58-C61 PolarHBondContact OG1-N 3.24Å; T58-D62 PolarHBondContact O-N 3.01Å
59	V	79.3	Confident	82.9	Confident	119 Å²	119	66.2 Å²	66.2	72%	0.721	35%	0.35	S	S	*	.	H	α-helix	trans	-53.1	-45	179.6	-179.8	0	0	0	0	112.2	C61 D62 L63	V59-C61 VanDerWaalsContact C-N 3.32Å; V59-C61 PolarHBondContact O-N 3.25Å; V59-D62 PolarHBondContact O-N 2.84Å; V59-L63 WeakPolarHBondContact O-CB 3.33Å; V59-L63 PolarHBondContact O-N 2.98Å
60	P	78.5	Confident	83	Confident	74 Å²	74	66.4 Å²	66.4	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-34.9	176.2	-23.4	34.9	0	0	0	113.9	T58 C64	T58-P60 VanDerWaalsContact C-N 3.33Å; P60-C64 WeakPolarHBondContact O-CB 3.44Å; P60-C64 PolarHBondContact O-N 3.45Å; P60-C64 VanDerWaalsContact O-N 3.16Å
61	C	85	Confident	82.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-75.3	-42.1	-179.9	179.5	0	0	0	0	111.6	T58 V59 K65 L135 C136	T58-C61 WeakPolarHBondContact O-CB 3.2Å; T58-C61 PolarHBondContact O-N 3.11Å; T58-C61 WeakPolarHBondContact OG1-CB 3.46Å; T58-C61 PolarHBondContact OG1-N 3.24Å; V59-C61 VanDerWaalsContact C-N 3.32Å; V59-C61 PolarHBondContact O-N 3.25Å; C61-K65 VanDerWaalsContact O-CG 3.28Å; C61-K65 WeakPolarHBondContact O-CG 3.29Å; C61-K65 PolarHBondContact O-N 3Å; C61-K65 WeakPolarHBondContact SG-CE 3.09Å; C61-K65 PolarHBondContact SG-NZ 2.87Å; C61-L135 WeakPolarHBondContact CA-O 3.48Å; C61-L135 WeakPolarHBondContact CB-O 3.46Å; C61-L135 PolarHBondContact N-O 3.49Å; C61-C136 WeakPolarHBondContact CA-SG 3.47Å; C61-C136 HydrophobicContact CB-CB 3.98Å; C61-C136 WeakPolarHBondContact CB-SG 3.27Å; C61-C136 WeakPolarHBondContact SG-CB 3.47Å; C61-C136 CovalentContact SG-SG 2.03Å; C61-C136 PolarHBondContact SG-SG 3.41Å
62	D	87.7	Confident	82.4	Confident	52 Å²	52	67.5 Å²	67.5	28%	0.278	36%	0.364	S	S	.	.	H	α-helix	trans	-72.6	-42.6	-178.4	-64.8	-30.2	0	0	0	110.7	T58 V59 C64 K65 E66	T58-D62 PolarHBondContact O-N 3.01Å; V59-D62 PolarHBondContact O-N 2.84Å; D62-C64 PolarHBondContact O-N 3.37Å; D62-K65 PolarHBondContact O-N 3.33Å; D62-K65 IonicContact OD1-NZ 2.74Å; D62-E66 WeakPolarHBondContact O-CG 3.45Å; D62-E66 PolarHBondContact O-N 2.93Å
63	L	86.3	Confident	82.1	Confident	102 Å²	102	70.7 Å²	70.7	53%	0.534	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-45	172.6	-178.6	64.3	0	0	0	111.7	V59 K65 E66 V67	V59-L63 WeakPolarHBondContact O-CB 3.33Å; V59-L63 PolarHBondContact O-N 2.98Å; L63-K65 VanDerWaalsContact C-N 3.31Å; L63-K65 PolarHBondContact O-N 2.97Å; L63-E66 PolarHBondContact O-N 3.24Å; L63-V67 HydrophobicContact CD1-CG2 4.31Å; L63-V67 HydrophobicContact CG-CG2 4.47Å; L63-V67 VanDerWaalsContact O-CG2 3.32Å; L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.99Å
64	C	88.9	Confident	81.7	Confident	13 Å²	13	71.8 Å²	71.8	9%	0.088	39%	0.385	C	S	.	.	H	α-helix	trans	-58.4	-44.9	176	176.5	0	0	0	0	111.4	P60 D62 E66 V67 L68 C130 L135	P60-C64 WeakPolarHBondContact O-CB 3.44Å; P60-C64 PolarHBondContact O-N 3.45Å; P60-C64 VanDerWaalsContact O-N 3.16Å; D62-C64 PolarHBondContact O-N 3.37Å; C64-E66 PolarHBondContact O-N 3.11Å; C64-V67 PolarHBondContact O-N 2.98Å; C64-L68 WeakPolarHBondContact O-CB 3.22Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.29Å; C64-C130 HydrophobicContact CB-CB 3.88Å; C64-C130 WeakPolarHBondContact CB-SG 3.18Å; C64-C130 WeakPolarHBondContact SG-CA 3.46Å; C64-C130 WeakPolarHBondContact SG-CB 3.46Å; C64-C130 CovalentContact SG-SG 2.03Å; C64-C130 PolarHBondContact SG-SG 3.45Å; C64-L135 HydrophobicContact CB-CB 4.12Å; C64-L135 HydrophobicContact CB-CD1 3.8Å
65	K	88.3	Confident	81.2	Confident	46 Å²	46	68.4 Å²	68.4	20%	0.2	36%	0.362	C	S	.	.	H	α-helix	trans	-63.8	-42.1	178.3	-72.1	166.9	-174	161.5	0	111.7	C61 D62 L63 L68 M69 P126 C130	C61-K65 VanDerWaalsContact O-CG 3.28Å; C61-K65 WeakPolarHBondContact O-CG 3.29Å; C61-K65 PolarHBondContact O-N 3Å; C61-K65 WeakPolarHBondContact SG-CE 3.09Å; C61-K65 PolarHBondContact SG-NZ 2.87Å; D62-K65 PolarHBondContact O-N 3.33Å; D62-K65 IonicContact OD1-NZ 2.74Å; L63-K65 VanDerWaalsContact C-N 3.31Å; L63-K65 PolarHBondContact O-N 2.97Å; K65-L68 PolarHBondContact O-N 2.68Å; K65-M69 WeakPolarHBondContact O-CB 3.47Å; K65-M69 VanDerWaalsContact O-CG 3.24Å; K65-M69 WeakPolarHBondContact O-CG 3.19Å; K65-M69 PolarHBondContact O-N 3.42Å; K65-P126 HydrophobicContact CB-CB 4.27Å; K65-P126 HydrophobicContact CB-CG 4.44Å; K65-P126 HydrophobicContact CG-CB 4.21Å; K65-P126 HydrophobicContact CG-CG 4.42Å; K65-C130 PolarHBondContact N-SG 3.44Å; K65-C130 VanDerWaalsContact N-SG 3.41Å
66	E	87.3	Confident	80.7	Confident	115 Å²	115	74.5 Å²	74.5	54%	0.537	39%	0.388	S	S	.	.	H	α-helix	trans	-63	-46.3	177.5	-74	177.7	-177.8	0	0	112	D62 L63 C64 L68 M69 V70	D62-E66 WeakPolarHBondContact O-CG 3.45Å; D62-E66 PolarHBondContact O-N 2.93Å; L63-E66 PolarHBondContact O-N 3.24Å; C64-E66 PolarHBondContact O-N 3.11Å; E66-L68 VanDerWaalsContact C-N 3.35Å; E66-L68 PolarHBondContact O-N 2.82Å; E66-M69 HydrophobicContact CB-CE 4.37Å; E66-M69 HydrophobicContact CG-CE 3.89Å; E66-M69 WeakPolarHBondContact O-CB 3.48Å; E66-M69 PolarHBondContact O-N 3.22Å; E66-V70 WeakPolarHBondContact O-CG2 3.24Å; E66-V70 PolarHBondContact O-N 3.35Å
67	V	85.3	Confident	80.6	Confident	77 Å²	77	75.8 Å²	75.8	47%	0.467	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-46.2	175	172.1	0	0	0	0	110.7	L63 C64 M69 V70 V71	L63-V67 HydrophobicContact CD1-CG2 4.31Å; L63-V67 HydrophobicContact CG-CG2 4.47Å; L63-V67 VanDerWaalsContact O-CG2 3.32Å; L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.99Å; C64-V67 PolarHBondContact O-N 2.98Å; V67-M69 VanDerWaalsContact C-N 3.32Å; V67-M69 PolarHBondContact O-N 3.37Å; V67-V70 PolarHBondContact O-N 2.94Å; V67-V71 HydrophobicContact CG1-CG2 4.32Å; V67-V71 WeakPolarHBondContact O-CB 3.39Å; V67-V71 VanDerWaalsContact O-CG2 3.28Å; V67-V71 WeakPolarHBondContact O-CG2 3.43Å; V67-V71 PolarHBondContact O-N 2.83Å
68	L	83.9	Confident	80.1	Confident	24 Å²	24	73.1 Å²	73.1	13%	0.126	39%	0.391	C	S	.	.	H	α-helix	trans	-67.6	-31.1	178.3	-70.7	-171.2	0	0	0	113.2	C64 K65 E66 G72 L123 P126 A129 C130 M133	C64-L68 WeakPolarHBondContact O-CB 3.22Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.29Å; K65-L68 PolarHBondContact O-N 2.68Å; E66-L68 VanDerWaalsContact C-N 3.35Å; E66-L68 PolarHBondContact O-N 2.82Å; L68-G72 PolarHBondContact O-N 2.95Å; L68-L123 HydrophobicContact CB-CD2 4.21Å; L68-L123 HydrophobicContact CD1-CD2 4.38Å; L68-L123 HydrophobicContact CD2-CD2 3.78Å; L68-L123 HydrophobicContact CG-CD2 4.35Å; L68-P126 HydrophobicContact CB-CB 3.84Å; L68-P126 HydrophobicContact CD1-CB 4.13Å; L68-A129 HydrophobicContact CD1-CB 3.47Å; L68-A129 VanDerWaalsContact CD1-CB 3.47Å; L68-C130 VanDerWaalsContact CD1-SG 3.51Å; L68-M133 HydrophobicContact CD1-CE 3.7Å; L68-M133 HydrophobicContact CD2-CE 4.23Å; L68-M133 HydrophobicContact CG-CE 4.28Å
69	M	83.3	Confident	79.3	Confident	95 Å²	95	73.2 Å²	73.2	47%	0.468	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-43.8	171.7	-77.4	-171.7	-61.1	0	0	111.2	K65 E66 V67 G72 Q73 P126	K65-M69 WeakPolarHBondContact O-CB 3.47Å; K65-M69 VanDerWaalsContact O-CG 3.24Å; K65-M69 WeakPolarHBondContact O-CG 3.19Å; K65-M69 PolarHBondContact O-N 3.42Å; E66-M69 HydrophobicContact CB-CE 4.37Å; E66-M69 HydrophobicContact CG-CE 3.89Å; E66-M69 WeakPolarHBondContact O-CB 3.48Å; E66-M69 PolarHBondContact O-N 3.22Å; V67-M69 VanDerWaalsContact C-N 3.32Å; V67-M69 PolarHBondContact O-N 3.37Å; M69-G72 PolarHBondContact O-N 3.37Å; M69-Q73 WeakPolarHBondContact O-CB 3.37Å; M69-Q73 VanDerWaalsContact O-CG 3.26Å; M69-Q73 WeakPolarHBondContact O-CG 3.11Å; M69-Q73 PolarHBondContact O-N 3.01Å; M69-P126 HydrophobicContact CG-CG 4.16Å
70	V	82.9	Confident	79	Confident	78 Å²	78	69.3 Å²	69.3	47%	0.473	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-47.2	175.8	173.4	0	0	0	0	110.5	E66 V67 G72 Q73 L74	E66-V70 WeakPolarHBondContact O-CG2 3.24Å; E66-V70 PolarHBondContact O-N 3.35Å; V67-V70 PolarHBondContact O-N 2.94Å; V70-G72 VanDerWaalsContact C-N 3.32Å; V70-G72 PolarHBondContact O-N 3.07Å; V70-Q73 WeakPolarHBondContact O-CB 3.32Å; V70-Q73 PolarHBondContact O-N 3.13Å; V70-Q73 VanDerWaalsContact O-N 3.14Å; V70-L74 HydrophobicContact CG1-CD1 4.05Å; V70-L74 HydrophobicContact CG1-CG 4.43Å; V70-L74 WeakPolarHBondContact O-CG 3.23Å; V70-L74 PolarHBondContact O-N 3.26Å
71	V	80.8	Confident	79	Confident	56 Å²	56	67.9 Å²	67.9	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-60.1	-42.9	175.9	171	0	0	0	0	110.9	V67 Q73 L74 L75 L123	V67-V71 HydrophobicContact CG1-CG2 4.32Å; V67-V71 WeakPolarHBondContact O-CB 3.39Å; V67-V71 VanDerWaalsContact O-CG2 3.28Å; V67-V71 WeakPolarHBondContact O-CG2 3.43Å; V67-V71 PolarHBondContact O-N 2.83Å; V71-Q73 VanDerWaalsContact C-N 3.33Å; V71-Q73 PolarHBondContact O-N 3.15Å; V71-L74 PolarHBondContact O-N 2.9Å; V71-L75 HydrophobicContact CG1-CD1 3.76Å; V71-L75 HydrophobicContact CG1-CG 4.31Å; V71-L75 WeakPolarHBondContact O-CB 3.46Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.5Å; V71-L75 PolarHBondContact O-N 2.84Å; V71-L123 HydrophobicContact CG1-CD1 4.33Å
72	G	77.6	Confident	78.8	Confident	11 Å²	11	70.9 Å²	70.9	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-64.5	-34.4	175.5	0	0	0	0	0	113.1	L68 M69 V70 K76	L68-G72 PolarHBondContact O-N 2.95Å; M69-G72 PolarHBondContact O-N 3.37Å; V70-G72 VanDerWaalsContact C-N 3.32Å; V70-G72 PolarHBondContact O-N 3.07Å; G72-K76 WeakPolarHBondContact O-CB 3.27Å; G72-K76 WeakPolarHBondContact O-CD 3.4Å; G72-K76 WeakPolarHBondContact O-CG 3.32Å; G72-K76 PolarHBondContact O-N 3.25Å
73	Q	75.5	Confident	78.6	Confident	135 Å²	135	74.2 Å²	74.2	63%	0.631	40%	0.399	S	S	*	.	H	α-helix	trans	-70.6	-42.7	174	-75.9	174.1	4.4	0	0	112	M69 V70 V71 K76 D77	M69-Q73 WeakPolarHBondContact O-CB 3.37Å; M69-Q73 VanDerWaalsContact O-CG 3.26Å; M69-Q73 WeakPolarHBondContact O-CG 3.11Å; M69-Q73 PolarHBondContact O-N 3.01Å; V70-Q73 WeakPolarHBondContact O-CB 3.32Å; V70-Q73 PolarHBondContact O-N 3.13Å; V70-Q73 VanDerWaalsContact O-N 3.14Å; V71-Q73 VanDerWaalsContact C-N 3.33Å; V71-Q73 PolarHBondContact O-N 3.15Å; Q73-K76 WeakPolarHBondContact O-CB 3.39Å; Q73-K76 PolarHBondContact O-N 3.43Å; Q73-D77 PolarHBondContact O-N 2.98Å
74	L	73.8	Confident	78.5	Confident	98 Å²	98	72.2 Å²	72.2	51%	0.513	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-41.7	174.9	-68.9	172.8	0	0	0	111.2	V70 V71 K76 D77 T80	V70-L74 HydrophobicContact CG1-CD1 4.05Å; V70-L74 HydrophobicContact CG1-CG 4.43Å; V70-L74 WeakPolarHBondContact O-CG 3.23Å; V70-L74 PolarHBondContact O-N 3.26Å; V71-L74 PolarHBondContact O-N 2.9Å; L74-K76 VanDerWaalsContact C-N 3.27Å; L74-K76 PolarHBondContact O-N 3.45Å; L74-D77 VanDerWaalsContact O-CB 3.31Å; L74-D77 WeakPolarHBondContact O-CB 3.26Å; L74-D77 PolarHBondContact O-N 2.93Å; L74-D77 VanDerWaalsContact O-N 3.09Å; L74-T80 VanDerWaalsContact O-CB 3.31Å; L74-T80 WeakPolarHBondContact O-CB 3.49Å; L74-T80 PolarHBondContact O-OG1 3.21Å
75	L	72.2	Confident	78.3	Confident	25 Å²	25	73.7 Å²	73.7	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-73	-17.6	176.8	-70	173.6	0	0	0	113.5	V71 D77 Q81 I84 I119 L123	V71-L75 HydrophobicContact CG1-CD1 3.76Å; V71-L75 HydrophobicContact CG1-CG 4.31Å; V71-L75 WeakPolarHBondContact O-CB 3.46Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.5Å; V71-L75 PolarHBondContact O-N 2.84Å; L75-D77 VanDerWaalsContact C-N 3.3Å; L75-Q81 WeakPolarHBondContact O-CG 3.47Å; L75-Q81 PolarHBondContact O-NE2 3.48Å; L75-I84 HydrophobicContact CD2-CD1 4.03Å; L75-I119 HydrophobicContact CD1-CG2 3.87Å; L75-L123 HydrophobicContact CD1-CD1 3.59Å
76	K	70.6	Confident	78.2	Confident	152 Å²	152	72.5 Å²	72.5	66%	0.661	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-14	169.2	-80.7	170.8	-177	178.3	0	112.6	G72 Q73 L74 N78	G72-K76 WeakPolarHBondContact O-CB 3.27Å; G72-K76 WeakPolarHBondContact O-CD 3.4Å; G72-K76 WeakPolarHBondContact O-CG 3.32Å; G72-K76 PolarHBondContact O-N 3.25Å; Q73-K76 WeakPolarHBondContact O-CB 3.39Å; Q73-K76 PolarHBondContact O-N 3.43Å; L74-K76 VanDerWaalsContact C-N 3.27Å; L74-K76 PolarHBondContact O-N 3.45Å; K76-N78 PolarHBondContact O-N 3.44Å
77	D	72.2	Confident	78.2	Confident	85 Å²	85	74.5 Å²	74.5	46%	0.455	40%	0.4	S	S	.	.			trans	-73.9	113.9	170.4	-166.1	-14.6	0	0	0	109.2	Q73 L74 L75 A79 T80 Q81	Q73-D77 PolarHBondContact O-N 2.98Å; L74-D77 VanDerWaalsContact O-CB 3.31Å; L74-D77 WeakPolarHBondContact O-CB 3.26Å; L74-D77 PolarHBondContact O-N 2.93Å; L74-D77 VanDerWaalsContact O-N 3.09Å; L75-D77 VanDerWaalsContact C-N 3.3Å; D77-A79 PolarHBondContact O-N 3.33Å; D77-A79 VanDerWaalsContact O-N 3.11Å; D77-A79 VanDerWaalsContact OD1-CB 3.3Å; D77-A79 WeakPolarHBondContact OD1-CB 3.49Å; D77-A79 PolarHBondContact OD1-N 3.2Å; D77-T80 PolarHBondContact O-N 3.41Å; D77-Q81 PolarHBondContact O-N 3.18Å
78	N	64.3	Low	78.3	Confident	128 Å²	128	74.3 Å²	74.3	68%	0.684	40%	0.395	S	S	*	.	H	α-helix	trans	-57.2	-24.9	176.2	-73.9	-17.9	0	0	0	111.7	K76 A82	K76-N78 PolarHBondContact O-N 3.44Å; N78-A82 WeakPolarHBondContact O-CB 3.03Å; N78-A82 PolarHBondContact O-N 3.4Å
79	A	61.3	Low	78.6	Confident	52 Å²	52	76.3 Å²	76.3	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-43	174.1	0	0	0	0	0	111.8	D77 A82 E83	D77-A79 PolarHBondContact O-N 3.33Å; D77-A79 VanDerWaalsContact O-N 3.11Å; D77-A79 VanDerWaalsContact OD1-CB 3.3Å; D77-A79 WeakPolarHBondContact OD1-CB 3.49Å; D77-A79 PolarHBondContact OD1-N 3.2Å; A79-A82 PolarHBondContact O-N 2.94Å; A79-E83 WeakPolarHBondContact O-CG 3.42Å; A79-E83 PolarHBondContact O-N 2.87Å
80	T	74.6	Confident	78.9	Confident	37 Å²	37	78.2 Å²	78.2	23%	0.227	41%	0.41	C	S	.	.	H	α-helix	trans	-68.8	-37.5	179.1	-46.8	0	0	0	0	111.6	L74 D77 E83 I84	L74-T80 VanDerWaalsContact O-CB 3.31Å; L74-T80 WeakPolarHBondContact O-CB 3.49Å; L74-T80 PolarHBondContact O-OG1 3.21Å; D77-T80 PolarHBondContact O-N 3.41Å; T80-E83 PolarHBondContact O-N 3.45Å; T80-I84 HydrophobicContact CG2-CD1 4.33Å; T80-I84 VanDerWaalsContact O-CG1 3.3Å; T80-I84 WeakPolarHBondContact O-CG1 3.38Å; T80-I84 PolarHBondContact O-N 3.42Å
81	Q	77.2	Confident	79.2	Confident	45 Å²	45	76.9 Å²	76.9	21%	0.21	41%	0.407	C	S	.	.	H	α-helix	trans	-66.4	-38	172.6	-65	-173.3	0.2	0	0	112.1	L75 D77 E83 L85 Y112 I116	L75-Q81 WeakPolarHBondContact O-CG 3.47Å; L75-Q81 PolarHBondContact O-NE2 3.48Å; D77-Q81 PolarHBondContact O-N 3.18Å; Q81-E83 VanDerWaalsContact C-N 3.33Å; Q81-L85 WeakPolarHBondContact O-CB 3.28Å; Q81-L85 PolarHBondContact O-N 3.1Å; Q81-Y112 VanDerWaalsContact C-OH 3.3Å; Q81-Y112 VanDerWaalsContact CA-OH 3.3Å; Q81-Y112 WeakPolarHBondContact CA-OH 3.3Å; Q81-Y112 PolarHBondContact O-OH 3.06Å; Q81-I116 HydrophobicContact CG-CG2 4.29Å; Q81-I116 VanDerWaalsContact NE2-CG2 3.28Å
82	A	80.1	Confident	79.7	Confident	63 Å²	63	74.2 Å²	74.2	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-66.8	-35.7	175.8	0	0	0	0	0	112	N78 A79 G86	N78-A82 WeakPolarHBondContact O-CB 3.03Å; N78-A82 PolarHBondContact O-N 3.4Å; A79-A82 PolarHBondContact O-N 2.94Å; A82-G86 PolarHBondContact O-N 3.14Å
83	E	84	Confident	80.3	Confident	121 Å²	121	79.2 Å²	79.2	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-65.9	-47.1	175.3	-75.9	-178.6	175.3	0	0	112.3	A79 T80 Q81 L85 G86 Y87	A79-E83 WeakPolarHBondContact O-CG 3.42Å; A79-E83 PolarHBondContact O-N 2.87Å; T80-E83 PolarHBondContact O-N 3.45Å; Q81-E83 VanDerWaalsContact C-N 3.33Å; E83-L85 PolarHBondContact O-N 3.38Å; E83-G86 PolarHBondContact O-N 2.87Å; E83-G86 VanDerWaalsContact O-N 3.16Å; E83-Y87 HydrophobicContact CB-CE2 4.43Å; E83-Y87 WeakPolarHBondContact O-CD2 3.24Å; E83-Y87 PolarHBondContact O-N 2.84Å
84	I	83.9	Confident	81.1	Confident	61 Å²	61	79.7 Å²	79.7	31%	0.313	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-45	177.8	-64.2	166.4	0	0	0	110.5	L75 T80 G86 Y87 L88 Y112	L75-I84 HydrophobicContact CD2-CD1 4.03Å; T80-I84 HydrophobicContact CG2-CD1 4.33Å; T80-I84 VanDerWaalsContact O-CG1 3.3Å; T80-I84 WeakPolarHBondContact O-CG1 3.38Å; T80-I84 PolarHBondContact O-N 3.42Å; I84-G86 VanDerWaalsContact C-N 3.3Å; I84-G86 PolarHBondContact O-N 2.82Å; I84-Y87 PolarHBondContact O-N 3.35Å; I84-L88 HydrophobicContact CG2-CD1 4.31Å; I84-L88 WeakPolarHBondContact O-CG 3.17Å; I84-L88 PolarHBondContact O-N 3.24Å; I84-L88 VanDerWaalsContact O-N 3.1Å; I84-Y112 HydrophobicContact CB-CE2 4.38Å; I84-Y112 HydrophobicContact CG2-CE2 3.82Å
85	L	85.5	Confident	81.9	Confident	43 Å²	43	77.7 Å²	77.7	23%	0.225	41%	0.406	C	S	.	.	H	α-helix	trans	-57.7	-45.6	173.6	179.9	58.4	0	0	0	111	Q81 E83 Y87 L88 E89 V108 Y112	Q81-L85 WeakPolarHBondContact O-CB 3.28Å; Q81-L85 PolarHBondContact O-N 3.1Å; E83-L85 PolarHBondContact O-N 3.38Å; L85-Y87 VanDerWaalsContact C-N 3.3Å; L85-Y87 PolarHBondContact O-N 2.58Å; L85-L88 PolarHBondContact O-N 3.43Å; L85-L88 VanDerWaalsContact O-N 3.11Å; L85-E89 HydrophobicContact CD1-CG 4.28Å; L85-E89 HydrophobicContact CG-CG 4.47Å; L85-E89 WeakPolarHBondContact O-CG 3.36Å; L85-E89 PolarHBondContact O-N 2.8Å; L85-V108 HydrophobicContact CD1-CG1 3.65Å; L85-Y112 HydrophobicContact CB-CD1 4.16Å; L85-Y112 HydrophobicContact CB-CE1 3.72Å; L85-Y112 HydrophobicContact CB-CE2 4.35Å; L85-Y112 HydrophobicContact CD1-CD1 3.77Å; L85-Y112 HydrophobicContact CD1-CD2 4.35Å; L85-Y112 HydrophobicContact CD1-CE1 4.23Å; L85-Y112 HydrophobicContact CD1-CG 3.83Å; L85-Y112 HydrophobicContact CD2-CD1 4.29Å; L85-Y112 HydrophobicContact CD2-CE1 4.32Å; L85-Y112 HydrophobicContact CG-CD1 4.29Å; L85-Y112 HydrophobicContact CG-CE1 4.3Å
86	G	86.1	Confident	82.6	Confident	22 Å²	22	82.8 Å²	82.8	23%	0.227	44%	0.441	C	S	.	.	H	α-helix	trans	-61.4	-33.8	177.7	0	0	0	0	0	113.8	A82 E83 I84 K90	A82-G86 PolarHBondContact O-N 3.14Å; E83-G86 PolarHBondContact O-N 2.87Å; E83-G86 VanDerWaalsContact O-N 3.16Å; I84-G86 VanDerWaalsContact C-N 3.3Å; I84-G86 PolarHBondContact O-N 2.82Å; G86-K90 WeakPolarHBondContact O-CB 3.26Å; G86-K90 WeakPolarHBondContact O-CD 3.3Å; G86-K90 WeakPolarHBondContact O-CG 3.35Å; G86-K90 PolarHBondContact O-N 2.89Å; G86-K90 VanDerWaalsContact O-N 3.1Å
87	Y	87.8	Confident	83.8	Confident	157 Å²	157	79.6 Å²	79.6	62%	0.616	43%	0.431	S	S	*	.	H	α-helix	trans	-69.2	-40.7	172.6	-72.8	-64.4	0	0	0	112.3	E83 I84 L85 K90 A91	E83-Y87 HydrophobicContact CB-CE2 4.43Å; E83-Y87 WeakPolarHBondContact O-CD2 3.24Å; E83-Y87 PolarHBondContact O-N 2.84Å; I84-Y87 PolarHBondContact O-N 3.35Å; L85-Y87 VanDerWaalsContact C-N 3.3Å; L85-Y87 PolarHBondContact O-N 2.58Å; Y87-K90 PolarHBondContact O-N 3.05Å; Y87-A91 PolarHBondContact O-N 3.02Å
88	L	87.5	Confident	84.4	Confident	72 Å²	72	83.8 Å²	83.8	38%	0.377	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-42.7	178.1	-67.1	170.6	0	0	0	111.7	I84 L85 K90 A91 C92 V108 Y112	I84-L88 HydrophobicContact CG2-CD1 4.31Å; I84-L88 WeakPolarHBondContact O-CG 3.17Å; I84-L88 PolarHBondContact O-N 3.24Å; I84-L88 VanDerWaalsContact O-N 3.1Å; L85-L88 PolarHBondContact O-N 3.43Å; L85-L88 VanDerWaalsContact O-N 3.11Å; L88-K90 PolarHBondContact O-N 3.5Å; L88-A91 WeakPolarHBondContact O-CB 3.3Å; L88-A91 PolarHBondContact O-N 3.07Å; L88-C92 PolarHBondContact O-N 3.06Å; L88-C92 VanDerWaalsContact O-N 3.13Å; L88-V108 HydrophobicContact CB-CG1 3.79Å; L88-V108 HydrophobicContact CB-CG2 4.15Å; L88-V108 HydrophobicContact CD1-CG1 4.5Å; L88-Y112 HydrophobicContact CD1-CD2 3.57Å; L88-Y112 HydrophobicContact CD1-CE2 3.88Å
89	E	89.8	Confident	85.7	Confident	66 Å²	66	79.9 Å²	79.9	31%	0.308	44%	0.438	S	S	.	.	H	α-helix	trans	-63.5	-40.2	174.4	-72.4	-178.7	-172.5	0	0	112.3	L85 A91 C92 H93 V108	L85-E89 HydrophobicContact CD1-CG 4.28Å; L85-E89 HydrophobicContact CG-CG 4.47Å; L85-E89 WeakPolarHBondContact O-CG 3.36Å; L85-E89 PolarHBondContact O-N 2.8Å; E89-A91 VanDerWaalsContact C-N 3.29Å; E89-A91 PolarHBondContact O-N 3.04Å; E89-C92 WeakPolarHBondContact O-CB 3.4Å; E89-C92 PolarHBondContact O-N 2.71Å; E89-H93 PolarHBondContact O-CD2 3.16Å; E89-H93 PolarHBondContact O-N 3.02Å; E89-V108 HydrophobicContact CG-CG1 4.4Å
90	K	90	Very high	86.8	Confident	135 Å²	135	82 Å²	82	59%	0.587	44%	0.442	S	S	*	.	H	α-helix	trans	-62.9	-35.7	173.4	-78	170.5	-173.5	171	0	112	G86 Y87 L88 H93 L94	G86-K90 WeakPolarHBondContact O-CB 3.26Å; G86-K90 WeakPolarHBondContact O-CD 3.3Å; G86-K90 WeakPolarHBondContact O-CG 3.35Å; G86-K90 PolarHBondContact O-N 2.89Å; G86-K90 VanDerWaalsContact O-N 3.1Å; Y87-K90 PolarHBondContact O-N 3.05Å; L88-K90 PolarHBondContact O-N 3.5Å; K90-H93 WeakPolarHBondContact O-CB 3.27Å; K90-H93 PolarHBondContact O-N 3.19Å; K90-L94 PolarHBondContact O-N 2.84Å
91	A	89.4	Confident	87.6	Confident	50 Å²	50	81 Å²	81	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-40.7	174.9	0	0	0	0	0	111.5	Y87 L88 E89 H93 L94	Y87-A91 PolarHBondContact O-N 3.02Å; L88-A91 WeakPolarHBondContact O-CB 3.3Å; L88-A91 PolarHBondContact O-N 3.07Å; E89-A91 VanDerWaalsContact C-N 3.29Å; E89-A91 PolarHBondContact O-N 3.04Å; A91-H93 PolarHBondContact O-N 2.77Å; A91-L94 WeakPolarHBondContact O-CB 3.17Å; A91-L94 PolarHBondContact O-N 3.35Å
92	C	91	Very high	88.3	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.007	45%	0.45	C	S	.	.	H	α-helix	trans	-63	-26.6	173.5	-64.6	0	0	0	0	113.3	L88 E89 L94 I95 S101 C104 K105	L88-C92 PolarHBondContact O-N 3.06Å; L88-C92 VanDerWaalsContact O-N 3.13Å; E89-C92 WeakPolarHBondContact O-CB 3.4Å; E89-C92 PolarHBondContact O-N 2.71Å; C92-L94 VanDerWaalsContact C-N 3.32Å; C92-I95 WeakPolarHBondContact O-CB 3.44Å; C92-I95 PolarHBondContact O-N 3.23Å; C92-S101 WeakPolarHBondContact O-CB 3.5Å; C92-S101 PolarHBondContact O-OG 2.91Å; C92-C104 WeakPolarHBondContact CA-SG 3.36Å; C92-C104 HydrophobicContact CB-CB 3.71Å; C92-C104 WeakPolarHBondContact CB-SG 3.49Å; C92-C104 WeakPolarHBondContact SG-CB 3.3Å; C92-C104 PolarHBondContact SG-O 3.26Å; C92-C104 CovalentContact SG-SG 2.05Å; C92-C104 PolarHBondContact SG-SG 3.3Å; C92-K105 HydrophobicContact CB-CG 3.82Å
93	H	89.5	Confident	88.8	Confident	116 Å²	116	84 Å²	84	54%	0.537	45%	0.449	S	S	.	.	H	α-helix	trans	-74.1	-17.7	173.9	-79.4	-65.3	0	0	0	114.6	E89 K90 A91 I95 K105	E89-H93 PolarHBondContact O-CD2 3.16Å; E89-H93 PolarHBondContact O-N 3.02Å; K90-H93 WeakPolarHBondContact O-CB 3.27Å; K90-H93 PolarHBondContact O-N 3.19Å; A91-H93 PolarHBondContact O-N 2.77Å; H93-I95 PolarHBondContact O-N 2.98Å; H93-K105 VanDerWaalsContact CE1-CE 3.43Å; H93-K105 WeakPolarHBondContact CE1-CE 3.43Å; H93-K105 PolarHBondContact CE1-NZ 3.18Å; H93-K105 VanDerWaalsContact NE2-CE 3.3Å; H93-K105 WeakPolarHBondContact NE2-CE 3.47Å; H93-K105 PolarHBondContact NE2-NZ 3.44Å
94	L	91.9	Very high	89.2	Confident	145 Å²	145	79.8 Å²	79.8	76%	0.759	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-10.2	175.2	-62.7	173.7	0	0	0	112.3	K90 A91 C92 P96	K90-L94 PolarHBondContact O-N 2.84Å; A91-L94 WeakPolarHBondContact O-CB 3.17Å; A91-L94 PolarHBondContact O-N 3.35Å; C92-L94 VanDerWaalsContact C-N 3.32Å; L94-P96 VanDerWaalsContact O-CD 3.32Å; L94-P96 WeakPolarHBondContact O-CD 3.39Å
95	I	91.1	Very high	89.6	Confident	55 Å²	55	79.9 Å²	79.9	28%	0.282	43%	0.431	S	S	.	.			trans	-77.2	117.2	177.6	-58.3	176.3	0	0	0	108.8	C92 H93 D97 L100 C104	C92-I95 WeakPolarHBondContact O-CB 3.44Å; C92-I95 PolarHBondContact O-N 3.23Å; H93-I95 PolarHBondContact O-N 2.98Å; I95-D97 VanDerWaalsContact C-N 3.3Å; I95-D97 HydrophobicContact CG2-CB 4.45Å; I95-D97 PolarHBondContact O-N 3.39Å; I95-L100 HydrophobicContact CG2-CB 3.75Å; I95-C104 HydrophobicContact CD1-CB 3.74Å
96	P	88.1	Confident	89.9	Confident	133 Å²	133	84.6 Å²	84.6	86%	0.864	45%	0.452	S	S	*	.	S	Bend	trans	-69.4	-26.7	-175.7	-20.1	33	0	0	0	113.9	L94	L94-P96 VanDerWaalsContact O-CD 3.32Å; L94-P96 WeakPolarHBondContact O-CD 3.39Å
97	D	94.2	Very high	89.8	Confident	85 Å²	85	88.6 Å²	88.6	46%	0.455	47%	0.466	S	S	.	.			trans	-80.6	121.8	178.2	-175.7	-84	0	0	0	110.6	I95 G99 L100 S101	I95-D97 VanDerWaalsContact C-N 3.3Å; I95-D97 HydrophobicContact CG2-CB 4.45Å; I95-D97 PolarHBondContact O-N 3.39Å; D97-G99 VanDerWaalsContact C-N 3.31Å; D97-G99 PolarHBondContact O-N 3.04Å; D97-G99 WeakPolarHBondContact OD1-CA 3.22Å; D97-G99 PolarHBondContact OD1-N 2.85Å; D97-L100 HydrophobicContact CB-CB 4.15Å; D97-L100 HydrophobicContact CB-CD1 4.04Å; D97-L100 HydrophobicContact CB-CG 4.23Å; D97-L100 PolarHBondContact O-N 2.66Å; D97-L100 PolarHBondContact OD1-N 3.36Å; D97-S101 VanDerWaalsContact O-CB 3.29Å; D97-S101 WeakPolarHBondContact O-CB 3.44Å; D97-S101 PolarHBondContact O-N 3.18Å
98	Q	86	Confident	90	Very high	173 Å²	173	82.2 Å²	82.2	81%	0.808	44%	0.443	S	S	*	.	H	α-helix	trans	-66.6	-30.3	-177	-85.7	-176.1	-15.1	0	0	113.4	A102	Q98-A102 WeakPolarHBondContact O-CB 3.24Å; Q98-A102 PolarHBondContact O-N 2.82Å; Q98-A102 VanDerWaalsContact O-N 3.14Å
99	G	89.9	Confident	90.2	Very high	46 Å²	46	83.1 Å²	83.1	47%	0.474	45%	0.449	S	S	.	.	H	α-helix	trans	-69.8	-49	177.3	0	0	0	0	0	111	D97 S101 A102 E103	D97-G99 VanDerWaalsContact C-N 3.31Å; D97-G99 PolarHBondContact O-N 3.04Å; D97-G99 WeakPolarHBondContact OD1-CA 3.22Å; D97-G99 PolarHBondContact OD1-N 2.85Å; G99-S101 PolarHBondContact O-N 3.13Å; G99-A102 PolarHBondContact O-N 3.21Å; G99-E103 WeakPolarHBondContact O-CB 3.45Å; G99-E103 PolarHBondContact O-N 2.95Å
100	L	85.1	Confident	90	Very high	95 Å²	95	83.1 Å²	83.1	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-68.3	-32.4	177.5	-65.6	175.6	0	0	0	112.8	I95 D97 C104	I95-L100 HydrophobicContact CG2-CB 3.75Å; D97-L100 HydrophobicContact CB-CB 4.15Å; D97-L100 HydrophobicContact CB-CD1 4.04Å; D97-L100 HydrophobicContact CB-CG 4.23Å; D97-L100 PolarHBondContact O-N 2.66Å; D97-L100 PolarHBondContact OD1-N 3.36Å; L100-C104 WeakPolarHBondContact O-CB 3.02Å; L100-C104 PolarHBondContact O-N 3.23Å
101	S	91.6	Very high	89.6	Confident	18 Å²	18	82.9 Å²	82.9	13%	0.126	45%	0.452	C	S	.	.	H	α-helix	trans	-65.6	-40.7	173.4	-173.6	0	0	0	0	111.5	C92 D97 G99 K105	C92-S101 WeakPolarHBondContact O-CB 3.5Å; C92-S101 PolarHBondContact O-OG 2.91Å; D97-S101 VanDerWaalsContact O-CB 3.29Å; D97-S101 WeakPolarHBondContact O-CB 3.44Å; D97-S101 PolarHBondContact O-N 3.18Å; G99-S101 PolarHBondContact O-N 3.13Å; S101-K105 WeakPolarHBondContact O-CG 3.2Å; S101-K105 PolarHBondContact O-N 3.49Å; S101-K105 VanDerWaalsContact O-N 3.08Å
102	A	91.4	Very high	89.4	Confident	58 Å²	58	81.5 Å²	81.5	48%	0.479	44%	0.437	S	S	.	.	H	α-helix	trans	-68.5	-44	176	0	0	0	0	0	112.1	Q98 G99 C104 K105 E106	Q98-A102 WeakPolarHBondContact O-CB 3.24Å; Q98-A102 PolarHBondContact O-N 2.82Å; Q98-A102 VanDerWaalsContact O-N 3.14Å; G99-A102 PolarHBondContact O-N 3.21Å; A102-C104 VanDerWaalsContact C-N 3.35Å; A102-C104 PolarHBondContact O-N 3.13Å; A102-K105 PolarHBondContact O-N 3.38Å; A102-E106 PolarHBondContact O-N 2.76Å
103	E	91.5	Very high	89	Confident	111 Å²	111	85.3 Å²	85.3	52%	0.519	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-38.7	176.4	-169.5	175	-172.7	0	0	111.8	G99 E106 M107	G99-E103 WeakPolarHBondContact O-CB 3.45Å; G99-E103 PolarHBondContact O-N 2.95Å; E103-E106 PolarHBondContact O-N 3.48Å; E103-M107 WeakPolarHBondContact O-CB 3.23Å; E103-M107 PolarHBondContact O-N 3.36Å
104	C	91.4	Very high	88.4	Confident	33 Å²	33	84.1 Å²	84.1	22%	0.223	46%	0.458	C	S	.	.	H	α-helix	trans	-60.4	-45	172.6	-179.3	0	0	0	0	111.7	C92 I95 L100 A102 M107 V108	C92-C104 WeakPolarHBondContact CA-SG 3.36Å; C92-C104 HydrophobicContact CB-CB 3.71Å; C92-C104 WeakPolarHBondContact CB-SG 3.49Å; C92-C104 WeakPolarHBondContact SG-CB 3.3Å; C92-C104 PolarHBondContact SG-O 3.26Å; C92-C104 CovalentContact SG-SG 2.05Å; C92-C104 PolarHBondContact SG-SG 3.3Å; I95-C104 HydrophobicContact CD1-CB 3.74Å; L100-C104 WeakPolarHBondContact O-CB 3.02Å; L100-C104 PolarHBondContact O-N 3.23Å; A102-C104 VanDerWaalsContact C-N 3.35Å; A102-C104 PolarHBondContact O-N 3.13Å; C104-M107 WeakPolarHBondContact O-CB 3.14Å; C104-M107 PolarHBondContact O-N 3.27Å; C104-V108 WeakPolarHBondContact O-CG2 3.03Å; C104-V108 PolarHBondContact O-N 3.4Å
105	K	92.1	Very high	87.6	Confident	63 Å²	63	81.4 Å²	81.4	27%	0.274	44%	0.443	S	S	.	.	H	α-helix	trans	-63.7	-45.3	177.3	-77.4	-175.8	170.8	-145.1	0	112.2	C92 H93 S101 A102 M107 V108 D109	C92-K105 HydrophobicContact CB-CG 3.82Å; H93-K105 VanDerWaalsContact CE1-CE 3.43Å; H93-K105 WeakPolarHBondContact CE1-CE 3.43Å; H93-K105 PolarHBondContact CE1-NZ 3.18Å; H93-K105 VanDerWaalsContact NE2-CE 3.3Å; H93-K105 WeakPolarHBondContact NE2-CE 3.47Å; H93-K105 PolarHBondContact NE2-NZ 3.44Å; S101-K105 WeakPolarHBondContact O-CG 3.2Å; S101-K105 PolarHBondContact O-N 3.49Å; S101-K105 VanDerWaalsContact O-N 3.08Å; A102-K105 PolarHBondContact O-N 3.38Å; K105-M107 PolarHBondContact O-N 3.25Å; K105-V108 PolarHBondContact O-N 3.09Å; K105-D109 WeakPolarHBondContact O-CB 3.45Å; K105-D109 VanDerWaalsContact O-CG 3.26Å; K105-D109 PolarHBondContact O-N 3.18Å
106	E	91.9	Very high	87	Confident	143 Å²	143	79.5 Å²	79.5	67%	0.668	43%	0.433	S	S	*	.	H	α-helix	trans	-59.5	-38.6	176	-173	178.4	179.7	0	0	111.5	A102 E103 S110	A102-E106 PolarHBondContact O-N 2.76Å; E103-E106 PolarHBondContact O-N 3.48Å; E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.3Å
107	M	84.5	Confident	86.4	Confident	106 Å²	106	74.9 Å²	74.9	52%	0.522	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-46.7	174.7	-169	179.4	-62.3	0	0	111.8	E103 C104 K105 S110 Y111	E103-M107 WeakPolarHBondContact O-CB 3.23Å; E103-M107 PolarHBondContact O-N 3.36Å; C104-M107 WeakPolarHBondContact O-CB 3.14Å; C104-M107 PolarHBondContact O-N 3.27Å; K105-M107 PolarHBondContact O-N 3.25Å; M107-S110 PolarHBondContact O-N 3.06Å; M107-Y111 HydrophobicContact CB-CD2 4.41Å; M107-Y111 HydrophobicContact CG-CD2 3.49Å; M107-Y111 VanDerWaalsContact CG-CD2 3.49Å; M107-Y111 HydrophobicContact CG-CE2 3.8Å; M107-Y111 WeakPolarHBondContact O-CB 3.38Å; M107-Y111 VanDerWaalsContact O-CD2 3.24Å; M107-Y111 WeakPolarHBondContact O-CD2 3.25Å; M107-Y111 PolarHBondContact O-N 3.21Å
108	V	92.1	Very high	85.1	Confident	22 Å²	22	75.8 Å²	75.8	13%	0.133	41%	0.414	C	S	.	.	H	α-helix	trans	-59.7	-49.8	176.3	170.3	0	0	0	0	110	L85 L88 E89 C104 K105 S110 Y111 Y112	L85-V108 HydrophobicContact CD1-CG1 3.65Å; L88-V108 HydrophobicContact CB-CG1 3.79Å; L88-V108 HydrophobicContact CB-CG2 4.15Å; L88-V108 HydrophobicContact CD1-CG1 4.5Å; E89-V108 HydrophobicContact CG-CG1 4.4Å; C104-V108 WeakPolarHBondContact O-CG2 3.03Å; C104-V108 PolarHBondContact O-N 3.4Å; K105-V108 PolarHBondContact O-N 3.09Å; V108-S110 VanDerWaalsContact C-N 3.32Å; V108-S110 PolarHBondContact O-N 2.99Å; V108-Y111 PolarHBondContact O-N 3.45Å; V108-Y112 WeakPolarHBondContact O-CA 3.36Å; V108-Y112 WeakPolarHBondContact O-CB 3.38Å; V108-Y112 PolarHBondContact O-N 3.01Å
109	D	91	Very high	84.4	Confident	92 Å²	92	71 Å²	71	49%	0.492	39%	0.393	S	S	.	.	H	α-helix	trans	-61.6	-38.8	-179.2	-68.8	-19	0	0	0	112.7	K105 P113	K105-D109 WeakPolarHBondContact O-CB 3.45Å; K105-D109 VanDerWaalsContact O-CG 3.26Å; K105-D109 PolarHBondContact O-N 3.18Å; D109-P113 VanDerWaalsContact O-CD 3.27Å; D109-P113 WeakPolarHBondContact O-CD 3.44Å
110	S	85.4	Confident	83.5	Confident	65 Å²	65	70.7 Å²	70.7	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-75.9	-43.8	-177.8	-175.6	0	0	0	0	112.8	E106 M107 V108 I114	E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.3Å; M107-S110 PolarHBondContact O-N 3.06Å; V108-S110 VanDerWaalsContact C-N 3.32Å; V108-S110 PolarHBondContact O-N 2.99Å; S110-I114 WeakPolarHBondContact O-CD1 3.33Å
111	Y	81.6	Confident	82.9	Confident	130 Å²	130	67.8 Å²	67.8	51%	0.51	38%	0.375	S	S	.	.	H	α-helix	trans	-94.9	-26	-172.4	-68.7	-71.7	0	0	0	113.9	M107 V108 I114 I115	M107-Y111 HydrophobicContact CB-CD2 4.41Å; M107-Y111 HydrophobicContact CG-CD2 3.49Å; M107-Y111 VanDerWaalsContact CG-CD2 3.49Å; M107-Y111 HydrophobicContact CG-CE2 3.8Å; M107-Y111 WeakPolarHBondContact O-CB 3.38Å; M107-Y111 VanDerWaalsContact O-CD2 3.24Å; M107-Y111 WeakPolarHBondContact O-CD2 3.25Å; M107-Y111 PolarHBondContact O-N 3.21Å; V108-Y111 PolarHBondContact O-N 3.45Å; Y111-I114 HydrophobicContact CD1-CD1 4.42Å; Y111-I114 WeakPolarHBondContact O-CB 3.4Å; Y111-I114 PolarHBondContact O-N 2.97Å; Y111-I114 VanDerWaalsContact O-N 3.11Å; Y111-I115 WeakPolarHBondContact O-CB 3.35Å; Y111-I115 VanDerWaalsContact O-CG1 3.3Å; Y111-I115 WeakPolarHBondContact O-CG1 2.94Å; Y111-I115 PolarHBondContact O-N 3.06Å
112	Y	86.6	Confident	81.9	Confident	22 Å²	22	71.3 Å²	71.3	9%	0.086	39%	0.39	C	S	.	.	H	α-helix	trans	-53	-52	180	-178.4	-103.4	0	0	0	114.3	Q81 I84 L85 L88 V108 I114 I115 I116	Q81-Y112 VanDerWaalsContact C-OH 3.3Å; Q81-Y112 VanDerWaalsContact CA-OH 3.3Å; Q81-Y112 WeakPolarHBondContact CA-OH 3.3Å; Q81-Y112 PolarHBondContact O-OH 3.06Å; I84-Y112 HydrophobicContact CB-CE2 4.38Å; I84-Y112 HydrophobicContact CG2-CE2 3.82Å; L85-Y112 HydrophobicContact CB-CD1 4.16Å; L85-Y112 HydrophobicContact CB-CE1 3.72Å; L85-Y112 HydrophobicContact CB-CE2 4.35Å; L85-Y112 HydrophobicContact CD1-CD1 3.77Å; L85-Y112 HydrophobicContact CD1-CD2 4.35Å; L85-Y112 HydrophobicContact CD1-CE1 4.23Å; L85-Y112 HydrophobicContact CD1-CG 3.83Å; L85-Y112 HydrophobicContact CD2-CD1 4.29Å; L85-Y112 HydrophobicContact CD2-CE1 4.32Å; L85-Y112 HydrophobicContact CG-CD1 4.29Å; L85-Y112 HydrophobicContact CG-CE1 4.3Å; L88-Y112 HydrophobicContact CD1-CD2 3.57Å; L88-Y112 HydrophobicContact CD1-CE2 3.88Å; V108-Y112 WeakPolarHBondContact O-CA 3.36Å; V108-Y112 WeakPolarHBondContact O-CB 3.38Å; V108-Y112 PolarHBondContact O-N 3.01Å; Y112-I114 PolarHBondContact O-N 3.43Å; Y112-I115 PolarHBondContact O-N 3.05Å; Y112-I116 HydrophobicContact CD1-CG1 4.45Å; Y112-I116 HydrophobicContact CD2-CG1 4.12Å; Y112-I116 HydrophobicContact CE1-CG1 3.98Å; Y112-I116 HydrophobicContact CE2-CD1 4.04Å; Y112-I116 HydrophobicContact CE2-CG1 3.57Å; Y112-I116 VanDerWaalsContact CZ-CG1 3.5Å; Y112-I116 WeakPolarHBondContact O-CB 3.35Å; Y112-I116 PolarHBondContact O-N 3.02Å
113	P	82.5	Confident	80.9	Confident	80 Å²	80	70 Å²	70	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-30.2	178.8	24.3	-33.6	0	0	0	112.5	D109 G117	D109-P113 VanDerWaalsContact O-CD 3.27Å; D109-P113 WeakPolarHBondContact O-CD 3.44Å; P113-G117 PolarHBondContact O-N 2.56Å
114	I	76.5	Confident	80.1	Confident	91 Å²	91	72.3 Å²	72.3	47%	0.467	39%	0.385	S	S	.	.	H	α-helix	trans	-71.2	-47	177.2	-56.9	174.7	0	0	0	110.1	S110 Y111 Y112 G117 I118	S110-I114 WeakPolarHBondContact O-CD1 3.33Å; Y111-I114 HydrophobicContact CD1-CD1 4.42Å; Y111-I114 WeakPolarHBondContact O-CB 3.4Å; Y111-I114 PolarHBondContact O-N 2.97Å; Y111-I114 VanDerWaalsContact O-N 3.11Å; Y112-I114 PolarHBondContact O-N 3.43Å; I114-G117 PolarHBondContact O-N 2.89Å; I114-I118 HydrophobicContact CG2-CD1 4.04Å; I114-I118 VanDerWaalsContact O-CG1 3.3Å; I114-I118 WeakPolarHBondContact O-CG1 3.48Å; I114-I118 PolarHBondContact O-N 3.18Å
115	I	75.1	Confident	79.5	Confident	88 Å²	88	74.4 Å²	74.4	45%	0.451	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-47.5	-179.3	-69.7	167.1	0	0	0	110.4	Y111 Y112 G117 I118 I119	Y111-I115 WeakPolarHBondContact O-CB 3.35Å; Y111-I115 VanDerWaalsContact O-CG1 3.3Å; Y111-I115 WeakPolarHBondContact O-CG1 2.94Å; Y111-I115 PolarHBondContact O-N 3.06Å; Y112-I115 PolarHBondContact O-N 3.05Å; I115-G117 VanDerWaalsContact C-N 3.31Å; I115-G117 PolarHBondContact O-N 3.21Å; I115-I118 PolarHBondContact O-N 3.32Å; I115-I119 HydrophobicContact CG2-CD1 3.72Å; I115-I119 HydrophobicContact CG2-CG1 4.48Å; I115-I119 VanDerWaalsContact O-CG1 3.26Å; I115-I119 WeakPolarHBondContact O-CG1 3.17Å; I115-I119 PolarHBondContact O-N 3.37Å
116	I	78.8	Confident	79.1	Confident	15 Å²	15	72.4 Å²	72.4	8%	0.077	39%	0.388	C	S	.	.	H	α-helix	trans	-62.2	-41.7	175.4	-72.1	-61.7	0	0	0	110.6	Q81 Y112 I118 I119 T120	Q81-I116 HydrophobicContact CG-CG2 4.29Å; Q81-I116 VanDerWaalsContact NE2-CG2 3.28Å; Y112-I116 HydrophobicContact CD1-CG1 4.45Å; Y112-I116 HydrophobicContact CD2-CG1 4.12Å; Y112-I116 HydrophobicContact CE1-CG1 3.98Å; Y112-I116 HydrophobicContact CE2-CD1 4.04Å; Y112-I116 HydrophobicContact CE2-CG1 3.57Å; Y112-I116 VanDerWaalsContact CZ-CG1 3.5Å; Y112-I116 WeakPolarHBondContact O-CB 3.35Å; Y112-I116 PolarHBondContact O-N 3.02Å; I116-I118 VanDerWaalsContact C-N 3.35Å; I116-I118 PolarHBondContact O-N 3.03Å; I116-I119 PolarHBondContact O-N 2.02Å; I116-T120 HydrophobicContact CG2-CG2 4.2Å; I116-T120 WeakPolarHBondContact O-CB 3.4Å; I116-T120 WeakPolarHBondContact O-CG2 3.32Å; I116-T120 PolarHBondContact O-N 3.36Å; I116-T120 PolarHBondContact O-OG1 2.84Å
117	G	74.3	Confident	78.7	Confident	37 Å²	37	65.9 Å²	65.9	38%	0.381	36%	0.359	S	S	.	.	H	α-helix	trans	-56.3	-46	174.5	0	0	0	0	0	113	P113 I114 I115 T120 G121	P113-G117 PolarHBondContact O-N 2.56Å; I114-G117 PolarHBondContact O-N 2.89Å; I115-G117 VanDerWaalsContact C-N 3.31Å; I115-G117 PolarHBondContact O-N 3.21Å; G117-T120 WeakPolarHBondContact CA-OG1 3.43Å; G117-T120 PolarHBondContact O-N 2.92Å; G117-T120 PolarHBondContact O-OG1 2.89Å; G117-G121 PolarHBondContact O-N 3.17Å
118	I	67.4	Low	78.7	Confident	104 Å²	104	61.6 Å²	61.6	53%	0.533	34%	0.339	S	S	.	.	H	α-helix	trans	-63	-47.6	176	-67.9	164	0	0	0	110.8	I114 I115 I116 T120 G121 E122	I114-I118 HydrophobicContact CG2-CD1 4.04Å; I114-I118 VanDerWaalsContact O-CG1 3.3Å; I114-I118 WeakPolarHBondContact O-CG1 3.48Å; I114-I118 PolarHBondContact O-N 3.18Å; I115-I118 PolarHBondContact O-N 3.32Å; I116-I118 VanDerWaalsContact C-N 3.35Å; I116-I118 PolarHBondContact O-N 3.03Å; I118-T120 PolarHBondContact O-N 3.44Å; I118-G121 PolarHBondContact O-N 3.44Å; I118-E122 WeakPolarHBondContact O-CG 3.26Å; I118-E122 PolarHBondContact O-N 3.49Å
119	I	71.9	Confident	78.4	Confident	73 Å²	73	61.4 Å²	61.4	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-61.1	-46.2	179.6	-68.2	166.3	0	0	0	110.4	L75 I115 I116 G121 E122 L123	L75-I119 HydrophobicContact CD1-CG2 3.87Å; I115-I119 HydrophobicContact CG2-CD1 3.72Å; I115-I119 HydrophobicContact CG2-CG1 4.48Å; I115-I119 VanDerWaalsContact O-CG1 3.26Å; I115-I119 WeakPolarHBondContact O-CG1 3.17Å; I115-I119 PolarHBondContact O-N 3.37Å; I116-I119 PolarHBondContact O-N 2.02Å; I119-G121 VanDerWaalsContact C-N 3.34Å; I119-G121 PolarHBondContact O-N 3.04Å; I119-E122 PolarHBondContact O-N 3.27Å; I119-L123 HydrophobicContact CG2-CD1 3.86Å; I119-L123 WeakPolarHBondContact O-CB 3.49Å; I119-L123 WeakPolarHBondContact O-CD1 3.43Å; I119-L123 WeakPolarHBondContact O-CG 3.28Å; I119-L123 PolarHBondContact O-N 3.41Å
120	T	71.6	Confident	78.2	Confident	38 Å²	38	57 Å²	57	23%	0.233	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-35.9	178.4	52.1	0	0	0	0	112.4	I116 G117 I118 L123 E124	I116-T120 HydrophobicContact CG2-CG2 4.2Å; I116-T120 WeakPolarHBondContact O-CB 3.4Å; I116-T120 WeakPolarHBondContact O-CG2 3.32Å; I116-T120 PolarHBondContact O-N 3.36Å; I116-T120 PolarHBondContact O-OG1 2.84Å; G117-T120 WeakPolarHBondContact CA-OG1 3.43Å; G117-T120 PolarHBondContact O-N 2.92Å; G117-T120 PolarHBondContact O-OG1 2.89Å; I118-T120 PolarHBondContact O-N 3.44Å; T120-L123 PolarHBondContact O-N 2.97Å; T120-E124 WeakPolarHBondContact O-CG 3.2Å; T120-E124 PolarHBondContact O-N 3.37Å
121	G	72.6	Confident	78.2	Confident	35 Å²	35	54 Å²	54	36%	0.361	30%	0.295	S	S	.	.	H	α-helix	trans	-67.1	-39.7	177.9	0	0	0	0	0	112.8	G117 I118 I119 L123 E124	G117-G121 PolarHBondContact O-N 3.17Å; I118-G121 PolarHBondContact O-N 3.44Å; I119-G121 VanDerWaalsContact C-N 3.34Å; I119-G121 PolarHBondContact O-N 3.04Å; G121-L123 VanDerWaalsContact C-N 3.26Å; G121-L123 PolarHBondContact O-N 2.92Å; G121-E124 PolarHBondContact O-N 3.11Å
122	E	69.9	Low	78.3	Confident	92 Å²	92	48.4 Å²	48.4	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-74.9	-15.9	175.7	-66	-66.2	155	0	0	112.9	Q47 I118 I119	Q47-E122 PolarHBondContact NE2-OE1 3.41Å; Q47-E122 VanDerWaalsContact NE2-OE1 3.11Å; Q47-E122 PolarHBondContact NE2-OE2 3.41Å; I118-E122 WeakPolarHBondContact O-CG 3.26Å; I118-E122 PolarHBondContact O-N 3.49Å; I119-E122 PolarHBondContact O-N 3.27Å
123	L	70.9	Confident	78.1	Confident	31 Å²	31	52 Å²	52	16%	0.162	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.5	174	-69.6	170.3	0	0	0	113.6	L68 V71 L75 I119 T120 G121 D125	L68-L123 HydrophobicContact CB-CD2 4.21Å; L68-L123 HydrophobicContact CD1-CD2 4.38Å; L68-L123 HydrophobicContact CD2-CD2 3.78Å; L68-L123 HydrophobicContact CG-CD2 4.35Å; V71-L123 HydrophobicContact CG1-CD1 4.33Å; L75-L123 HydrophobicContact CD1-CD1 3.59Å; I119-L123 HydrophobicContact CG2-CD1 3.86Å; I119-L123 WeakPolarHBondContact O-CB 3.49Å; I119-L123 WeakPolarHBondContact O-CD1 3.43Å; I119-L123 WeakPolarHBondContact O-CG 3.28Å; I119-L123 PolarHBondContact O-N 3.41Å; T120-L123 PolarHBondContact O-N 2.97Å; G121-L123 VanDerWaalsContact C-N 3.26Å; G121-L123 PolarHBondContact O-N 2.92Å; L123-D125 VanDerWaalsContact C-N 3.33Å
124	E	73.8	Confident	78	Confident	158 Å²	158	49.7 Å²	49.7	74%	0.738	29%	0.285	S	S	*	.	S	Bend	trans	-67.4	-34.1	177.3	-69.1	-172.3	163.8	0	0	112.5	T120 G121	T120-E124 WeakPolarHBondContact O-CG 3.2Å; T120-E124 PolarHBondContact O-N 3.37Å; G121-E124 PolarHBondContact O-N 3.11Å
125	D	79.9	Confident	78.4	Confident	77 Å²	77	48.8 Å²	48.8	41%	0.412	28%	0.281	S	S	.	.			trans	-117.1	91.8	170.4	-171	-15.6	0	0	0	109.8	L123 G127 V128	L123-D125 VanDerWaalsContact C-N 3.33Å; D125-G127 PolarHBondContact O-N 3.1Å; D125-G127 VanDerWaalsContact O-N 3.07Å; D125-G127 WeakPolarHBondContact OD1-CA 3.33Å; D125-G127 PolarHBondContact OD1-N 3.13Å; D125-V128 HydrophobicContact CB-CB 4.44Å; D125-V128 HydrophobicContact CB-CG2 4Å; D125-V128 PolarHBondContact O-N 3.07Å
126	P	82.7	Confident	78.9	Confident	22 Å²	22	44.8 Å²	44.8	14%	0.143	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-19.8	179.5	25.6	-34.1	0	0	0	112.2	K65 L68 M69 C130	K65-P126 HydrophobicContact CB-CB 4.27Å; K65-P126 HydrophobicContact CB-CG 4.44Å; K65-P126 HydrophobicContact CG-CB 4.21Å; K65-P126 HydrophobicContact CG-CG 4.42Å; L68-P126 HydrophobicContact CB-CB 3.84Å; L68-P126 HydrophobicContact CD1-CB 4.13Å; M69-P126 HydrophobicContact CG-CG 4.16Å; P126-C130 WeakPolarHBondContact O-CB 3.42Å; P126-C130 PolarHBondContact O-N 3.18Å; P126-C130 PolarHBondContact O-SG 3.48Å
127	G	83.6	Confident	79.1	Confident	6 Å²	6	47.5 Å²	47.5	6%	0.062	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-38	174.4	0	0	0	0	0	112.9	D125 G131	D125-G127 PolarHBondContact O-N 3.1Å; D125-G127 VanDerWaalsContact O-N 3.07Å; D125-G127 WeakPolarHBondContact OD1-CA 3.33Å; D125-G127 PolarHBondContact OD1-N 3.13Å; G127-G131 PolarHBondContact O-N 3.24Å
128	V	84.7	Confident	79.4	Confident	15 Å²	15	46.4 Å²	46.4	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-67.5	-48.6	177.5	175.3	0	0	0	0	110.4	Q47 W51 N52 D125 G131 A132	Q47-V128 HydrophobicContact CG-CG1 3.77Å; W51-V128 HydrophobicContact CB-CG1 4.18Å; N52-V128 HydrophobicContact CB-CG2 3.83Å; D125-V128 HydrophobicContact CB-CB 4.44Å; D125-V128 HydrophobicContact CB-CG2 4Å; D125-V128 PolarHBondContact O-N 3.07Å; V128-G131 PolarHBondContact O-N 3.44Å; V128-A132 WeakPolarHBondContact O-CB 3.4Å; V128-A132 PolarHBondContact O-N 2.72Å
129	A	85	Confident	79.6	Confident	19 Å²	19	45.8 Å²	45.8	16%	0.157	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-44.1	178.6	0	0	0	0	0	112	L68 G131 A132 M133	L68-A129 HydrophobicContact CD1-CB 3.47Å; L68-A129 VanDerWaalsContact CD1-CB 3.47Å; A129-G131 VanDerWaalsContact C-N 3.34Å; A129-G131 PolarHBondContact O-N 3.28Å; A129-A132 WeakPolarHBondContact O-CB 3.5Å; A129-A132 PolarHBondContact O-N 3.38Å; A129-M133 HydrophobicContact CB-CE 4.23Å; A129-M133 WeakPolarHBondContact O-CE 3.49Å; A129-M133 WeakPolarHBondContact O-CG 3.41Å; A129-M133 PolarHBondContact O-N 3.42Å
130	C	86.8	Confident	79.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-32.5	175.6	-67.2	0	0	0	0	113.2	C64 K65 L68 P126 M133 G134 L135 C136	C64-C130 HydrophobicContact CB-CB 3.88Å; C64-C130 WeakPolarHBondContact CB-SG 3.18Å; C64-C130 WeakPolarHBondContact SG-CA 3.46Å; C64-C130 WeakPolarHBondContact SG-CB 3.46Å; C64-C130 CovalentContact SG-SG 2.03Å; C64-C130 PolarHBondContact SG-SG 3.45Å; K65-C130 PolarHBondContact N-SG 3.44Å; K65-C130 VanDerWaalsContact N-SG 3.41Å; L68-C130 VanDerWaalsContact CD1-SG 3.51Å; P126-C130 WeakPolarHBondContact O-CB 3.42Å; P126-C130 PolarHBondContact O-N 3.18Å; P126-C130 PolarHBondContact O-SG 3.48Å; C130-M133 PolarHBondContact O-N 3.08Å; C130-G134 PolarHBondContact O-N 2.99Å; C130-L135 PolarHBondContact O-N 3.47Å; C130-C136 HydrophobicContact CB-CB 4.13Å; C130-C136 WeakPolarHBondContact CB-SG 2.91Å; C130-C136 PolarHBondContact O-N 2.79Å; C130-C136 VanDerWaalsContact O-N 3.08Å
131	G	86.2	Confident	78.9	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-42.2	170.2	0	0	0	0	0	111.9	W51 G127 V128 A129 M133 G134	W51-G131 PolarHBondContact NE1-O 3.2Å; G127-G131 PolarHBondContact O-N 3.24Å; V128-G131 PolarHBondContact O-N 3.44Å; A129-G131 VanDerWaalsContact C-N 3.34Å; A129-G131 PolarHBondContact O-N 3.28Å; G131-M133 VanDerWaalsContact C-N 3.26Å; G131-M133 PolarHBondContact O-N 3.36Å; G131-G134 WeakPolarHBondContact O-CA 3.41Å; G131-G134 PolarHBondContact O-N 2.89Å
132	A	83.4	Confident	78.5	Confident	12 Å²	12	48.8 Å²	48.8	10%	0.099	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-31.5	176	0	0	0	0	0	112.5	N33 V34 W51 V128 A129 G134	N33-A132 CarbonylContact C-O 3.6Å; N33-A132 WeakPolarHBondContact CA-O 3.35Å; N33-A132 WeakPolarHBondContact CB-O 3.12Å; V34-A132 HydrophobicContact CG2-CB 3.52Å; V34-A132 WeakPolarHBondContact CG2-O 3.07Å; V34-A132 PolarHBondContact N-O 2.05Å; W51-A132 HydrophobicContact CD2-CB 3.83Å; W51-A132 HydrophobicContact CE3-CB 3.51Å; W51-A132 HydrophobicContact CH2-CB 3.97Å; W51-A132 HydrophobicContact CZ2-CB 4.26Å; W51-A132 HydrophobicContact CZ3-CB 3.58Å; V128-A132 WeakPolarHBondContact O-CB 3.4Å; V128-A132 PolarHBondContact O-N 2.72Å; A129-A132 WeakPolarHBondContact O-CB 3.5Å; A129-A132 PolarHBondContact O-N 3.38Å; A132-G134 VanDerWaalsContact C-N 3.26Å; A132-G134 PolarHBondContact O-N 3.27Å
133	M	82.2	Confident	78	Confident	98 Å²	98	49 Å²	49	48%	0.483	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.7	172.1	-70.5	-176.1	-89.2	0	0	113.7	L68 A129 C130 G131 L135	L68-M133 HydrophobicContact CD1-CE 3.7Å; L68-M133 HydrophobicContact CD2-CE 4.23Å; L68-M133 HydrophobicContact CG-CE 4.28Å; A129-M133 HydrophobicContact CB-CE 4.23Å; A129-M133 WeakPolarHBondContact O-CE 3.49Å; A129-M133 WeakPolarHBondContact O-CG 3.41Å; A129-M133 PolarHBondContact O-N 3.42Å; C130-M133 PolarHBondContact O-N 3.08Å; G131-M133 VanDerWaalsContact C-N 3.26Å; G131-M133 PolarHBondContact O-N 3.36Å; M133-L135 HydrophobicContact CB-CD1 4.03Å; M133-L135 HydrophobicContact CB-CG 4.11Å; M133-L135 PolarHBondContact O-N 3.33Å
134	G	80.6	Confident	77.3	Confident	31 Å²	31	50.5 Å²	50.5	32%	0.32	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	11.2	-177.2	0	0	0	0	0	114.2	Q32 C130 G131 A132	Q32-G134 WeakPolarHBondContact O-CA 3.43Å; C130-G134 PolarHBondContact O-N 2.99Å; G131-G134 WeakPolarHBondContact O-CA 3.41Å; G131-G134 PolarHBondContact O-N 2.89Å; A132-G134 VanDerWaalsContact C-N 3.26Å; A132-G134 PolarHBondContact O-N 3.27Å
135	L	84.9	Confident	76.4	Confident	73 Å²	73	50 Å²	50	38%	0.382	27%	0.272	S	S	.	.	S	Bend	trans	-87	-26.8	-180	-63.3	172.5	0	0	0	111.7	C61 C64 C130 M133	C61-L135 WeakPolarHBondContact CA-O 3.48Å; C61-L135 WeakPolarHBondContact CB-O 3.46Å; C61-L135 PolarHBondContact N-O 3.49Å; C64-L135 HydrophobicContact CB-CB 4.12Å; C64-L135 HydrophobicContact CB-CD1 3.8Å; C130-L135 PolarHBondContact O-N 3.47Å; M133-L135 HydrophobicContact CB-CD1 4.03Å; M133-L135 HydrophobicContact CB-CG 4.11Å; M133-L135 PolarHBondContact O-N 3.33Å
136	C	86	Confident	75	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.027	29%	0.285	C	S	.	.	S	Bend	trans	-108.8	133.8	170.6	-68.1	0	0	0	0	111.3	Q55 C61 C130	Q55-C136 HydrophobicContact CB-CB 4.06Å; Q55-C136 HydrophobicContact CG-CB 3.85Å; Q55-C136 VanDerWaalsContact OE1-C 3.27Å; Q55-C136 PolarHBondContact OE1-O 3.23Å; C61-C136 WeakPolarHBondContact CA-SG 3.47Å; C61-C136 HydrophobicContact CB-CB 3.98Å; C61-C136 WeakPolarHBondContact CB-SG 3.27Å; C61-C136 WeakPolarHBondContact SG-CB 3.47Å; C61-C136 CovalentContact SG-SG 2.03Å; C61-C136 PolarHBondContact SG-SG 3.41Å; C130-C136 HydrophobicContact CB-CB 4.13Å; C130-C136 WeakPolarHBondContact CB-SG 2.91Å; C130-C136 PolarHBondContact O-N 2.79Å; C130-C136 VanDerWaalsContact O-N 3.08Å
137	N	83.2	Confident	73	Confident	71 Å²	71	61 Å²	61	38%	0.38	32%	0.317	S	S	.	.			trans	-113.1	140.8	173	-70.9	-65.3	0	0	0	110.5	Q55 M56	Q55-N137 WeakPolarHBondContact CA-O 3.45Å; Q55-N137 PolarHBondContact OE1-O 3.27Å; M56-N137 PolarHBondContact N-O 3.28Å
138	S	79.9	Confident	71	Confident	14 Å²	14	65.7 Å²	65.7	10%	0.098	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-65.1	141.5	-180	77.8	0	0	0	0	110.4	Q140 M141 S142	S138-Q140 VanDerWaalsContact C-N 3.26Å; S138-Q140 PolarHBondContact O-N 2.92Å; S138-M141 PolarHBondContact O-N 2.87Å; S138-M141 WeakPolarHBondContact OG-CB 3.48Å; S138-M141 PolarHBondContact OG-N 3.33Å; S138-S142 PolarHBondContact O-N 2.83Å; S138-S142 PolarHBondContact O-OG 3.32Å
139	M	71.7	Confident	68.5	Low	92 Å²	92	72.6 Å²	72.6	45%	0.453	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-38.3	-179.1	-173.6	168.9	164.9	0	0	111.2	P54 M56 S142 L143	P54-M139 WeakPolarHBondContact O-CB 3.35Å; P54-M139 PolarHBondContact O-N 3.5Å; M56-M139 HydrophobicContact SD-CB 4.39Å; M56-M139 HydrophobicContact SD-CG 3.97Å; M139-S142 PolarHBondContact O-N 3.17Å; M139-L143 HydrophobicContact CE-CD1 4.38Å; M139-L143 HydrophobicContact CG-CD1 4.07Å; M139-L143 WeakPolarHBondContact O-CB 3.5Å; M139-L143 VanDerWaalsContact O-CG 3.25Å; M139-L143 WeakPolarHBondContact O-CG 3.35Å; M139-L143 PolarHBondContact O-N 3.35Å
140	Q	66.8	Low	66.2	Low	137 Å²	137	80.3 Å²	80.3	64%	0.64	41%	0.411	S	S	*	.	H	α-helix	trans	-62.7	-43.9	174.5	-77.8	165.7	-24.5	0	0	112.8	S138 S142 L143 A144	S138-Q140 VanDerWaalsContact C-N 3.26Å; S138-Q140 PolarHBondContact O-N 2.92Å; Q140-S142 VanDerWaalsContact C-N 3.27Å; Q140-S142 PolarHBondContact O-N 3.33Å; Q140-L143 PolarHBondContact O-N 2.99Å; Q140-A144 WeakPolarHBondContact O-CB 3.47Å; Q140-A144 PolarHBondContact O-N 3.42Å
141	M	63.3	Low	63.5	Low	57 Å²	57	89.5 Å²	89.5	28%	0.281	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-34.5	177.5	-172.5	69.2	-165.5	0	0	111.7	P28 S138 R145	P28-M141 HydrophobicContact CB-CE 3.61Å; P28-M141 HydrophobicContact CG-CE 3.75Å; P28-M141 HydrophobicContact CG-SD 4.42Å; S138-M141 PolarHBondContact O-N 2.87Å; S138-M141 WeakPolarHBondContact OG-CB 3.48Å; S138-M141 PolarHBondContact OG-N 3.33Å; M141-R145 WeakPolarHBondContact O-CG 3.28Å; M141-R145 PolarHBondContact O-N 2.95Å
142	S	63.3	Low	61.1	Low	15 Å²	15	97.4 Å²	97.4	11%	0.105	50%	0.495	C	S	.	.	H	α-helix	trans	-72.4	-44.9	178.9	-55.4	0	0	0	0	111.2	M56 S138 M139 Q140 A144 R145 F146	M56-S142 VanDerWaalsContact CG-OG 3.32Å; M56-S142 WeakPolarHBondContact CG-OG 3.27Å; S138-S142 PolarHBondContact O-N 2.83Å; S138-S142 PolarHBondContact O-OG 3.32Å; M139-S142 PolarHBondContact O-N 3.17Å; Q140-S142 VanDerWaalsContact C-N 3.27Å; Q140-S142 PolarHBondContact O-N 3.33Å; S142-A144 VanDerWaalsContact C-N 3.35Å; S142-A144 PolarHBondContact O-N 3.12Å; S142-R145 WeakPolarHBondContact O-CB 3.46Å; S142-R145 PolarHBondContact O-N 2.97Å; S142-R145 VanDerWaalsContact O-N 3.11Å; S142-F146 WeakPolarHBondContact O-CD2 3.27Å
143	L	58.8	Low	58.8	Low	96 Å²	96	105 Å²	105	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-60.8	-41.1	175.7	-71.2	167.5	0	0	0	112.3	M139 Q140 R145 F146	M139-L143 HydrophobicContact CE-CD1 4.38Å; M139-L143 HydrophobicContact CG-CD1 4.07Å; M139-L143 WeakPolarHBondContact O-CB 3.5Å; M139-L143 VanDerWaalsContact O-CG 3.25Å; M139-L143 WeakPolarHBondContact O-CG 3.35Å; M139-L143 PolarHBondContact O-N 3.35Å; Q140-L143 PolarHBondContact O-N 2.99Å; L143-R145 PolarHBondContact O-N 3.39Å; L143-F146 PolarHBondContact O-N 3.5Å; L143-F146 VanDerWaalsContact O-N 3.07Å
144	A	56.5	Low	56.6	Low	62 Å²	62	104.4 Å²	104.4	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-20.1	176.3	0	0	0	0	0	113.9	Q140 S142	Q140-A144 WeakPolarHBondContact O-CB 3.47Å; Q140-A144 PolarHBondContact O-N 3.42Å; S142-A144 VanDerWaalsContact C-N 3.35Å; S142-A144 PolarHBondContact O-N 3.12Å
145	R	55.9	Low	54.6	Low	147 Å²	147	111.5 Å²	111.5	56%	0.555	56%	0.561	S	S	*	*	H	α-helix	trans	-83	-21.3	174.4	-72.8	178.5	-178.6	167.1	2.6	113.3	M141 S142 L143 P148	M141-R145 WeakPolarHBondContact O-CG 3.28Å; M141-R145 PolarHBondContact O-N 2.95Å; S142-R145 WeakPolarHBondContact O-CB 3.46Å; S142-R145 PolarHBondContact O-N 2.97Å; S142-R145 VanDerWaalsContact O-N 3.11Å; L143-R145 PolarHBondContact O-N 3.39Å; R145-P148 VanDerWaalsContact O-CD 3.31Å; R145-P148 WeakPolarHBondContact O-CD 3.02Å
146	F	49.3	Very low	52.4	Low	156 Å²	156	115.6 Å²	115.6	68%	0.684	58%	0.578	S	S	*	*	H	α-helix	trans	-85.5	-24.4	-178.1	-76.6	-73	0	0	0	113.6	S142 L143 P148	S142-F146 WeakPolarHBondContact O-CD2 3.27Å; L143-F146 PolarHBondContact O-N 3.5Å; L143-F146 VanDerWaalsContact O-N 3.07Å; F146-P148 VanDerWaalsContact C-CD 3.47Å
147	E	42.1	Very low	49.8	Very low	175 Å²	175	123 Å²	123	82%	0.818	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-19.2	-178	-74.8	-174.3	141.5	0	0	117.4
148	P	39.7	Very low	47.5	Very low	105 Å²	105	124.4 Å²	124.4	68%	0.682	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-5.4	-175.4	-9.1	27.6	0	0	0	118	R145 F146	R145-P148 VanDerWaalsContact O-CD 3.31Å; R145-P148 WeakPolarHBondContact O-CD 3.02Å; F146-P148 VanDerWaalsContact C-CD 3.47Å
149	Q	34.1	Very low	45.5	Very low	159 Å²	159	133.1 Å²	133.1	74%	0.743	67%	0.668	S	S	*	*	S	Bend	trans	-121.1	-17.9	-156.9	-117.4	178.5	-2	0	0	120.3
150	E	35.8	Very low	44	Very low	182 Å²	182	133.7 Å²	133.7	85%	0.85	68%	0.677	S	S	*	*	S	Bend	trans	-99.7	-21.4	-171.9	-80.3	-79.7	134.6	0	0	115.7
151	E	29.6	Very low	42.4	Very low	192 Å²	192	133.2 Å²	133.2	90%	0.897	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	1	-167.1	-71.3	-162.9	155.1	0	0	117.7
152	L	35.9	Very low	41.2	Very low	168 Å²	168	138.3 Å²	138.3	88%	0.88	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	19.9	-171.5	-79.4	167.5	0	0	0	117
153	K	36.3	Very low	40.2	Very low	172 Å²	172	141.8 Å²	141.8	75%	0.748	74%	0.736	S	S	*	*	S	Bend	trans	-120.8	7.4	-178.1	-71.5	-166.8	179.7	178.2	0	118.2
154	S	36	Very low	39.3	Very low	84 Å²	84	145.4 Å²	145.4	59%	0.587	75%	0.75	S	S	*	*			trans	-149.1	133.3	167.4	-166.3	0	0	0	0	112.6	E156	S154-E156 VanDerWaalsContact C-N 3.25Å; S154-E156 PolarHBondContact OG-N 2.84Å
155	N	37.2	Very low	38.2	Very low	180 Å²	180	154.3 Å²	154.3	96%	0.963	77%	0.77	S	S	*	*			trans	-90.4	19.5	167.1	-85.5	-18.1	0	0	0	111.7
156	E	38.6	Very low	37.2	Very low	159 Å²	159	153.9 Å²	153.9	74%	0.743	78%	0.784	S	S	*	*			trans	-97.5	127.5	168.7	-83.4	177.1	145.2	0	0	110.4	S154 P158	S154-E156 VanDerWaalsContact C-N 3.25Å; S154-E156 PolarHBondContact OG-N 2.84Å; E156-P158 VanDerWaalsContact O-CD 3.23Å; E156-P158 WeakPolarHBondContact O-CD 3.22Å
157	I	33	Very low	36.4	Very low	161 Å²	161	149.6 Å²	149.6	83%	0.826	78%	0.777	S	S	*	*			trans	-71.5	114.9	165.6	-59	169.9	0	0	0	106.2	E159	I157-E159 PolarHBondContact O-N 2.87Å
158	P	33.9	Very low	36	Very low	99 Å²	99	146.4 Å²	146.4	64%	0.643	77%	0.772	S	S	*	*			trans	-72.1	123.3	172.3	-9.8	27.3	0	0	0	108.2	E156 V160	E156-P158 VanDerWaalsContact O-CD 3.23Å; E156-P158 WeakPolarHBondContact O-CD 3.22Å; P158-V160 HydrophobicContact CB-CG2 3.98Å; P158-V160 PolarHBondContact O-N 3.43Å
159	E	37.7	Very low	35.7	Very low	198 Å²	198	150.1 Å²	150.1	93%	0.925	78%	0.778	S	S	*	*			trans	-68.6	98.2	163.9	-77	-169.8	162.7	0	0	108	I157	I157-E159 PolarHBondContact O-N 2.87Å
160	V	40	Very low	35.8	Very low	104 Å²	104	150.1 Å²	150.1	63%	0.63	78%	0.782	S	S	*	*			trans	-104.2	117	172.3	-170.9	0	0	0	0	108.2	P158 L162	P158-V160 HydrophobicContact CB-CG2 3.98Å; P158-V160 PolarHBondContact O-N 3.43Å; V160-L162 PolarHBondContact O-N 3.39Å
161	D	32.8	Very low	35.8	Very low	126 Å²	126	149.2 Å²	149.2	67%	0.674	78%	0.782	S	S	*	*			trans	-67.4	108.1	168	-173.7	-2.3	0	0	0	109.4	A163	D161-A163 PolarHBondContact O-N 2.05Å; D161-A163 WeakPolarHBondContact OD1-CB 3.41Å; D161-A163 PolarHBondContact OD1-N 3.42Å
162	L	38.2	Very low	36.4	Very low	164 Å²	164	147 Å²	147	86%	0.859	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	6.5	-176	-87.8	135.3	0	0	0	113.7	V160	V160-L162 PolarHBondContact O-N 3.39Å
163	A	42.3	Very low	36.4	Very low	88 Å²	88	144.4 Å²	144.4	73%	0.727	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-11.6	-179	0	0	0	0	0	114.9	D161	D161-A163 PolarHBondContact O-N 2.05Å; D161-A163 WeakPolarHBondContact OD1-CB 3.41Å; D161-A163 PolarHBondContact OD1-N 3.42Å
164	Q	40.3	Very low	36.2	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	77%	0.766	S	S	*	*	S	Bend	trans	-122.8	11.1	-162.7	-131	167.4	5.6	0	0	117.9
165	R	33.6	Very low	36.2	Very low	248 Å²	248	144 Å²	144	94%	0.936	77%	0.773	S	S	*	*			trans	-109.7	98.6	168.1	-76.9	-169.6	178.9	-173.7	0.9	111.9	A167	R165-A167 PolarHBondContact O-N 2.98Å
166	V	34.3	Very low	36.3	Very low	138 Å²	138	143 Å²	143	84%	0.836	77%	0.766	S	S	*	*			trans	-75.9	109.2	160.1	-175.1	0	0	0	0	107.3
167	A	32.4	Very low	36.2	Very low	66 Å²	66	143.1 Å²	143.1	55%	0.545	77%	0.771	S	S	.	*			trans	-71.9	128.3	169.8	0	0	0	0	0	109.6	R165 F169	R165-A167 PolarHBondContact O-N 2.98Å; A167-F169 PolarHBondContact O-N 3.19Å; A167-F169 VanDerWaalsContact O-N 3.15Å
168	P	35.2	Very low	36.2	Very low	108 Å²	108	144.6 Å²	144.6	70%	0.701	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	3.5	-178.2	-15.9	29.5	0	0	0	116.1
169	F	33.3	Very low	36	Very low	184 Å²	184	145.6 Å²	145.6	81%	0.807	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	38.8	-169.6	-63.4	-69.5	0	0	0	115.9	A167	A167-F169 PolarHBondContact O-N 3.19Å; A167-F169 VanDerWaalsContact O-N 3.15Å
170	L	35.8	Very low	35.9	Very low	158 Å²	158	144.6 Å²	144.6	83%	0.827	77%	0.77	S	S	*	*			trans	-117.8	42.5	165.4	-74	178.9	0	0	0	113
171	L	35.6	Very low	35.6	Very low	164 Å²	164	147.3 Å²	147.3	86%	0.859	78%	0.781	S	S	*	*	S	Bend	trans	-120.9	104	166.8	-82	157.5	0	0	0	109.8
172	N	42.4	Very low	35.5	Very low	144 Å²	144	147.9 Å²	147.9	77%	0.77	79%	0.789	S	S	*	*	S	Bend	trans	72.7	83.4	166.5	-67.7	-17.1	0	0	0	119.4
173	V	35.6	Very low	35.7	Very low	115 Å²	115	143 Å²	143	70%	0.697	78%	0.778	S	S	*	*			trans	-149.5	87.7	135.7	-170.2	0	0	0	0	110.5	D175 L176	V173-D175 PolarHBondContact O-N 3.25Å; V173-L176 HydrophobicContact CG1-CD1 4.49Å
174	P	33.1	Very low	34.8	Very low	111 Å²	111	149.8 Å²	149.8	72%	0.721	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	88.9	166.5	31.5	-24	0	0	0	108.5
175	D	34.5	Very low	34.5	Very low	137 Å²	137	147 Å²	147	73%	0.733	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.2	-5	158.4	-96.8	-26.3	0	0	0	115.8	V173 L177	V173-D175 PolarHBondContact O-N 3.25Å; D175-L177 VanDerWaalsContact C-N 3.34Å; D175-L177 PolarHBondContact O-N 2.89Å
176	L	39.4	Very low	34.5	Very low	157 Å²	157	139.7 Å²	139.7	82%	0.822	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	0.7	178.7	-76.6	170.6	0	0	0	115.2	V173	V173-L176 HydrophobicContact CG1-CD1 4.49Å
177	L	37	Very low	34.4	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-6.5	178.3	-71	169.4	0	0	0	114	D175	D175-L177 VanDerWaalsContact C-N 3.34Å; D175-L177 PolarHBondContact O-N 2.89Å
178	Y	33.3	Very low	34.4	Very low	193 Å²	193	145.9 Å²	145.9	76%	0.757	79%	0.792	S	S	*	*			trans	-151.7	105.1	172.4	-83	-84	0	0	0	111.9	Q180	Y178-Q180 PolarHBondContact O-N 2.73Å
179	P	30.3	Very low	34.7	Very low	120 Å²	120	150.3 Å²	150.3	78%	0.779	80%	0.803	S	S	*	*			trans	-71.5	104.4	164.5	27.4	-28.4	0	0	0	109.2	N181	P179-N181 PolarHBondContact O-N 3.34Å
180	Q	35	Very low	34.6	Very low	177 Å²	177	145.3 Å²	145.3	83%	0.827	80%	0.803	S	S	*	*			trans	-64.9	110.7	161.9	-72.6	-84.1	-4	0	0	107.7	Y178 T182	Y178-Q180 PolarHBondContact O-N 2.73Å; Q180-T182 PolarHBondContact O-N 3.42Å
181	N	32.6	Very low	34.2	Very low	161 Å²	161	142.3 Å²	142.3	86%	0.861	80%	0.801	S	S	*	*			trans	-77.6	107.4	-171	-138.3	5.4	0	0	0	110	P179	P179-N181 PolarHBondContact O-N 3.34Å
182	T	32	Very low	34.2	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	80%	0.799	S	S	*	*			trans	-137.6	108.7	165.7	54.2	0	0	0	0	112.2	Q180	Q180-T182 PolarHBondContact O-N 3.42Å
183	G	41.5	Very low	34.1	Very low	61 Å²	61	143.5 Å²	143.5	63%	0.629	81%	0.806	S	S	*	*			trans	97.1	113.7	140.9	0	0	0	0	0	118.7
184	Y	23.6	Very low	34.6	Very low	232 Å²	232	146 Å²	146	91%	0.91	81%	0.809	S	S	*	*			trans	90.1	150.7	156.7	-57.4	-78.6	0	0	0	118.9
185	P	33.9	Very low	35.1	Very low	115 Å²	115	144 Å²	144	75%	0.747	80%	0.796	S	S	*	*				-122.1	156.5	-63	27.5	-9.6	0	0	0	111.5
186	A	34.3	Very low	36.2	Very low	93 Å²	93	140.6 Å²	140.6	77%	0.769	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.2	-174.4	0	0	0	0	0	114.4
187	P	30.9	Very low	37.6	Very low	127 Å²	127	138.5 Å²	138.5	83%	0.825	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.8	134.6	156.2	-10.5	26.8	0	0	0	109.8
188	K	33.5	Very low	39.8	Very low	207 Å²	207	134.2 Å²	134.2	90%	0.9	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.4	151.8	-176.8	-67.6	175.6	179.8	176	0	112
189	Q	41.2	Very low	42.4	Very low	201 Å²	201	128.1 Å²	128.1	94%	0.939	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-50.3	144.3	-175.8	-66.6	159.7	-19.5	0	0	114.8
190	G	30.5	Very low	45.1	Very low	79 Å²	79	122.6 Å²	122.6	81%	0.814	71%	0.71	S	S	*	*			trans	178.3	50.2	165.2	0	0	0	0	0	116.5
191	A	28.4	Very low	47.8	Very low	95 Å²	95	119 Å²	119	79%	0.785	69%	0.693	S	S	*	*	S	Bend	trans	173.9	146.7	148.8	0	0	0	0	0	111.3
192	P	36.1	Very low	50.7	Low	123 Å²	123	116 Å²	116	80%	0.799	68%	0.677	S	S	*	*			trans	-72.1	136.2	-169.9	27.7	-32.6	0	0	0	113.2	Q194	P192-Q194 PolarHBondContact O-N 2.03Å
193	K	40.3	Very low	53.5	Low	211 Å²	211	110.3 Å²	110.3	92%	0.917	64%	0.643	S	S	*	*			trans	-64.9	96.9	168.5	-79.6	-179.7	174.2	179.5	0	110.2
194	Q	44.2	Very low	55.9	Low	166 Å²	166	108.9 Å²	108.9	78%	0.776	62%	0.62	S	S	*	*			trans	-141.5	153	153.3	-68.1	-172.1	-8.1	0	0	109.4	P192	P192-Q194 PolarHBondContact O-N 2.03Å
195	T	45.5	Very low	59.3	Low	70 Å²	70	104 Å²	104	43%	0.429	60%	0.604	S	S	.	*			trans	91.4	16.7	152.5	75.6	0	0	0	0	123.8	D197 V198 V199	T195-D197 VanDerWaalsContact C-N 3.29Å; T195-D197 PolarHBondContact O-N 3.48Å; T195-V198 HydrophobicContact CG2-CB 3.89Å; T195-V198 HydrophobicContact CG2-CG1 4.37Å; T195-V198 HydrophobicContact CG2-CG2 3.97Å; T195-V199 VanDerWaalsContact O-CG2 3.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.5Å
196	G	56.1	Low	62.1	Low	66 Å²	66	105.4 Å²	105.4	68%	0.68	60%	0.599	S	S	*	*	H	α-helix	trans	-61	-38.7	164.5	0	0	0	0	0	113.2
197	D	69.3	Low	64.7	Low	113 Å²	113	102.7 Å²	102.7	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-81.3	-35.5	179	-167	37.6	0	0	0	112.2	T195 C200 Q201	T195-D197 VanDerWaalsContact C-N 3.29Å; T195-D197 PolarHBondContact O-N 3.48Å; D197-C200 PolarHBondContact O-N 3.37Å; D197-Q201 VanDerWaalsContact O-CG 3.28Å; D197-Q201 WeakPolarHBondContact O-CG 3Å; D197-Q201 PolarHBondContact O-N 3.19Å
198	V	84.2	Confident	67.6	Low	72 Å²	72	98.5 Å²	98.5	44%	0.436	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-43.8	-179.2	-178.6	0	0	0	0	111.4	T195 C200 Q201 D202	T195-V198 HydrophobicContact CG2-CB 3.89Å; T195-V198 HydrophobicContact CG2-CG1 4.37Å; T195-V198 HydrophobicContact CG2-CG2 3.97Å; V198-C200 VanDerWaalsContact C-N 3.31Å; V198-C200 PolarHBondContact O-N 3.41Å; V198-Q201 PolarHBondContact O-N 3.3Å; V198-D202 WeakPolarHBondContact O-CB 2.99Å; V198-D202 VanDerWaalsContact O-CG 3.29Å; V198-D202 PolarHBondContact O-N 3.42Å
199	V	86.2	Confident	70.2	Confident	64 Å²	64	93 Å²	93	39%	0.388	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-37.2	177.9	175.4	0	0	0	0	111.4	T195 C203 F272	T195-V199 VanDerWaalsContact O-CG2 3.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.5Å; V199-C203 WeakPolarHBondContact O-CB 3.43Å; V199-C203 PolarHBondContact O-N 3.05Å; V199-F272 HydrophobicContact CG1-CD1 3.91Å
200	C	88.6	Confident	72.3	Confident	5 Å²	5	84.9 Å²	84.9	3%	0.034	49%	0.492	C	S	.	.	H	α-helix	trans	-63.7	-45.8	173	174.5	0	0	0	0	111.4	D197 V198 C203 I204 F272 C273	D197-C200 PolarHBondContact O-N 3.37Å; V198-C200 VanDerWaalsContact C-N 3.31Å; V198-C200 PolarHBondContact O-N 3.41Å; C200-C203 PolarHBondContact O-N 3.31Å; C200-I204 VanDerWaalsContact O-CG1 3.24Å; C200-I204 WeakPolarHBondContact O-CG1 3.47Å; C200-I204 PolarHBondContact O-N 3.16Å; C200-F272 VanDerWaalsContact CA-O 3.32Å; C200-F272 WeakPolarHBondContact CA-O 3.42Å; C200-F272 VanDerWaalsContact CB-O 3.24Å; C200-F272 WeakPolarHBondContact CB-O 3.25Å; C200-C273 WeakPolarHBondContact CA-SG 3.37Å; C200-C273 HydrophobicContact CB-CB 4.01Å; C200-C273 WeakPolarHBondContact CB-SG 3.41Å; C200-C273 VanDerWaalsContact SG-CA 3.58Å; C200-C273 WeakPolarHBondContact SG-CB 3.46Å; C200-C273 CovalentContact SG-SG 2.04Å; C200-C273 PolarHBondContact SG-SG 3.33Å
201	Q	91.4	Very high	75	Confident	102 Å²	102	82.2 Å²	82.2	48%	0.477	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.4	-68.5	-62	-29.2	0	0	112.4	D197 V198 I204 K205	D197-Q201 VanDerWaalsContact O-CG 3.28Å; D197-Q201 WeakPolarHBondContact O-CG 3Å; D197-Q201 PolarHBondContact O-N 3.19Å; V198-Q201 PolarHBondContact O-N 3.3Å; Q201-I204 PolarHBondContact O-N 2.99Å; Q201-K205 VanDerWaalsContact O-CB 3.26Å; Q201-K205 WeakPolarHBondContact O-CB 3.35Å; Q201-K205 PolarHBondContact O-N 3.13Å
202	D	92.7	Very high	77.8	Confident	96 Å²	96	81.5 Å²	81.5	51%	0.513	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177	-72	-22.8	0	0	0	111.3	V198 K205 F206	V198-D202 WeakPolarHBondContact O-CB 2.99Å; V198-D202 VanDerWaalsContact O-CG 3.29Å; V198-D202 PolarHBondContact O-N 3.42Å; D202-K205 PolarHBondContact O-N 3.42Å; D202-F206 VanDerWaalsContact O-CB 3.25Å; D202-F206 WeakPolarHBondContact O-CB 3.29Å; D202-F206 PolarHBondContact O-N 2.92Å
203	C	91.7	Very high	80.1	Confident	19 Å²	19	79.5 Å²	79.5	13%	0.128	43%	0.425	C	S	.	.	H	α-helix	trans	-61.8	-48	173.6	178.5	0	0	0	0	111.8	V199 C200 K205 F206 L207 C267 F272	V199-C203 WeakPolarHBondContact O-CB 3.43Å; V199-C203 PolarHBondContact O-N 3.05Å; C200-C203 PolarHBondContact O-N 3.31Å; C203-K205 VanDerWaalsContact C-N 3.3Å; C203-K205 PolarHBondContact O-N 2.83Å; C203-F206 PolarHBondContact O-N 3.32Å; C203-L207 WeakPolarHBondContact O-CG 3.31Å; C203-L207 PolarHBondContact O-N 3.31Å; C203-C267 HydrophobicContact CB-CB 3.95Å; C203-C267 WeakPolarHBondContact CB-SG 3.48Å; C203-C267 PolarHBondContact O-SG 3.36Å; C203-C267 VanDerWaalsContact SG-CA 3.59Å; C203-C267 WeakPolarHBondContact SG-CB 3.4Å; C203-C267 CovalentContact SG-SG 2.04Å; C203-C267 PolarHBondContact SG-SG 3.45Å; C203-F272 HydrophobicContact CB-CB 3.89Å; C203-F272 HydrophobicContact CB-CD2 4.46Å; C203-F272 HydrophobicContact CB-CG 4.24Å
204	I	92.3	Very high	82	Confident	30 Å²	30	70.3 Å²	70.3	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-60.3	-44.7	179.7	-70.6	167	0	0	0	110.1	C200 Q201 S208 P263 K264 C267	C200-I204 VanDerWaalsContact O-CG1 3.24Å; C200-I204 WeakPolarHBondContact O-CG1 3.47Å; C200-I204 PolarHBondContact O-N 3.16Å; Q201-I204 PolarHBondContact O-N 2.99Å; I204-S208 VanDerWaalsContact O-CB 3.31Å; I204-S208 WeakPolarHBondContact O-CB 3.49Å; I204-S208 PolarHBondContact O-N 3.04Å; I204-S208 PolarHBondContact O-OG 3.42Å; I204-P263 HydrophobicContact CG2-CB 4.36Å; I204-K264 HydrophobicContact CD1-CB 4.1Å; I204-K264 HydrophobicContact CD1-CD 4.38Å; I204-K264 HydrophobicContact CD1-CG 3.94Å; I204-K264 HydrophobicContact CG1-CB 4.22Å; I204-K264 HydrophobicContact CG1-CG 4.49Å; I204-C267 HydrophobicContact CG1-CB 4.36Å; I204-C267 PolarHBondContact N-SG 2.94Å; I204-C267 VanDerWaalsContact N-SG 3.36Å
205	K	93.7	Very high	83.7	Confident	130 Å²	130	69.5 Å²	69.5	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-64.4	-49.6	179.3	-174.9	178.8	177.4	-173.8	0	111.2	Q201 D202 C203 L207 S208 D209	Q201-K205 VanDerWaalsContact O-CB 3.26Å; Q201-K205 WeakPolarHBondContact O-CB 3.35Å; Q201-K205 PolarHBondContact O-N 3.13Å; D202-K205 PolarHBondContact O-N 3.42Å; C203-K205 VanDerWaalsContact C-N 3.3Å; C203-K205 PolarHBondContact O-N 2.83Å; K205-L207 VanDerWaalsContact C-N 3.34Å; K205-L207 PolarHBondContact O-N 3.25Å; K205-S208 PolarHBondContact O-N 3.06Å; K205-S208 VanDerWaalsContact O-N 3.13Å; K205-D209 WeakPolarHBondContact O-CB 3.16Å; K205-D209 PolarHBondContact O-N 3.1Å
206	F	92.2	Very high	85.5	Confident	145 Å²	145	71.1 Å²	71.1	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-54.8	-48.2	177.7	173.5	-98.4	0	0	0	112.2	D202 C203 D209 A210	D202-F206 VanDerWaalsContact O-CB 3.25Å; D202-F206 WeakPolarHBondContact O-CB 3.29Å; D202-F206 PolarHBondContact O-N 2.92Å; C203-F206 PolarHBondContact O-N 3.32Å; F206-D209 PolarHBondContact O-N 2.71Å; F206-A210 WeakPolarHBondContact O-CB 3.31Å; F206-A210 PolarHBondContact O-N 2.91Å
207	L	90.6	Very high	86.7	Confident	36 Å²	36	70.4 Å²	70.4	19%	0.188	37%	0.372	C	S	.	.	H	α-helix	trans	-68.3	-35.6	178.6	-71.7	-178.9	0	0	0	112.5	C203 K205 Q211 P263 I266 C267	C203-L207 WeakPolarHBondContact O-CG 3.31Å; C203-L207 PolarHBondContact O-N 3.31Å; K205-L207 VanDerWaalsContact C-N 3.34Å; K205-L207 PolarHBondContact O-N 3.25Å; L207-Q211 WeakPolarHBondContact O-CB 3.48Å; L207-Q211 VanDerWaalsContact O-CG 3.25Å; L207-Q211 WeakPolarHBondContact O-CG 3.35Å; L207-Q211 PolarHBondContact O-N 3.46Å; L207-P263 HydrophobicContact CB-CB 3.82Å; L207-P263 HydrophobicContact CB-CG 4.32Å; L207-I266 HydrophobicContact CD1-CB 3.62Å; L207-I266 HydrophobicContact CD1-CD1 4.2Å; L207-I266 HydrophobicContact CD1-CG2 3.51Å; L207-C267 WeakPolarHBondContact CD1-SG 3.4Å
208	S	90.4	Very high	87.1	Confident	39 Å²	39	70.5 Å²	70.5	27%	0.273	38%	0.382	S	S	.	.	H	α-helix	trans	-66.6	-41	175.7	-57.9	0	0	0	0	111.8	I204 K205 Q211 T212	I204-S208 VanDerWaalsContact O-CB 3.31Å; I204-S208 WeakPolarHBondContact O-CB 3.49Å; I204-S208 PolarHBondContact O-N 3.04Å; I204-S208 PolarHBondContact O-OG 3.42Å; K205-S208 PolarHBondContact O-N 3.06Å; K205-S208 VanDerWaalsContact O-N 3.13Å; S208-Q211 PolarHBondContact O-N 3.32Å; S208-T212 WeakPolarHBondContact O-CB 2.97Å; S208-T212 PolarHBondContact O-N 3.31Å; S208-T212 PolarHBondContact O-OG1 2.85Å
209	D	89.4	Confident	87	Confident	91 Å²	91	69.9 Å²	69.9	49%	0.487	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-45.3	177.2	-67.5	-14.8	0	0	0	110.1	K205 F206 Q211 T212 E213	K205-D209 WeakPolarHBondContact O-CB 3.16Å; K205-D209 PolarHBondContact O-N 3.1Å; F206-D209 PolarHBondContact O-N 2.71Å; D209-Q211 PolarHBondContact O-N 3.2Å; D209-T212 PolarHBondContact O-N 2.96Å; D209-T212 VanDerWaalsContact O-N 3.16Å; D209-E213 PolarHBondContact O-N 3.42Å
210	A	85.5	Confident	87	Confident	30 Å²	30	69.5 Å²	69.5	25%	0.248	37%	0.374	C	S	.	.	H	α-helix	trans	-62.7	-41.7	175.9	0	0	0	0	0	112.8	F206 T212 A214	F206-A210 WeakPolarHBondContact O-CB 3.31Å; F206-A210 PolarHBondContact O-N 2.91Å; A210-T212 VanDerWaalsContact C-N 3.3Å; A210-T212 PolarHBondContact O-N 2.93Å; A210-A214 VanDerWaalsContact O-CB 3.26Å; A210-A214 WeakPolarHBondContact O-CB 3.47Å; A210-A214 PolarHBondContact O-N 3.23Å
211	Q	85.8	Confident	86.6	Confident	23 Å²	23	70.8 Å²	70.8	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-66.9	-32.3	174.4	-75.1	-177	-11.1	0	0	112.2	L207 S208 D209 K215 L258 M259 M261	L207-Q211 WeakPolarHBondContact O-CB 3.48Å; L207-Q211 VanDerWaalsContact O-CG 3.25Å; L207-Q211 WeakPolarHBondContact O-CG 3.35Å; L207-Q211 PolarHBondContact O-N 3.46Å; S208-Q211 PolarHBondContact O-N 3.32Å; D209-Q211 PolarHBondContact O-N 3.2Å; Q211-K215 VanDerWaalsContact O-CG 3.31Å; Q211-K215 WeakPolarHBondContact O-CG 3.28Å; Q211-K215 PolarHBondContact O-N 3.5Å; Q211-L258 PolarHBondContact NE2-O 3.46Å; Q211-M259 HydrophobicContact CB-CE 4.01Å; Q211-M259 HydrophobicContact CB-SD 3.99Å; Q211-M259 HydrophobicContact CG-CE 4.3Å; Q211-M259 HydrophobicContact CG-SD 3.73Å; Q211-M259 WeakPolarHBondContact O-CE 3.37Å; Q211-M261 PolarHBondContact NE2-O 3.39Å
212	T	87.8	Confident	86.3	Confident	81 Å²	81	70.7 Å²	70.7	50%	0.497	38%	0.383	S	S	.	.	H	α-helix	trans	-70.7	-48.4	177.4	-58.7	0	0	0	0	110.4	S208 D209 A210 A214 K215 T216	S208-T212 WeakPolarHBondContact O-CB 2.97Å; S208-T212 PolarHBondContact O-N 3.31Å; S208-T212 PolarHBondContact O-OG1 2.85Å; D209-T212 PolarHBondContact O-N 2.96Å; D209-T212 VanDerWaalsContact O-N 3.16Å; A210-T212 VanDerWaalsContact C-N 3.3Å; A210-T212 PolarHBondContact O-N 2.93Å; T212-A214 VanDerWaalsContact C-N 3.32Å; T212-A214 PolarHBondContact O-N 2.88Å; T212-K215 WeakPolarHBondContact O-CB 3.46Å; T212-K215 PolarHBondContact O-N 3.03Å; T212-T216 PolarHBondContact O-N 3.45Å; T212-T216 PolarHBondContact O-OG1 2.95Å
213	E	83.8	Confident	86	Confident	81 Å²	81	69.1 Å²	69.1	38%	0.379	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-41.5	177.7	-170.7	61.6	-153.6	0	0	111.5	D209 K215 T216 N217 F220	D209-E213 PolarHBondContact O-N 3.42Å; E213-K215 VanDerWaalsContact C-N 3.25Å; E213-K215 PolarHBondContact O-N 3.22Å; E213-T216 PolarHBondContact O-N 3.18Å; E213-T216 PolarHBondContact O-OG1 3.02Å; E213-N217 HydrophobicContact CG-CB 4.49Å; E213-N217 VanDerWaalsContact O-CB 3.28Å; E213-N217 WeakPolarHBondContact O-CB 3.5Å; E213-N217 PolarHBondContact O-N 3.43Å; E213-N217 WeakPolarHBondContact OE1-CB 3.2Å; E213-N217 PolarHBondContact OE1-ND2 3.31Å; E213-F220 HydrophobicContact CB-CD1 4.48Å; E213-F220 HydrophobicContact CB-CD2 4.41Å; E213-F220 HydrophobicContact CB-CE2 4.44Å; E213-F220 HydrophobicContact CB-CG 4.44Å; E213-F220 HydrophobicContact CG-CB 4.29Å; E213-F220 HydrophobicContact CG-CD1 4.34Å; E213-F220 HydrophobicContact CG-CD2 3.57Å; E213-F220 HydrophobicContact CG-CE2 3.91Å; E213-F220 HydrophobicContact CG-CG 3.81Å; E213-F220 HydrophobicContact CG-CZ 4.44Å
214	A	80.6	Confident	85.7	Confident	18 Å²	18	71.6 Å²	71.6	15%	0.149	39%	0.391	C	S	.	.	H	α-helix	trans	-62.6	-26.9	174.4	0	0	0	0	0	114.2	A210 T212 F220 I221 M259	A210-A214 VanDerWaalsContact O-CB 3.26Å; A210-A214 WeakPolarHBondContact O-CB 3.47Å; A210-A214 PolarHBondContact O-N 3.23Å; T212-A214 VanDerWaalsContact C-N 3.32Å; T212-A214 PolarHBondContact O-N 2.88Å; A214-F220 HydrophobicContact CB-CD1 3.74Å; A214-F220 HydrophobicContact CB-CE1 4.07Å; A214-I221 HydrophobicContact CB-CD1 3.65Å; A214-I221 HydrophobicContact CB-CG1 4.21Å; A214-M259 HydrophobicContact CB-CE 3.67Å; A214-M259 HydrophobicContact CB-SD 3.6Å; A214-M259 VanDerWaalsContact CB-SD 3.6Å
215	K	81.1	Confident	85.3	Confident	148 Å²	148	70.8 Å²	70.8	64%	0.643	39%	0.387	S	S	*	.	H	α-helix	trans	-83.2	-33	176.3	-76.1	169.4	-176.2	169.9	0	112.5	Q211 T212 E213 M259	Q211-K215 VanDerWaalsContact O-CG 3.31Å; Q211-K215 WeakPolarHBondContact O-CG 3.28Å; Q211-K215 PolarHBondContact O-N 3.5Å; T212-K215 WeakPolarHBondContact O-CB 3.46Å; T212-K215 PolarHBondContact O-N 3.03Å; E213-K215 VanDerWaalsContact C-N 3.25Å; E213-K215 PolarHBondContact O-N 3.22Å; K215-M259 HydrophobicContact CD-CE 4.14Å; K215-M259 HydrophobicContact CG-CE 3.6Å
216	T	82.6	Confident	85.1	Confident	104 Å²	104	70.7 Å²	70.7	64%	0.638	39%	0.389	S	S	*	.	H	α-helix	trans	-91.9	-26.3	-175.3	50.4	0	0	0	0	113	T212 E213	T212-T216 PolarHBondContact O-N 3.45Å; T212-T216 PolarHBondContact O-OG1 2.95Å; E213-T216 PolarHBondContact O-N 3.18Å; E213-T216 PolarHBondContact O-OG1 3.02Å
217	N	81.5	Confident	84.9	Confident	51 Å²	51	68.7 Å²	68.7	27%	0.273	39%	0.385	S	S	.	.			trans	-120.1	102.7	-175.3	-174	-12	0	0	0	110.5	E213 S219 F220	E213-N217 HydrophobicContact CG-CB 4.49Å; E213-N217 VanDerWaalsContact O-CB 3.28Å; E213-N217 WeakPolarHBondContact O-CB 3.5Å; E213-N217 PolarHBondContact O-N 3.43Å; E213-N217 WeakPolarHBondContact OE1-CB 3.2Å; E213-N217 PolarHBondContact OE1-ND2 3.31Å; N217-S219 PolarHBondContact O-N 3.16Å; N217-S219 VanDerWaalsContact O-N 3.08Å; N217-S219 PolarHBondContact OD1-N 2.03Å; N217-S219 VanDerWaalsContact OD1-N 3.08Å; N217-S219 PolarHBondContact OD1-OG 2.03Å; N217-F220 HydrophobicContact CB-CB 4.01Å; N217-F220 WeakPolarHBondContact O-CB 3.15Å; N217-F220 PolarHBondContact O-N 3.35Å; N217-F220 VanDerWaalsContact O-N 3.12Å
218	S	76.3	Confident	84.6	Confident	115 Å²	115	70.8 Å²	70.8	80%	0.804	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.5	-179.3	58.9	0	0	0	0	114
219	S	83.8	Confident	84.5	Confident	59 Å²	59	71.4 Å²	71.4	41%	0.413	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-9	180	73.2	0	0	0	0	113.9	N217 I221 D222 S223	N217-S219 PolarHBondContact O-N 3.16Å; N217-S219 VanDerWaalsContact O-N 3.08Å; N217-S219 PolarHBondContact OD1-N 2.03Å; N217-S219 VanDerWaalsContact OD1-N 3.08Å; N217-S219 PolarHBondContact OD1-OG 2.03Å; S219-I221 PolarHBondContact O-N 3.12Å; S219-D222 PolarHBondContact O-N 2.9Å; S219-S223 WeakPolarHBondContact O-CB 3.07Å; S219-S223 PolarHBondContact O-N 3.49Å; S219-S223 PolarHBondContact O-OG 3.28Å
220	F	84.6	Confident	84.5	Confident	57 Å²	57	72.5 Å²	72.5	25%	0.25	40%	0.395	C	S	.	.	H	α-helix	trans	-64.3	-41.1	-177.3	174.6	-104.3	0	0	0	111.8	E213 A214 N217 S223 L224	E213-F220 HydrophobicContact CB-CD1 4.48Å; E213-F220 HydrophobicContact CB-CD2 4.41Å; E213-F220 HydrophobicContact CB-CE2 4.44Å; E213-F220 HydrophobicContact CB-CG 4.44Å; E213-F220 HydrophobicContact CG-CB 4.29Å; E213-F220 HydrophobicContact CG-CD1 4.34Å; E213-F220 HydrophobicContact CG-CD2 3.57Å; E213-F220 HydrophobicContact CG-CE2 3.91Å; E213-F220 HydrophobicContact CG-CG 3.81Å; E213-F220 HydrophobicContact CG-CZ 4.44Å; A214-F220 HydrophobicContact CB-CD1 3.74Å; A214-F220 HydrophobicContact CB-CE1 4.07Å; N217-F220 HydrophobicContact CB-CB 4.01Å; N217-F220 WeakPolarHBondContact O-CB 3.15Å; N217-F220 PolarHBondContact O-N 3.35Å; N217-F220 VanDerWaalsContact O-N 3.12Å; F220-S223 PolarHBondContact O-N 2.89Å; F220-L224 VanDerWaalsContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CB 3.39Å; F220-L224 PolarHBondContact O-N 3.46Å
221	I	81	Confident	84.7	Confident	32 Å²	32	77 Å²	77	16%	0.164	41%	0.411	C	S	.	.	H	α-helix	trans	-67.7	-45.1	179.3	-63.8	-47.3	0	0	0	111.9	A214 S219 S223 L224 I225 V255	A214-I221 HydrophobicContact CB-CD1 3.65Å; A214-I221 HydrophobicContact CB-CG1 4.21Å; S219-I221 PolarHBondContact O-N 3.12Å; I221-S223 VanDerWaalsContact C-N 3.3Å; I221-S223 PolarHBondContact O-N 2.86Å; I221-L224 PolarHBondContact O-N 3.4Å; I221-I225 HydrophobicContact CG2-CD1 3.84Å; I221-I225 VanDerWaalsContact O-CG1 3.31Å; I221-I225 WeakPolarHBondContact O-CG1 3.49Å; I221-I225 PolarHBondContact O-N 3.05Å; I221-V255 HydrophobicContact CB-CG1 4.38Å; I221-V255 HydrophobicContact CD1-CB 4.45Å; I221-V255 HydrophobicContact CD1-CG1 3.25Å; I221-V255 HydrophobicContact CD1-CG2 4.41Å; I221-V255 HydrophobicContact CG1-CG1 3.73Å; I221-V255 HydrophobicContact CG2-CB 4.26Å; I221-V255 HydrophobicContact CG2-CG1 3.78Å; I221-V255 HydrophobicContact CG2-CG2 4.23Å
222	D	85.3	Confident	84.8	Confident	100 Å²	100	75.9 Å²	75.9	54%	0.535	41%	0.406	S	S	.	.	H	α-helix	trans	-62.8	-41.1	177.3	-65.1	-23.5	0	0	0	110.7	S219 I225 Q226	S219-D222 PolarHBondContact O-N 2.9Å; D222-I225 PolarHBondContact O-N 2.87Å; D222-Q226 WeakPolarHBondContact O-CB 3.42Å; D222-Q226 WeakPolarHBondContact O-CG 3.33Å; D222-Q226 PolarHBondContact O-N 2.91Å
223	S	86.6	Confident	84.8	Confident	63 Å²	63	75.5 Å²	75.5	44%	0.441	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-38.4	176.5	-57.7	0	0	0	0	112.2	S219 F220 I221 N227	S219-S223 WeakPolarHBondContact O-CB 3.07Å; S219-S223 PolarHBondContact O-N 3.49Å; S219-S223 PolarHBondContact O-OG 3.28Å; F220-S223 PolarHBondContact O-N 2.89Å; I221-S223 VanDerWaalsContact C-N 3.3Å; I221-S223 PolarHBondContact O-N 2.86Å; S223-N227 WeakPolarHBondContact O-CB 3.05Å; S223-N227 PolarHBondContact O-N 3.07Å
224	L	84.2	Confident	85	Confident	70 Å²	70	79.4 Å²	79.4	37%	0.366	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-45.5	176.8	179.7	63	0	0	0	111.3	F220 I221 N227 I228	F220-L224 VanDerWaalsContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CB 3.39Å; F220-L224 PolarHBondContact O-N 3.46Å; I221-L224 PolarHBondContact O-N 3.4Å; L224-N227 PolarHBondContact O-N 3.19Å; L224-I228 HydrophobicContact CG-CD1 4.31Å; L224-I228 WeakPolarHBondContact O-CG1 3Å; L224-I228 PolarHBondContact O-N 2.9Å; L224-I228 VanDerWaalsContact O-N 3.1Å
225	I	85.7	Confident	85	Confident	13 Å²	13	83 Å²	83	7%	0.067	44%	0.437	C	S	.	.	H	α-helix	trans	-62.2	-46.7	177.4	-68.1	169	0	0	0	109.9	I221 D222 N227 I228 E229 V247 P252	I221-I225 HydrophobicContact CG2-CD1 3.84Å; I221-I225 VanDerWaalsContact O-CG1 3.31Å; I221-I225 WeakPolarHBondContact O-CG1 3.49Å; I221-I225 PolarHBondContact O-N 3.05Å; D222-I225 PolarHBondContact O-N 2.87Å; I225-N227 VanDerWaalsContact C-N 3.27Å; I225-N227 PolarHBondContact O-N 2.86Å; I225-I228 PolarHBondContact O-N 3.29Å; I225-I228 VanDerWaalsContact O-N 3.1Å; I225-E229 HydrophobicContact CG2-CG 4.44Å; I225-E229 WeakPolarHBondContact O-CG 3.2Å; I225-E229 PolarHBondContact O-N 3.23Å; I225-V247 HydrophobicContact CG2-CG1 3.99Å; I225-P252 HydrophobicContact CD1-CG 3.84Å
226	Q	88.3	Confident	84.8	Confident	129 Å²	129	77.4 Å²	77.4	60%	0.603	42%	0.422	S	S	*	.	H	α-helix	trans	-59.8	-36.3	175.9	-77.5	-174.8	-8.1	0	0	112.9	D222 I228 E229 H230	D222-Q226 WeakPolarHBondContact O-CB 3.42Å; D222-Q226 WeakPolarHBondContact O-CG 3.33Å; D222-Q226 PolarHBondContact O-N 2.91Å; Q226-I228 VanDerWaalsContact C-N 3.32Å; Q226-E229 PolarHBondContact O-N 2.87Å; Q226-H230 PolarHBondContact O-N 3.49Å
227	N	88.1	Confident	84.2	Confident	103 Å²	103	79.1 Å²	79.1	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-67.5	-36.8	177.8	-137.3	8.2	0	0	0	111.4	S223 L224 I225 H230 Q231	S223-N227 WeakPolarHBondContact O-CB 3.05Å; S223-N227 PolarHBondContact O-N 3.07Å; L224-N227 PolarHBondContact O-N 3.19Å; I225-N227 VanDerWaalsContact C-N 3.27Å; I225-N227 PolarHBondContact O-N 2.86Å; N227-H230 PolarHBondContact O-N 2.96Å; N227-Q231 WeakPolarHBondContact O-CG 3.43Å; N227-Q231 PolarHBondContact O-N 3.43Å
228	I	84.6	Confident	83.7	Confident	80 Å²	80	78.9 Å²	78.9	41%	0.41	45%	0.445	S	S	.	.	H	α-helix	trans	-69.7	-41.1	174.5	-62.6	165.4	0	0	0	110.4	L224 I225 Q226 H230 Q231 C232 V247	L224-I228 HydrophobicContact CG-CD1 4.31Å; L224-I228 WeakPolarHBondContact O-CG1 3Å; L224-I228 PolarHBondContact O-N 2.9Å; L224-I228 VanDerWaalsContact O-N 3.1Å; I225-I228 PolarHBondContact O-N 3.29Å; I225-I228 VanDerWaalsContact O-N 3.1Å; Q226-I228 VanDerWaalsContact C-N 3.32Å; I228-H230 PolarHBondContact O-N 3.28Å; I228-Q231 WeakPolarHBondContact O-CB 3.01Å; I228-Q231 PolarHBondContact O-N 3.18Å; I228-Q231 VanDerWaalsContact O-N 3.11Å; I228-C232 PolarHBondContact O-N 3.48Å; I228-V247 HydrophobicContact CB-CG1 4Å; I228-V247 HydrophobicContact CG2-CB 4.44Å; I228-V247 HydrophobicContact CG2-CG1 3.72Å; I228-V247 HydrophobicContact CG2-CG2 3.77Å
229	E	88.4	Confident	83.5	Confident	51 Å²	51	78.1 Å²	78.1	24%	0.238	43%	0.431	C	S	.	.	H	α-helix	trans	-60.6	-34.2	173.2	-71.6	177.3	166.3	0	0	112.1	I225 Q226 C232 K244 V247	I225-E229 HydrophobicContact CG2-CG 4.44Å; I225-E229 WeakPolarHBondContact O-CG 3.2Å; I225-E229 PolarHBondContact O-N 3.23Å; Q226-E229 PolarHBondContact O-N 2.87Å; E229-C232 WeakPolarHBondContact O-CB 3.33Å; E229-C232 PolarHBondContact O-N 2.98Å; E229-K244 HydrophobicContact CB-CG 4.14Å; E229-K244 HydrophobicContact CG-CG 4.46Å; E229-K244 VanDerWaalsContact O-CE 3.27Å; E229-K244 WeakPolarHBondContact O-CE 3.43Å; E229-V247 HydrophobicContact CG-CB 4.04Å; E229-V247 HydrophobicContact CG-CG1 3.61Å
230	H	89.3	Confident	83.5	Confident	114 Å²	114	75.9 Å²	75.9	53%	0.528	42%	0.415	S	S	.	.	H	α-helix	trans	-70.2	-33	175.1	-169.9	43.4	0	0	0	112.4	Q226 N227 I228 C232 D233	Q226-H230 PolarHBondContact O-N 3.49Å; N227-H230 PolarHBondContact O-N 2.96Å; I228-H230 PolarHBondContact O-N 3.28Å; H230-C232 PolarHBondContact O-N 3.49Å; H230-D233 IonicContact CE1-OD2 2.7Å; H230-D233 IonicContact CG-OD2 3.03Å; H230-D233 IonicContact ND1-OD2 3.98Å; H230-D233 PolarHBondContact ND1-OD2 3.49Å; H230-D233 VanDerWaalsContact O-CB 3.3Å; H230-D233 WeakPolarHBondContact O-CB 3.5Å; H230-D233 PolarHBondContact O-N 3.14Å; H230-D233 VanDerWaalsContact O-N 3.15Å
231	Q	89.4	Confident	83.5	Confident	124 Å²	124	78.4 Å²	78.4	58%	0.579	43%	0.431	S	S	*	.	H	α-helix	trans	-65.3	-27.3	172.4	-63.3	-58.9	-58.2	0	0	112.1	N227 I228 D233 M234	N227-Q231 WeakPolarHBondContact O-CG 3.43Å; N227-Q231 PolarHBondContact O-N 3.43Å; I228-Q231 WeakPolarHBondContact O-CB 3.01Å; I228-Q231 PolarHBondContact O-N 3.18Å; I228-Q231 VanDerWaalsContact O-N 3.11Å; Q231-D233 PolarHBondContact O-N 3.27Å; Q231-M234 PolarHBondContact O-N 2.87Å
232	C	87.7	Confident	83.3	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.007	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-61.5	-23.9	174.3	-62.3	0	0	0	0	112.9	I228 E229 H230 M234 L235 S240 C243 K244	I228-C232 PolarHBondContact O-N 3.48Å; E229-C232 WeakPolarHBondContact O-CB 3.33Å; E229-C232 PolarHBondContact O-N 2.98Å; H230-C232 PolarHBondContact O-N 3.49Å; C232-M234 PolarHBondContact O-N 2.93Å; C232-M234 VanDerWaalsContact O-N 3.14Å; C232-L235 HydrophobicContact CB-CD1 4.46Å; C232-L235 WeakPolarHBondContact O-CB 3.35Å; C232-L235 PolarHBondContact O-N 3.28Å; C232-S240 WeakPolarHBondContact O-CA 3.38Å; C232-S240 WeakPolarHBondContact O-CB 3.26Å; C232-S240 PolarHBondContact O-OG 2.97Å; C232-C243 HydrophobicContact CB-CB 3.52Å; C232-C243 WeakPolarHBondContact CB-SG 3.49Å; C232-C243 WeakPolarHBondContact SG-CB 3.44Å; C232-C243 CovalentContact SG-SG 2.04Å; C232-C243 PolarHBondContact SG-SG 3.41Å; C232-K244 HydrophobicContact CB-CG 3.81Å
233	D	89.1	Confident	83.4	Confident	72 Å²	72	78.2 Å²	78.2	39%	0.385	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23.7	178.3	-71.1	-42.6	0	0	0	113.4	H230 Q231 L235 S240 K244	H230-D233 IonicContact CE1-OD2 2.7Å; H230-D233 IonicContact CG-OD2 3.03Å; H230-D233 IonicContact ND1-OD2 3.98Å; H230-D233 PolarHBondContact ND1-OD2 3.49Å; H230-D233 VanDerWaalsContact O-CB 3.3Å; H230-D233 WeakPolarHBondContact O-CB 3.5Å; H230-D233 PolarHBondContact O-N 3.14Å; H230-D233 VanDerWaalsContact O-N 3.15Å; Q231-D233 PolarHBondContact O-N 3.27Å; D233-L235 PolarHBondContact O-N 2.93Å; D233-S240 PolarHBondContact OD1-OG 2.83Å; D233-K244 WeakPolarHBondContact OD1-CE 3.3Å; D233-K244 IonicContact OD1-NZ 2.72Å; D233-K244 PolarHBondContact OD1-NZ 3.46Å; D233-K244 IonicContact OD2-NZ 2.61Å
234	M	86.8	Confident	83.5	Confident	163 Å²	163	78.3 Å²	78.3	80%	0.803	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-75.2	-10.7	178.5	-63.7	-67.2	-69.7	0	0	113.4	Q231 C232 G236	Q231-M234 PolarHBondContact O-N 2.87Å; C232-M234 PolarHBondContact O-N 2.93Å; C232-M234 VanDerWaalsContact O-N 3.14Å; M234-G236 VanDerWaalsContact C-N 3.35Å; M234-G236 PolarHBondContact O-N 3.47Å
235	L	80.9	Confident	83.6	Confident	93 Å²	93	81.1 Å²	81.1	49%	0.487	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-86.8	0.8	-172.3	-61.1	172.9	0	0	0	114.3	C232 D233 L239 C243	C232-L235 HydrophobicContact CB-CD1 4.46Å; C232-L235 WeakPolarHBondContact O-CB 3.35Å; C232-L235 PolarHBondContact O-N 3.28Å; D233-L235 PolarHBondContact O-N 2.93Å; L235-L239 HydrophobicContact CB-CB 3.92Å; L235-C243 HydrophobicContact CD1-CB 3.76Å; L235-C243 VanDerWaalsContact CD1-SG 3.56Å
236	G	76.5	Confident	83.3	Confident	32 Å²	32	86.6 Å²	86.6	33%	0.33	46%	0.456	S	S	.	.			trans	78.5	171.8	-179.7	0	0	0	0	0	114.3	M234 S240	M234-G236 VanDerWaalsContact C-N 3.35Å; M234-G236 PolarHBondContact O-N 3.47Å; G236-S240 WeakPolarHBondContact O-CB 3.29Å; G236-S240 PolarHBondContact O-N 3.3Å
237	P	70.2	Confident	83.1	Confident	140 Å²	140	81.8 Å²	81.8	91%	0.909	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	133.3	-174.5	25.8	-32.1	0	0	0	111.7
238	G	71.4	Confident	82.8	Confident	46 Å²	46	78.4 Å²	78.4	47%	0.474	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-50.4	-175.7	0	0	0	0	0	114	M242	G238-M242 PolarHBondContact O-N 2.93Å
239	L	71.2	Confident	82.7	Confident	99 Å²	99	79.9 Å²	79.9	52%	0.518	43%	0.43	S	S	.	.	H	α-helix	trans	-76	-34.3	176.4	-74.9	169.6	0	0	0	112.4	L235 M242 C243	L235-L239 HydrophobicContact CB-CB 3.92Å; L239-M242 HydrophobicContact CD2-CE 3.94Å; L239-C243 WeakPolarHBondContact O-CB 3.14Å; L239-C243 PolarHBondContact O-N 2.98Å
240	S	84.9	Confident	82.3	Confident	11 Å²	11	82.9 Å²	82.9	8%	0.077	44%	0.44	C	S	.	.	H	α-helix	trans	-59.5	-47.9	174.6	177	0	0	0	0	111.6	C232 D233 G236 M242 C243 K244	C232-S240 WeakPolarHBondContact O-CA 3.38Å; C232-S240 WeakPolarHBondContact O-CB 3.26Å; C232-S240 PolarHBondContact O-OG 2.97Å; D233-S240 PolarHBondContact OD1-OG 2.83Å; G236-S240 WeakPolarHBondContact O-CB 3.29Å; G236-S240 PolarHBondContact O-N 3.3Å; S240-M242 PolarHBondContact O-N 3.41Å; S240-C243 PolarHBondContact O-N 2.94Å; S240-K244 WeakPolarHBondContact O-CG 3.43Å; S240-K244 PolarHBondContact O-N 2.96Å
241	D	83.3	Confident	81.8	Confident	110 Å²	110	78.1 Å²	78.1	59%	0.588	42%	0.422	S	S	*	.	H	α-helix	trans	-66.5	-42	-177.5	-61.1	-47.5	0	0	0	112	K244 Q245	D241-K244 PolarHBondContact O-N 3.11Å; D241-Q245 WeakPolarHBondContact O-CB 3.3Å; D241-Q245 PolarHBondContact O-N 3.06Å
242	M	77.4	Confident	81.3	Confident	95 Å²	95	75.3 Å²	75.3	47%	0.468	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-42	175.7	-169.4	173.9	66.3	0	0	111.4	G238 L239 S240 Q245 Y246	G238-M242 PolarHBondContact O-N 2.93Å; L239-M242 HydrophobicContact CD2-CE 3.94Å; S240-M242 PolarHBondContact O-N 3.41Å; M242-Q245 PolarHBondContact O-N 3.28Å; M242-Y246 HydrophobicContact CG-CD2 3.91Å; M242-Y246 HydrophobicContact CG-CE2 3.91Å; M242-Y246 VanDerWaalsContact O-CD2 3.32Å; M242-Y246 WeakPolarHBondContact O-CD2 3.49Å; M242-Y246 PolarHBondContact O-N 2.94Å
243	C	87.8	Confident	80.8	Confident	34 Å²	34	77.9 Å²	77.9	23%	0.23	44%	0.435	C	S	.	.	H	α-helix	trans	-59.8	-47.5	175.7	177.9	0	0	0	0	111.3	C232 L235 L239 S240 Q245 Y246 V247	C232-C243 HydrophobicContact CB-CB 3.52Å; C232-C243 WeakPolarHBondContact CB-SG 3.49Å; C232-C243 WeakPolarHBondContact SG-CB 3.44Å; C232-C243 CovalentContact SG-SG 2.04Å; C232-C243 PolarHBondContact SG-SG 3.41Å; L235-C243 HydrophobicContact CD1-CB 3.76Å; L235-C243 VanDerWaalsContact CD1-SG 3.56Å; L239-C243 WeakPolarHBondContact O-CB 3.14Å; L239-C243 PolarHBondContact O-N 2.98Å; S240-C243 PolarHBondContact O-N 2.94Å; C243-Q245 VanDerWaalsContact C-N 3.34Å; C243-Q245 PolarHBondContact O-N 3.49Å; C243-Y246 PolarHBondContact O-N 2.72Å; C243-V247 WeakPolarHBondContact O-CB 3.44Å; C243-V247 WeakPolarHBondContact O-CG2 3.41Å; C243-V247 PolarHBondContact O-N 3.16Å
244	K	89	Confident	80.2	Confident	65 Å²	65	78.2 Å²	78.2	28%	0.283	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-42.8	176	-70.3	177.9	-177.1	-177	0	112.1	E229 C232 D233 S240 D241 Y246 V247 G248	E229-K244 HydrophobicContact CB-CG 4.14Å; E229-K244 HydrophobicContact CG-CG 4.46Å; E229-K244 VanDerWaalsContact O-CE 3.27Å; E229-K244 WeakPolarHBondContact O-CE 3.43Å; C232-K244 HydrophobicContact CB-CG 3.81Å; D233-K244 WeakPolarHBondContact OD1-CE 3.3Å; D233-K244 IonicContact OD1-NZ 2.72Å; D233-K244 PolarHBondContact OD1-NZ 3.46Å; D233-K244 IonicContact OD2-NZ 2.61Å; S240-K244 WeakPolarHBondContact O-CG 3.43Å; S240-K244 PolarHBondContact O-N 2.96Å; D241-K244 PolarHBondContact O-N 3.11Å; K244-Y246 PolarHBondContact O-N 3.45Å; K244-V247 PolarHBondContact O-N 3.05Å; K244-G248 PolarHBondContact O-N 3.46Å
245	Q	85.1	Confident	79.8	Confident	128 Å²	128	71.5 Å²	71.5	60%	0.598	41%	0.408	S	S	*	.	H	α-helix	trans	-60.6	-45.2	176.7	-175.5	-179.9	-3.6	0	0	112	D241 M242 C243 Q249	D241-Q245 WeakPolarHBondContact O-CB 3.3Å; D241-Q245 PolarHBondContact O-N 3.06Å; M242-Q245 PolarHBondContact O-N 3.28Å; C243-Q245 VanDerWaalsContact C-N 3.34Å; C243-Q245 PolarHBondContact O-N 3.49Å; Q245-Q249 VanDerWaalsContact O-CB 3.23Å; Q245-Q249 WeakPolarHBondContact O-CB 3.24Å; Q245-Q249 PolarHBondContact O-N 3.29Å
246	Y	79.1	Confident	79.5	Confident	128 Å²	128	74 Å²	74	50%	0.502	42%	0.418	S	S	.	.	H	α-helix	trans	-67.8	-42.9	178.4	-92.3	-98.4	0	0	0	112.2	M242 C243 K244 Q249 Y250	M242-Y246 HydrophobicContact CG-CD2 3.91Å; M242-Y246 HydrophobicContact CG-CE2 3.91Å; M242-Y246 VanDerWaalsContact O-CD2 3.32Å; M242-Y246 WeakPolarHBondContact O-CD2 3.49Å; M242-Y246 PolarHBondContact O-N 2.94Å; C243-Y246 PolarHBondContact O-N 2.72Å; K244-Y246 PolarHBondContact O-N 3.45Å; Y246-Q249 PolarHBondContact O-N 2.75Å; Y246-Y250 AromaticContact CD1-CD2 3.8Å; Y246-Y250 HydrophobicContact CD1-CD2 3.8Å; Y246-Y250 AromaticContact CD1-CE2 3.63Å; Y246-Y250 HydrophobicContact CD1-CE2 3.63Å; Y246-Y250 HydrophobicContact CE1-CD2 4.48Å; Y246-Y250 AromaticContact CE1-CE2 3.88Å; Y246-Y250 HydrophobicContact CE1-CE2 3.88Å; Y246-Y250 HydrophobicContact CG-CE2 4.47Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.36Å; Y246-Y250 PolarHBondContact O-N 3.43Å
247	V	85.1	Confident	79.6	Confident	28 Å²	28	78.6 Å²	78.6	17%	0.17	43%	0.43	C	S	.	.	H	α-helix	trans	-63.1	-44	177.9	171.9	0	0	0	0	110.5	I225 I228 E229 C243 K244 G251	I225-V247 HydrophobicContact CG2-CG1 3.99Å; I228-V247 HydrophobicContact CB-CG1 4Å; I228-V247 HydrophobicContact CG2-CB 4.44Å; I228-V247 HydrophobicContact CG2-CG1 3.72Å; I228-V247 HydrophobicContact CG2-CG2 3.77Å; E229-V247 HydrophobicContact CG-CB 4.04Å; E229-V247 HydrophobicContact CG-CG1 3.61Å; C243-V247 WeakPolarHBondContact O-CB 3.44Å; C243-V247 WeakPolarHBondContact O-CG2 3.41Å; C243-V247 PolarHBondContact O-N 3.16Å; K244-V247 PolarHBondContact O-N 3.05Å; V247-G251 WeakPolarHBondContact O-CA 3.14Å; V247-G251 PolarHBondContact O-N 3.24Å
248	G	82.4	Confident	79.7	Confident	33 Å²	33	75.6 Å²	75.6	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-66	-36.9	175.1	0	0	0	0	0	113.4	K244	K244-G248 PolarHBondContact O-N 3.46Å
249	Q	81	Confident	79.9	Confident	111 Å²	111	75.6 Å²	75.6	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-73.8	-41.6	-178.4	-175.7	175.9	11	0	0	113.1	Q245 Y246	Q245-Q249 VanDerWaalsContact O-CB 3.23Å; Q245-Q249 WeakPolarHBondContact O-CB 3.24Å; Q245-Q249 PolarHBondContact O-N 3.29Å; Y246-Q249 PolarHBondContact O-N 2.75Å
250	Y	80.1	Confident	80.3	Confident	114 Å²	114	75.4 Å²	75.4	45%	0.447	40%	0.401	S	S	.	.	H	α-helix	trans	-108.5	-18.5	-171.8	-63	-75.9	0	0	0	113.6	Y246 A253 V254	Y246-Y250 AromaticContact CD1-CD2 3.8Å; Y246-Y250 HydrophobicContact CD1-CD2 3.8Å; Y246-Y250 AromaticContact CD1-CE2 3.63Å; Y246-Y250 HydrophobicContact CD1-CE2 3.63Å; Y246-Y250 HydrophobicContact CE1-CD2 4.48Å; Y246-Y250 AromaticContact CE1-CE2 3.88Å; Y246-Y250 HydrophobicContact CE1-CE2 3.88Å; Y246-Y250 HydrophobicContact CG-CE2 4.47Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.36Å; Y246-Y250 PolarHBondContact O-N 3.43Å; Y250-A253 PolarHBondContact O-N 3.1Å; Y250-A253 VanDerWaalsContact O-N 3.13Å; Y250-V254 WeakPolarHBondContact O-CG2 3.05Å; Y250-V254 PolarHBondContact O-N 3.17Å
251	G	79.4	Confident	80.1	Confident	14 Å²	14	77.7 Å²	77.7	14%	0.144	41%	0.412	C	S	.	.	H	α-helix	trans	-50.2	-51	-179.5	0	0	0	0	0	113.7	V247 A253 V254 V255	V247-G251 WeakPolarHBondContact O-CA 3.14Å; V247-G251 PolarHBondContact O-N 3.24Å; G251-A253 VanDerWaalsContact C-N 3.34Å; G251-A253 PolarHBondContact O-N 2.84Å; G251-V254 PolarHBondContact O-N 3.25Å; G251-V255 WeakPolarHBondContact O-CB 3.39Å; G251-V255 VanDerWaalsContact O-CG2 3.28Å; G251-V255 WeakPolarHBondContact O-CG2 3.36Å; G251-V255 PolarHBondContact O-N 3.07Å
252	P	80	Confident	80.2	Confident	64 Å²	64	77.9 Å²	77.9	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-39.1	179	-25.2	35.1	0	0	0	113.5	I225 Q256	I225-P252 HydrophobicContact CD1-CG 3.84Å; P252-Q256 VanDerWaalsContact O-CB 3.31Å; P252-Q256 WeakPolarHBondContact O-CB 3.34Å; P252-Q256 PolarHBondContact O-N 3.41Å
253	A	76.3	Confident	80.7	Confident	55 Å²	55	74.3 Å²	74.3	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-70.7	-41.8	-179.9	0	0	0	0	0	112.1	Y250 G251 Q256 Q257	Y250-A253 PolarHBondContact O-N 3.1Å; Y250-A253 VanDerWaalsContact O-N 3.13Å; G251-A253 VanDerWaalsContact C-N 3.34Å; G251-A253 PolarHBondContact O-N 2.84Å; A253-Q256 PolarHBondContact O-N 3.18Å; A253-Q257 WeakPolarHBondContact O-CB 3.45Å; A253-Q257 PolarHBondContact O-N 3.12Å
254	V	76.5	Confident	80.5	Confident	80 Å²	80	77 Å²	77	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-44.4	176.5	172.2	0	0	0	0	110.5	Y250 G251 Q257 L258	Y250-V254 WeakPolarHBondContact O-CG2 3.05Å; Y250-V254 PolarHBondContact O-N 3.17Å; G251-V254 PolarHBondContact O-N 3.25Å; V254-Q257 PolarHBondContact O-N 2.71Å; V254-L258 HydrophobicContact CG1-CD1 4Å; V254-L258 WeakPolarHBondContact O-CB 3.37Å; V254-L258 WeakPolarHBondContact O-CG 3.37Å; V254-L258 PolarHBondContact O-N 2.99Å
255	V	77.6	Confident	80.2	Confident	22 Å²	22	77.8 Å²	77.8	13%	0.133	41%	0.405	C	S	.	.	H	α-helix	trans	-59	-49	173.7	165.8	0	0	0	0	110.4	I221 G251 Q257 L258 M259	I221-V255 HydrophobicContact CB-CG1 4.38Å; I221-V255 HydrophobicContact CD1-CB 4.45Å; I221-V255 HydrophobicContact CD1-CG1 3.25Å; I221-V255 HydrophobicContact CD1-CG2 4.41Å; I221-V255 HydrophobicContact CG1-CG1 3.73Å; I221-V255 HydrophobicContact CG2-CB 4.26Å; I221-V255 HydrophobicContact CG2-CG1 3.78Å; I221-V255 HydrophobicContact CG2-CG2 4.23Å; G251-V255 WeakPolarHBondContact O-CB 3.39Å; G251-V255 VanDerWaalsContact O-CG2 3.28Å; G251-V255 WeakPolarHBondContact O-CG2 3.36Å; G251-V255 PolarHBondContact O-N 3.07Å; V255-Q257 VanDerWaalsContact C-N 3.25Å; V255-Q257 PolarHBondContact O-N 2.03Å; V255-L258 PolarHBondContact O-N 3.23Å; V255-L258 VanDerWaalsContact O-N 3.15Å; V255-M259 HydrophobicContact CG1-CG 4.21Å; V255-M259 WeakPolarHBondContact O-CB 3.4Å; V255-M259 WeakPolarHBondContact O-CG 3.05Å; V255-M259 PolarHBondContact O-N 2.82Å
256	Q	75.6	Confident	80	Confident	146 Å²	146	72.8 Å²	72.8	68%	0.682	38%	0.382	S	S	*	.	H	α-helix	trans	-59.3	-37.9	-179.8	-175.4	173.8	3.5	0	0	112.3	P252 A253 M259 S260	P252-Q256 VanDerWaalsContact O-CB 3.31Å; P252-Q256 WeakPolarHBondContact O-CB 3.34Å; P252-Q256 PolarHBondContact O-N 3.41Å; A253-Q256 PolarHBondContact O-N 3.18Å; Q256-M259 PolarHBondContact O-N 3.12Å; Q256-S260 PolarHBondContact O-N 3.3Å
257	Q	77.4	Confident	80.4	Confident	127 Å²	127	66.7 Å²	66.7	59%	0.593	36%	0.359	S	S	*	.	H	α-helix	trans	-69.1	-44.3	175.2	-172.8	167	-16.5	0	0	111.9	A253 V254 V255 M259 S260 M261	A253-Q257 WeakPolarHBondContact O-CB 3.45Å; A253-Q257 PolarHBondContact O-N 3.12Å; V254-Q257 PolarHBondContact O-N 2.71Å; V255-Q257 VanDerWaalsContact C-N 3.25Å; V255-Q257 PolarHBondContact O-N 2.03Å; Q257-M259 PolarHBondContact O-N 3.42Å; Q257-S260 WeakPolarHBondContact O-CB 3.42Å; Q257-S260 PolarHBondContact O-N 3.36Å; Q257-S260 PolarHBondContact O-OG 3.42Å; Q257-M261 PolarHBondContact O-N 3.21Å
258	L	73.3	Confident	80.3	Confident	77 Å²	77	66.8 Å²	66.8	40%	0.403	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-32.3	174.7	-73.9	169.7	0	0	0	112.6	Q211 V254 V255 S260 I266	Q211-L258 PolarHBondContact NE2-O 3.46Å; V254-L258 HydrophobicContact CG1-CD1 4Å; V254-L258 WeakPolarHBondContact O-CB 3.37Å; V254-L258 WeakPolarHBondContact O-CG 3.37Å; V254-L258 PolarHBondContact O-N 2.99Å; V255-L258 PolarHBondContact O-N 3.23Å; V255-L258 VanDerWaalsContact O-N 3.15Å; L258-S260 VanDerWaalsContact C-N 3.26Å; L258-S260 PolarHBondContact O-N 3.29Å; L258-I266 HydrophobicContact CD2-CD1 4.2Å
259	M	76.1	Confident	80.1	Confident	47 Å²	47	72.3 Å²	72.3	23%	0.232	38%	0.383	C	S	.	.	H	α-helix	trans	-70.1	-20	174.3	-71.7	-54.4	-68.8	0	0	113.8	Q211 A214 K215 V255 Q256 Q257	Q211-M259 HydrophobicContact CB-CE 4.01Å; Q211-M259 HydrophobicContact CB-SD 3.99Å; Q211-M259 HydrophobicContact CG-CE 4.3Å; Q211-M259 HydrophobicContact CG-SD 3.73Å; Q211-M259 WeakPolarHBondContact O-CE 3.37Å; A214-M259 HydrophobicContact CB-CE 3.67Å; A214-M259 HydrophobicContact CB-SD 3.6Å; A214-M259 VanDerWaalsContact CB-SD 3.6Å; K215-M259 HydrophobicContact CD-CE 4.14Å; K215-M259 HydrophobicContact CG-CE 3.6Å; V255-M259 HydrophobicContact CG1-CG 4.21Å; V255-M259 WeakPolarHBondContact O-CB 3.4Å; V255-M259 WeakPolarHBondContact O-CG 3.05Å; V255-M259 PolarHBondContact O-N 2.82Å; Q256-M259 PolarHBondContact O-N 3.12Å; Q257-M259 PolarHBondContact O-N 3.42Å
260	S	78.1	Confident	80.1	Confident	95 Å²	95	69.7 Å²	69.7	66%	0.664	38%	0.38	S	S	*	.	H	α-helix	trans	-92.6	-11.8	-179	74	0	0	0	0	114.2	Q256 Q257 L258	Q256-S260 PolarHBondContact O-N 3.3Å; Q257-S260 WeakPolarHBondContact O-CB 3.42Å; Q257-S260 PolarHBondContact O-N 3.36Å; Q257-S260 PolarHBondContact O-OG 3.42Å; L258-S260 VanDerWaalsContact C-N 3.26Å; L258-S260 PolarHBondContact O-N 3.29Å
261	M	81.4	Confident	80.1	Confident	59 Å²	59	67.3 Å²	67.3	29%	0.291	39%	0.39	S	S	.	.	S	Bend	trans	-96.7	154.8	-177.5	-68.5	177.8	73.3	0	0	112.1	Q211 Q257 I266	Q211-M261 PolarHBondContact NE2-O 3.39Å; Q257-M261 PolarHBondContact O-N 3.21Å; M261-I266 HydrophobicContact CB-CD1 3.84Å; M261-I266 HydrophobicContact CB-CG1 3.78Å; M261-I266 HydrophobicContact CE-CG1 4.13Å; M261-I266 HydrophobicContact SD-CG1 4.37Å
262	Q	84.9	Confident	80.4	Confident	114 Å²	114	71.8 Å²	71.8	53%	0.533	41%	0.406	S	S	.	.			trans	-76.4	132.4	174.6	-59.9	-170.8	11.2	0	0	110.5	K264 E265 I266	Q262-K264 PolarHBondContact O-N 3.01Å; Q262-K264 VanDerWaalsContact O-N 3.1Å; Q262-E265 HydrophobicContact CB-CB 4.34Å; Q262-E265 HydrophobicContact CB-CG 4.04Å; Q262-E265 WeakPolarHBondContact O-CB 3.41Å; Q262-E265 PolarHBondContact O-N 3.08Å; Q262-I266 PolarHBondContact O-N 2.94Å; Q262-I266 VanDerWaalsContact O-N 3.08Å
263	P	87.6	Confident	80.7	Confident	20 Å²	20	69.2 Å²	69.2	13%	0.13	39%	0.389	C	S	.	.	H	α-helix	trans	-48.8	-39.8	176.8	-34.8	39.3	0	0	0	114.2	I204 L207 E265 I266 C267	I204-P263 HydrophobicContact CG2-CB 4.36Å; L207-P263 HydrophobicContact CB-CB 3.82Å; L207-P263 HydrophobicContact CB-CG 4.32Å; P263-E265 PolarHBondContact O-N 2.93Å; P263-I266 PolarHBondContact O-N 3.29Å; P263-C267 WeakPolarHBondContact O-CB 3.32Å; P263-C267 PolarHBondContact O-N 2.99Å; P263-C267 PolarHBondContact O-SG 2.94Å
264	K	84.4	Confident	80.8	Confident	90 Å²	90	71.6 Å²	71.6	39%	0.391	40%	0.4	S	S	.	.	H	α-helix	trans	-66.1	-34.8	178.1	-172.8	174	-178.1	-173.6	0	113.3	I204 Q262 A268 M276	I204-K264 HydrophobicContact CD1-CB 4.1Å; I204-K264 HydrophobicContact CD1-CD 4.38Å; I204-K264 HydrophobicContact CD1-CG 3.94Å; I204-K264 HydrophobicContact CG1-CB 4.22Å; I204-K264 HydrophobicContact CG1-CG 4.49Å; Q262-K264 PolarHBondContact O-N 3.01Å; Q262-K264 VanDerWaalsContact O-N 3.1Å; K264-A268 WeakPolarHBondContact O-CB 3.38Å; K264-A268 PolarHBondContact O-N 3.43Å; K264-M276 HydrophobicContact CD-CE 3.97Å; K264-M276 HydrophobicContact CD-SD 4.42Å
265	E	81.8	Confident	80.2	Confident	82 Å²	82	74.9 Å²	74.9	38%	0.383	41%	0.41	S	S	.	.	H	α-helix	trans	-73.9	-39.7	177.3	-66.8	171.6	165.4	0	0	110.8	Q262 P263 A268 L269	Q262-E265 HydrophobicContact CB-CB 4.34Å; Q262-E265 HydrophobicContact CB-CG 4.04Å; Q262-E265 WeakPolarHBondContact O-CB 3.41Å; Q262-E265 PolarHBondContact O-N 3.08Å; P263-E265 PolarHBondContact O-N 2.93Å; E265-A268 PolarHBondContact O-N 2.86Å; E265-L269 WeakPolarHBondContact O-CB 3.12Å; E265-L269 PolarHBondContact O-N 3.47Å
266	I	82.6	Confident	78.8	Confident	23 Å²	23	78.5 Å²	78.5	12%	0.118	43%	0.427	C	S	.	.	H	α-helix	trans	-62.5	-45.3	173.6	-57.2	168.5	0	0	0	110.2	L207 L258 M261 Q262 P263 A268 L269 A270	L207-I266 HydrophobicContact CD1-CB 3.62Å; L207-I266 HydrophobicContact CD1-CD1 4.2Å; L207-I266 HydrophobicContact CD1-CG2 3.51Å; L258-I266 HydrophobicContact CD2-CD1 4.2Å; M261-I266 HydrophobicContact CB-CD1 3.84Å; M261-I266 HydrophobicContact CB-CG1 3.78Å; M261-I266 HydrophobicContact CE-CG1 4.13Å; M261-I266 HydrophobicContact SD-CG1 4.37Å; Q262-I266 PolarHBondContact O-N 2.94Å; Q262-I266 VanDerWaalsContact O-N 3.08Å; P263-I266 PolarHBondContact O-N 3.29Å; I266-A268 VanDerWaalsContact C-N 3.33Å; I266-A268 PolarHBondContact O-N 3.21Å; I266-L269 PolarHBondContact O-N 3.33Å; I266-A270 VanDerWaalsContact O-CB 3.31Å; I266-A270 WeakPolarHBondContact O-CB 3.5Å; I266-A270 PolarHBondContact O-N 3.47Å
267	C	86.4	Confident	77.3	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-66.5	-31.9	177.2	-67.9	0	0	0	0	113.2	C203 I204 L207 P263 G271 F272 C273	C203-C267 HydrophobicContact CB-CB 3.95Å; C203-C267 WeakPolarHBondContact CB-SG 3.48Å; C203-C267 PolarHBondContact O-SG 3.36Å; C203-C267 VanDerWaalsContact SG-CA 3.59Å; C203-C267 WeakPolarHBondContact SG-CB 3.4Å; C203-C267 CovalentContact SG-SG 2.04Å; C203-C267 PolarHBondContact SG-SG 3.45Å; I204-C267 HydrophobicContact CG1-CB 4.36Å; I204-C267 PolarHBondContact N-SG 2.94Å; I204-C267 VanDerWaalsContact N-SG 3.36Å; L207-C267 WeakPolarHBondContact CD1-SG 3.4Å; P263-C267 WeakPolarHBondContact O-CB 3.32Å; P263-C267 PolarHBondContact O-N 2.99Å; P263-C267 PolarHBondContact O-SG 2.94Å; C267-G271 PolarHBondContact O-N 3.2Å; C267-F272 HydrophobicContact CB-CB 4.35Å; C267-F272 WeakPolarHBondContact O-CA 3.41Å; C267-F272 PolarHBondContact O-N 3.48Å; C267-C273 HydrophobicContact CB-CB 4.21Å; C267-C273 WeakPolarHBondContact CB-SG 3.33Å; C267-C273 PolarHBondContact O-N 3.06Å
268	A	83.5	Confident	75.5	Confident	29 Å²	29	81.9 Å²	81.9	24%	0.24	44%	0.437	C	S	.	.	H	α-helix	trans	-70	-43.7	173	0	0	0	0	0	111.3	K264 E265 I266 A270 G271 C273	K264-A268 WeakPolarHBondContact O-CB 3.38Å; K264-A268 PolarHBondContact O-N 3.43Å; E265-A268 PolarHBondContact O-N 2.86Å; I266-A268 VanDerWaalsContact C-N 3.33Å; I266-A268 PolarHBondContact O-N 3.21Å; A268-A270 VanDerWaalsContact C-N 3.3Å; A268-A270 PolarHBondContact O-N 3.26Å; A268-G271 PolarHBondContact O-N 2.87Å; A268-C273 HydrophobicContact CB-CB 4.26Å
269	L	78.8	Confident	73.8	Confident	149 Å²	149	83.1 Å²	83.1	78%	0.78	45%	0.453	S	S	*	.	H	α-helix	trans	-62.8	-37.4	176.1	-171.3	70.7	0	0	0	112.1	E265 I266 G271	E265-L269 WeakPolarHBondContact O-CB 3.12Å; E265-L269 PolarHBondContact O-N 3.47Å; I266-L269 PolarHBondContact O-N 3.33Å; L269-G271 PolarHBondContact O-N 3.37Å
270	A	79.9	Confident	71.9	Confident	56 Å²	56	87 Å²	87	46%	0.463	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	0.5	175.5	0	0	0	0	0	113.5	I266 A268 F272	I266-A270 VanDerWaalsContact O-CB 3.31Å; I266-A270 WeakPolarHBondContact O-CB 3.5Å; I266-A270 PolarHBondContact O-N 3.47Å; A268-A270 VanDerWaalsContact C-N 3.3Å; A268-A270 PolarHBondContact O-N 3.26Å; A270-F272 VanDerWaalsContact C-N 3.3Å; A270-F272 HydrophobicContact CB-CD2 3.56Å; A270-F272 HydrophobicContact CB-CE2 3.73Å; A270-F272 PolarHBondContact O-N 2.86Å
271	G	81.3	Confident	70.1	Confident	64 Å²	64	87.7 Å²	87.7	66%	0.66	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	8.4	176.4	0	0	0	0	0	115.4	C267 A268 L269	C267-G271 PolarHBondContact O-N 3.2Å; A268-G271 PolarHBondContact O-N 2.87Å; L269-G271 PolarHBondContact O-N 3.37Å
272	F	83.9	Confident	67.7	Low	109 Å²	109	93.5 Å²	93.5	48%	0.478	51%	0.51	S	S	.	.	S	Bend	trans	-81.8	-21	176.3	-63.6	-68.5	0	0	0	113.2	V199 C200 C203 C267 A270	V199-F272 HydrophobicContact CG1-CD1 3.91Å; C200-F272 VanDerWaalsContact CA-O 3.32Å; C200-F272 WeakPolarHBondContact CA-O 3.42Å; C200-F272 VanDerWaalsContact CB-O 3.24Å; C200-F272 WeakPolarHBondContact CB-O 3.25Å; C203-F272 HydrophobicContact CB-CB 3.89Å; C203-F272 HydrophobicContact CB-CD2 4.46Å; C203-F272 HydrophobicContact CB-CG 4.24Å; C267-F272 HydrophobicContact CB-CB 4.35Å; C267-F272 WeakPolarHBondContact O-CA 3.41Å; C267-F272 PolarHBondContact O-N 3.48Å; A270-F272 VanDerWaalsContact C-N 3.3Å; A270-F272 HydrophobicContact CB-CD2 3.56Å; A270-F272 HydrophobicContact CB-CE2 3.73Å; A270-F272 PolarHBondContact O-N 2.86Å
273	C	87.2	Confident	65.6	Low	9 Å²	9	95.5 Å²	95.5	6%	0.061	52%	0.523	C	S	.	.	S	Bend	trans	-121.7	146	177.7	-70.4	0	0	0	0	112.1	C200 C267 A268	C200-C273 WeakPolarHBondContact CA-SG 3.37Å; C200-C273 HydrophobicContact CB-CB 4.01Å; C200-C273 WeakPolarHBondContact CB-SG 3.41Å; C200-C273 VanDerWaalsContact SG-CA 3.58Å; C200-C273 WeakPolarHBondContact SG-CB 3.46Å; C200-C273 CovalentContact SG-SG 2.04Å; C200-C273 PolarHBondContact SG-SG 3.33Å; C267-C273 HydrophobicContact CB-CB 4.21Å; C267-C273 WeakPolarHBondContact CB-SG 3.33Å; C267-C273 PolarHBondContact O-N 3.06Å; A268-C273 HydrophobicContact CB-CB 4.26Å
274	P	79	Confident	63.1	Low	105 Å²	105	102.2 Å²	102.2	68%	0.682	56%	0.558	S	S	*	*			trans	-66.1	138.9	174.1	26.8	-32.5	0	0	0	111.4	M276	P274-M276 PolarHBondContact O-N 2.81Å
275	E	62.5	Low	60.6	Low	150 Å²	150	106.1 Å²	106.1	70%	0.701	58%	0.582	S	S	*	*			trans	-50.9	128.1	-174.2	-67.5	-177.8	165.1	0	0	113.6	K277	E275-K277 PolarHBondContact O-N 3.45Å; E275-K277 WeakPolarHBondContact OE2-CE 3.32Å
276	M	49.4	Very low	58.6	Low	98 Å²	98	110.6 Å²	110.6	48%	0.483	60%	0.603	S	S	.	*			trans	-82.6	85.4	162	-74.7	-143.4	-72.3	0	0	109.4	K264 P274 K278	K264-M276 HydrophobicContact CD-CE 3.97Å; K264-M276 HydrophobicContact CD-SD 4.42Å; P274-M276 PolarHBondContact O-N 2.81Å; M276-K278 PolarHBondContact O-N 3.29Å
277	K	44.3	Very low	56.3	Low	170 Å²	170	115.7 Å²	115.7	74%	0.739	64%	0.638	S	S	*	*			trans	-64.6	98.5	161.8	-70	-175.3	-180	-177.3	0	108.6	E275 S279	E275-K277 PolarHBondContact O-N 3.45Å; E275-K277 WeakPolarHBondContact OE2-CE 3.32Å; K277-S279 PolarHBondContact O-N 3.38Å
278	K	40.1	Very low	53.7	Low	173 Å²	173	120.6 Å²	120.6	75%	0.752	68%	0.678	S	S	*	*			trans	-80.4	79.9	156.8	-79.6	-178.1	179.8	170.4	0	107.6	M276 V280	M276-K278 PolarHBondContact O-N 3.29Å; K278-V280 PolarHBondContact O-N 3Å
279	S	37.3	Very low	51.5	Low	104 Å²	104	128.7 Å²	128.7	73%	0.727	71%	0.708	S	S	*	*			trans	-67	112.5	157	43.9	0	0	0	0	107.2	K277 P281	K277-S279 PolarHBondContact O-N 3.38Å; S279-P281 WeakPolarHBondContact O-CD 3.24Å
280	V	34.9	Very low	49.3	Very low	129 Å²	129	126.6 Å²	126.6	78%	0.782	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-74.8	122.5	167.4	-172.5	0	0	0	0	106.4	K278 M282	K278-V280 PolarHBondContact O-N 3Å; V280-M282 PolarHBondContact O-N 3.11Å
281	P	41.6	Very low	47.2	Very low	108 Å²	108	131.1 Å²	131.1	70%	0.701	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-64.3	131.2	175.6	-14.3	27.8	0	0	0	109.2	S279 L283	S279-P281 WeakPolarHBondContact O-CD 3.24Å; P281-L283 PolarHBondContact O-N 3.21Å
282	M	30.8	Very low	45	Very low	182 Å²	182	133.6 Å²	133.6	90%	0.897	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64.2	126.4	168.9	-75.3	-168.9	70.1	0	0	109.2	V280	V280-M282 PolarHBondContact O-N 3.11Å
283	L	40.4	Very low	42.7	Very low	156 Å²	156	133.7 Å²	133.7	82%	0.817	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-79.4	140	165.3	-103.3	83.1	0	0	0	109.5	P281 L285	P281-L283 PolarHBondContact O-N 3.21Å; L283-L285 PolarHBondContact O-N 3.22Å
284	D	36	Very low	40.5	Very low	160 Å²	160	137.2 Å²	137.2	86%	0.856	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-59.3	131.5	171.4	-76.6	-42.4	0	0	0	111.2	Q286	D284-Q286 PolarHBondContact O-N 2.83Å
285	L	30.4	Very low	38.7	Very low	173 Å²	173	141.7 Å²	141.7	91%	0.906	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.6	116.9	179.3	-69.5	168.6	0	0	0	110.3	L283	L283-L285 PolarHBondContact O-N 3.22Å
286	Q	41.2	Very low	37	Very low	176 Å²	176	140.7 Å²	140.7	82%	0.822	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-92.9	145.4	164.7	-69.6	-164.8	-20.6	0	0	110.9	D284 A288	D284-Q286 PolarHBondContact O-N 2.83Å; Q286-A288 PolarHBondContact O-N 2.91Å
287	P	32.8	Very low	36.1	Very low	130 Å²	130	145.4 Å²	145.4	84%	0.844	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-63.6	129.9	180	-18.6	31.1	0	0	0	111.8	K289	P287-K289 PolarHBondContact O-N 2.91Å
288	A	32.2	Very low	35.5	Very low	103 Å²	103	143.7 Å²	143.7	85%	0.851	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-68.8	117.6	179.1	0	0	0	0	0	111.4	Q286 A290	Q286-A288 PolarHBondContact O-N 2.91Å; A288-A290 PolarHBondContact O-N 2.61Å
289	K	38	Very low	35.5	Very low	199 Å²	199	140 Å²	140	87%	0.865	82%	0.823	S	S	*	*			trans	-74.9	114.9	162.6	-117.2	178.3	-178.1	176	0	108.1	P287 I291	P287-K289 PolarHBondContact O-N 2.91Å; K289-I291 PolarHBondContact O-N 2.81Å
290	A	32.7	Very low	35.1	Very low	104 Å²	104	139.5 Å²	139.5	86%	0.86	83%	0.825	S	S	*	*			trans	-63.6	121.9	174.7	0	0	0	0	0	110.6	A288	A288-A290 PolarHBondContact O-N 2.61Å
291	I	34.3	Very low	35	Very low	151 Å²	151	143.1 Å²	143.1	77%	0.774	83%	0.83	S	S	*	*			trans	-119.6	133.4	164.7	-56.9	179.5	0	0	0	107.3	K289	K289-I291 PolarHBondContact O-N 2.81Å
292	P	35.2	Very low	34.4	Very low	117 Å²	117	146 Å²	146	76%	0.76	84%	0.839	S	S	*	*			trans	-66.3	143.3	-175	-16.6	29.7	0	0	0	113	A294	P292-A294 PolarHBondContact O-N 3.2Å
293	A	36.7	Very low	34.3	Very low	111 Å²	111	146.9 Å²	146.9	92%	0.917	84%	0.838	S	S	*	*	S	Bend	trans	-66.6	88.2	177.3	0	0	0	0	0	112.1
294	A	40.3	Very low	34	Very low	82 Å²	82	145 Å²	145	68%	0.678	84%	0.835	S	S	*	*			trans	-151.8	118.2	157.7	0	0	0	0	0	109.2	P292	P292-A294 PolarHBondContact O-N 3.2Å
295	K	41.1	Very low	33.8	Very low	200 Å²	200	142.2 Å²	142.2	87%	0.87	84%	0.835	S	S	*	*	S	Bend	trans	87.9	96.2	-179.1	-53.6	171.3	-179.6	179.2	0	113.8
296	T	27.6	Very low	33.9	Very low	129 Å²	129	140.3 Å²	140.3	79%	0.791	83%	0.831	S	S	*	*				-178.7	97.5	109.6	-58.8	0	0	0	0	108.2	V298	T296-V298 HydrophobicContact CG2-CG2 4.3Å
297	M	31.4	Very low	33.7	Very low	196 Å²	196	141.2 Å²	141.2	97%	0.966	83%	0.832	S	S	*	*			trans	-110.3	114.9	157.9	-79.4	-173.3	130	0	0	106.5
298	V	30.9	Very low	33.5	Very low	135 Å²	135	141.3 Å²	141.3	82%	0.818	83%	0.83	S	S	*	*			trans	-105	119.9	161.1	-178.5	0	0	0	0	106.7	T296 A300	T296-V298 HydrophobicContact CG2-CG2 4.3Å; V298-A300 PolarHBondContact O-N 3.31Å
299	A	39.1	Very low	33.3	Very low	95 Å²	95	144.6 Å²	144.6	79%	0.785	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-64.4	120.2	-177.1	0	0	0	0	0	112
300	A	29.3	Very low	33	Very low	93 Å²	93	139.1 Å²	139.1	77%	0.769	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-93.5	119.9	156	0	0	0	0	0	108.2	V298 L302	V298-A300 PolarHBondContact O-N 3.31Å; A300-L302 PolarHBondContact O-N 3.29Å
301	K	32.3	Very low	33	Very low	205 Å²	205	139.9 Å²	139.9	89%	0.891	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.1	121.3	-178.1	-66.8	172.9	177.1	176.5	0	110.6
302	L	30.6	Very low	33.1	Very low	170 Å²	170	139.5 Å²	139.5	89%	0.89	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-95.3	131.5	163	-82.3	140.7	0	0	0	109	A300	A300-L302 PolarHBondContact O-N 3.29Å
303	F	27.4	Very low	33.4	Very low	199 Å²	199	139 Å²	139	87%	0.873	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.1	148.4	170	-69.6	-88.3	0	0	0	110.4	A305	F303-A305 PolarHBondContact O-N 3.05Å
304	P	34.8	Very low	33.4	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-74.3	124.4	178.9	28.5	-30.1	0	0	0	110.5	T306	P304-T306 PolarHBondContact O-N 3.16Å
305	A	30.8	Very low	33.3	Very low	102 Å²	102	143 Å²	143	84%	0.843	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.8	118.2	172.5	0	0	0	0	0	109.8	F303 K307	F303-A305 PolarHBondContact O-N 3.05Å; A305-K307 PolarHBondContact O-N 2.95Å
306	T	33.5	Very low	32.9	Very low	133 Å²	133	139.5 Å²	139.5	82%	0.816	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-60.8	130.9	169.5	-31	0	0	0	0	109.1	P304 V308	P304-T306 PolarHBondContact O-N 3.16Å; T306-V308 PolarHBondContact O-N 3.34Å; T306-V308 VanDerWaalsContact O-N 3.12Å
307	K	36.7	Very low	33.6	Very low	194 Å²	194	137.6 Å²	137.6	84%	0.843	78%	0.782	S	S	*	*			trans	-64.2	106.5	-176.9	-157.6	179.7	-172.3	-172.8	0	110	A305	A305-K307 PolarHBondContact O-N 2.95Å
308	V	28.1	Very low	34	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-90.8	118.5	163.9	178.4	0	0	0	0	106.8	T306 A310	T306-V308 PolarHBondContact O-N 3.34Å; T306-V308 VanDerWaalsContact O-N 3.12Å; V308-A310 PolarHBondContact O-N 3.05Å
309	E	29.7	Very low	34.7	Very low	172 Å²	172	134 Å²	134	80%	0.804	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-65.3	116.9	172.6	-69.8	176.1	161.3	0	0	108.7
310	A	30.1	Very low	35.4	Very low	84 Å²	84	140.7 Å²	140.7	69%	0.694	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68.1	139.2	178.7	0	0	0	0	0	110.3	V308	V308-A310 PolarHBondContact O-N 3.05Å
311	P	32.5	Very low	36.6	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-65.2	138.5	167.2	28.2	-30.5	0	0	0	108.9	S313	P311-S313 PolarHBondContact O-N 2.94Å
312	V	37.1	Very low	38	Very low	143 Å²	143	133 Å²	133	87%	0.867	71%	0.712	S	S	*	*			trans	-49.8	104.6	-177.8	-179.8	0	0	0	0	110.5
313	S	40.7	Very low	39.3	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-77.7	121.5	170.5	46.5	0	0	0	0	108.7	P311	P311-S313 PolarHBondContact O-N 2.94Å
314	R	37.3	Very low	40.9	Very low	179 Å²	179	124 Å²	124	68%	0.675	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-67.6	130	172.3	-64.1	-179.9	180	174.2	-1.7	108.1	M316 V407	R314-M316 PolarHBondContact O-N 2.8Å; R314-V407 HydrophobicContact CB-CG1 4.32Å
315	P	39.3	Very low	42.6	Very low	96 Å²	96	118.6 Å²	118.6	62%	0.623	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-64.3	133.4	174.9	24.2	-27.7	0	0	0	108.9	A408	P315-A408 HydrophobicContact CB-CB 4.45Å; P315-A408 HydrophobicContact CG-CB 4.14Å; P315-A408 WeakPolarHBondContact O-CB 3.27Å; P315-A408 PolarHBondContact O-N 3.35Å
316	M	32.5	Very low	44.5	Very low	127 Å²	127	115.6 Å²	115.6	63%	0.626	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.4	140	175.2	-62.4	-176.9	-173.1	0	0	108.7	R314 Y405	R314-M316 PolarHBondContact O-N 2.8Å; M316-Y405 HydrophobicContact CB-CD1 3.99Å; M316-Y405 HydrophobicContact SD-CG 4.42Å
317	V	41.1	Very low	46.1	Very low	89 Å²	89	114.4 Å²	114.4	54%	0.539	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	142.5	177.6	179.7	0	0	0	0	109.7	A408	V317-A408 HydrophobicContact CG2-CB 4.03Å
318	R	40.3	Very low	47.7	Very low	180 Å²	180	105.6 Å²	105.6	68%	0.679	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.4	130.9	-179.9	-165.5	178.3	-177.2	-178.6	0.2	110.4
319	V	45.3	Very low	49.9	Very low	76 Å²	76	100.7 Å²	100.7	46%	0.461	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-62	134.1	173.5	174.5	0	0	0	0	109.7	A404 I406	V319-A404 HydrophobicContact CG2-CB 4.08Å; V319-A404 VanDerWaalsContact CG2-O 3.29Å; V319-A404 WeakPolarHBondContact CG2-O 3.33Å; V319-I406 HydrophobicContact CG2-CD1 4.28Å; V319-I406 HydrophobicContact CG2-CG1 4.19Å
320	R	54	Low	51.9	Low	235 Å²	235	96.4 Å²	96.4	89%	0.887	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-69.1	143.3	172.2	-82.8	-175	171	-178	-3.4	109.6
321	E	54.9	Low	53.9	Low	97 Å²	97	94.4 Å²	94.4	45%	0.453	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-54.9	150	179.4	-68.7	175.2	178.2	0	0	111.7	C325 K389	E321-C325 HydrophobicContact CB-CB 4.24Å; E321-K389 VanDerWaalsContact CD-NZ 3.35Å; E321-K389 IonicContact OE1-NZ 2.83Å; E321-K389 PolarHBondContact OE1-NZ 2.78Å; E321-K389 IonicContact OE2-NZ 3.77Å; E321-K389 PolarHBondContact OE2-NZ 3.41Å
322	S	61	Low	55.8	Low	41 Å²	41	89 Å²	89	29%	0.287	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-59.4	151.9	-175.3	63.5	0	0	0	0	111.4	T324 C325 A326 L397	S322-T324 PolarHBondContact O-N 2.94Å; S322-T324 PolarHBondContact OG-OG1 3.32Å; S322-C325 WeakPolarHBondContact O-CB 3.12Å; S322-C325 PolarHBondContact O-N 3.38Å; S322-C325 WeakPolarHBondContact OG-CB 3.39Å; S322-C325 PolarHBondContact OG-N 2.93Å; S322-A326 PolarHBondContact O-N 3.42Å; S322-L397 PolarHBondContact OG-O 3.02Å
323	P	57.6	Low	57.5	Low	103 Å²	103	87.6 Å²	87.6	67%	0.669	45%	0.445	S	S	*	.	H	α-helix	trans	-54	-35.3	174	-25.9	34.4	0	0	0	112.8	A326 I327	P323-A326 PolarHBondContact O-N 3.06Å; P323-I327 WeakPolarHBondContact O-CB 3.39Å; P323-I327 WeakPolarHBondContact O-CD1 3.2Å; P323-I327 WeakPolarHBondContact O-CG1 2.91Å; P323-I327 PolarHBondContact O-N 3.33Å
324	T	61.1	Low	58.7	Low	77 Å²	77	85.8 Å²	85.8	47%	0.472	43%	0.425	S	S	.	.	H	α-helix	trans	-64.5	-38.5	176	56.9	0	0	0	0	112.6	S322 C328 L397	S322-T324 PolarHBondContact O-N 2.94Å; S322-T324 PolarHBondContact OG-OG1 3.32Å; T324-C328 WeakPolarHBondContact O-CB 3.32Å; T324-C328 PolarHBondContact O-N 3.22Å; T324-L397 PolarHBondContact OG1-O 3.36Å; T324-L397 VanDerWaalsContact OG1-O 3.12Å
325	C	71.9	Confident	60.2	Low	2 Å²	2	77.5 Å²	77.5	1%	0.014	39%	0.394	C	S	.	.	H	α-helix	trans	-67.9	-45.5	176.4	-179.4	0	0	0	0	111.1	E321 S322 I327 C328 E329 L397 C398	E321-C325 HydrophobicContact CB-CB 4.24Å; S322-C325 WeakPolarHBondContact O-CB 3.12Å; S322-C325 PolarHBondContact O-N 3.38Å; S322-C325 WeakPolarHBondContact OG-CB 3.39Å; S322-C325 PolarHBondContact OG-N 2.93Å; C325-I327 VanDerWaalsContact C-N 3.34Å; C325-I327 PolarHBondContact O-N 2.82Å; C325-C328 PolarHBondContact O-N 2.84Å; C325-E329 PolarHBondContact O-N 3.39Å; C325-L397 WeakPolarHBondContact CA-O 3.27Å; C325-L397 WeakPolarHBondContact CB-O 3.39Å; C325-L397 PolarHBondContact N-O 3.03Å; C325-C398 WeakPolarHBondContact CA-SG 3.41Å; C325-C398 HydrophobicContact CB-CB 3.88Å; C325-C398 WeakPolarHBondContact CB-SG 3.08Å; C325-C398 WeakPolarHBondContact SG-CB 3.41Å; C325-C398 CovalentContact SG-SG 2.03Å; C325-C398 PolarHBondContact SG-SG 3.19Å
326	A	70.1	Confident	61.5	Low	39 Å²	39	76.8 Å²	76.8	32%	0.322	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-38.2	178.3	0	0	0	0	0	112.8	S322 P323 F330	S322-A326 PolarHBondContact O-N 3.42Å; P323-A326 PolarHBondContact O-N 3.06Å; A326-F330 WeakPolarHBondContact O-CB 3.24Å; A326-F330 PolarHBondContact O-N 2.98Å; A326-F330 VanDerWaalsContact O-N 3.13Å
327	I	66.8	Low	63.1	Low	108 Å²	108	74.7 Å²	74.7	55%	0.554	38%	0.381	S	S	*	.	H	α-helix	trans	-65.9	-45.1	175.3	-69.4	163.4	0	0	0	110.2	P323 C325 F330 V331	P323-I327 WeakPolarHBondContact O-CB 3.39Å; P323-I327 WeakPolarHBondContact O-CD1 3.2Å; P323-I327 WeakPolarHBondContact O-CG1 2.91Å; P323-I327 PolarHBondContact O-N 3.33Å; C325-I327 VanDerWaalsContact C-N 3.34Å; C325-I327 PolarHBondContact O-N 2.82Å; I327-F330 PolarHBondContact O-N 3.31Å; I327-V331 WeakPolarHBondContact O-CG2 3.4Å; I327-V331 PolarHBondContact O-N 3.11Å
328	C	70.9	Confident	64.1	Low	10 Å²	10	73.7 Å²	73.7	7%	0.068	37%	0.371	C	S	.	.	H	α-helix	trans	-61.5	-49.7	178	-177.6	0	0	0	0	111.8	T324 C325 F330 V331 M332 C392 L397	T324-C328 WeakPolarHBondContact O-CB 3.32Å; T324-C328 PolarHBondContact O-N 3.22Å; C325-C328 PolarHBondContact O-N 2.84Å; C328-F330 PolarHBondContact O-N 3.13Å; C328-V331 PolarHBondContact O-N 3.47Å; C328-M332 WeakPolarHBondContact O-CB 3.45Å; C328-M332 WeakPolarHBondContact O-CG 3.26Å; C328-M332 PolarHBondContact O-N 3.45Å; C328-C392 VanDerWaalsContact CA-SG 3.59Å; C328-C392 HydrophobicContact CB-CB 3.72Å; C328-C392 WeakPolarHBondContact CB-SG 3.26Å; C328-C392 PolarHBondContact O-SG 2.71Å; C328-C392 WeakPolarHBondContact SG-CA 3.18Å; C328-C392 WeakPolarHBondContact SG-CB 3.48Å; C328-C392 CovalentContact SG-SG 2.02Å; C328-C392 PolarHBondContact SG-SG 3.17Å; C328-L397 HydrophobicContact CB-CB 3.98Å; C328-L397 HydrophobicContact CB-CD1 3.8Å
329	E	74.1	Confident	65.3	Low	29 Å²	29	66.6 Å²	66.6	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-60	-33.9	179.4	-74.5	-166.5	177.7	0	0	111.6	C325 K333 K389 C392	C325-E329 PolarHBondContact O-N 3.39Å; E329-K333 WeakPolarHBondContact O-CB 3.21Å; E329-K333 VanDerWaalsContact O-CG 3.3Å; E329-K333 WeakPolarHBondContact O-CG 3.44Å; E329-K333 PolarHBondContact O-N 3.04Å; E329-K389 VanDerWaalsContact OE1-CG 3.31Å; E329-K389 WeakPolarHBondContact OE1-CG 3.5Å; E329-K389 IonicContact OE1-NZ 3.62Å; E329-K389 PolarHBondContact OE1-NZ 3.01Å; E329-C392 PolarHBondContact N-SG 2.64Å
330	F	70.3	Confident	66	Low	83 Å²	83	71.2 Å²	71.2	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-68.2	-47.5	176.6	177.7	-97	0	0	0	112.3	A326 I327 C328 M332 K333 Q334 F500	A326-F330 WeakPolarHBondContact O-CB 3.24Å; A326-F330 PolarHBondContact O-N 2.98Å; A326-F330 VanDerWaalsContact O-N 3.13Å; I327-F330 PolarHBondContact O-N 3.31Å; C328-F330 PolarHBondContact O-N 3.13Å; F330-M332 VanDerWaalsContact C-N 3.31Å; F330-M332 PolarHBondContact O-N 3.32Å; F330-K333 PolarHBondContact O-N 3.07Å; F330-Q334 PolarHBondContact O-N 3.19Å; F330-F500 HydrophobicContact CD2-CE1 4.24Å
331	V	72.8	Confident	66.1	Low	42 Å²	42	67.3 Å²	67.3	26%	0.255	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-43.2	178	171.7	0	0	0	0	110.6	I327 C328 Q334 L335 V355	I327-V331 WeakPolarHBondContact O-CG2 3.4Å; I327-V331 PolarHBondContact O-N 3.11Å; C328-V331 PolarHBondContact O-N 3.47Å; V331-Q334 PolarHBondContact O-N 3.48Å; V331-L335 HydrophobicContact CG1-CD1 4.06Å; V331-L335 WeakPolarHBondContact O-CG 3.49Å; V331-L335 PolarHBondContact O-N 3.31Å; V331-V355 HydrophobicContact CG1-CG1 3.79Å; V331-V355 HydrophobicContact CG1-CG2 4.4Å
332	M	73	Confident	66.1	Low	6 Å²	6	71.4 Å²	71.4	3%	0.03	38%	0.379	C	S	.	.	H	α-helix	trans	-65	-41.8	178.9	-69.9	-54.7	-57.2	0	0	112.6	C328 F330 Q334 L335 E336 L382 P388 V391	C328-M332 WeakPolarHBondContact O-CB 3.45Å; C328-M332 WeakPolarHBondContact O-CG 3.26Å; C328-M332 PolarHBondContact O-N 3.45Å; F330-M332 VanDerWaalsContact C-N 3.31Å; F330-M332 PolarHBondContact O-N 3.32Å; M332-Q334 VanDerWaalsContact C-N 3.31Å; M332-Q334 PolarHBondContact O-N 2.92Å; M332-L335 WeakPolarHBondContact O-CB 3.32Å; M332-L335 PolarHBondContact O-N 3.29Å; M332-L335 HydrophobicContact SD-CD1 4.15Å; M332-E336 WeakPolarHBondContact O-CG 3.33Å; M332-E336 PolarHBondContact O-N 2.87Å; M332-L382 HydrophobicContact CE-CD2 3.42Å; M332-L382 VanDerWaalsContact CE-CD2 3.42Å; M332-L382 HydrophobicContact CE-CG 4.1Å; M332-P388 HydrophobicContact CB-CB 3.61Å; M332-P388 HydrophobicContact CB-CG 4.24Å; M332-V391 HydrophobicContact CE-CB 3.79Å; M332-V391 HydrophobicContact CE-CG1 3.55Å; M332-V391 HydrophobicContact CE-CG2 3.85Å; M332-V391 HydrophobicContact CG-CB 4.48Å; M332-V391 HydrophobicContact CG-CG1 4.31Å; M332-V391 HydrophobicContact SD-CB 4.41Å; M332-V391 HydrophobicContact SD-CG1 3.77Å
333	K	71.7	Confident	66.1	Low	112 Å²	112	70.8 Å²	70.8	49%	0.487	38%	0.376	S	S	.	.	H	α-helix	trans	-64.5	-35.2	173.3	-77.9	172.8	179.2	161	0	113	E329 F330 L335 S337 P388	E329-K333 WeakPolarHBondContact O-CB 3.21Å; E329-K333 VanDerWaalsContact O-CG 3.3Å; E329-K333 WeakPolarHBondContact O-CG 3.44Å; E329-K333 PolarHBondContact O-N 3.04Å; F330-K333 PolarHBondContact O-N 3.07Å; K333-L335 VanDerWaalsContact C-N 3.35Å; K333-S337 PolarHBondContact O-N 3.37Å; K333-P388 HydrophobicContact CG-CB 4.22Å; K333-P388 HydrophobicContact CG-CG 3.85Å
334	Q	66.7	Low	66.5	Low	71 Å²	71	69.3 Å²	69.3	33%	0.332	37%	0.365	S	S	.	.	H	α-helix	trans	-69	-38.6	177.4	-166.1	58.3	71.3	0	0	110.8	F330 V331 M332 S337 M338	F330-Q334 PolarHBondContact O-N 3.19Å; V331-Q334 PolarHBondContact O-N 3.48Å; M332-Q334 VanDerWaalsContact C-N 3.31Å; M332-Q334 PolarHBondContact O-N 2.92Å; Q334-S337 PolarHBondContact NE2-OG 2.99Å; Q334-S337 PolarHBondContact O-N 3.03Å; Q334-S337 PolarHBondContact O-OG 3.38Å; Q334-M338 VanDerWaalsContact O-CG 3.31Å; Q334-M338 WeakPolarHBondContact O-CG 3.25Å; Q334-M338 PolarHBondContact O-N 3.42Å
335	L	68.1	Low	66.6	Low	5 Å²	5	71.2 Å²	71.2	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-62.2	-46.6	172.1	-77.7	165.1	0	0	0	112	V331 M332 K333 S337 M338 L339 A351 V352 V355 L382	V331-L335 HydrophobicContact CG1-CD1 4.06Å; V331-L335 WeakPolarHBondContact O-CG 3.49Å; V331-L335 PolarHBondContact O-N 3.31Å; M332-L335 WeakPolarHBondContact O-CB 3.32Å; M332-L335 PolarHBondContact O-N 3.29Å; M332-L335 HydrophobicContact SD-CD1 4.15Å; K333-L335 VanDerWaalsContact C-N 3.35Å; L335-S337 VanDerWaalsContact C-N 3.31Å; L335-S337 PolarHBondContact O-N 2.99Å; L335-M338 PolarHBondContact O-N 3.35Å; L335-M338 VanDerWaalsContact O-N 3.09Å; L335-L339 VanDerWaalsContact O-CG 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.46Å; L335-L339 PolarHBondContact O-N 3.24Å; L335-A351 HydrophobicContact CD2-CB 4.17Å; L335-V352 HydrophobicContact CD2-CB 4.49Å; L335-V352 HydrophobicContact CD2-CG2 3.9Å; L335-V355 HydrophobicContact CD1-CG2 4.13Å; L335-V355 HydrophobicContact CD2-CG2 3.45Å; L335-V355 VanDerWaalsContact CD2-CG2 3.45Å; L335-V355 HydrophobicContact CG-CG2 3.65Å; L335-L382 HydrophobicContact CB-CD1 4.43Å; L335-L382 HydrophobicContact CB-CD2 4.47Å; L335-L382 HydrophobicContact CD1-CD1 4.22Å
336	E	66.9	Low	66.2	Low	80 Å²	80	78 Å²	78	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-57.3	-43	173.3	-74.9	177.6	165.4	0	0	112	M332 M338 L339 P388	M332-E336 WeakPolarHBondContact O-CG 3.33Å; M332-E336 PolarHBondContact O-N 2.87Å; E336-M338 PolarHBondContact O-N 3.28Å; E336-L339 PolarHBondContact O-N 2.84Å; E336-L339 VanDerWaalsContact O-N 3.16Å; E336-P388 VanDerWaalsContact CD-CG 3.41Å; E336-P388 WeakPolarHBondContact OE1-CD 3.16Å; E336-P388 WeakPolarHBondContact OE1-CG 3.4Å; E336-P388 VanDerWaalsContact OE2-CG 3.22Å; E336-P388 WeakPolarHBondContact OE2-CG 3.26Å
337	S	67.1	Low	65.9	Low	84 Å²	84	81 Å²	81	59%	0.587	41%	0.408	S	S	*	.	H	α-helix	trans	-68.8	-16.7	179.4	80.1	0	0	0	0	114.3	K333 Q334 L335	K333-S337 PolarHBondContact O-N 3.37Å; Q334-S337 PolarHBondContact NE2-OG 2.99Å; Q334-S337 PolarHBondContact O-N 3.03Å; Q334-S337 PolarHBondContact O-OG 3.38Å; L335-S337 VanDerWaalsContact C-N 3.31Å; L335-S337 PolarHBondContact O-N 2.99Å
338	M	61.9	Low	65.9	Low	68 Å²	68	76 Å²	76	34%	0.335	38%	0.382	S	S	.	.	H	α-helix	trans	-93.4	-7.5	178	-70.4	177.1	69.5	0	0	112.4	Q334 L335 E336 A351 K354 F358	Q334-M338 VanDerWaalsContact O-CG 3.31Å; Q334-M338 WeakPolarHBondContact O-CG 3.25Å; Q334-M338 PolarHBondContact O-N 3.42Å; L335-M338 PolarHBondContact O-N 3.35Å; L335-M338 VanDerWaalsContact O-N 3.09Å; E336-M338 PolarHBondContact O-N 3.28Å; M338-A351 HydrophobicContact CB-CB 4.3Å; M338-K354 HydrophobicContact CE-CB 4.1Å; M338-K354 HydrophobicContact CE-CD 4.02Å; M338-F358 HydrophobicContact SD-CE2 4.31Å
339	L	64.2	Low	65.7	Low	30 Å²	30	77.7 Å²	77.7	16%	0.157	39%	0.392	C	S	.	.	S	Bend	trans	-115.9	122.4	-177.6	-62.9	171.1	0	0	0	109	L335 E336 A343 V348 A351 L382	L335-L339 VanDerWaalsContact O-CG 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.46Å; L335-L339 PolarHBondContact O-N 3.24Å; E336-L339 PolarHBondContact O-N 2.84Å; E336-L339 VanDerWaalsContact O-N 3.16Å; L339-A343 HydrophobicContact CB-CB 3.93Å; L339-A343 HydrophobicContact CD2-CB 3.74Å; L339-A343 HydrophobicContact CG-CB 4.37Å; L339-V348 HydrophobicContact CD1-CB 4.47Å; L339-V348 HydrophobicContact CD1-CG1 4.11Å; L339-V348 HydrophobicContact CD1-CG2 4.1Å; L339-V348 HydrophobicContact CD2-CB 4.27Å; L339-V348 HydrophobicContact CD2-CG2 3.9Å; L339-A351 HydrophobicContact CD2-CB 3.82Å; L339-A351 HydrophobicContact CG-CB 4.26Å; L339-L382 HydrophobicContact CD1-CD1 4.33Å
340	E	59.8	Low	65.4	Low	173 Å²	173	82.7 Å²	82.7	81%	0.808	41%	0.413	S	S	*	.			trans	-71.2	161.8	172.4	-66.1	-176.1	177.3	0	0	110.3	Q342 A343	E340-Q342 PolarHBondContact O-N 3.33Å; E340-A343 PolarHBondContact O-N 3.4Å
341	D	57.1	Low	65.3	Low	153 Å²	153	79 Å²	79	82%	0.818	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-11.8	-176.1	-69.1	-36.7	0	0	0	114.7
342	Q	53.9	Low	65.1	Low	184 Å²	184	77.3 Å²	77.3	86%	0.86	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	46.5	176	-61.8	-175.6	1.4	0	0	112.2	E340 T344	E340-Q342 PolarHBondContact O-N 3.33Å; Q342-T344 PolarHBondContact O-N 2.86Å
343	A	61.5	Low	64.9	Low	28 Å²	28	82.7 Å²	82.7	23%	0.231	41%	0.413	C	S	.	.			trans	-63.5	131	175.7	0	0	0	0	0	112.1	L339 E340 E347 V348	L339-A343 HydrophobicContact CB-CB 3.93Å; L339-A343 HydrophobicContact CD2-CB 3.74Å; L339-A343 HydrophobicContact CG-CB 4.37Å; E340-A343 PolarHBondContact O-N 3.4Å; A343-E347 HydrophobicContact CB-CB 4.44Å; A343-V348 HydrophobicContact CB-CG2 4.02Å
344	T	66.9	Low	64.9	Low	72 Å²	72	83.2 Å²	83.2	44%	0.442	42%	0.415	S	S	.	.			trans	-72.4	154.5	172.4	57.2	0	0	0	0	111	Q342 E346 E347 V348	Q342-T344 PolarHBondContact O-N 2.86Å; T344-E346 PolarHBondContact O-N 3.01Å; T344-E346 VanDerWaalsContact O-N 3.09Å; T344-E347 PolarHBondContact N-OE2 3.15Å; T344-E347 WeakPolarHBondContact O-CA 3.29Å; T344-E347 WeakPolarHBondContact O-CB 3.42Å; T344-E347 PolarHBondContact O-N 3.48Å; T344-E347 VanDerWaalsContact OG1-CG 3.28Å; T344-E347 WeakPolarHBondContact OG1-CG 2.96Å; T344-E347 PolarHBondContact OG1-OE2 2.97Å; T344-V348 WeakPolarHBondContact O-CG2 3.31Å; T344-V348 PolarHBondContact O-N 3Å
345	E	62.5	Low	65.2	Low	117 Å²	117	80.8 Å²	80.8	55%	0.547	41%	0.405	S	S	.	.	H	α-helix	trans	-51.1	-38	178.7	-171.8	177.6	176.3	0	0	112	E347 V348 V349 I379	E345-E347 PolarHBondContact O-N 3.43Å; E345-V348 PolarHBondContact O-N 3.39Å; E345-V349 WeakPolarHBondContact O-CG2 3.25Å; E345-V349 PolarHBondContact O-N 3.26Å; E345-I379 HydrophobicContact CG-CG2 4.15Å
346	E	64	Low	65.4	Low	145 Å²	145	80.6 Å²	80.6	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-69.4	-28	178.2	-65.5	173.4	167.4	0	0	113.7	T344 K350	T344-E346 PolarHBondContact O-N 3.01Å; T344-E346 VanDerWaalsContact O-N 3.09Å; E346-K350 WeakPolarHBondContact O-CG 3.37Å; E346-K350 PolarHBondContact O-N 2.92Å
347	E	64.1	Low	65.8	Low	102 Å²	102	81.4 Å²	81.4	48%	0.477	42%	0.415	S	S	.	.	H	α-helix	trans	-79.1	-36.2	174.6	-72.4	164.1	155.1	0	0	111.3	A343 T344 E345 K350 A351	A343-E347 HydrophobicContact CB-CB 4.44Å; T344-E347 PolarHBondContact N-OE2 3.15Å; T344-E347 WeakPolarHBondContact O-CA 3.29Å; T344-E347 WeakPolarHBondContact O-CB 3.42Å; T344-E347 PolarHBondContact O-N 3.48Å; T344-E347 VanDerWaalsContact OG1-CG 3.28Å; T344-E347 WeakPolarHBondContact OG1-CG 2.96Å; T344-E347 PolarHBondContact OG1-OE2 2.97Å; E345-E347 PolarHBondContact O-N 3.43Å; E347-K350 PolarHBondContact O-N 2.76Å; E347-A351 WeakPolarHBondContact O-CB 3.23Å; E347-A351 PolarHBondContact O-N 3.42Å
348	V	66	Low	65.7	Low	3 Å²	3	84 Å²	84	2%	0.018	42%	0.416	C	S	.	.	H	α-helix	trans	-63.7	-46.6	173.1	-174.2	0	0	0	0	110.7	L339 A343 T344 E345 K350 A351 V352 I379 L382 V383	L339-V348 HydrophobicContact CD1-CB 4.47Å; L339-V348 HydrophobicContact CD1-CG1 4.11Å; L339-V348 HydrophobicContact CD1-CG2 4.1Å; L339-V348 HydrophobicContact CD2-CB 4.27Å; L339-V348 HydrophobicContact CD2-CG2 3.9Å; A343-V348 HydrophobicContact CB-CG2 4.02Å; T344-V348 WeakPolarHBondContact O-CG2 3.31Å; T344-V348 PolarHBondContact O-N 3Å; E345-V348 PolarHBondContact O-N 3.39Å; V348-K350 PolarHBondContact O-N 2.64Å; V348-A351 PolarHBondContact O-N 2.87Å; V348-V352 HydrophobicContact CG1-CG2 4.37Å; V348-V352 VanDerWaalsContact O-CG2 3.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.3Å; V348-V352 PolarHBondContact O-N 3.47Å; V348-I379 HydrophobicContact CB-CG2 4.24Å; V348-I379 HydrophobicContact CG1-CB 4.13Å; V348-I379 HydrophobicContact CG1-CG1 3.94Å; V348-I379 HydrophobicContact CG1-CG2 3.92Å; V348-L382 HydrophobicContact CG1-CB 4Å; V348-L382 HydrophobicContact CG1-CD1 3.99Å; V348-V383 HydrophobicContact CG2-CG2 4.24Å
349	V	67.1	Low	65.4	Low	44 Å²	44	83.9 Å²	83.9	27%	0.267	42%	0.416	S	S	.	.	H	α-helix	trans	-55.3	-49.4	175	172.3	0	0	0	0	111.1	E345 A351 V352 E353 I379	E345-V349 WeakPolarHBondContact O-CG2 3.25Å; E345-V349 PolarHBondContact O-N 3.26Å; V349-A351 VanDerWaalsContact C-N 3.31Å; V349-A351 PolarHBondContact O-N 3.26Å; V349-V352 PolarHBondContact O-N 2.8Å; V349-E353 WeakPolarHBondContact O-CG 3.33Å; V349-E353 PolarHBondContact O-N 3.37Å; V349-I379 HydrophobicContact CB-CD1 4.27Å; V349-I379 HydrophobicContact CG2-CD1 3.44Å; V349-I379 VanDerWaalsContact CG2-CD1 3.44Å; V349-I379 HydrophobicContact CG2-CG1 4.27Å
350	K	68	Low	65.4	Low	135 Å²	135	86.1 Å²	86.1	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-64.9	-31.7	-180	-76.9	173.9	-176.8	163.1	0	113.4	E346 E347 V348 K354	E346-K350 WeakPolarHBondContact O-CG 3.37Å; E346-K350 PolarHBondContact O-N 2.92Å; E347-K350 PolarHBondContact O-N 2.76Å; V348-K350 PolarHBondContact O-N 2.64Å; K350-K354 WeakPolarHBondContact O-CB 3.1Å; K350-K354 WeakPolarHBondContact O-CG 3.49Å; K350-K354 PolarHBondContact O-N 2.04Å
351	A	67.6	Low	65.5	Low	6 Å²	6	83.4 Å²	83.4	5%	0.05	43%	0.433	C	S	.	.	H	α-helix	trans	-72.5	-43.4	176.5	0	0	0	0	0	111.4	L335 M338 L339 E347 V348 V349 K354 V355	L335-A351 HydrophobicContact CD2-CB 4.17Å; M338-A351 HydrophobicContact CB-CB 4.3Å; L339-A351 HydrophobicContact CD2-CB 3.82Å; L339-A351 HydrophobicContact CG-CB 4.26Å; E347-A351 WeakPolarHBondContact O-CB 3.23Å; E347-A351 PolarHBondContact O-N 3.42Å; V348-A351 PolarHBondContact O-N 2.87Å; V349-A351 VanDerWaalsContact C-N 3.31Å; V349-A351 PolarHBondContact O-N 3.26Å; A351-K354 PolarHBondContact O-N 2.8Å; A351-V355 PolarHBondContact O-N 2.84Å
352	V	68.8	Low	65.8	Low	5 Å²	5	80.4 Å²	80.4	3%	0.03	42%	0.423	C	S	.	.	H	α-helix	trans	-64.6	-40.7	177.5	177	0	0	0	0	111.3	L335 V348 V349 K354 V355 V371 I378 I379 L382	L335-V352 HydrophobicContact CD2-CB 4.49Å; L335-V352 HydrophobicContact CD2-CG2 3.9Å; V348-V352 HydrophobicContact CG1-CG2 4.37Å; V348-V352 VanDerWaalsContact O-CG2 3.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.3Å; V348-V352 PolarHBondContact O-N 3.47Å; V349-V352 PolarHBondContact O-N 2.8Å; V352-K354 VanDerWaalsContact C-N 3.33Å; V352-K354 PolarHBondContact O-N 3.47Å; V352-V355 WeakPolarHBondContact O-CB 3.47Å; V352-V355 PolarHBondContact O-N 2.94Å; V352-V371 HydrophobicContact CG1-CG1 3.72Å; V352-V371 HydrophobicContact CG1-CG2 4.09Å; V352-I378 HydrophobicContact CG1-CG2 4.49Å; V352-I378 HydrophobicContact CG2-CG2 4.17Å; V352-I379 HydrophobicContact CG2-CG1 4.3Å; V352-L382 HydrophobicContact CG2-CD1 3.89Å
353	E	68.6	Low	65.6	Low	119 Å²	119	75.2 Å²	75.2	56%	0.556	40%	0.401	S	S	*	.	H	α-helix	trans	-65.5	-33.9	174	-73.1	-179.5	166.3	0	0	113.1	V349 V355	V349-E353 WeakPolarHBondContact O-CG 3.33Å; V349-E353 PolarHBondContact O-N 3.37Å; E353-V355 VanDerWaalsContact C-N 3.32Å; E353-V355 PolarHBondContact O-N 3.29Å
354	K	72.8	Confident	65.9	Low	124 Å²	124	75.5 Å²	75.5	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-70.9	-24.3	177.5	-90.3	-179.1	177.3	175.1	0	113.2	M338 K350 A351 V352 C356 T357 F358	M338-K354 HydrophobicContact CE-CB 4.1Å; M338-K354 HydrophobicContact CE-CD 4.02Å; K350-K354 WeakPolarHBondContact O-CB 3.1Å; K350-K354 WeakPolarHBondContact O-CG 3.49Å; K350-K354 PolarHBondContact O-N 2.04Å; A351-K354 PolarHBondContact O-N 2.8Å; V352-K354 VanDerWaalsContact C-N 3.33Å; V352-K354 PolarHBondContact O-N 3.47Å; K354-C356 PolarHBondContact O-N 3.38Å; K354-T357 WeakPolarHBondContact O-CB 3.33Å; K354-T357 PolarHBondContact O-N 3.03Å; K354-T357 PolarHBondContact O-OG1 3.16Å; K354-F358 VanDerWaalsContact O-CD2 3.29Å; K354-F358 WeakPolarHBondContact O-CD2 3.42Å
355	V	73.1	Confident	66.1	Low	20 Å²	20	75.1 Å²	75.1	12%	0.121	40%	0.404	C	S	.	.	H	α-helix	trans	-56.3	-38.7	179.9	157.2	0	0	0	0	112.2	V331 L335 A351 V352 E353 T357 F358	V331-V355 HydrophobicContact CG1-CG1 3.79Å; V331-V355 HydrophobicContact CG1-CG2 4.4Å; L335-V355 HydrophobicContact CD1-CG2 4.13Å; L335-V355 HydrophobicContact CD2-CG2 3.45Å; L335-V355 VanDerWaalsContact CD2-CG2 3.45Å; L335-V355 HydrophobicContact CG-CG2 3.65Å; A351-V355 PolarHBondContact O-N 2.84Å; V352-V355 WeakPolarHBondContact O-CB 3.47Å; V352-V355 PolarHBondContact O-N 2.94Å; E353-V355 VanDerWaalsContact C-N 3.32Å; E353-V355 PolarHBondContact O-N 3.29Å; V355-T357 PolarHBondContact O-N 2.82Å; V355-T357 VanDerWaalsContact O-N 3.13Å; V355-F358 PolarHBondContact O-N 2.86Å
356	C	72.1	Confident	66.1	Low	1 Å²	1	75.8 Å²	75.8	1%	0.007	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-66.6	-16	179.6	-62	0	0	0	0	114.1	K354 F358 C367 K368 V371	K354-C356 PolarHBondContact O-N 3.38Å; C356-F358 VanDerWaalsContact C-N 3.33Å; C356-C367 WeakPolarHBondContact CA-SG 3.16Å; C356-C367 HydrophobicContact CB-CB 3.73Å; C356-C367 WeakPolarHBondContact CB-SG 3.21Å; C356-C367 WeakPolarHBondContact SG-CB 3.06Å; C356-C367 PolarHBondContact SG-O 3.41Å; C356-C367 CovalentContact SG-SG 2.05Å; C356-C367 PolarHBondContact SG-SG 2.85Å; C356-K368 HydrophobicContact CB-CG 4.12Å; C356-K368 PolarHBondContact SG-N 3.07Å; C356-V371 VanDerWaalsContact SG-CG2 3.58Å
357	T	74.4	Confident	66.4	Low	97 Å²	97	69.5 Å²	69.5	60%	0.595	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-81	-13.4	175.7	71	0	0	0	0	113.4	K354 V355	K354-T357 WeakPolarHBondContact O-CB 3.33Å; K354-T357 PolarHBondContact O-N 3.03Å; K354-T357 PolarHBondContact O-OG1 3.16Å; V355-T357 PolarHBondContact O-N 2.82Å; V355-T357 VanDerWaalsContact O-N 3.13Å
358	F	65.5	Low	66.9	Low	138 Å²	138	69.9 Å²	69.9	61%	0.605	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-89.4	-7.9	173.9	-63.4	-81.9	0	0	0	113	M338 K354 V355 C356	M338-F358 HydrophobicContact SD-CE2 4.31Å; K354-F358 VanDerWaalsContact O-CD2 3.29Å; K354-F358 WeakPolarHBondContact O-CD2 3.42Å; V355-F358 PolarHBondContact O-N 2.86Å; C356-F358 VanDerWaalsContact C-N 3.33Å
359	L	56.1	Low	67.2	Low	65 Å²	65	74.4 Å²	74.4	34%	0.34	40%	0.403	S	S	.	.	S	Bend	trans	-87.9	151.9	176	-67.5	174.9	0	0	0	111.4	L363 C367	L359-L363 HydrophobicContact CB-CB 4.42Å; L359-C367 HydrophobicContact CD1-CB 3.46Å; L359-C367 VanDerWaalsContact CD1-CB 3.46Å; L359-C367 WeakPolarHBondContact CD1-SG 3.46Å
360	P	63	Low	67.2	Low	78 Å²	78	76.9 Å²	76.9	51%	0.506	42%	0.415	S	S	.	.			trans	-53.7	147.6	171.9	-22.3	32.1	0	0	0	111.3	S362 L363 T364	P360-S362 PolarHBondContact O-N 2.93Å; P360-L363 PolarHBondContact O-N 3.46Å; P360-T364 PolarHBondContact O-N 2.04Å; P360-T364 PolarHBondContact O-OG1 3.34Å
361	S	62	Low	67.5	Low	116 Å²	116	71.6 Å²	71.6	81%	0.811	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.8	-177	48.9	0	0	0	0	114.1	L363 T364	S361-L363 VanDerWaalsContact C-N 3.28Å; S361-L363 PolarHBondContact O-N 3.37Å; S361-T364 WeakPolarHBondContact CA-OG1 3.46Å
362	S	63.8	Low	67.7	Low	89 Å²	89	78.9 Å²	78.9	62%	0.622	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.4	174.2	52.1	0	0	0	0	114.1	P360	P360-S362 PolarHBondContact O-N 2.93Å
363	L	49.6	Very low	67.7	Low	75 Å²	75	83.1 Å²	83.1	39%	0.393	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-8.3	-176.2	-62.2	178.3	0	0	0	113	L359 P360 S361 A365 Q366 C367	L359-L363 HydrophobicContact CB-CB 4.42Å; P360-L363 PolarHBondContact O-N 3.46Å; S361-L363 VanDerWaalsContact C-N 3.28Å; S361-L363 PolarHBondContact O-N 3.37Å; L363-A365 VanDerWaalsContact C-N 3.3Å; L363-A365 PolarHBondContact O-N 3.09Å; L363-Q366 PolarHBondContact O-N 3.39Å; L363-C367 VanDerWaalsContact O-CB 3.29Å; L363-C367 WeakPolarHBondContact O-CB 3.44Å; L363-C367 PolarHBondContact O-N 3.22Å
364	T	68.2	Low	67.5	Low	35 Å²	35	83.8 Å²	83.8	22%	0.215	45%	0.451	C	S	.	.	H	α-helix	trans	-59.4	-38.8	-179.3	-53.5	0	0	0	0	112.6	P360 S361 K368	P360-T364 PolarHBondContact O-N 2.04Å; P360-T364 PolarHBondContact O-OG1 3.34Å; S361-T364 WeakPolarHBondContact CA-OG1 3.46Å; T364-K368 WeakPolarHBondContact O-CG 3.44Å; T364-K368 PolarHBondContact O-N 3.06Å
365	A	70.7	Confident	67.3	Low	64 Å²	64	78 Å²	78	53%	0.529	43%	0.427	S	S	.	.	H	α-helix	trans	-67.4	-49.6	178.9	0	0	0	0	0	111.6	L363 C367 K368 D369	L363-A365 VanDerWaalsContact C-N 3.3Å; L363-A365 PolarHBondContact O-N 3.09Å; A365-C367 VanDerWaalsContact C-N 3.28Å; A365-C367 PolarHBondContact O-N 3.38Å; A365-K368 PolarHBondContact O-N 3.15Å; A365-K368 VanDerWaalsContact O-N 3.11Å; A365-D369 PolarHBondContact O-N 3.43Å
366	Q	63.7	Low	66.9	Low	131 Å²	131	82 Å²	82	61%	0.612	44%	0.444	S	S	*	.	H	α-helix	trans	-64.4	-34.3	178.3	-63.7	176.2	24.5	0	0	112.1	L363 L370	L363-Q366 PolarHBondContact O-N 3.39Å; Q366-L370 WeakPolarHBondContact O-CB 3.16Å; Q366-L370 PolarHBondContact O-N 2.95Å
367	C	70.3	Confident	66.5	Low	13 Å²	13	84.3 Å²	84.3	9%	0.088	46%	0.464	C	S	.	.	H	α-helix	trans	-65.8	-42.5	173.2	179.6	0	0	0	0	111.9	C356 L359 L363 A365 D369 L370 V371	C356-C367 WeakPolarHBondContact CA-SG 3.16Å; C356-C367 HydrophobicContact CB-CB 3.73Å; C356-C367 WeakPolarHBondContact CB-SG 3.21Å; C356-C367 WeakPolarHBondContact SG-CB 3.06Å; C356-C367 PolarHBondContact SG-O 3.41Å; C356-C367 CovalentContact SG-SG 2.05Å; C356-C367 PolarHBondContact SG-SG 2.85Å; L359-C367 HydrophobicContact CD1-CB 3.46Å; L359-C367 VanDerWaalsContact CD1-CB 3.46Å; L359-C367 WeakPolarHBondContact CD1-SG 3.46Å; L363-C367 VanDerWaalsContact O-CB 3.29Å; L363-C367 WeakPolarHBondContact O-CB 3.44Å; L363-C367 PolarHBondContact O-N 3.22Å; A365-C367 VanDerWaalsContact C-N 3.28Å; A365-C367 PolarHBondContact O-N 3.38Å; C367-D369 VanDerWaalsContact C-N 3.35Å; C367-L370 WeakPolarHBondContact O-CB 3.43Å; C367-L370 PolarHBondContact O-N 3.39Å; C367-V371 WeakPolarHBondContact O-CB 3.12Å; C367-V371 WeakPolarHBondContact O-CG2 3.44Å; C367-V371 PolarHBondContact O-N 2.99Å
368	K	72.6	Confident	66.1	Low	109 Å²	109	80.9 Å²	80.9	47%	0.474	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-43.5	177	-77.8	-177.8	175.3	-167.2	0	111.2	C356 T364 A365 L370 V371 E372	C356-K368 HydrophobicContact CB-CG 4.12Å; C356-K368 PolarHBondContact SG-N 3.07Å; T364-K368 WeakPolarHBondContact O-CG 3.44Å; T364-K368 PolarHBondContact O-N 3.06Å; A365-K368 PolarHBondContact O-N 3.15Å; A365-K368 VanDerWaalsContact O-N 3.11Å; K368-L370 VanDerWaalsContact C-N 3.28Å; K368-L370 PolarHBondContact O-N 3.15Å; K368-V371 PolarHBondContact O-N 2.72Å; K368-E372 WeakPolarHBondContact O-CB 3.26Å; K368-E372 WeakPolarHBondContact O-CG 3.48Å; K368-E372 PolarHBondContact O-N 2.7Å
369	D	72.6	Confident	66.2	Low	98 Å²	98	74.8 Å²	74.8	52%	0.524	42%	0.415	S	S	.	.	H	α-helix	trans	-60.6	-39.6	174.8	-66.3	-8.9	0	0	0	111.4	A365 C367 E372 T373	A365-D369 PolarHBondContact O-N 3.43Å; C367-D369 VanDerWaalsContact C-N 3.35Å; D369-E372 PolarHBondContact O-N 3.47Å; D369-T373 VanDerWaalsContact O-CB 3.26Å; D369-T373 WeakPolarHBondContact O-CB 3.33Å; D369-T373 PolarHBondContact O-N 3.06Å; D369-T373 PolarHBondContact O-OG1 3.26Å
370	L	68	Low	66.7	Low	96 Å²	96	76.8 Å²	76.8	50%	0.503	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-43.3	175.7	-167.8	82.9	0	0	0	111.9	Q366 C367 K368 T373 Y374	Q366-L370 WeakPolarHBondContact O-CB 3.16Å; Q366-L370 PolarHBondContact O-N 2.95Å; C367-L370 WeakPolarHBondContact O-CB 3.43Å; C367-L370 PolarHBondContact O-N 3.39Å; K368-L370 VanDerWaalsContact C-N 3.28Å; K368-L370 PolarHBondContact O-N 3.15Å; L370-T373 PolarHBondContact O-N 2.84Å; L370-Y374 HydrophobicContact CD1-CD2 3.5Å; L370-Y374 VanDerWaalsContact CD1-CD2 3.5Å; L370-Y374 HydrophobicContact CD1-CE2 3.6Å; L370-Y374 HydrophobicContact CG-CD2 3.87Å; L370-Y374 HydrophobicContact CG-CE2 4.45Å; L370-Y374 WeakPolarHBondContact O-CB 3.04Å; L370-Y374 WeakPolarHBondContact O-CD2 3.29Å; L370-Y374 PolarHBondContact O-N 3.2Å
371	V	73.5	Confident	66.6	Low	24 Å²	24	75 Å²	75	15%	0.145	41%	0.409	C	S	.	.	H	α-helix	trans	-68.9	-36.7	177.2	166.5	0	0	0	0	111.2	V352 C356 C367 K368 T373 G375	V352-V371 HydrophobicContact CG1-CG1 3.72Å; V352-V371 HydrophobicContact CG1-CG2 4.09Å; C356-V371 VanDerWaalsContact SG-CG2 3.58Å; C367-V371 WeakPolarHBondContact O-CB 3.12Å; C367-V371 WeakPolarHBondContact O-CG2 3.44Å; C367-V371 PolarHBondContact O-N 2.99Å; K368-V371 PolarHBondContact O-N 2.72Å; V371-T373 VanDerWaalsContact C-N 3.34Å; V371-G375 WeakPolarHBondContact O-CA 3.26Å; V371-G375 PolarHBondContact O-N 3.01Å
372	E	72	Confident	66.6	Low	159 Å²	159	70.3 Å²	70.3	74%	0.743	38%	0.375	S	S	*	.	H	α-helix	trans	-68.3	-35.3	174	-75.2	179.1	-174.6	0	0	111.7	K368 D369	K368-E372 WeakPolarHBondContact O-CB 3.26Å; K368-E372 WeakPolarHBondContact O-CG 3.48Å; K368-E372 PolarHBondContact O-N 2.7Å; D369-E372 PolarHBondContact O-N 3.47Å
373	T	68.9	Low	66.5	Low	95 Å²	95	70.2 Å²	70.2	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-80.3	-39.4	-178.2	-55.3	0	0	0	0	112.9	D369 L370 V371	D369-T373 VanDerWaalsContact O-CB 3.26Å; D369-T373 WeakPolarHBondContact O-CB 3.33Å; D369-T373 PolarHBondContact O-N 3.06Å; D369-T373 PolarHBondContact O-OG1 3.26Å; L370-T373 PolarHBondContact O-N 2.84Å; V371-T373 VanDerWaalsContact C-N 3.34Å
374	Y	65.1	Low	67	Low	132 Å²	132	73.4 Å²	73.4	52%	0.518	38%	0.383	S	S	.	.	H	α-helix	trans	-118.3	-3.2	-171	-57.9	-75	0	0	0	113.5	L370 Q376 A377 I378	L370-Y374 HydrophobicContact CD1-CD2 3.5Å; L370-Y374 VanDerWaalsContact CD1-CD2 3.5Å; L370-Y374 HydrophobicContact CD1-CE2 3.6Å; L370-Y374 HydrophobicContact CG-CD2 3.87Å; L370-Y374 HydrophobicContact CG-CE2 4.45Å; L370-Y374 WeakPolarHBondContact O-CB 3.04Å; L370-Y374 WeakPolarHBondContact O-CD2 3.29Å; L370-Y374 PolarHBondContact O-N 3.2Å; Y374-Q376 VanDerWaalsContact C-N 3.32Å; Y374-Q376 PolarHBondContact O-N 2.94Å; Y374-A377 PolarHBondContact O-N 3.18Å; Y374-A377 VanDerWaalsContact O-N 3.13Å; Y374-I378 WeakPolarHBondContact O-CG1 3.1Å; Y374-I378 PolarHBondContact O-N 3.19Å
375	G	67.3	Low	66.5	Low	4 Å²	4	79 Å²	79	4%	0.041	41%	0.407	C	S	.	.	H	α-helix	trans	-56.2	-43	-174.7	0	0	0	0	0	112.8	V371 A377 I378 I379	V371-G375 WeakPolarHBondContact O-CA 3.26Å; V371-G375 PolarHBondContact O-N 3.01Å; G375-A377 PolarHBondContact O-N 2.82Å; G375-I378 CarbonylContact O-C 3.59Å; G375-I378 PolarHBondContact O-N 3.25Å; G375-I378 VanDerWaalsContact O-N 3.16Å; G375-I379 WeakPolarHBondContact O-CB 3.42Å; G375-I379 VanDerWaalsContact O-CD1 3.26Å; G375-I379 WeakPolarHBondContact O-CD1 3.02Å; G375-I379 WeakPolarHBondContact O-CG1 3.45Å; G375-I379 PolarHBondContact O-N 2.88Å
376	Q	66.5	Low	66	Low	102 Å²	102	77 Å²	77	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-41.7	179.3	-164.8	65.2	23.6	0	0	112.3	Y374 I378 I379 E380	Y374-Q376 VanDerWaalsContact C-N 3.32Å; Y374-Q376 PolarHBondContact O-N 2.94Å; Q376-I378 VanDerWaalsContact C-N 3.35Å; Q376-I379 PolarHBondContact O-N 3.17Å; Q376-E380 WeakPolarHBondContact O-CG 3.44Å; Q376-E380 PolarHBondContact O-N 3.46Å
377	A	63.9	Low	66.2	Low	51 Å²	51	74.5 Å²	74.5	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-36.7	176.1	0	0	0	0	0	111.9	Y374 G375 L381	Y374-A377 PolarHBondContact O-N 3.18Å; Y374-A377 VanDerWaalsContact O-N 3.13Å; G375-A377 PolarHBondContact O-N 2.82Å; A377-L381 WeakPolarHBondContact O-CB 3Å; A377-L381 WeakPolarHBondContact O-CD1 3.32Å; A377-L381 VanDerWaalsContact O-CG 3.23Å; A377-L381 WeakPolarHBondContact O-CG 3.21Å; A377-L381 PolarHBondContact O-N 3.25Å
378	I	65.2	Low	66.1	Low	24 Å²	24	74.5 Å²	74.5	12%	0.123	38%	0.381	C	S	.	.	H	α-helix	trans	-67.6	-41	175.4	-65.7	166	0	0	0	110.5	V352 Y374 G375 Q376 L381 L382	V352-I378 HydrophobicContact CG1-CG2 4.49Å; V352-I378 HydrophobicContact CG2-CG2 4.17Å; Y374-I378 WeakPolarHBondContact O-CG1 3.1Å; Y374-I378 PolarHBondContact O-N 3.19Å; G375-I378 CarbonylContact O-C 3.59Å; G375-I378 PolarHBondContact O-N 3.25Å; G375-I378 VanDerWaalsContact O-N 3.16Å; Q376-I378 VanDerWaalsContact C-N 3.35Å; I378-L381 PolarHBondContact O-N 3.34Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.39Å; I378-L382 WeakPolarHBondContact O-CB 3.33Å; I378-L382 VanDerWaalsContact O-CG 3.24Å; I378-L382 WeakPolarHBondContact O-CG 3.46Å; I378-L382 PolarHBondContact O-N 2.91Å
379	I	67.8	Low	65.8	Low	10 Å²	10	73.4 Å²	73.4	5%	0.051	38%	0.376	C	S	.	.	H	α-helix	trans	-62.4	-46.9	176.1	-68.8	156	0	0	0	110	E345 V348 V349 V352 G375 Q376 L381 L382 V383	E345-I379 HydrophobicContact CG-CG2 4.15Å; V348-I379 HydrophobicContact CB-CG2 4.24Å; V348-I379 HydrophobicContact CG1-CB 4.13Å; V348-I379 HydrophobicContact CG1-CG1 3.94Å; V348-I379 HydrophobicContact CG1-CG2 3.92Å; V349-I379 HydrophobicContact CB-CD1 4.27Å; V349-I379 HydrophobicContact CG2-CD1 3.44Å; V349-I379 VanDerWaalsContact CG2-CD1 3.44Å; V349-I379 HydrophobicContact CG2-CG1 4.27Å; V352-I379 HydrophobicContact CG2-CG1 4.3Å; G375-I379 WeakPolarHBondContact O-CB 3.42Å; G375-I379 VanDerWaalsContact O-CD1 3.26Å; G375-I379 WeakPolarHBondContact O-CD1 3.02Å; G375-I379 WeakPolarHBondContact O-CG1 3.45Å; G375-I379 PolarHBondContact O-N 2.88Å; Q376-I379 PolarHBondContact O-N 3.17Å; I379-L381 VanDerWaalsContact C-N 3.34Å; I379-L381 PolarHBondContact O-N 2.88Å; I379-L382 PolarHBondContact O-N 3.35Å; I379-V383 HydrophobicContact CG2-CG2 4.34Å; I379-V383 WeakPolarHBondContact O-CB 3.36Å; I379-V383 VanDerWaalsContact O-CG2 3.25Å; I379-V383 WeakPolarHBondContact O-CG2 3.42Å; I379-V383 PolarHBondContact O-N 3.37Å
380	E	65.3	Low	65.7	Low	107 Å²	107	71.9 Å²	71.9	50%	0.5	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-38.8	177.2	-77.2	178.2	-174.6	0	0	112.8	Q376 Q384	Q376-E380 WeakPolarHBondContact O-CG 3.44Å; Q376-E380 PolarHBondContact O-N 3.46Å; E380-Q384 VanDerWaalsContact O-CG 3.27Å; E380-Q384 WeakPolarHBondContact O-CG 3.49Å; E380-Q384 PolarHBondContact O-N 3.46Å
381	L	62.5	Low	66	Low	41 Å²	41	67.3 Å²	67.3	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-70.1	-35.2	176.6	-72.2	169.8	0	0	0	112.6	A377 I378 I379 Q384 A386 V391	A377-L381 WeakPolarHBondContact O-CB 3Å; A377-L381 WeakPolarHBondContact O-CD1 3.32Å; A377-L381 VanDerWaalsContact O-CG 3.23Å; A377-L381 WeakPolarHBondContact O-CG 3.21Å; A377-L381 PolarHBondContact O-N 3.25Å; I378-L381 PolarHBondContact O-N 3.34Å; I379-L381 VanDerWaalsContact C-N 3.34Å; I379-L381 PolarHBondContact O-N 2.88Å; L381-Q384 PolarHBondContact O-N 3.09Å; L381-A386 WeakPolarHBondContact O-CB 3.41Å; L381-A386 PolarHBondContact O-N 3.02Å; L381-V391 HydrophobicContact CB-CG2 4.32Å; L381-V391 HydrophobicContact CD1-CG1 4.26Å
382	L	60.8	Low	65.8	Low	18 Å²	18	66.2 Å²	66.2	9%	0.094	34%	0.34	C	S	.	.	H	α-helix	trans	-73.4	-37.9	177.1	-74.8	169.8	0	0	0	112.3	M332 L335 L339 V348 V352 I378 I379 Q384 Q385	M332-L382 HydrophobicContact CE-CD2 3.42Å; M332-L382 VanDerWaalsContact CE-CD2 3.42Å; M332-L382 HydrophobicContact CE-CG 4.1Å; L335-L382 HydrophobicContact CB-CD1 4.43Å; L335-L382 HydrophobicContact CB-CD2 4.47Å; L335-L382 HydrophobicContact CD1-CD1 4.22Å; L339-L382 HydrophobicContact CD1-CD1 4.33Å; V348-L382 HydrophobicContact CG1-CB 4Å; V348-L382 HydrophobicContact CG1-CD1 3.99Å; V352-L382 HydrophobicContact CG2-CD1 3.89Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.39Å; I378-L382 WeakPolarHBondContact O-CB 3.33Å; I378-L382 VanDerWaalsContact O-CG 3.24Å; I378-L382 WeakPolarHBondContact O-CG 3.46Å; I378-L382 PolarHBondContact O-N 2.91Å; I379-L382 PolarHBondContact O-N 3.35Å; L382-Q384 PolarHBondContact O-N 3.25Å; L382-Q385 PolarHBondContact O-N 3.26Å; L382-Q385 VanDerWaalsContact O-N 3.1Å
383	V	62.7	Low	65.9	Low	86 Å²	86	61.2 Å²	61.2	52%	0.521	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-27.7	174.1	170.8	0	0	0	0	111.4	V348 I379 Q385	V348-V383 HydrophobicContact CG2-CG2 4.24Å; I379-V383 HydrophobicContact CG2-CG2 4.34Å; I379-V383 WeakPolarHBondContact O-CB 3.36Å; I379-V383 VanDerWaalsContact O-CG2 3.25Å; I379-V383 WeakPolarHBondContact O-CG2 3.42Å; I379-V383 PolarHBondContact O-N 3.37Å; V383-Q385 VanDerWaalsContact C-N 3.26Å; V383-Q385 PolarHBondContact O-N 3Å
384	Q	60.3	Low	65.8	Low	142 Å²	142	61.6 Å²	61.6	66%	0.664	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	3.7	176.1	-69.9	176.1	32.1	0	0	114.2	E380 L381 L382 A386	E380-Q384 VanDerWaalsContact O-CG 3.27Å; E380-Q384 WeakPolarHBondContact O-CG 3.49Å; E380-Q384 PolarHBondContact O-N 3.46Å; L381-Q384 PolarHBondContact O-N 3.09Å; L382-Q384 PolarHBondContact O-N 3.25Å; Q384-A386 PolarHBondContact O-N 2.04Å
385	Q	57.8	Low	65.8	Low	154 Å²	154	58.9 Å²	58.9	72%	0.72	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	38.9	-176.5	-57.5	-170.9	24.3	0	0	113	L382 V383	L382-Q385 PolarHBondContact O-N 3.26Å; L382-Q385 VanDerWaalsContact O-N 3.1Å; V383-Q385 VanDerWaalsContact C-N 3.26Å; V383-Q385 PolarHBondContact O-N 3Å
386	A	59.6	Low	65.7	Low	21 Å²	21	61.1 Å²	61.1	17%	0.174	34%	0.34	C	S	.	.			trans	-71.1	134.7	175.7	0	0	0	0	0	110.2	L381 Q384 V391	L381-A386 WeakPolarHBondContact O-CB 3.41Å; L381-A386 PolarHBondContact O-N 3.02Å; Q384-A386 PolarHBondContact O-N 2.04Å; A386-V391 HydrophobicContact CB-CG2 3.66Å
387	D	67.1	Low	65.8	Low	78 Å²	78	59.7 Å²	59.7	42%	0.417	34%	0.335	S	S	.	.			trans	-64.1	149.2	-179.3	74.5	-94	0	0	0	111.7	K389 T390 V391	D387-K389 PolarHBondContact O-N 3.34Å; D387-K389 WeakPolarHBondContact OD2-CA 3.28Å; D387-K389 VanDerWaalsContact OD2-CB 3.31Å; D387-K389 WeakPolarHBondContact OD2-CB 3.36Å; D387-K389 PolarHBondContact OD2-N 2.75Å; D387-K389 VanDerWaalsContact OD2-N 3.1Å; D387-T390 VanDerWaalsContact CG-OG1 3.25Å; D387-T390 PolarHBondContact O-N 2.93Å; D387-T390 WeakPolarHBondContact OD1-CB 3.07Å; D387-T390 PolarHBondContact OD1-OG1 2.93Å; D387-T390 PolarHBondContact OD2-N 3.21Å; D387-T390 PolarHBondContact OD2-OG1 3.11Å; D387-V391 PolarHBondContact O-N 3.23Å
388	P	68.9	Low	66.2	Low	14 Å²	14	57.5 Å²	57.5	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-54.8	-35	-173.9	-32.4	41.6	0	0	0	113.4	M332 K333 E336 C392	M332-P388 HydrophobicContact CB-CB 3.61Å; M332-P388 HydrophobicContact CB-CG 4.24Å; K333-P388 HydrophobicContact CG-CB 4.22Å; K333-P388 HydrophobicContact CG-CG 3.85Å; E336-P388 VanDerWaalsContact CD-CG 3.41Å; E336-P388 WeakPolarHBondContact OE1-CD 3.16Å; E336-P388 WeakPolarHBondContact OE1-CG 3.4Å; E336-P388 VanDerWaalsContact OE2-CG 3.22Å; E336-P388 WeakPolarHBondContact OE2-CG 3.26Å; P388-C392 WeakPolarHBondContact O-CB 3.48Å; P388-C392 PolarHBondContact O-N 3.24Å; P388-C392 PolarHBondContact O-SG 3.18Å
389	K	67	Low	66.4	Low	85 Å²	85	63.3 Å²	63.3	37%	0.37	35%	0.348	S	S	.	.	H	α-helix	trans	-75.4	-39.2	-176.5	-174.7	-179.2	-157.5	79.3	0	111	E321 E329 D387 C392 T393	E321-K389 VanDerWaalsContact CD-NZ 3.35Å; E321-K389 IonicContact OE1-NZ 2.83Å; E321-K389 PolarHBondContact OE1-NZ 2.78Å; E321-K389 IonicContact OE2-NZ 3.77Å; E321-K389 PolarHBondContact OE2-NZ 3.41Å; E329-K389 VanDerWaalsContact OE1-CG 3.31Å; E329-K389 WeakPolarHBondContact OE1-CG 3.5Å; E329-K389 IonicContact OE1-NZ 3.62Å; E329-K389 PolarHBondContact OE1-NZ 3.01Å; D387-K389 PolarHBondContact O-N 3.34Å; D387-K389 WeakPolarHBondContact OD2-CA 3.28Å; D387-K389 VanDerWaalsContact OD2-CB 3.31Å; D387-K389 WeakPolarHBondContact OD2-CB 3.36Å; D387-K389 PolarHBondContact OD2-N 2.75Å; D387-K389 VanDerWaalsContact OD2-N 3.1Å; K389-C392 PolarHBondContact O-N 3.36Å; K389-T393 WeakPolarHBondContact O-CB 3.37Å; K389-T393 PolarHBondContact O-N 2.96Å; K389-T393 PolarHBondContact O-OG1 3.24Å
390	T	70.3	Confident	65.9	Low	66 Å²	66	65 Å²	65	41%	0.405	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-46.1	173	-67.6	0	0	0	0	110.8	D387 C392 T393 V394	D387-T390 VanDerWaalsContact CG-OG1 3.25Å; D387-T390 PolarHBondContact O-N 2.93Å; D387-T390 WeakPolarHBondContact OD1-CB 3.07Å; D387-T390 PolarHBondContact OD1-OG1 2.93Å; D387-T390 PolarHBondContact OD2-N 3.21Å; D387-T390 PolarHBondContact OD2-OG1 3.11Å; T390-C392 VanDerWaalsContact C-N 3.35Å; T390-C392 PolarHBondContact O-N 2.83Å; T390-T393 PolarHBondContact O-N 2.85Å; T390-V394 HydrophobicContact CG2-CG2 4.37Å; T390-V394 WeakPolarHBondContact O-CB 3.42Å; T390-V394 VanDerWaalsContact O-CG2 3.28Å; T390-V394 WeakPolarHBondContact O-CG2 3.29Å; T390-V394 PolarHBondContact O-N 3.34Å
391	V	73.3	Confident	65.2	Low	1 Å²	1	63.8 Å²	63.8	1%	0.006	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-47.3	176.2	177.5	0	0	0	0	110.9	M332 L381 A386 D387 T393 V394 L395	M332-V391 HydrophobicContact CE-CB 3.79Å; M332-V391 HydrophobicContact CE-CG1 3.55Å; M332-V391 HydrophobicContact CE-CG2 3.85Å; M332-V391 HydrophobicContact CG-CB 4.48Å; M332-V391 HydrophobicContact CG-CG1 4.31Å; M332-V391 HydrophobicContact SD-CB 4.41Å; M332-V391 HydrophobicContact SD-CG1 3.77Å; L381-V391 HydrophobicContact CB-CG2 4.32Å; L381-V391 HydrophobicContact CD1-CG1 4.26Å; A386-V391 HydrophobicContact CB-CG2 3.66Å; D387-V391 PolarHBondContact O-N 3.23Å; V391-T393 VanDerWaalsContact C-N 3.28Å; V391-T393 PolarHBondContact O-N 3.03Å; V391-V394 PolarHBondContact O-N 2.7Å; V391-L395 HydrophobicContact CG1-CD1 3.82Å; V391-L395 HydrophobicContact CG1-CG 4.29Å; V391-L395 WeakPolarHBondContact O-CB 3.31Å; V391-L395 VanDerWaalsContact O-CG 3.26Å; V391-L395 WeakPolarHBondContact O-CG 3.46Å; V391-L395 PolarHBondContact O-N 3.46Å
392	C	69.5	Low	64.2	Low	0 Å²	0	69.3 Å²	69.3	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-67.1	-27.1	179.4	-67	0	0	0	0	114.6	C328 E329 P388 K389 T390 G396 L397 C398	C328-C392 VanDerWaalsContact CA-SG 3.59Å; C328-C392 HydrophobicContact CB-CB 3.72Å; C328-C392 WeakPolarHBondContact CB-SG 3.26Å; C328-C392 PolarHBondContact O-SG 2.71Å; C328-C392 WeakPolarHBondContact SG-CA 3.18Å; C328-C392 WeakPolarHBondContact SG-CB 3.48Å; C328-C392 CovalentContact SG-SG 2.02Å; C328-C392 PolarHBondContact SG-SG 3.17Å; E329-C392 PolarHBondContact N-SG 2.64Å; P388-C392 WeakPolarHBondContact O-CB 3.48Å; P388-C392 PolarHBondContact O-N 3.24Å; P388-C392 PolarHBondContact O-SG 3.18Å; K389-C392 PolarHBondContact O-N 3.36Å; T390-C392 VanDerWaalsContact C-N 3.35Å; T390-C392 PolarHBondContact O-N 2.83Å; C392-G396 PolarHBondContact O-N 3.18Å; C392-L397 PolarHBondContact O-N 3.36Å; C392-C398 HydrophobicContact CB-CB 4.38Å; C392-C398 WeakPolarHBondContact CB-SG 3.23Å; C392-C398 PolarHBondContact O-N 3.46Å
393	T	74.3	Confident	63.6	Low	55 Å²	55	76.8 Å²	76.8	34%	0.337	43%	0.433	S	S	.	.	H	α-helix	trans	-75.7	-40.5	173.5	-55.9	0	0	0	0	111	K389 T390 V391 L395 G396	K389-T393 WeakPolarHBondContact O-CB 3.37Å; K389-T393 PolarHBondContact O-N 2.96Å; K389-T393 PolarHBondContact O-OG1 3.24Å; T390-T393 PolarHBondContact O-N 2.85Å; V391-T393 VanDerWaalsContact C-N 3.28Å; V391-T393 PolarHBondContact O-N 3.03Å; T393-L395 VanDerWaalsContact C-N 3.32Å; T393-L395 PolarHBondContact O-N 3.4Å; T393-G396 PolarHBondContact O-N 3.47Å
394	V	67.4	Low	62.3	Low	102 Å²	102	75.6 Å²	75.6	62%	0.618	43%	0.432	S	S	*	.	H	α-helix	trans	-64.5	-38	175	169.9	0	0	0	0	111.3	T390 V391 G396	T390-V394 HydrophobicContact CG2-CG2 4.37Å; T390-V394 WeakPolarHBondContact O-CB 3.42Å; T390-V394 VanDerWaalsContact O-CG2 3.28Å; T390-V394 WeakPolarHBondContact O-CG2 3.29Å; T390-V394 PolarHBondContact O-N 3.34Å; V391-V394 PolarHBondContact O-N 2.7Å; V394-G396 PolarHBondContact O-N 3.06Å
395	L	64.7	Low	61.4	Low	75 Å²	75	74.7 Å²	74.7	39%	0.393	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-2.6	173.3	-66.2	174.3	0	0	0	113.4	V391 T393 L397	V391-L395 HydrophobicContact CG1-CD1 3.82Å; V391-L395 HydrophobicContact CG1-CG 4.29Å; V391-L395 WeakPolarHBondContact O-CB 3.31Å; V391-L395 VanDerWaalsContact O-CG 3.26Å; V391-L395 WeakPolarHBondContact O-CG 3.46Å; V391-L395 PolarHBondContact O-N 3.46Å; T393-L395 VanDerWaalsContact C-N 3.32Å; T393-L395 PolarHBondContact O-N 3.4Å; L395-L397 HydrophobicContact CB-CD1 4.06Å; L395-L397 HydrophobicContact CB-CG 4.15Å; L395-L397 HydrophobicContact CD1-CD1 4.37Å; L395-L397 PolarHBondContact O-N 3.16Å
396	G	65.6	Low	60.5	Low	52 Å²	52	72.5 Å²	72.5	54%	0.536	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	10.3	-179.9	0	0	0	0	0	114.5	C392 T393 V394	C392-G396 PolarHBondContact O-N 3.18Å; T393-G396 PolarHBondContact O-N 3.47Å; V394-G396 PolarHBondContact O-N 3.06Å
397	L	68.6	Low	59.6	Low	71 Å²	71	75.4 Å²	75.4	37%	0.372	43%	0.431	S	S	.	.	S	Bend	trans	-83.7	-26.1	-179.5	-64.2	172.2	0	0	0	111.9	S322 T324 C325 C328 C392 L395	S322-L397 PolarHBondContact OG-O 3.02Å; T324-L397 PolarHBondContact OG1-O 3.36Å; T324-L397 VanDerWaalsContact OG1-O 3.12Å; C325-L397 WeakPolarHBondContact CA-O 3.27Å; C325-L397 WeakPolarHBondContact CB-O 3.39Å; C325-L397 PolarHBondContact N-O 3.03Å; C328-L397 HydrophobicContact CB-CB 3.98Å; C328-L397 HydrophobicContact CB-CD1 3.8Å; C392-L397 PolarHBondContact O-N 3.36Å; L395-L397 HydrophobicContact CB-CD1 4.06Å; L395-L397 HydrophobicContact CB-CG 4.15Å; L395-L397 HydrophobicContact CD1-CD1 4.37Å; L395-L397 PolarHBondContact O-N 3.16Å
398	C	71.8	Confident	58.5	Low	6 Å²	6	73.1 Å²	73.1	4%	0.041	42%	0.423	C	S	.	.	S	Bend	trans	-106.2	129.3	164.9	-63.5	0	0	0	0	109.4	C325 C392 G400	C325-C398 WeakPolarHBondContact CA-SG 3.41Å; C325-C398 HydrophobicContact CB-CB 3.88Å; C325-C398 WeakPolarHBondContact CB-SG 3.08Å; C325-C398 WeakPolarHBondContact SG-CB 3.41Å; C325-C398 CovalentContact SG-SG 2.03Å; C325-C398 PolarHBondContact SG-SG 3.19Å; C392-C398 HydrophobicContact CB-CB 4.38Å; C392-C398 WeakPolarHBondContact CB-SG 3.23Å; C392-C398 PolarHBondContact O-N 3.46Å; C398-G400 PolarHBondContact O-N 3.19Å
399	N	68.4	Low	57.3	Low	145 Å²	145	79.9 Å²	79.9	78%	0.775	46%	0.457	S	S	*	.			trans	-72.2	126.8	167.4	-69.7	-30.5	0	0	0	108.2	A401	N399-A401 PolarHBondContact O-N 3Å
400	G	57.6	Low	56.2	Low	47 Å²	47	80.3 Å²	80.3	49%	0.485	46%	0.464	S	S	.	.			trans	-49	137	167.1	0	0	0	0	0	108.9	C398 D402	C398-G400 PolarHBondContact O-N 3.19Å; G400-D402 PolarHBondContact O-N 3.22Å
401	A	50.2	Low	55	Low	81 Å²	81	84.3 Å²	84.3	67%	0.669	48%	0.476	S	S	*	.	S	Bend	trans	-61.3	69.2	-161.9	0	0	0	0	0	115.3	N399	N399-A401 PolarHBondContact O-N 3Å
402	D	42.5	Very low	53.7	Low	157 Å²	157	87.2 Å²	87.2	84%	0.84	50%	0.5	S	S	*	.			trans	-93.1	132.6	167.3	-92.9	-32.9	0	0	0	110.5	G400 A404	G400-D402 PolarHBondContact O-N 3.22Å; D402-A404 PolarHBondContact O-N 3.31Å
403	R	47.8	Very low	52.4	Low	174 Å²	174	97.1 Å²	97.1	66%	0.657	54%	0.537	S	S	*	.			trans	-82.2	99.3	-159.2	-69.7	154.7	165.8	174.9	4	111.1	Y405	R403-Y405 HydrophobicContact CB-CD2 3.82Å; R403-Y405 HydrophobicContact CB-CE2 3.62Å; R403-Y405 HydrophobicContact CG-CD2 4.45Å; R403-Y405 HydrophobicContact CG-CE2 3.74Å; R403-Y405 PolarHBondContact O-N 3.19Å
404	A	35.9	Very low	50.9	Low	61 Å²	61	99.2 Å²	99.2	50%	0.504	54%	0.542	S	S	.	.			trans	-84	101.3	153.6	0	0	0	0	0	108.5	V319 D402	V319-A404 HydrophobicContact CG2-CB 4.08Å; V319-A404 VanDerWaalsContact CG2-O 3.29Å; V319-A404 WeakPolarHBondContact CG2-O 3.33Å; D402-A404 PolarHBondContact O-N 3.31Å
405	Y	42.2	Very low	49.8	Very low	124 Å²	124	101.2 Å²	101.2	49%	0.486	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.1	164.3	-72.9	-79.5	0	0	0	108.2	M316 R403	M316-Y405 HydrophobicContact CB-CD1 3.99Å; M316-Y405 HydrophobicContact SD-CG 4.42Å; R403-Y405 HydrophobicContact CB-CD2 3.82Å; R403-Y405 HydrophobicContact CB-CE2 3.62Å; R403-Y405 HydrophobicContact CG-CD2 4.45Å; R403-Y405 HydrophobicContact CG-CE2 3.74Å; R403-Y405 PolarHBondContact O-N 3.19Å
406	I	38.8	Very low	49	Very low	108 Å²	108	103.7 Å²	103.7	55%	0.554	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.9	147.5	169.4	52.4	174.1	0	0	0	109.3	V319 A408	V319-I406 HydrophobicContact CG2-CD1 4.28Å; V319-I406 HydrophobicContact CG2-CG1 4.19Å; I406-A408 PolarHBondContact O-N 2.04Å
407	V	39.7	Very low	48.5	Very low	81 Å²	81	104.3 Å²	104.3	49%	0.491	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-58.4	125.9	173.8	179.2	0	0	0	0	107.9	R314 L409	R314-V407 HydrophobicContact CB-CG1 4.32Å; V407-L409 PolarHBondContact O-N 3.49Å; V407-L409 VanDerWaalsContact O-N 3.16Å
408	A	43.5	Very low	48	Very low	31 Å²	31	102.3 Å²	102.3	26%	0.256	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-59.6	123.8	175.4	0	0	0	0	0	109.2	P315 V317 I406 D410	P315-A408 HydrophobicContact CB-CB 4.45Å; P315-A408 HydrophobicContact CG-CB 4.14Å; P315-A408 WeakPolarHBondContact O-CB 3.27Å; P315-A408 PolarHBondContact O-N 3.35Å; V317-A408 HydrophobicContact CG2-CB 4.03Å; I406-A408 PolarHBondContact O-N 2.04Å; A408-D410 PolarHBondContact O-N 3.46Å
409	L	44.6	Very low	47.5	Very low	155 Å²	155	110.5 Å²	110.5	81%	0.812	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-57.2	130.9	169.1	-94.9	151.3	0	0	0	108.8	V407 K411	V407-L409 PolarHBondContact O-N 3.49Å; V407-L409 VanDerWaalsContact O-N 3.16Å; L409-K411 PolarHBondContact O-N 3.39Å
410	D	43.6	Very low	47.5	Very low	95 Å²	95	104.8 Å²	104.8	51%	0.508	57%	0.568	S	S	.	*			trans	-60	107.5	-179.2	-174	0.6	0	0	0	109.7	A408 A412 R413 F414	A408-D410 PolarHBondContact O-N 3.46Å; D410-A412 PolarHBondContact O-N 3.46Å; D410-A412 VanDerWaalsContact O-N 3.1Å; D410-A412 WeakPolarHBondContact OD1-CB 3.32Å; D410-A412 PolarHBondContact OD1-N 3.14Å; D410-R413 HydrophobicContact CB-CB 4.5Å; D410-R413 PolarHBondContact O-N 2.95Å; D410-F414 PolarHBondContact O-N 3.35Å
411	K	45	Very low	48.4	Very low	149 Å²	149	108.1 Å²	108.1	65%	0.648	57%	0.571	S	S	*	*	H	α-helix	trans	-56.2	-28	-178.1	-167.4	-179.5	177.5	-169.2	0	111.8	L409 F414 E415	L409-K411 PolarHBondContact O-N 3.39Å; K411-F414 PolarHBondContact O-N 3.29Å; K411-E415 VanDerWaalsContact CE-OE1 3.25Å; K411-E415 WeakPolarHBondContact CE-OE1 3.4Å; K411-E415 IonicContact NZ-OE1 4Å; K411-E415 PolarHBondContact O-N 3.48Å; K411-E415 VanDerWaalsContact O-N 3.14Å
412	A	45.5	Very low	49.4	Very low	62 Å²	62	108.4 Å²	108.4	51%	0.512	56%	0.564	S	S	.	*	H	α-helix	trans	-70.6	-29.1	176.3	0	0	0	0	0	113.2	D410 V416	D410-A412 PolarHBondContact O-N 3.46Å; D410-A412 VanDerWaalsContact O-N 3.1Å; D410-A412 WeakPolarHBondContact OD1-CB 3.32Å; D410-A412 PolarHBondContact OD1-N 3.14Å; A412-V416 WeakPolarHBondContact O-CG2 3.11Å
413	R	42.8	Very low	50.8	Low	209 Å²	209	101.9 Å²	101.9	79%	0.789	53%	0.53	S	S	*	.	H	α-helix	trans	-77.4	-25.5	170.4	-81.6	-176.6	176.8	178.7	-1.3	112.7	D410	D410-R413 HydrophobicContact CB-CB 4.5Å; D410-R413 PolarHBondContact O-N 2.95Å
414	F	41.9	Very low	52.2	Low	98 Å²	98	96 Å²	96	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-78.3	-36.7	-178.1	-156	-94.9	0	0	0	112.6	D410 K411 G491	D410-F414 PolarHBondContact O-N 3.35Å; K411-F414 PolarHBondContact O-N 3.29Å; F414-G491 WeakPolarHBondContact CZ-O 3.21Å
415	E	45.7	Very low	53.9	Low	145 Å²	145	99.4 Å²	99.4	68%	0.678	52%	0.517	S	S	*	.	H	α-helix	trans	-83.5	-17.4	-179.6	-69.6	-171.5	-175.6	0	0	114.2	K411 G417	K411-E415 VanDerWaalsContact CE-OE1 3.25Å; K411-E415 WeakPolarHBondContact CE-OE1 3.4Å; K411-E415 IonicContact NZ-OE1 4Å; K411-E415 PolarHBondContact O-N 3.48Å; K411-E415 VanDerWaalsContact O-N 3.14Å; E415-G417 VanDerWaalsContact C-N 3.32Å; E415-G417 PolarHBondContact O-N 3.09Å
416	V	46.5	Very low	55.2	Low	126 Å²	126	95.8 Å²	95.8	76%	0.764	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	10	-174.2	178.3	0	0	0	0	114.2	A412	A412-V416 WeakPolarHBondContact O-CG2 3.11Å
417	G	55.2	Low	56.8	Low	66 Å²	66	91.4 Å²	91.4	68%	0.68	49%	0.491	S	S	*	.	S	Bend	trans	93.1	131.1	159.5	0	0	0	0	0	114.2	E415	E415-G417 VanDerWaalsContact C-N 3.32Å; E415-G417 PolarHBondContact O-N 3.09Å
418	G	57.9	Low	58.4	Low	29 Å²	29	90.3 Å²	90.3	30%	0.299	49%	0.486	S	S	.	.	S	Bend	trans	148.4	-52.8	174.2	0	0	0	0	0	111.1	C420 E421 V422	G418-C420 PolarHBondContact O-N 2.78Å; G418-E421 CarbonylContact O-C 3.59Å; G418-E421 PolarHBondContact O-N 3.12Å; G418-V422 WeakPolarHBondContact O-CB 3.44Å; G418-V422 WeakPolarHBondContact O-CG2 3.03Å; G418-V422 PolarHBondContact O-N 3.32Å
419	Y	62.4	Low	59.4	Low	177 Å²	177	96.8 Å²	96.8	69%	0.694	51%	0.505	S	S	*	.	H	α-helix	trans	-68	-42.4	-168.2	-121.6	-93.1	0	0	0	114.3	C423	Y419-C423 WeakPolarHBondContact O-CB 3.48Å; Y419-C423 PolarHBondContact O-N 3.37Å
420	C	69.4	Low	60.4	Low	25 Å²	25	91.3 Å²	91.3	17%	0.169	48%	0.477	C	S	.	.	H	α-helix	trans	-63.2	-43.7	174.1	178.3	0	0	0	0	111.1	G418 C423 K424 A492 C493	G418-C420 PolarHBondContact O-N 2.78Å; C420-C423 PolarHBondContact O-N 3.44Å; C420-K424 WeakPolarHBondContact O-CB 3.26Å; C420-K424 VanDerWaalsContact O-CG 3.29Å; C420-K424 WeakPolarHBondContact O-CG 3.25Å; C420-K424 PolarHBondContact O-N 3.28Å; C420-K424 VanDerWaalsContact SG-CE 3.51Å; C420-A492 VanDerWaalsContact CA-O 3.31Å; C420-A492 WeakPolarHBondContact CA-O 3.39Å; C420-A492 VanDerWaalsContact CB-O 3.3Å; C420-A492 WeakPolarHBondContact CB-O 3.08Å; C420-A492 PolarHBondContact N-O 2.92Å; C420-C493 WeakPolarHBondContact CA-SG 3.14Å; C420-C493 HydrophobicContact CB-CB 3.99Å; C420-C493 WeakPolarHBondContact CB-SG 3.37Å; C420-C493 VanDerWaalsContact SG-CA 3.54Å; C420-C493 WeakPolarHBondContact SG-CB 3.34Å; C420-C493 CovalentContact SG-SG 2.04Å; C420-C493 PolarHBondContact SG-SG 2.68Å
421	E	74.6	Confident	61.5	Low	117 Å²	117	88 Å²	88	55%	0.547	46%	0.459	S	S	.	.	H	α-helix	trans	-69.8	-38.1	178.7	-64	-54	139.7	0	0	112.8	G418 K424 M425	G418-E421 CarbonylContact O-C 3.59Å; G418-E421 PolarHBondContact O-N 3.12Å; E421-K424 PolarHBondContact O-N 3.34Å; E421-M425 WeakPolarHBondContact O-CB 3.43Å; E421-M425 PolarHBondContact O-N 2.97Å
422	V	72.9	Confident	62.4	Low	88 Å²	88	82.6 Å²	82.6	53%	0.533	45%	0.446	S	S	.	.	H	α-helix	trans	-67.6	-42	175.6	168.6	0	0	0	0	110	G418 M425 A426	G418-V422 WeakPolarHBondContact O-CB 3.44Å; G418-V422 WeakPolarHBondContact O-CG2 3.03Å; G418-V422 PolarHBondContact O-N 3.32Å; V422-M425 PolarHBondContact O-N 3.19Å; V422-A426 VanDerWaalsContact O-CB 3.29Å; V422-A426 WeakPolarHBondContact O-CB 3.13Å; V422-A426 PolarHBondContact O-N 3.4Å
423	C	71.3	Confident	62.9	Low	19 Å²	19	82 Å²	82	13%	0.128	43%	0.434	C	S	.	.	H	α-helix	trans	-61.7	-50.2	173	179.4	0	0	0	0	110.5	Y419 C420 M425 A426 V427 C487 A492	Y419-C423 WeakPolarHBondContact O-CB 3.48Å; Y419-C423 PolarHBondContact O-N 3.37Å; C420-C423 PolarHBondContact O-N 3.44Å; C423-M425 VanDerWaalsContact C-N 3.27Å; C423-M425 PolarHBondContact O-N 3.42Å; C423-A426 PolarHBondContact O-N 3.14Å; C423-V427 WeakPolarHBondContact O-CG2 3.25Å; C423-V427 PolarHBondContact O-N 3.24Å; C423-C487 HydrophobicContact CB-CB 3.84Å; C423-C487 WeakPolarHBondContact CB-SG 3.42Å; C423-C487 PolarHBondContact O-SG 3.49Å; C423-C487 VanDerWaalsContact O-SG 3.37Å; C423-C487 WeakPolarHBondContact SG-CA 3.31Å; C423-C487 WeakPolarHBondContact SG-CB 3.28Å; C423-C487 CovalentContact SG-SG 2.04Å; C423-C487 PolarHBondContact SG-SG 3.37Å; C423-A492 HydrophobicContact CB-CB 3.58Å
424	K	77.1	Confident	63.5	Low	51 Å²	51	73.3 Å²	73.3	22%	0.222	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-38.7	178.8	-74.2	-176.7	-166.3	-170.9	0	111.6	C420 E421 S428 P483 D484 C487 C493	C420-K424 WeakPolarHBondContact O-CB 3.26Å; C420-K424 VanDerWaalsContact O-CG 3.29Å; C420-K424 WeakPolarHBondContact O-CG 3.25Å; C420-K424 PolarHBondContact O-N 3.28Å; C420-K424 VanDerWaalsContact SG-CE 3.51Å; E421-K424 PolarHBondContact O-N 3.34Å; K424-S428 WeakPolarHBondContact O-CB 3.3Å; K424-S428 PolarHBondContact O-N 3.2Å; K424-S428 PolarHBondContact O-OG 3.37Å; K424-P483 HydrophobicContact CB-CB 4.32Å; K424-P483 HydrophobicContact CG-CB 4.36Å; K424-D484 WeakPolarHBondContact CE-OD1 3.25Å; K424-D484 IonicContact NZ-OD1 2.6Å; K424-D484 PolarHBondContact NZ-OD1 2.95Å; K424-C487 HydrophobicContact CG-CB 4.24Å; K424-C487 PolarHBondContact N-SG 2.04Å; K424-C493 WeakPolarHBondContact CE-SG 3.35Å
425	M	72.1	Confident	64.2	Low	133 Å²	133	73.8 Å²	73.8	66%	0.655	41%	0.406	S	S	*	.	H	α-helix	trans	-66.1	-43	176.2	-173.9	-176.4	-60.1	0	0	111.5	E421 V422 C423 S428 Y429	E421-M425 WeakPolarHBondContact O-CB 3.43Å; E421-M425 PolarHBondContact O-N 2.97Å; V422-M425 PolarHBondContact O-N 3.19Å; C423-M425 VanDerWaalsContact C-N 3.27Å; C423-M425 PolarHBondContact O-N 3.42Å; M425-S428 PolarHBondContact O-N 3.23Å; M425-Y429 WeakPolarHBondContact O-CB 3.4Å; M425-Y429 PolarHBondContact O-N 3.16Å
426	A	69.2	Low	64.4	Low	48 Å²	48	75.2 Å²	75.2	40%	0.397	41%	0.41	S	S	.	.	H	α-helix	trans	-64.7	-46.2	176.6	0	0	0	0	0	111.4	V422 C423 Y429 I430	V422-A426 VanDerWaalsContact O-CB 3.29Å; V422-A426 WeakPolarHBondContact O-CB 3.13Å; V422-A426 PolarHBondContact O-N 3.4Å; C423-A426 PolarHBondContact O-N 3.14Å; A426-Y429 PolarHBondContact O-N 3.22Å; A426-I430 VanDerWaalsContact O-CG1 3.26Å; A426-I430 WeakPolarHBondContact O-CG1 3.18Å; A426-I430 PolarHBondContact O-N 3.1Å
427	V	71.9	Confident	64.7	Low	16 Å²	16	76.9 Å²	76.9	10%	0.097	42%	0.415	C	S	.	.	H	α-helix	trans	-66.9	-39.9	177.5	-179.1	0	0	0	0	110.8	C423 Y429 I430 D431 P483 V486	C423-V427 WeakPolarHBondContact O-CG2 3.25Å; C423-V427 PolarHBondContact O-N 3.24Å; V427-Y429 VanDerWaalsContact C-N 3.33Å; V427-Y429 PolarHBondContact O-N 3Å; V427-I430 PolarHBondContact O-N 3.3Å; V427-D431 VanDerWaalsContact O-CB 3.26Å; V427-D431 WeakPolarHBondContact O-CB 3.28Å; V427-D431 PolarHBondContact O-N 2.92Å; V427-P483 HydrophobicContact CB-CB 3.98Å; V427-P483 HydrophobicContact CB-CG 4.46Å; V427-P483 HydrophobicContact CG1-CB 3.96Å; V427-P483 HydrophobicContact CG1-CG 4.09Å; V427-V486 HydrophobicContact CG1-CB 4.2Å; V427-V486 HydrophobicContact CG1-CG1 4.46Å; V427-V486 HydrophobicContact CG1-CG2 4.27Å; V427-V486 HydrophobicContact CG2-CB 4.17Å; V427-V486 HydrophobicContact CG2-CG1 3.75Å
428	S	72.6	Confident	64.7	Low	57 Å²	57	74.9 Å²	74.9	40%	0.399	39%	0.392	S	S	.	.	H	α-helix	trans	-67.3	-32.4	174.7	-57.1	0	0	0	0	112.8	K424 M425 G432 P483	K424-S428 WeakPolarHBondContact O-CB 3.3Å; K424-S428 PolarHBondContact O-N 3.2Å; K424-S428 PolarHBondContact O-OG 3.37Å; M425-S428 PolarHBondContact O-N 3.23Å; S428-G432 PolarHBondContact O-N 3.5Å; S428-P483 WeakPolarHBondContact OG-CG 3.31Å
429	Y	66.1	Low	65	Low	167 Å²	167	77.1 Å²	77.1	66%	0.655	40%	0.4	S	S	*	.	H	α-helix	trans	-70	-42.7	175.5	179.4	-103.4	0	0	0	110.9	M425 A426 V427 G432 I433	M425-Y429 WeakPolarHBondContact O-CB 3.4Å; M425-Y429 PolarHBondContact O-N 3.16Å; A426-Y429 PolarHBondContact O-N 3.22Å; V427-Y429 VanDerWaalsContact C-N 3.33Å; V427-Y429 PolarHBondContact O-N 3Å; Y429-G432 PolarHBondContact O-N 3.21Å; Y429-I433 HydrophobicContact CD1-CD1 3.79Å; Y429-I433 HydrophobicContact CE1-CD1 3.37Å; Y429-I433 HydrophobicContact CE1-CG1 4.47Å; Y429-I433 HydrophobicContact CE2-CD1 4.44Å; Y429-I433 HydrophobicContact CG-CD1 4.49Å; Y429-I433 VanDerWaalsContact O-CG1 3.32Å; Y429-I433 WeakPolarHBondContact O-CG1 3.29Å; Y429-I433 PolarHBondContact O-N 3.06Å
430	I	64.3	Low	64.9	Low	41 Å²	41	74.5 Å²	74.5	21%	0.21	39%	0.394	C	S	.	.	H	α-helix	trans	-62.7	-48.1	172.8	-67.8	165.1	0	0	0	109.8	A426 V427 G432 I433 L434 L481	A426-I430 VanDerWaalsContact O-CG1 3.26Å; A426-I430 WeakPolarHBondContact O-CG1 3.18Å; A426-I430 PolarHBondContact O-N 3.1Å; V427-I430 PolarHBondContact O-N 3.3Å; I430-G432 VanDerWaalsContact C-N 3.33Å; I430-G432 PolarHBondContact O-N 2.92Å; I430-I433 WeakPolarHBondContact O-CB 3.36Å; I430-I433 PolarHBondContact O-N 3.38Å; I430-I433 VanDerWaalsContact O-N 3.07Å; I430-L434 HydrophobicContact CG2-CD1 3.57Å; I430-L434 HydrophobicContact CG2-CG 4.29Å; I430-L434 WeakPolarHBondContact O-CB 3.48Å; I430-L434 WeakPolarHBondContact O-CG 3.21Å; I430-L434 PolarHBondContact O-N 3.43Å; I430-L481 HydrophobicContact CG2-CD2 4.16Å
431	D	66.1	Low	64.5	Low	25 Å²	25	80 Å²	80	13%	0.134	42%	0.417	C	S	.	.	H	α-helix	trans	-56.9	-44.2	175.5	-169.8	42.7	0	0	0	111.9	V427 I433 L434 E435 L481	V427-D431 VanDerWaalsContact O-CB 3.26Å; V427-D431 WeakPolarHBondContact O-CB 3.28Å; V427-D431 PolarHBondContact O-N 2.92Å; D431-I433 VanDerWaalsContact C-N 3.31Å; D431-I433 PolarHBondContact O-N 3.05Å; D431-L434 CarbonylContact O-C 3.42Å; D431-L434 PolarHBondContact O-N 3.47Å; D431-E435 PolarHBondContact O-N 3.11Å; D431-L481 HydrophobicContact CB-CB 4.15Å; D431-L481 VanDerWaalsContact OD1-CB 3.26Å; D431-L481 WeakPolarHBondContact OD1-CB 3.48Å; D431-L481 WeakPolarHBondContact OD1-CD1 3.49Å
432	G	63.9	Low	63.9	Low	36 Å²	36	79.2 Å²	79.2	37%	0.371	41%	0.413	S	S	.	.	H	α-helix	trans	-67.8	-23.5	176	0	0	0	0	0	115.1	S428 Y429 I430	S428-G432 PolarHBondContact O-N 3.5Å; Y429-G432 PolarHBondContact O-N 3.21Å; I430-G432 VanDerWaalsContact C-N 3.33Å; I430-G432 PolarHBondContact O-N 2.92Å
433	I	57.4	Low	63.4	Low	50 Å²	50	75.2 Å²	75.2	26%	0.256	39%	0.389	S	S	.	.	H	α-helix	trans	-75.2	-40.2	168.7	-70.4	166.2	0	0	0	109.6	Y429 I430 D431 A438 A446	Y429-I433 HydrophobicContact CD1-CD1 3.79Å; Y429-I433 HydrophobicContact CE1-CD1 3.37Å; Y429-I433 HydrophobicContact CE1-CG1 4.47Å; Y429-I433 HydrophobicContact CE2-CD1 4.44Å; Y429-I433 HydrophobicContact CG-CD1 4.49Å; Y429-I433 VanDerWaalsContact O-CG1 3.32Å; Y429-I433 WeakPolarHBondContact O-CG1 3.29Å; Y429-I433 PolarHBondContact O-N 3.06Å; I430-I433 WeakPolarHBondContact O-CB 3.36Å; I430-I433 PolarHBondContact O-N 3.38Å; I430-I433 VanDerWaalsContact O-N 3.07Å; D431-I433 VanDerWaalsContact C-N 3.31Å; D431-I433 PolarHBondContact O-N 3.05Å; I433-A438 WeakPolarHBondContact O-CB 3.2Å; I433-A446 HydrophobicContact CD1-CB 4.38Å
434	L	56	Low	63	Low	25 Å²	25	76.9 Å²	76.9	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-75.5	-30	-176	-66.7	174.7	0	0	0	114.1	I430 D431 K436 I443 L481	I430-L434 HydrophobicContact CG2-CD1 3.57Å; I430-L434 HydrophobicContact CG2-CG 4.29Å; I430-L434 WeakPolarHBondContact O-CB 3.48Å; I430-L434 WeakPolarHBondContact O-CG 3.21Å; I430-L434 PolarHBondContact O-N 3.43Å; D431-L434 CarbonylContact O-C 3.42Å; D431-L434 PolarHBondContact O-N 3.47Å; L434-K436 PolarHBondContact O-N 3.45Å; L434-I443 HydrophobicContact CD2-CB 4.05Å; L434-I443 HydrophobicContact CD2-CD1 3.24Å; L434-I443 HydrophobicContact CD2-CG1 3.29Å; L434-I443 HydrophobicContact CD2-CG2 3.76Å; L434-L481 HydrophobicContact CB-CD1 3.97Å; L434-L481 HydrophobicContact CD1-CD1 3.36Å; L434-L481 HydrophobicContact CD1-CD2 3.73Å; L434-L481 HydrophobicContact CD1-CG 4.15Å; L434-L481 HydrophobicContact CG-CD1 4.26Å
435	E	55.7	Low	62.6	Low	108 Å²	108	79.8 Å²	79.8	51%	0.505	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-15	177.3	-81	-167.8	148.4	0	0	113.9	D431 Y532	D431-E435 PolarHBondContact O-N 3.11Å; E435-Y532 PolarHBondContact OE1-OH 3.27Å
436	K	49.8	Very low	62.4	Low	175 Å²	175	74.4 Å²	74.4	76%	0.761	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	64.3	-177.7	-71.7	-173.1	-179.6	174.9	0	113.2	L434 A438	L434-K436 PolarHBondContact O-N 3.45Å; K436-A438 PolarHBondContact O-N 2.91Å
437	N	53.2	Low	62.3	Low	162 Å²	162	73 Å²	73	87%	0.866	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.1	39	173	-74.4	-26.9	0	0	0	113.1	T439	N437-T439 PolarHBondContact O-N 3.2Å
438	A	55.7	Low	62.2	Low	24 Å²	24	76 Å²	76	20%	0.198	38%	0.384	C	S	.	.			trans	-69.8	127.3	-175.7	0	0	0	0	0	109	I433 K436 E442 I443	I433-A438 WeakPolarHBondContact O-CB 3.2Å; K436-A438 PolarHBondContact O-N 2.91Å; A438-E442 VanDerWaalsContact CA-OE2 3.24Å; A438-E442 WeakPolarHBondContact CA-OE2 3.24Å; A438-E442 HydrophobicContact CB-CB 4.19Å; A438-I443 HydrophobicContact CB-CG1 4.23Å
439	T	63.5	Low	62.2	Low	76 Å²	76	78.2 Å²	78.2	47%	0.466	39%	0.386	S	S	.	.			trans	-69	154.1	172.8	57.7	0	0	0	0	109.7	N437 Q441 E442 I443	N437-T439 PolarHBondContact O-N 3.2Å; T439-Q441 PolarHBondContact O-N 3.26Å; T439-E442 PolarHBondContact N-OE2 2.98Å; T439-E442 WeakPolarHBondContact O-CB 3.22Å; T439-E442 PolarHBondContact O-N 3.31Å; T439-E442 WeakPolarHBondContact OG1-CG 3.08Å; T439-E442 PolarHBondContact OG1-OE2 2.74Å; T439-I443 PolarHBondContact O-N 2.89Å
440	E	60.3	Low	62.6	Low	121 Å²	121	73.6 Å²	73.6	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-46.7	-39.9	178.9	-163.5	170.8	-175.7	0	0	112.2	E442 I443 E444 V474	E440-E442 PolarHBondContact O-N 3.42Å; E440-I443 WeakPolarHBondContact O-CB 3.03Å; E440-I443 PolarHBondContact O-N 3.04Å; E440-E444 WeakPolarHBondContact O-CG 3.44Å; E440-E444 PolarHBondContact O-N 3.38Å; E440-V474 HydrophobicContact CG-CG1 3.88Å
441	Q	59.9	Low	63.2	Low	142 Å²	142	71.6 Å²	71.6	66%	0.664	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-34.9	176.3	-71.8	-176.6	-25.4	0	0	114.6	T439 I443 E445	T439-Q441 PolarHBondContact O-N 3.26Å; Q441-I443 VanDerWaalsContact C-N 3.3Å; Q441-E445 PolarHBondContact O-N 3.07Å
442	E	62.5	Low	63.8	Low	99 Å²	99	75.2 Å²	75.2	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-72.6	-28.7	177.7	-71.9	168.2	143.8	0	0	111.5	A438 T439 E440 A446	A438-E442 VanDerWaalsContact CA-OE2 3.24Å; A438-E442 WeakPolarHBondContact CA-OE2 3.24Å; A438-E442 HydrophobicContact CB-CB 4.19Å; T439-E442 PolarHBondContact N-OE2 2.98Å; T439-E442 WeakPolarHBondContact O-CB 3.22Å; T439-E442 PolarHBondContact O-N 3.31Å; T439-E442 WeakPolarHBondContact OG1-CG 3.08Å; T439-E442 PolarHBondContact OG1-OE2 2.74Å; E440-E442 PolarHBondContact O-N 3.42Å; E442-A446 PolarHBondContact O-N 3.41Å
443	I	63.5	Low	64.2	Low	5 Å²	5	82.1 Å²	82.1	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-74	-46.6	175	-47.3	-177.4	0	0	0	110.2	L434 A438 T439 E440 Q441 E445 A446 V447 V474 L478	L434-I443 HydrophobicContact CD2-CB 4.05Å; L434-I443 HydrophobicContact CD2-CD1 3.24Å; L434-I443 HydrophobicContact CD2-CG1 3.29Å; L434-I443 HydrophobicContact CD2-CG2 3.76Å; A438-I443 HydrophobicContact CB-CG1 4.23Å; T439-I443 PolarHBondContact O-N 2.89Å; E440-I443 WeakPolarHBondContact O-CB 3.03Å; E440-I443 PolarHBondContact O-N 3.04Å; Q441-I443 VanDerWaalsContact C-N 3.3Å; I443-E445 VanDerWaalsContact C-N 3.3Å; I443-E445 PolarHBondContact O-N 2.99Å; I443-A446 PolarHBondContact O-N 2.92Å; I443-A446 VanDerWaalsContact O-N 3.09Å; I443-V447 HydrophobicContact CG2-CG2 4.39Å; I443-V447 WeakPolarHBondContact O-CG2 3.42Å; I443-V447 PolarHBondContact O-N 3.15Å; I443-V474 HydrophobicContact CB-CG1 4.26Å; I443-V474 HydrophobicContact CD1-CG1 4.28Å; I443-V474 HydrophobicContact CG2-CG1 4.15Å; I443-V474 HydrophobicContact CG2-CG2 4.08Å; I443-L478 HydrophobicContact CD1-CD2 4.07Å
444	E	62.5	Low	64.5	Low	53 Å²	53	83.3 Å²	83.3	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-52.4	-48	173.2	-75.7	179.7	177.1	0	0	111.4	E440 A446 V447 K448 E470 V474	E440-E444 WeakPolarHBondContact O-CG 3.44Å; E440-E444 PolarHBondContact O-N 3.38Å; E444-A446 VanDerWaalsContact C-N 3.34Å; E444-A446 PolarHBondContact O-N 3.42Å; E444-V447 PolarHBondContact O-N 3Å; E444-K448 WeakPolarHBondContact O-CB 3.18Å; E444-K448 WeakPolarHBondContact O-CG 3.48Å; E444-K448 PolarHBondContact O-N 2.94Å; E444-E470 VanDerWaalsContact CA-OE1 3.28Å; E444-E470 WeakPolarHBondContact CA-OE1 3.41Å; E444-E470 WeakPolarHBondContact CB-OE1 3.23Å; E444-E470 HydrophobicContact CG-CG 3.96Å; E444-E470 VanDerWaalsContact CG-OE1 3.25Å; E444-E470 WeakPolarHBondContact CG-OE1 3.29Å; E444-V474 HydrophobicContact CG-CG2 4.15Å
445	E	68.4	Low	65.2	Low	113 Å²	113	85.9 Å²	85.9	53%	0.528	43%	0.429	S	S	.	.	H	α-helix	trans	-63.3	-37.1	176.7	-82.4	-161.2	-168.4	0	0	113.7	Q441 I443 K449	Q441-E445 PolarHBondContact O-N 3.07Å; I443-E445 VanDerWaalsContact C-N 3.3Å; I443-E445 PolarHBondContact O-N 2.99Å; E445-K449 WeakPolarHBondContact O-CD 2.97Å; E445-K449 VanDerWaalsContact O-CG 3.24Å; E445-K449 WeakPolarHBondContact O-CG 3.37Å; E445-K449 PolarHBondContact O-N 2.87Å; E445-K449 IonicContact OE2-NZ 3.25Å; E445-K449 PolarHBondContact OE2-NZ 3.08Å
446	A	67.1	Low	66	Low	19 Å²	19	86.5 Å²	86.5	16%	0.157	44%	0.436	C	S	.	.	H	α-helix	trans	-69.5	-41	179.6	0	0	0	0	0	111.4	I433 E442 I443 E444 K449	I433-A446 HydrophobicContact CD1-CB 4.38Å; E442-A446 PolarHBondContact O-N 3.41Å; I443-A446 PolarHBondContact O-N 2.92Å; I443-A446 VanDerWaalsContact O-N 3.09Å; E444-A446 VanDerWaalsContact C-N 3.34Å; E444-A446 PolarHBondContact O-N 3.42Å; A446-K449 PolarHBondContact O-N 3.08Å
447	V	67.2	Low	66.8	Low	18 Å²	18	82.3 Å²	82.3	11%	0.109	43%	0.429	C	S	.	.	H	α-helix	trans	-66.5	-45.3	177.6	176.7	0	0	0	0	110.3	I443 E444 K449 V450 I466 L477	I443-V447 HydrophobicContact CG2-CG2 4.39Å; I443-V447 WeakPolarHBondContact O-CG2 3.42Å; I443-V447 PolarHBondContact O-N 3.15Å; E444-V447 PolarHBondContact O-N 3Å; V447-K449 PolarHBondContact O-N 3.4Å; V447-V450 WeakPolarHBondContact O-CB 3.3Å; V447-V450 VanDerWaalsContact O-CG2 3.28Å; V447-V450 WeakPolarHBondContact O-CG2 3.02Å; V447-V450 PolarHBondContact O-N 3.47Å; V447-I466 HydrophobicContact CG1-CD1 4.09Å; V447-I466 HydrophobicContact CG1-CG1 4.43Å; V447-I466 HydrophobicContact CG1-CG2 3.78Å; V447-I466 WeakPolarHBondContact O-CD1 3.23Å; V447-L477 HydrophobicContact CG2-CD1 3.85Å
448	K	69.6	Low	67.3	Low	79 Å²	79	80.8 Å²	80.8	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-57.4	-34.2	174.1	-76.4	179.1	169.3	104.8	0	113.4	E444 V450 C451 I466 E470	E444-K448 WeakPolarHBondContact O-CB 3.18Å; E444-K448 WeakPolarHBondContact O-CG 3.48Å; E444-K448 PolarHBondContact O-N 2.94Å; K448-V450 PolarHBondContact O-N 2.91Å; K448-C451 PolarHBondContact O-N 3.21Å; K448-I466 HydrophobicContact CG-CG2 3.98Å; K448-E470 IonicContact NZ-OE1 2.96Å; K448-E470 PolarHBondContact NZ-OE1 2.86Å; K448-E470 IonicContact NZ-OE2 3.73Å; K448-E470 PolarHBondContact NZ-OE2 2.86Å
449	K	73.8	Confident	68.4	Low	105 Å²	105	82.1 Å²	82.1	46%	0.457	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-68	-13.6	177.9	-75.1	163.8	-169.4	153.9	0	113.4	E445 A446 V447 C451 N452	E445-K449 WeakPolarHBondContact O-CD 2.97Å; E445-K449 VanDerWaalsContact O-CG 3.24Å; E445-K449 WeakPolarHBondContact O-CG 3.37Å; E445-K449 PolarHBondContact O-N 2.87Å; E445-K449 IonicContact OE2-NZ 3.25Å; E445-K449 PolarHBondContact OE2-NZ 3.08Å; A446-K449 PolarHBondContact O-N 3.08Å; V447-K449 PolarHBondContact O-N 3.4Å; K449-C451 VanDerWaalsContact C-N 3.33Å; K449-C451 PolarHBondContact O-N 2.92Å; K449-N452 WeakPolarHBondContact O-CB 3.2Å; K449-N452 PolarHBondContact O-N 3.38Å
450	V	74.6	Confident	69.1	Low	69 Å²	69	82.9 Å²	82.9	42%	0.418	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-64.6	-36.5	177	177.9	0	0	0	0	111.7	V447 K448 N452 F453 I466	V447-V450 WeakPolarHBondContact O-CB 3.3Å; V447-V450 VanDerWaalsContact O-CG2 3.28Å; V447-V450 WeakPolarHBondContact O-CG2 3.02Å; V447-V450 PolarHBondContact O-N 3.47Å; K448-V450 PolarHBondContact O-N 2.91Å; V450-N452 PolarHBondContact O-N 2.99Å; V450-N452 VanDerWaalsContact O-N 3.16Å; V450-F453 WeakPolarHBondContact O-CB 3.05Å; V450-F453 PolarHBondContact O-N 3.1Å; V450-I466 HydrophobicContact CB-CD1 4.48Å
451	C	76.8	Confident	69.8	Low	0 Å²	0	83 Å²	83	0%	0	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-64.5	-21.6	178.3	-62	0	0	0	0	112.8	K448 K449 F453 L454 C462 D463 I466	K448-C451 PolarHBondContact O-N 3.21Å; K449-C451 VanDerWaalsContact C-N 3.33Å; K449-C451 PolarHBondContact O-N 2.92Å; C451-F453 PolarHBondContact O-N 2.04Å; C451-L454 PolarHBondContact O-N 2.83Å; C451-C462 WeakPolarHBondContact CA-SG 3.41Å; C451-C462 HydrophobicContact CB-CB 3.77Å; C451-C462 WeakPolarHBondContact CB-SG 3.36Å; C451-C462 WeakPolarHBondContact SG-CB 2.98Å; C451-C462 PolarHBondContact SG-O 2.89Å; C451-C462 CovalentContact SG-SG 2.04Å; C451-C462 PolarHBondContact SG-SG 3.31Å; C451-D463 WeakPolarHBondContact CB-OD1 3.44Å; C451-D463 PolarHBondContact SG-N 3.45Å; C451-D463 PolarHBondContact SG-OD1 3.3Å; C451-D463 VanDerWaalsContact SG-OD1 3.39Å; C451-I466 WeakPolarHBondContact SG-CD1 3.43Å
452	N	78.6	Confident	70.6	Confident	101 Å²	101	77.3 Å²	77.3	54%	0.54	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-67.6	-15.8	175.1	-66.2	-44.2	0	0	0	113.9	K449 V450	K449-N452 WeakPolarHBondContact O-CB 3.2Å; K449-N452 PolarHBondContact O-N 3.38Å; V450-N452 PolarHBondContact O-N 2.99Å; V450-N452 VanDerWaalsContact O-N 3.16Å
453	F	72.1	Confident	71.4	Confident	181 Å²	181	75.6 Å²	75.6	79%	0.794	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-85.3	-8.4	174.2	-65.4	-85.5	0	0	0	113.2	V450 C451	V450-F453 WeakPolarHBondContact O-CB 3.05Å; V450-F453 PolarHBondContact O-N 3.1Å; C451-F453 PolarHBondContact O-N 2.04Å
454	L	64.8	Low	72.1	Confident	74 Å²	74	81 Å²	81	39%	0.387	41%	0.413	S	S	.	.	S	Bend	trans	-91.1	154.1	177	-63.7	177.2	0	0	0	111.9	C451 K459 C462	C451-L454 PolarHBondContact O-N 2.83Å; L454-K459 WeakPolarHBondContact O-CE 3.09Å; L454-C462 HydrophobicContact CD1-CB 3.64Å; L454-C462 VanDerWaalsContact CD1-SG 3.5Å
455	P	69.3	Low	72.6	Confident	79 Å²	79	83.3 Å²	83.3	51%	0.513	43%	0.426	S	S	.	.			trans	-58.5	148.6	170.6	-20.7	32	0	0	0	111.9	S457 Y458 K459	P455-S457 PolarHBondContact O-N 3.36Å; P455-Y458 HydrophobicContact CB-CD2 4.3Å; P455-Y458 HydrophobicContact CG-CD2 4.33Å; P455-Y458 PolarHBondContact O-N 3.41Å; P455-K459 PolarHBondContact O-N 2.94Å
456	D	73.4	Confident	73	Confident	122 Å²	122	78.7 Å²	78.7	65%	0.652	41%	0.405	S	S	*	.	H	α-helix	trans	-55.2	-28.1	-174.1	-65	-33.1	0	0	0	114.1	Y458 K459	D456-Y458 PolarHBondContact O-N 3.21Å; D456-K459 PolarHBondContact O-N 3.42Å; D456-K459 VanDerWaalsContact OD1-CE 3.26Å; D456-K459 WeakPolarHBondContact OD1-CE 3.2Å; D456-K459 IonicContact OD1-NZ 2.71Å; D456-K459 PolarHBondContact OD1-NZ 3.02Å
457	S	66.1	Low	73.4	Confident	87 Å²	87	83.9 Å²	83.9	61%	0.608	43%	0.426	S	S	*	.	H	α-helix	trans	-62.7	-21.6	176.7	55.5	0	0	0	0	114.5	P455	P455-S457 PolarHBondContact O-N 3.36Å
458	Y	64.1	Low	73.5	Confident	130 Å²	130	89.2 Å²	89.2	51%	0.51	45%	0.45	S	S	.	.	H	α-helix	trans	-115.4	-3.8	-175.2	-60.4	-67.9	0	0	0	113.3	P455 D456 E461 C462	P455-Y458 HydrophobicContact CB-CD2 4.3Å; P455-Y458 HydrophobicContact CG-CD2 4.33Å; P455-Y458 PolarHBondContact O-N 3.41Å; D456-Y458 PolarHBondContact O-N 3.21Å; Y458-E461 PolarHBondContact O-N 3.26Å; Y458-C462 VanDerWaalsContact O-CB 3.23Å; Y458-C462 WeakPolarHBondContact O-CB 3.5Å; Y458-C462 PolarHBondContact O-N 3.44Å
459	K	78.3	Confident	73.4	Confident	52 Å²	52	90.8 Å²	90.8	23%	0.226	45%	0.454	C	S	.	.	H	α-helix	trans	-61.5	-48.8	-177.5	-75.3	-173.2	178	167.3	0	111.8	L454 P455 D456 E461 C462 D463	L454-K459 WeakPolarHBondContact O-CE 3.09Å; P455-K459 PolarHBondContact O-N 2.94Å; D456-K459 PolarHBondContact O-N 3.42Å; D456-K459 VanDerWaalsContact OD1-CE 3.26Å; D456-K459 WeakPolarHBondContact OD1-CE 3.2Å; D456-K459 IonicContact OD1-NZ 2.71Å; D456-K459 PolarHBondContact OD1-NZ 3.02Å; K459-E461 VanDerWaalsContact C-N 3.34Å; K459-E461 PolarHBondContact O-N 3.48Å; K459-C462 CarbonylContact O-C 3.58Å; K459-C462 WeakPolarHBondContact O-CB 3.42Å; K459-C462 PolarHBondContact O-N 3.38Å; K459-C462 VanDerWaalsContact O-N 3.14Å; K459-D463 WeakPolarHBondContact O-CB 3.48Å; K459-D463 PolarHBondContact O-N 2.96Å
460	T	77.6	Confident	72.9	Confident	91 Å²	91	86.5 Å²	86.5	56%	0.558	44%	0.436	S	S	*	.	H	α-helix	trans	-60.8	-41.3	-178.5	-45.6	0	0	0	0	112.8	Q464	T460-Q464 VanDerWaalsContact O-CG 3.29Å; T460-Q464 WeakPolarHBondContact O-CG 3.35Å; T460-Q464 PolarHBondContact O-N 2.66Å; T460-Q464 VanDerWaalsContact O-N 3.09Å
461	E	76.4	Confident	72	Confident	125 Å²	125	86.8 Å²	86.8	58%	0.584	44%	0.439	S	S	*	.	H	α-helix	trans	-71	-37.3	177.7	-69.1	172.5	161.4	0	0	111.3	Y458 K459 L465	Y458-E461 PolarHBondContact O-N 3.26Å; K459-E461 VanDerWaalsContact C-N 3.34Å; K459-E461 PolarHBondContact O-N 3.48Å; E461-L465 WeakPolarHBondContact O-CB 3.26Å; E461-L465 PolarHBondContact O-N 2.99Å
462	C	77	Confident	71	Confident	21 Å²	21	91.1 Å²	91.1	14%	0.142	47%	0.466	C	S	.	.	H	α-helix	trans	-64.2	-45.3	173.5	179.8	0	0	0	0	111.6	C451 L454 Y458 K459 Q464 L465 I466	C451-C462 WeakPolarHBondContact CA-SG 3.41Å; C451-C462 HydrophobicContact CB-CB 3.77Å; C451-C462 WeakPolarHBondContact CB-SG 3.36Å; C451-C462 WeakPolarHBondContact SG-CB 2.98Å; C451-C462 PolarHBondContact SG-O 2.89Å; C451-C462 CovalentContact SG-SG 2.04Å; C451-C462 PolarHBondContact SG-SG 3.31Å; L454-C462 HydrophobicContact CD1-CB 3.64Å; L454-C462 VanDerWaalsContact CD1-SG 3.5Å; Y458-C462 VanDerWaalsContact O-CB 3.23Å; Y458-C462 WeakPolarHBondContact O-CB 3.5Å; Y458-C462 PolarHBondContact O-N 3.44Å; K459-C462 CarbonylContact O-C 3.58Å; K459-C462 WeakPolarHBondContact O-CB 3.42Å; K459-C462 PolarHBondContact O-N 3.38Å; K459-C462 VanDerWaalsContact O-N 3.14Å; C462-Q464 VanDerWaalsContact C-N 3.35Å; C462-Q464 PolarHBondContact O-N 2.96Å; C462-L465 WeakPolarHBondContact O-CB 3.14Å; C462-L465 PolarHBondContact O-N 3.35Å; C462-I466 WeakPolarHBondContact O-CG1 3.46Å; C462-I466 PolarHBondContact O-N 3.47Å
463	D	79	Confident	70.1	Confident	64 Å²	64	89.6 Å²	89.6	34%	0.342	46%	0.457	S	S	.	.	H	α-helix	trans	-62.5	-43.3	179.7	-68	-32.5	0	0	0	110.5	C451 K459 L465 I466 E467	C451-D463 WeakPolarHBondContact CB-OD1 3.44Å; C451-D463 PolarHBondContact SG-N 3.45Å; C451-D463 PolarHBondContact SG-OD1 3.3Å; C451-D463 VanDerWaalsContact SG-OD1 3.39Å; K459-D463 WeakPolarHBondContact O-CB 3.48Å; K459-D463 PolarHBondContact O-N 2.96Å; D463-L465 VanDerWaalsContact C-N 3.35Å; D463-L465 PolarHBondContact O-N 3.43Å; D463-I466 PolarHBondContact O-N 2.87Å; D463-E467 WeakPolarHBondContact O-CG 3.31Å; D463-E467 PolarHBondContact O-N 3.31Å
464	Q	77.1	Confident	69.5	Low	118 Å²	118	81 Å²	81	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-39.4	175.1	-74.4	174.4	1.3	0	0	112.7	T460 C462 Q468	T460-Q464 VanDerWaalsContact O-CG 3.29Å; T460-Q464 WeakPolarHBondContact O-CG 3.35Å; T460-Q464 PolarHBondContact O-N 2.66Å; T460-Q464 VanDerWaalsContact O-N 3.09Å; C462-Q464 VanDerWaalsContact C-N 3.35Å; C462-Q464 PolarHBondContact O-N 2.96Å; Q464-Q468 WeakPolarHBondContact O-CB 3.46Å; Q464-Q468 PolarHBondContact O-N 2.91Å
465	L	74.4	Confident	68.9	Low	102 Å²	102	84.5 Å²	84.5	53%	0.534	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-41.9	175.8	-169.6	75.6	0	0	0	110.7	E461 C462 D463 Q468 Y469	E461-L465 WeakPolarHBondContact O-CB 3.26Å; E461-L465 PolarHBondContact O-N 2.99Å; C462-L465 WeakPolarHBondContact O-CB 3.14Å; C462-L465 PolarHBondContact O-N 3.35Å; D463-L465 VanDerWaalsContact C-N 3.35Å; D463-L465 PolarHBondContact O-N 3.43Å; L465-Q468 PolarHBondContact O-N 3.31Å; L465-Y469 HydrophobicContact CD1-CD2 3.7Å; L465-Y469 HydrophobicContact CD1-CE2 3.53Å; L465-Y469 HydrophobicContact CG-CD2 4.09Å; L465-Y469 HydrophobicContact CG-CE2 4.42Å; L465-Y469 VanDerWaalsContact O-CD2 3.25Å; L465-Y469 WeakPolarHBondContact O-CD2 3.1Å; L465-Y469 PolarHBondContact O-N 3.15Å; L465-Y469 VanDerWaalsContact O-N 3.17Å
466	I	75.6	Confident	68	Low	15 Å²	15	85 Å²	85	8%	0.077	43%	0.432	C	S	.	.	H	α-helix	trans	-63.8	-51.3	176.1	-68.8	-172.9	0	0	0	109.6	V447 K448 V450 C451 C462 D463 Q468 Y469 E470	V447-I466 HydrophobicContact CG1-CD1 4.09Å; V447-I466 HydrophobicContact CG1-CG1 4.43Å; V447-I466 HydrophobicContact CG1-CG2 3.78Å; V447-I466 WeakPolarHBondContact O-CD1 3.23Å; K448-I466 HydrophobicContact CG-CG2 3.98Å; V450-I466 HydrophobicContact CB-CD1 4.48Å; C451-I466 WeakPolarHBondContact SG-CD1 3.43Å; C462-I466 WeakPolarHBondContact O-CG1 3.46Å; C462-I466 PolarHBondContact O-N 3.47Å; D463-I466 PolarHBondContact O-N 2.87Å; I466-Q468 PolarHBondContact O-N 3.45Å; I466-Q468 VanDerWaalsContact O-N 3.15Å; I466-Y469 PolarHBondContact O-N 3.29Å; I466-Y469 VanDerWaalsContact O-N 3.15Å; I466-E470 HydrophobicContact CG2-CB 4.32Å; I466-E470 VanDerWaalsContact O-CA 3.31Å; I466-E470 WeakPolarHBondContact O-CA 3.47Å; I466-E470 WeakPolarHBondContact O-CB 3.03Å; I466-E470 PolarHBondContact O-N 2.92Å
467	E	75.6	Confident	67.1	Low	129 Å²	129	81.2 Å²	81.2	60%	0.603	41%	0.411	S	S	*	.	H	α-helix	trans	-55.3	-36.6	178.3	-75.3	-179.1	172.7	0	0	113.5	D463	D463-E467 WeakPolarHBondContact O-CG 3.31Å; D463-E467 PolarHBondContact O-N 3.31Å
468	Q	69.2	Low	66.6	Low	129 Å²	129	82.8 Å²	82.8	60%	0.603	41%	0.412	S	S	*	.	H	α-helix	trans	-73.7	-34.8	-179	-175.3	175.1	10.2	0	0	113.4	Q464 L465 I466	Q464-Q468 WeakPolarHBondContact O-CB 3.46Å; Q464-Q468 PolarHBondContact O-N 2.91Å; L465-Q468 PolarHBondContact O-N 3.31Å; I466-Q468 PolarHBondContact O-N 3.45Å; I466-Q468 VanDerWaalsContact O-N 3.15Å
469	Y	67.6	Low	65.9	Low	113 Å²	113	83.3 Å²	83.3	44%	0.443	42%	0.419	S	S	.	.	H	α-helix	trans	-111.5	-8.9	-171.9	-65.4	-80.6	0	0	0	113.4	L465 I466 V472 L473	L465-Y469 HydrophobicContact CD1-CD2 3.7Å; L465-Y469 HydrophobicContact CD1-CE2 3.53Å; L465-Y469 HydrophobicContact CG-CD2 4.09Å; L465-Y469 HydrophobicContact CG-CE2 4.42Å; L465-Y469 VanDerWaalsContact O-CD2 3.25Å; L465-Y469 WeakPolarHBondContact O-CD2 3.1Å; L465-Y469 PolarHBondContact O-N 3.15Å; L465-Y469 VanDerWaalsContact O-N 3.17Å; I466-Y469 PolarHBondContact O-N 3.29Å; I466-Y469 VanDerWaalsContact O-N 3.15Å; Y469-V472 PolarHBondContact O-N 3.41Å; Y469-V472 VanDerWaalsContact O-N 3.12Å; Y469-L473 WeakPolarHBondContact O-CB 3.47Å; Y469-L473 VanDerWaalsContact O-CG 3.29Å; Y469-L473 WeakPolarHBondContact O-CG 3.03Å; Y469-L473 PolarHBondContact O-N 2.68Å
470	E	63	Low	64.9	Low	15 Å²	15	85 Å²	85	7%	0.07	43%	0.429	C	S	.	.	H	α-helix	trans	-46.8	-55.3	-179.8	170.1	173.7	-134.9	0	0	113.8	E444 K448 I466 V472 L473 V474	E444-E470 VanDerWaalsContact CA-OE1 3.28Å; E444-E470 WeakPolarHBondContact CA-OE1 3.41Å; E444-E470 WeakPolarHBondContact CB-OE1 3.23Å; E444-E470 HydrophobicContact CG-CG 3.96Å; E444-E470 VanDerWaalsContact CG-OE1 3.25Å; E444-E470 WeakPolarHBondContact CG-OE1 3.29Å; K448-E470 IonicContact NZ-OE1 2.96Å; K448-E470 PolarHBondContact NZ-OE1 2.86Å; K448-E470 IonicContact NZ-OE2 3.73Å; K448-E470 PolarHBondContact NZ-OE2 2.86Å; I466-E470 HydrophobicContact CG2-CB 4.32Å; I466-E470 VanDerWaalsContact O-CA 3.31Å; I466-E470 WeakPolarHBondContact O-CA 3.47Å; I466-E470 WeakPolarHBondContact O-CB 3.03Å; I466-E470 PolarHBondContact O-N 2.92Å; E470-V472 PolarHBondContact O-N 3.45Å; E470-L473 PolarHBondContact O-N 3.36Å; E470-L473 VanDerWaalsContact O-N 3.1Å; E470-V474 HydrophobicContact CG-CG2 4.27Å; E470-V474 VanDerWaalsContact O-CG2 3.26Å; E470-V474 WeakPolarHBondContact O-CG2 3.24Å; E470-V474 PolarHBondContact O-N 2.04Å
471	P	56.5	Low	64	Low	74 Å²	74	82 Å²	82	48%	0.481	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-28.5	-177.2	21.9	-32.4	0	0	0	113.1
472	V	56.5	Low	63.5	Low	92 Å²	92	77.4 Å²	77.4	56%	0.558	39%	0.389	S	S	*	.	H	α-helix	trans	-80.1	-39.3	176.1	-177.9	0	0	0	0	110.7	Y469 E470 L476	Y469-V472 PolarHBondContact O-N 3.41Å; Y469-V472 VanDerWaalsContact O-N 3.12Å; E470-V472 PolarHBondContact O-N 3.45Å; V472-L476 WeakPolarHBondContact O-CB 3.32Å; V472-L476 PolarHBondContact O-N 3.47Å
473	L	58	Low	63.1	Low	68 Å²	68	77.3 Å²	77.3	36%	0.356	39%	0.388	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.5	-74.5	169.2	0	0	0	111.8	Y469 E470 L476 L477	Y469-L473 WeakPolarHBondContact O-CB 3.47Å; Y469-L473 VanDerWaalsContact O-CG 3.29Å; Y469-L473 WeakPolarHBondContact O-CG 3.03Å; Y469-L473 PolarHBondContact O-N 2.68Å; E470-L473 PolarHBondContact O-N 3.36Å; E470-L473 VanDerWaalsContact O-N 3.1Å; L473-L476 PolarHBondContact O-N 2.95Å; L473-L477 HydrophobicContact CB-CD1 4.5Å; L473-L477 WeakPolarHBondContact O-CB 3.28Å; L473-L477 WeakPolarHBondContact O-CD1 3.37Å; L473-L477 WeakPolarHBondContact O-CG 3.3Å; L473-L477 PolarHBondContact O-N 3.37Å
474	V	59.2	Low	62.5	Low	2 Å²	2	77.6 Å²	77.6	1%	0.012	39%	0.39	C	S	.	.	H	α-helix	trans	-64.1	-42.3	177.5	174.8	0	0	0	0	110.6	E440 I443 E444 E470 L476 L477 L478	E440-V474 HydrophobicContact CG-CG1 3.88Å; I443-V474 HydrophobicContact CB-CG1 4.26Å; I443-V474 HydrophobicContact CD1-CG1 4.28Å; I443-V474 HydrophobicContact CG2-CG1 4.15Å; I443-V474 HydrophobicContact CG2-CG2 4.08Å; E444-V474 HydrophobicContact CG-CG2 4.15Å; E470-V474 HydrophobicContact CG-CG2 4.27Å; E470-V474 VanDerWaalsContact O-CG2 3.26Å; E470-V474 WeakPolarHBondContact O-CG2 3.24Å; E470-V474 PolarHBondContact O-N 2.04Å; V474-L476 VanDerWaalsContact C-N 3.3Å; V474-L476 PolarHBondContact O-N 3.34Å; V474-L477 PolarHBondContact O-N 3.37Å; V474-L478 WeakPolarHBondContact O-CG 3.32Å; V474-L478 PolarHBondContact O-N 3.01Å
475	Q	52.3	Low	62.1	Low	146 Å²	146	73.5 Å²	73.5	68%	0.682	37%	0.37	S	S	*	.	H	α-helix	trans	-66.2	-31.9	176	-160.2	172.2	24.5	0	0	112.7
476	L	52	Low	61.8	Low	91 Å²	91	70.4 Å²	70.4	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-81.8	-34.2	177.5	-152.2	79.1	0	0	0	112.9	V472 L473 V474 L478 Q479 M480	V472-L476 WeakPolarHBondContact O-CB 3.32Å; V472-L476 PolarHBondContact O-N 3.47Å; L473-L476 PolarHBondContact O-N 2.95Å; V474-L476 VanDerWaalsContact C-N 3.3Å; V474-L476 PolarHBondContact O-N 3.34Å; L476-L478 VanDerWaalsContact C-N 3.29Å; L476-L478 PolarHBondContact O-N 2.87Å; L476-Q479 PolarHBondContact O-N 2.84Å; L476-M480 HydrophobicContact CD2-CE 4.46Å; L476-M480 HydrophobicContact CG-CE 4.49Å; L476-M480 PolarHBondContact O-N 3.29Å
477	L	53.8	Low	61.5	Low	41 Å²	41	69.7 Å²	69.7	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-66.5	-30.4	178.3	-82.8	162.5	0	0	0	111.8	V447 L473 V474 Q479 L481	V447-L477 HydrophobicContact CG2-CD1 3.85Å; L473-L477 HydrophobicContact CB-CD1 4.5Å; L473-L477 WeakPolarHBondContact O-CB 3.28Å; L473-L477 WeakPolarHBondContact O-CD1 3.37Å; L473-L477 WeakPolarHBondContact O-CG 3.3Å; L473-L477 PolarHBondContact O-N 3.37Å; V474-L477 PolarHBondContact O-N 3.37Å; L477-Q479 PolarHBondContact O-N 3.19Å; L477-Q479 VanDerWaalsContact O-N 3.16Å; L477-L481 HydrophobicContact CD2-CD2 3.9Å; L477-L481 WeakPolarHBondContact O-CD1 3.35Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å
478	L	54.8	Low	61.1	Low	120 Å²	120	67.1 Å²	67.1	63%	0.628	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.7	171.5	-70.2	171.1	0	0	0	113.5	I443 V474 L476	I443-L478 HydrophobicContact CD1-CD2 4.07Å; V474-L478 WeakPolarHBondContact O-CG 3.32Å; V474-L478 PolarHBondContact O-N 3.01Å; L476-L478 VanDerWaalsContact C-N 3.29Å; L476-L478 PolarHBondContact O-N 2.87Å
479	Q	51.1	Low	60.6	Low	141 Å²	141	65.7 Å²	65.7	66%	0.659	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-10.3	-177.3	-62.6	-163.8	-16.2	0	0	114.8	L476 L477	L476-Q479 PolarHBondContact O-N 2.84Å; L477-Q479 PolarHBondContact O-N 3.19Å; L477-Q479 VanDerWaalsContact O-N 3.16Å
480	M	56	Low	60.3	Low	88 Å²	88	65.2 Å²	65.2	43%	0.433	34%	0.341	S	S	.	.			trans	-150.8	99.2	-173.2	-69	-154.1	-73.1	0	0	113.4	L476 F485	L476-M480 HydrophobicContact CD2-CE 4.46Å; L476-M480 HydrophobicContact CG-CE 4.49Å; L476-M480 PolarHBondContact O-N 3.29Å; M480-F485 HydrophobicContact SD-CE1 3.96Å
481	L	58.5	Low	60	Low	27 Å²	27	66.6 Å²	66.6	14%	0.141	36%	0.359	C	S	.	.			trans	-135.2	19.4	178.9	-66.4	162.6	0	0	0	114.8	I430 D431 L434 L477 P483	I430-L481 HydrophobicContact CG2-CD2 4.16Å; D431-L481 HydrophobicContact CB-CB 4.15Å; D431-L481 VanDerWaalsContact OD1-CB 3.26Å; D431-L481 WeakPolarHBondContact OD1-CB 3.48Å; D431-L481 WeakPolarHBondContact OD1-CD1 3.49Å; L434-L481 HydrophobicContact CB-CD1 3.97Å; L434-L481 HydrophobicContact CD1-CD1 3.36Å; L434-L481 HydrophobicContact CD1-CD2 3.73Å; L434-L481 HydrophobicContact CD1-CG 4.15Å; L434-L481 HydrophobicContact CG-CD1 4.26Å; L477-L481 HydrophobicContact CD2-CD2 3.9Å; L477-L481 WeakPolarHBondContact O-CD1 3.35Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L481-P483 WeakPolarHBondContact O-CD 3.24Å; L481-P483 VanDerWaalsContact O-N 3.16Å
482	D	67.3	Low	60.6	Low	29 Å²	29	63.6 Å²	63.6	16%	0.155	34%	0.341	C	S	.	.			trans	-68.1	113.6	169.7	-177.4	-91.4	0	0	0	109.7	D484 F485 V486	D482-D484 VanDerWaalsContact C-N 3.26Å; D482-D484 PolarHBondContact O-N 3.3Å; D482-D484 WeakPolarHBondContact OD1-CB 3.31Å; D482-D484 PolarHBondContact OD1-N 3.47Å; D482-F485 HydrophobicContact CB-CB 3.95Å; D482-F485 PolarHBondContact O-N 3.29Å; D482-F485 WeakPolarHBondContact OD1-CB 3.5Å; D482-F485 PolarHBondContact OD1-N 2.96Å; D482-V486 WeakPolarHBondContact O-CG2 3.49Å; D482-V486 PolarHBondContact O-N 3.12Å
483	P	67.4	Low	61.1	Low	19 Å²	19	59.6 Å²	59.6	12%	0.123	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-32.3	-172.6	-22.8	35.2	0	0	0	112.9	K424 V427 S428 L481 C487	K424-P483 HydrophobicContact CB-CB 4.32Å; K424-P483 HydrophobicContact CG-CB 4.36Å; V427-P483 HydrophobicContact CB-CB 3.98Å; V427-P483 HydrophobicContact CB-CG 4.46Å; V427-P483 HydrophobicContact CG1-CB 3.96Å; V427-P483 HydrophobicContact CG1-CG 4.09Å; S428-P483 WeakPolarHBondContact OG-CG 3.31Å; L481-P483 WeakPolarHBondContact O-CD 3.24Å; L481-P483 VanDerWaalsContact O-N 3.16Å; P483-C487 WeakPolarHBondContact O-CB 3.48Å; P483-C487 PolarHBondContact O-N 2.93Å; P483-C487 PolarHBondContact O-SG 2.96Å
484	D	67.7	Low	61.4	Low	71 Å²	71	61.6 Å²	61.6	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-48.3	176.1	-74.6	-64.6	0	0	0	110.6	K424 D482 M488	K424-D484 WeakPolarHBondContact CE-OD1 3.25Å; K424-D484 IonicContact NZ-OD1 2.6Å; K424-D484 PolarHBondContact NZ-OD1 2.95Å; D482-D484 VanDerWaalsContact C-N 3.26Å; D482-D484 PolarHBondContact O-N 3.3Å; D482-D484 WeakPolarHBondContact OD1-CB 3.31Å; D482-D484 PolarHBondContact OD1-N 3.47Å; D484-M488 HydrophobicContact CB-CE 4.18Å; D484-M488 VanDerWaalsContact O-CB 3.27Å; D484-M488 WeakPolarHBondContact O-CB 3.04Å; D484-M488 VanDerWaalsContact O-CE 3.24Å; D484-M488 WeakPolarHBondContact O-CE 3.16Å; D484-M488 WeakPolarHBondContact O-CG 3.44Å; D484-M488 PolarHBondContact O-N 3.27Å
485	F	67.2	Low	61.3	Low	31 Å²	31	63.7 Å²	63.7	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-49.6	178.5	-178.1	-98.9	0	0	0	112.5	M480 D482 M488 K489	M480-F485 HydrophobicContact SD-CE1 3.96Å; D482-F485 HydrophobicContact CB-CB 3.95Å; D482-F485 PolarHBondContact O-N 3.29Å; D482-F485 WeakPolarHBondContact OD1-CB 3.5Å; D482-F485 PolarHBondContact OD1-N 2.96Å; F485-M488 PolarHBondContact O-N 3.13Å; F485-K489 HydrophobicContact CD1-CG 4.37Å; F485-K489 HydrophobicContact CE1-CG 4.04Å; F485-K489 HydrophobicContact CE2-CG 4.23Å; F485-K489 HydrophobicContact CZ-CD 4.46Å; F485-K489 HydrophobicContact CZ-CG 3.98Å; F485-K489 WeakPolarHBondContact O-CB 3.48Å; F485-K489 WeakPolarHBondContact O-CG 3.23Å; F485-K489 PolarHBondContact O-N 2.81Å
486	V	69.6	Low	61.1	Low	38 Å²	38	60.3 Å²	60.3	23%	0.23	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-50.2	-179.7	174.7	0	0	0	0	109.7	V427 D482 M488 K489 V490	V427-V486 HydrophobicContact CG1-CB 4.2Å; V427-V486 HydrophobicContact CG1-CG1 4.46Å; V427-V486 HydrophobicContact CG1-CG2 4.27Å; V427-V486 HydrophobicContact CG2-CB 4.17Å; V427-V486 HydrophobicContact CG2-CG1 3.75Å; D482-V486 WeakPolarHBondContact O-CG2 3.49Å; D482-V486 PolarHBondContact O-N 3.12Å; V486-M488 VanDerWaalsContact C-N 3.31Å; V486-M488 PolarHBondContact O-N 2.93Å; V486-K489 PolarHBondContact O-N 2.88Å; V486-V490 WeakPolarHBondContact O-CG2 3.42Å; V486-V490 PolarHBondContact O-N 3.43Å
487	C	68.3	Low	60.7	Low	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-68.8	-28.2	-177.4	-65.3	0	0	0	0	113.7	C423 K424 P483 G491 A492 C493	C423-C487 HydrophobicContact CB-CB 3.84Å; C423-C487 WeakPolarHBondContact CB-SG 3.42Å; C423-C487 PolarHBondContact O-SG 3.49Å; C423-C487 VanDerWaalsContact O-SG 3.37Å; C423-C487 WeakPolarHBondContact SG-CA 3.31Å; C423-C487 WeakPolarHBondContact SG-CB 3.28Å; C423-C487 CovalentContact SG-SG 2.04Å; C423-C487 PolarHBondContact SG-SG 3.37Å; K424-C487 HydrophobicContact CG-CB 4.24Å; K424-C487 PolarHBondContact N-SG 2.04Å; P483-C487 WeakPolarHBondContact O-CB 3.48Å; P483-C487 PolarHBondContact O-N 2.93Å; P483-C487 PolarHBondContact O-SG 2.96Å; C487-G491 PolarHBondContact O-N 3.47Å; C487-A492 HydrophobicContact CB-CB 4.43Å; C487-A492 PolarHBondContact O-N 3.37Å; C487-C493 HydrophobicContact CB-CB 4.19Å; C487-C493 WeakPolarHBondContact CB-SG 3.37Å; C487-C493 PolarHBondContact O-N 3.3Å
488	M	67.3	Low	60.5	Low	74 Å²	74	70 Å²	70	37%	0.365	39%	0.386	S	S	.	.	H	α-helix	trans	-68.8	-41.7	168.2	-78	-173.6	-72.1	0	0	112.1	D484 F485 V486 G491 C493	D484-M488 HydrophobicContact CB-CE 4.18Å; D484-M488 VanDerWaalsContact O-CB 3.27Å; D484-M488 WeakPolarHBondContact O-CB 3.04Å; D484-M488 VanDerWaalsContact O-CE 3.24Å; D484-M488 WeakPolarHBondContact O-CE 3.16Å; D484-M488 WeakPolarHBondContact O-CG 3.44Å; D484-M488 PolarHBondContact O-N 3.27Å; F485-M488 PolarHBondContact O-N 3.13Å; V486-M488 VanDerWaalsContact C-N 3.31Å; V486-M488 PolarHBondContact O-N 2.93Å; M488-G491 PolarHBondContact O-N 2.95Å; M488-C493 HydrophobicContact CG-CB 4.08Å
489	K	59.3	Low	60.1	Low	100 Å²	100	71.3 Å²	71.3	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-71.6	-36.9	-177.7	-74.6	-68.1	-175.8	176.1	0	113.3	F485 V486 G491	F485-K489 HydrophobicContact CD1-CG 4.37Å; F485-K489 HydrophobicContact CE1-CG 4.04Å; F485-K489 HydrophobicContact CE2-CG 4.23Å; F485-K489 HydrophobicContact CZ-CD 4.46Å; F485-K489 HydrophobicContact CZ-CG 3.98Å; F485-K489 WeakPolarHBondContact O-CB 3.48Å; F485-K489 WeakPolarHBondContact O-CG 3.23Å; F485-K489 PolarHBondContact O-N 2.81Å; V486-K489 PolarHBondContact O-N 2.88Å; K489-G491 PolarHBondContact O-N 3.41Å
490	V	59.8	Low	59.7	Low	102 Å²	102	70.2 Å²	70.2	62%	0.618	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	1	173.1	-57.2	0	0	0	0	112.9	V486 A492	V486-V490 WeakPolarHBondContact O-CG2 3.42Å; V486-V490 PolarHBondContact O-N 3.43Å; V490-A492 HydrophobicContact CG2-CB 3.92Å; V490-A492 PolarHBondContact O-N 2.86Å
491	G	57.9	Low	59.2	Low	44 Å²	44	72.1 Å²	72.1	45%	0.454	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	11	177.1	0	0	0	0	0	114.6	F414 C487 M488 K489	F414-G491 WeakPolarHBondContact CZ-O 3.21Å; C487-G491 PolarHBondContact O-N 3.47Å; M488-G491 PolarHBondContact O-N 2.95Å; K489-G491 PolarHBondContact O-N 3.41Å
492	A	69	Low	58.5	Low	12 Å²	12	74.1 Å²	74.1	10%	0.099	40%	0.402	C	S	.	.	S	Bend	trans	-75.6	-29	177	0	0	0	0	0	112.4	C420 C423 C487 V490	C420-A492 VanDerWaalsContact CA-O 3.31Å; C420-A492 WeakPolarHBondContact CA-O 3.39Å; C420-A492 VanDerWaalsContact CB-O 3.3Å; C420-A492 WeakPolarHBondContact CB-O 3.08Å; C420-A492 PolarHBondContact N-O 2.92Å; C423-A492 HydrophobicContact CB-CB 3.58Å; C487-A492 HydrophobicContact CB-CB 4.43Å; C487-A492 PolarHBondContact O-N 3.37Å; V490-A492 HydrophobicContact CG2-CB 3.92Å; V490-A492 PolarHBondContact O-N 2.86Å
493	C	66.1	Low	57.8	Low	7 Å²	7	76.7 Å²	76.7	5%	0.047	41%	0.414	C	S	.	.	S	Bend	trans	-109	143.3	172.3	-69	0	0	0	0	111.1	C420 K424 C487 M488 G495	C420-C493 WeakPolarHBondContact CA-SG 3.14Å; C420-C493 HydrophobicContact CB-CB 3.99Å; C420-C493 WeakPolarHBondContact CB-SG 3.37Å; C420-C493 VanDerWaalsContact SG-CA 3.54Å; C420-C493 WeakPolarHBondContact SG-CB 3.34Å; C420-C493 CovalentContact SG-SG 2.04Å; C420-C493 PolarHBondContact SG-SG 2.68Å; K424-C493 WeakPolarHBondContact CE-SG 3.35Å; C487-C493 HydrophobicContact CB-CB 4.19Å; C487-C493 WeakPolarHBondContact CB-SG 3.37Å; C487-C493 PolarHBondContact O-N 3.3Å; M488-C493 HydrophobicContact CG-CB 4.08Å; C493-G495 PolarHBondContact O-N 2.88Å
494	P	65.1	Low	57.1	Low	110 Å²	110	79 Å²	79	71%	0.714	43%	0.425	S	S	*	.			trans	-64.1	109.7	176.8	24.9	-31.3	0	0	0	110.2
495	G	57.2	Low	56.8	Low	47 Å²	47	76.5 Å²	76.5	49%	0.485	41%	0.414	S	S	.	.			trans	-78.1	137.7	170.7	0	0	0	0	0	111	C493 K497	C493-G495 PolarHBondContact O-N 2.88Å; G495-K497 PolarHBondContact O-N 3.07Å
496	A	48	Very low	56.8	Low	74 Å²	74	75.5 Å²	75.5	61%	0.612	41%	0.411	S	S	*	.			trans	-56.8	130.7	164.9	0	0	0	0	0	108.3	R498	A496-R498 HydrophobicContact CB-CG 4.45Å; A496-R498 PolarHBondContact O-N 2.04Å
497	K	42.4	Very low	56.8	Low	219 Å²	219	77.6 Å²	77.6	95%	0.952	43%	0.427	S	S	*	.			trans	-59.8	88.5	173.5	-70.5	-178.8	-179.7	179	0	108.9	G495	G495-K497 PolarHBondContact O-N 3.07Å
498	R	50.2	Low	56.8	Low	116 Å²	116	83.3 Å²	83.3	44%	0.438	45%	0.454	S	S	.	.			trans	-101.2	143.9	174.7	-77	-172.8	179.5	151.3	2.1	110	A496 E502 L522	A496-R498 HydrophobicContact CB-CG 4.45Å; A496-R498 PolarHBondContact O-N 2.04Å; R498-E502 WeakPolarHBondContact CB-OE2 3.45Å; R498-L522 PolarHBondContact NH1-O 3.28Å
499	H	46.2	Very low	56.9	Low	148 Å²	148	80.6 Å²	80.6	69%	0.685	45%	0.445	S	S	*	.			trans	-60.6	143.7	-175.2	-100.8	-97.3	0	0	0	110.2	L501 E502 M503	H499-L501 PolarHBondContact O-N 3.05Å; H499-E502 PolarHBondContact N-OE2 3.49Å; H499-E502 WeakPolarHBondContact O-CB 3.2Å; H499-E502 PolarHBondContact O-N 3.49Å; H499-M503 PolarHBondContact O-N 2.85Å
500	F	44.1	Very low	57.4	Low	119 Å²	119	77.7 Å²	77.7	52%	0.522	44%	0.436	S	S	.	.	H	α-helix	trans	-50.2	-34.9	-177.7	-176.7	-102.4	0	0	0	113.6	F330 M503 L504	F330-F500 HydrophobicContact CD2-CE1 4.24Å; F500-M503 PolarHBondContact O-N 3.42Å; F500-L504 HydrophobicContact CD1-CD1 3.85Å; F500-L504 HydrophobicContact CE1-CD1 3.53Å; F500-L504 HydrophobicContact CZ-CD1 4.15Å; F500-L504 PolarHBondContact O-N 3.36Å
501	L	44.1	Very low	58.1	Low	128 Å²	128	80 Å²	80	67%	0.67	45%	0.445	S	S	*	.	H	α-helix	trans	-66.8	-33.2	177.5	-68	165.6	0	0	0	113.7	H499 A505	H499-L501 PolarHBondContact O-N 3.05Å; L501-A505 PolarHBondContact O-N 3.48Å
502	E	44.6	Very low	59.1	Low	68 Å²	68	81.7 Å²	81.7	32%	0.318	44%	0.438	S	S	.	.	H	α-helix	trans	-73.6	-31.4	175.7	-69.9	173.9	150.9	0	0	111.4	R498 H499 A505 C506 L522	R498-E502 WeakPolarHBondContact CB-OE2 3.45Å; H499-E502 PolarHBondContact N-OE2 3.49Å; H499-E502 WeakPolarHBondContact O-CB 3.2Å; H499-E502 PolarHBondContact O-N 3.49Å; E502-A505 PolarHBondContact O-N 2.91Å; E502-C506 PolarHBondContact O-N 2.94Å; E502-C506 PolarHBondContact O-SG 3.48Å; E502-L522 HydrophobicContact CG-CD1 4.41Å; E502-L522 HydrophobicContact CG-CD2 4.48Å
503	M	52.8	Low	59.6	Low	83 Å²	83	82 Å²	82	41%	0.409	44%	0.437	S	S	.	.	H	α-helix	trans	-68.8	-35.4	176.1	-86.2	-168.9	-86.8	0	0	113.2	H499 F500 C506 S507	H499-M503 PolarHBondContact O-N 2.85Å; F500-M503 PolarHBondContact O-N 3.42Å; M503-C506 PolarHBondContact O-N 3.37Å; M503-S507 PolarHBondContact O-N 2.93Å; M503-S507 VanDerWaalsContact O-N 3.16Å; M503-S507 PolarHBondContact O-OG 2.75Å
504	L	52.8	Low	60.4	Low	69 Å²	69	82 Å²	82	36%	0.361	44%	0.437	S	S	.	.	H	α-helix	trans	-65.8	-38.7	176.1	-95.9	146.6	0	0	0	112.4	F500 S507	F500-L504 HydrophobicContact CD1-CD1 3.85Å; F500-L504 HydrophobicContact CE1-CD1 3.53Å; F500-L504 HydrophobicContact CZ-CD1 4.15Å; F500-L504 PolarHBondContact O-N 3.36Å; L504-S507 WeakPolarHBondContact CA-OG 3.35Å; L504-S507 PolarHBondContact O-N 3.13Å; L504-S507 PolarHBondContact O-OG 2.94Å
505	A	60.6	Low	61.3	Low	17 Å²	17	84.7 Å²	84.7	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-62.6	-44.8	174.3	0	0	0	0	0	111.2	L501 E502 S507 Q508 Y512	L501-A505 PolarHBondContact O-N 3.48Å; E502-A505 PolarHBondContact O-N 2.91Å; A505-S507 VanDerWaalsContact C-N 3.33Å; A505-S507 PolarHBondContact O-N 2.99Å; A505-Q508 WeakPolarHBondContact O-CB 3.06Å; A505-Q508 WeakPolarHBondContact O-CG 3.35Å; A505-Q508 PolarHBondContact O-N 3.36Å; A505-Y512 HydrophobicContact CB-CE1 3.77Å; A505-Y512 WeakPolarHBondContact O-CD1 3.11Å; A505-Y512 VanDerWaalsContact O-CE1 3.25Å; A505-Y512 WeakPolarHBondContact O-CE1 3.25Å
506	C	67.9	Low	62.6	Low	10 Å²	10	86.7 Å²	86.7	7%	0.068	44%	0.44	C	S	.	.	H	α-helix	trans	-73.7	-18.8	-178.3	-58.3	0	0	0	0	114.7	E502 M503 Q508 W513 C523	E502-C506 PolarHBondContact O-N 2.94Å; E502-C506 PolarHBondContact O-SG 3.48Å; M503-C506 PolarHBondContact O-N 3.37Å; C506-Q508 PolarHBondContact O-N 3.21Å; C506-W513 VanDerWaalsContact O-CD1 3.27Å; C506-W513 PolarHBondContact O-NE1 3.43Å; C506-C523 WeakPolarHBondContact CA-SG 3.31Å; C506-C523 HydrophobicContact CB-CB 3.67Å; C506-C523 WeakPolarHBondContact CB-SG 3.48Å; C506-C523 WeakPolarHBondContact SG-CA 3.3Å; C506-C523 WeakPolarHBondContact SG-CB 3.45Å; C506-C523 CovalentContact SG-SG 2.03Å; C506-C523 PolarHBondContact SG-SG 3.4Å
507	S	68.3	Low	64.3	Low	82 Å²	82	89.1 Å²	89.1	57%	0.573	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.5	172.5	45.6	0	0	0	0	114.2	M503 L504 A505 G509	M503-S507 PolarHBondContact O-N 2.93Å; M503-S507 VanDerWaalsContact O-N 3.16Å; M503-S507 PolarHBondContact O-OG 2.75Å; L504-S507 WeakPolarHBondContact CA-OG 3.35Å; L504-S507 PolarHBondContact O-N 3.13Å; L504-S507 PolarHBondContact O-OG 2.94Å; A505-S507 VanDerWaalsContact C-N 3.33Å; A505-S507 PolarHBondContact O-N 2.99Å; S507-G509 PolarHBondContact O-N 2.95Å
508	Q	68.3	Low	66	Low	121 Å²	121	80.9 Å²	80.9	57%	0.565	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	2.2	176.4	-62.2	-175	7.6	0	0	113.7	A505 C506 Y512	A505-Q508 WeakPolarHBondContact O-CB 3.06Å; A505-Q508 WeakPolarHBondContact O-CG 3.35Å; A505-Q508 PolarHBondContact O-N 3.36Å; C506-Q508 PolarHBondContact O-N 3.21Å; Q508-Y512 VanDerWaalsContact CB-CB 3.49Å; Q508-Y512 HydrophobicContact CB-CD1 4.34Å; Q508-Y512 HydrophobicContact CB-CD2 4.34Å; Q508-Y512 HydrophobicContact CB-CG 3.81Å
509	G	69.3	Low	67.4	Low	17 Å²	17	75.8 Å²	75.8	18%	0.175	40%	0.397	C	S	.	.			trans	79.6	178.9	172	0	0	0	0	0	115	S507 D511 Y512 W513	S507-G509 PolarHBondContact O-N 2.95Å; G509-D511 PolarHBondContact O-N 3.1Å; G509-D511 VanDerWaalsContact O-N 3.13Å; G509-Y512 PolarHBondContact O-N 3.24Å; G509-W513 VanDerWaalsContact C-CD1 3.46Å; G509-W513 VanDerWaalsContact C-CE2 3.48Å; G509-W513 PolarHBondContact O-N 2.88Å; G509-W513 PolarHBondContact O-NE1 3.43Å; G509-W513 VanDerWaalsContact O-NE1 3.09Å
510	P	69.9	Low	68.9	Low	39 Å²	39	68.8 Å²	68.8	25%	0.253	36%	0.364	S	S	.	.	H	α-helix	trans	-54.6	-33.8	-173.7	-23.7	31.3	0	0	0	113.5	Y512 W513 C514	P510-Y512 PolarHBondContact O-N 3.23Å; P510-W513 VanDerWaalsContact CA-CE2 3.49Å; P510-W513 HydrophobicContact CB-CH2 3.96Å; P510-W513 HydrophobicContact CB-CZ2 3.94Å; P510-W513 HydrophobicContact CB-CZ3 4.36Å; P510-W513 HydrophobicContact CG-CH2 3.87Å; P510-W513 HydrophobicContact CG-CZ2 3.58Å; P510-C514 WeakPolarHBondContact O-CA 3.35Å; P510-C514 WeakPolarHBondContact O-CB 3.36Å; P510-C514 PolarHBondContact O-N 2.86Å
511	D	75.8	Confident	70.5	Confident	150 Å²	150	68 Å²	68	80%	0.802	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-28.5	178.2	-66.1	-26	0	0	0	113.2	G509	G509-D511 PolarHBondContact O-N 3.1Å; G509-D511 VanDerWaalsContact O-N 3.13Å
512	Y	78.9	Confident	71.9	Confident	80 Å²	80	64.7 Å²	64.7	31%	0.314	35%	0.345	S	S	.	.	H	α-helix	trans	-86.5	-58.8	174.2	175.4	-95.2	0	0	0	111.5	A505 Q508 G509 P510 C514 K515 A519	A505-Y512 HydrophobicContact CB-CE1 3.77Å; A505-Y512 WeakPolarHBondContact O-CD1 3.11Å; A505-Y512 VanDerWaalsContact O-CE1 3.25Å; A505-Y512 WeakPolarHBondContact O-CE1 3.25Å; Q508-Y512 VanDerWaalsContact CB-CB 3.49Å; Q508-Y512 HydrophobicContact CB-CD1 4.34Å; Q508-Y512 HydrophobicContact CB-CD2 4.34Å; Q508-Y512 HydrophobicContact CB-CG 3.81Å; G509-Y512 PolarHBondContact O-N 3.24Å; P510-Y512 PolarHBondContact O-N 3.23Å; Y512-C514 PolarHBondContact O-N 3.36Å; Y512-K515 WeakPolarHBondContact O-CB 3.26Å; Y512-K515 PolarHBondContact O-N 3.1Å; Y512-K515 VanDerWaalsContact O-N 3.13Å; Y512-A519 HydrophobicContact CE1-CB 4.29Å
513	W	79.3	Confident	73.3	Confident	18 Å²	18	61.9 Å²	61.9	7%	0.068	33%	0.333	C	S	.	.	H	α-helix	trans	-79.5	-20.2	-169.6	44.9	-104.2	0	0	0	113.7	C506 G509 P510 K515 A520 C523 T525 H528 C529	C506-W513 VanDerWaalsContact O-CD1 3.27Å; C506-W513 PolarHBondContact O-NE1 3.43Å; G509-W513 VanDerWaalsContact C-CD1 3.46Å; G509-W513 VanDerWaalsContact C-CE2 3.48Å; G509-W513 PolarHBondContact O-N 2.88Å; G509-W513 PolarHBondContact O-NE1 3.43Å; G509-W513 VanDerWaalsContact O-NE1 3.09Å; P510-W513 VanDerWaalsContact CA-CE2 3.49Å; P510-W513 HydrophobicContact CB-CH2 3.96Å; P510-W513 HydrophobicContact CB-CZ2 3.94Å; P510-W513 HydrophobicContact CB-CZ3 4.36Å; P510-W513 HydrophobicContact CG-CH2 3.87Å; P510-W513 HydrophobicContact CG-CZ2 3.58Å; W513-K515 VanDerWaalsContact C-N 3.34Å; W513-A520 WeakPolarHBondContact O-CA 3.22Å; W513-A520 VanDerWaalsContact O-CB 3.27Å; W513-A520 WeakPolarHBondContact O-CB 3.31Å; W513-A520 PolarHBondContact O-N 3.15Å; W513-C523 HydrophobicContact CB-CB 3.89Å; W513-C523 HydrophobicContact CG-CB 4.25Å; W513-T525 HydrophobicContact CD2-CG2 3.9Å; W513-T525 VanDerWaalsContact CD2-OG1 3.26Å; W513-T525 HydrophobicContact CE3-CG2 3.84Å; W513-T525 HydrophobicContact CH2-CG2 4Å; W513-T525 HydrophobicContact CZ2-CG2 4.07Å; W513-T525 HydrophobicContact CZ3-CG2 3.88Å; W513-H528 HydrophobicContact CH2-CB 4.03Å; W513-H528 AromaticContact CH2-CD2 3.85Å; W513-H528 AromaticContact CH2-CE1 3.51Å; W513-H528 AromaticContact CH2-CG 3.45Å; W513-H528 VanDerWaalsContact CH2-CG 3.45Å; W513-H528 AromaticContact CH2-ND1 3.22Å; W513-H528 WeakPolarHBondContact CH2-ND1 3.49Å; W513-H528 AromaticContact CH2-NE2 3.88Å; W513-H528 HydrophobicContact CZ3-CB 3.9Å; W513-H528 AromaticContact CZ3-CE1 3.96Å; W513-H528 AromaticContact CZ3-CG 3.65Å; W513-H528 AromaticContact CZ3-ND1 3.27Å; W513-H528 VanDerWaalsContact CZ3-ND1 3.27Å; W513-H528 WeakPolarHBondContact CZ3-ND1 3.37Å; W513-C529 WeakPolarHBondContact CZ3-SG 3.46Å
514	C	82.9	Confident	74.1	Confident	7 Å²	7	59.9 Å²	59.9	5%	0.047	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	6.2	166.5	-59	0	0	0	0	114	P510 Y512 C529 V533 W534	P510-C514 WeakPolarHBondContact O-CA 3.35Å; P510-C514 WeakPolarHBondContact O-CB 3.36Å; P510-C514 PolarHBondContact O-N 2.86Å; Y512-C514 PolarHBondContact O-N 3.36Å; C514-C529 WeakPolarHBondContact CA-SG 3.4Å; C514-C529 HydrophobicContact CB-CB 3.75Å; C514-C529 WeakPolarHBondContact CB-SG 3.44Å; C514-C529 WeakPolarHBondContact SG-CA 3.33Å; C514-C529 WeakPolarHBondContact SG-CB 3.43Å; C514-C529 CovalentContact SG-SG 2.05Å; C514-C529 PolarHBondContact SG-SG 2.6Å; C514-V533 HydrophobicContact CB-CB 3.85Å; C514-V533 HydrophobicContact CB-CG1 3.76Å; C514-V533 HydrophobicContact CB-CG2 3.91Å; C514-W534 PolarHBondContact O-NE1 3.33Å
515	K	84.3	Confident	75.3	Confident	166 Å²	166	56.7 Å²	56.7	72%	0.722	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-38.3	175.8	-164.2	170	-177.6	173.4	0	112.5	Y512 W513	Y512-K515 WeakPolarHBondContact O-CB 3.26Å; Y512-K515 PolarHBondContact O-N 3.1Å; Y512-K515 VanDerWaalsContact O-N 3.13Å; W513-K515 VanDerWaalsContact C-N 3.34Å
516	V	83.3	Confident	76.3	Confident	89 Å²	89	57.5 Å²	57.5	54%	0.539	32%	0.32	S	S	.	.	S	Bend	trans	-142.6	144.1	-178.1	-68.4	0	0	0	0	110.9	G518 A519 A520	V516-G518 VanDerWaalsContact C-N 3.29Å; V516-G518 PolarHBondContact O-N 3.34Å; V516-A519 HydrophobicContact CG2-CB 3.68Å; V516-A519 PolarHBondContact O-N 3.3Å; V516-A520 PolarHBondContact O-N 3.35Å
517	K	83.6	Confident	76.6	Confident	125 Å²	125	60.3 Å²	60.3	54%	0.543	34%	0.344	S	S	.	.	H	α-helix	trans	-57.3	-39.8	-174.2	-165.8	-178.2	177.8	-165.1	0	113.8	A519 A520 E521 W534	K517-A519 VanDerWaalsContact C-N 3.31Å; K517-A519 PolarHBondContact O-N 2.99Å; K517-A520 PolarHBondContact O-N 2.91Å; K517-E521 WeakPolarHBondContact CE-OE1 3.27Å; K517-E521 IonicContact NZ-OE1 3.85Å; K517-E521 WeakPolarHBondContact O-CG 3.4Å; K517-E521 PolarHBondContact O-N 2.96Å; K517-W534 HydrophobicContact CB-CH2 4.13Å; K517-W534 HydrophobicContact CG-CH2 4.11Å; K517-W534 HydrophobicContact CG-CZ3 4.23Å
518	G	79.4	Confident	77	Confident	46 Å²	46	58 Å²	58	47%	0.474	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-32.8	177.9	0	0	0	0	0	113.7	V516 L522	V516-G518 VanDerWaalsContact C-N 3.29Å; V516-G518 PolarHBondContact O-N 3.34Å; G518-L522 VanDerWaalsContact O-CB 3.24Å; G518-L522 WeakPolarHBondContact O-CB 3.07Å; G518-L522 PolarHBondContact O-N 3.23Å
519	A	78.4	Confident	77.6	Confident	10 Å²	10	52.2 Å²	52.2	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-72.4	-38.6	176	0	0	0	0	0	111.2	Y512 V516 K517 E521 L522 C523	Y512-A519 HydrophobicContact CE1-CB 4.29Å; V516-A519 HydrophobicContact CG2-CB 3.68Å; V516-A519 PolarHBondContact O-N 3.3Å; K517-A519 VanDerWaalsContact C-N 3.31Å; K517-A519 PolarHBondContact O-N 2.99Å; A519-E521 VanDerWaalsContact C-N 3.35Å; A519-E521 PolarHBondContact O-N 3.22Å; A519-L522 PolarHBondContact O-N 3.27Å; A519-C523 VanDerWaalsContact O-CB 3.23Å; A519-C523 WeakPolarHBondContact O-CB 3.33Å; A519-C523 PolarHBondContact O-N 3.11Å; A519-C523 PolarHBondContact O-SG 3.23Å
520	A	77.6	Confident	78.3	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-37.7	173.9	0	0	0	0	0	112.1	W513 V516 K517 C523 G524 T525 V526 C529 W534	W513-A520 WeakPolarHBondContact O-CA 3.22Å; W513-A520 VanDerWaalsContact O-CB 3.27Å; W513-A520 WeakPolarHBondContact O-CB 3.31Å; W513-A520 PolarHBondContact O-N 3.15Å; V516-A520 PolarHBondContact O-N 3.35Å; K517-A520 PolarHBondContact O-N 2.91Å; A520-C523 CarbonylContact O-C 3.53Å; A520-C523 PolarHBondContact O-N 3.39Å; A520-G524 CarbonylContact O-C 3.52Å; A520-G524 WeakPolarHBondContact O-CA 3.22Å; A520-G524 PolarHBondContact O-N 3.14Å; A520-T525 PolarHBondContact O-N 3.25Å; A520-V526 HydrophobicContact CB-CB 4.47Å; A520-V526 HydrophobicContact CB-CG2 3.92Å; A520-C529 HydrophobicContact CB-CB 4.48Å; A520-W534 HydrophobicContact CB-CH2 3.41Å; A520-W534 VanDerWaalsContact CB-CH2 3.41Å; A520-W534 HydrophobicContact CB-CZ2 4.1Å; A520-W534 HydrophobicContact CB-CZ3 4.28Å
521	E	78.9	Confident	78.5	Confident	102 Å²	102	63.8 Å²	63.8	48%	0.477	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-43.4	174.7	-73.9	172.8	-177.9	0	0	111.1	K517 A519 C523 G524 V526	K517-E521 WeakPolarHBondContact CE-OE1 3.27Å; K517-E521 IonicContact NZ-OE1 3.85Å; K517-E521 WeakPolarHBondContact O-CG 3.4Å; K517-E521 PolarHBondContact O-N 2.96Å; A519-E521 VanDerWaalsContact C-N 3.35Å; A519-E521 PolarHBondContact O-N 3.22Å; E521-C523 VanDerWaalsContact C-N 3.3Å; E521-C523 PolarHBondContact O-N 3.02Å; E521-G524 PolarHBondContact O-N 3.26Å; E521-V526 HydrophobicContact CB-CG2 4.17Å; E521-V526 HydrophobicContact CG-CG2 3.49Å; E521-V526 VanDerWaalsContact CG-CG2 3.49Å
522	L	72.5	Confident	78.3	Confident	60 Å²	60	61.7 Å²	61.7	31%	0.314	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-37	175	-170.3	73.6	0	0	0	112.1	R498 E502 G518 A519	R498-L522 PolarHBondContact NH1-O 3.28Å; E502-L522 HydrophobicContact CG-CD1 4.41Å; E502-L522 HydrophobicContact CG-CD2 4.48Å; G518-L522 VanDerWaalsContact O-CB 3.24Å; G518-L522 WeakPolarHBondContact O-CB 3.07Å; G518-L522 PolarHBondContact O-N 3.23Å; A519-L522 PolarHBondContact O-N 3.27Å
523	C	73.6	Confident	78.2	Confident	8 Å²	8	61.4 Å²	61.4	5%	0.054	32%	0.322	C	S	.	.	H	α-helix	trans	-91	-6.1	-178.9	-62.4	0	0	0	0	114.3	C506 W513 A519 A520 E521 T525	C506-C523 WeakPolarHBondContact CA-SG 3.31Å; C506-C523 HydrophobicContact CB-CB 3.67Å; C506-C523 WeakPolarHBondContact CB-SG 3.48Å; C506-C523 WeakPolarHBondContact SG-CA 3.3Å; C506-C523 WeakPolarHBondContact SG-CB 3.45Å; C506-C523 CovalentContact SG-SG 2.03Å; C506-C523 PolarHBondContact SG-SG 3.4Å; W513-C523 HydrophobicContact CB-CB 3.89Å; W513-C523 HydrophobicContact CG-CB 4.25Å; A519-C523 VanDerWaalsContact O-CB 3.23Å; A519-C523 WeakPolarHBondContact O-CB 3.33Å; A519-C523 PolarHBondContact O-N 3.11Å; A519-C523 PolarHBondContact O-SG 3.23Å; A520-C523 CarbonylContact O-C 3.53Å; A520-C523 PolarHBondContact O-N 3.39Å; E521-C523 VanDerWaalsContact C-N 3.3Å; E521-C523 PolarHBondContact O-N 3.02Å; C523-T525 VanDerWaalsContact C-N 3.29Å; C523-T525 HydrophobicContact CB-CG2 4.27Å
524	G	71.1	Confident	78.4	Confident	42 Å²	42	63.8 Å²	63.8	43%	0.433	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	18.4	-177.9	0	0	0	0	0	114.3	A520 E521	A520-G524 CarbonylContact O-C 3.52Å; A520-G524 WeakPolarHBondContact O-CA 3.22Å; A520-G524 PolarHBondContact O-N 3.14Å; E521-G524 PolarHBondContact O-N 3.26Å
525	T	77.9	Confident	77.8	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.012	37%	0.369	C	S	.	.			trans	-111.3	17.8	-169.8	53.4	0	0	0	0	113.7	W513 A520 C523 A527 H528 C529	W513-T525 HydrophobicContact CD2-CG2 3.9Å; W513-T525 VanDerWaalsContact CD2-OG1 3.26Å; W513-T525 HydrophobicContact CE3-CG2 3.84Å; W513-T525 HydrophobicContact CH2-CG2 4Å; W513-T525 HydrophobicContact CZ2-CG2 4.07Å; W513-T525 HydrophobicContact CZ3-CG2 3.88Å; A520-T525 PolarHBondContact O-N 3.25Å; C523-T525 VanDerWaalsContact C-N 3.29Å; C523-T525 HydrophobicContact CB-CG2 4.27Å; T525-A527 VanDerWaalsContact C-N 3.26Å; T525-A527 PolarHBondContact O-N 2.99Å; T525-H528 PolarHBondContact O-N 3.03Å; T525-C529 PolarHBondContact O-N 3.48Å; T525-C529 PolarHBondContact O-SG 3.12Å; T525-C529 VanDerWaalsContact O-SG 3.39Å
526	V	80.9	Confident	76.3	Confident	34 Å²	34	76.9 Å²	76.9	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-55	-41.2	-179.3	-178.4	0	0	0	0	112.2	A520 E521 C529 K530 W534	A520-V526 HydrophobicContact CB-CB 4.47Å; A520-V526 HydrophobicContact CB-CG2 3.92Å; E521-V526 HydrophobicContact CB-CG2 4.17Å; E521-V526 HydrophobicContact CG-CG2 3.49Å; E521-V526 VanDerWaalsContact CG-CG2 3.49Å; V526-C529 PolarHBondContact O-N 2.91Å; V526-K530 HydrophobicContact CG1-CD 4.26Å; V526-K530 HydrophobicContact CG1-CG 4.5Å; V526-K530 WeakPolarHBondContact O-CB 3.28Å; V526-K530 WeakPolarHBondContact O-CG 3.34Å; V526-K530 PolarHBondContact O-N 3.08Å; V526-W534 HydrophobicContact CG1-CZ3 4.34Å
527	A	74.1	Confident	76	Confident	69 Å²	69	76.3 Å²	76.3	57%	0.57	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-46.6	180	0	0	0	0	0	111.4	T525 C529 K530 R531	T525-A527 VanDerWaalsContact C-N 3.26Å; T525-A527 PolarHBondContact O-N 2.99Å; A527-C529 PolarHBondContact O-N 3.04Å; A527-K530 PolarHBondContact O-N 3.49Å; A527-R531 WeakPolarHBondContact O-CB 3.26Å; A527-R531 PolarHBondContact O-N 2.98Å
528	H	76.4	Confident	75.6	Confident	32 Å²	32	73.7 Å²	73.7	15%	0.148	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-48.6	174.3	178.3	-68	0	0	0	111.5	W513 T525 K530 R531 Y532	W513-H528 HydrophobicContact CH2-CB 4.03Å; W513-H528 AromaticContact CH2-CD2 3.85Å; W513-H528 AromaticContact CH2-CE1 3.51Å; W513-H528 AromaticContact CH2-CG 3.45Å; W513-H528 VanDerWaalsContact CH2-CG 3.45Å; W513-H528 AromaticContact CH2-ND1 3.22Å; W513-H528 WeakPolarHBondContact CH2-ND1 3.49Å; W513-H528 AromaticContact CH2-NE2 3.88Å; W513-H528 HydrophobicContact CZ3-CB 3.9Å; W513-H528 AromaticContact CZ3-CE1 3.96Å; W513-H528 AromaticContact CZ3-CG 3.65Å; W513-H528 AromaticContact CZ3-ND1 3.27Å; W513-H528 VanDerWaalsContact CZ3-ND1 3.27Å; W513-H528 WeakPolarHBondContact CZ3-ND1 3.37Å; T525-H528 PolarHBondContact O-N 3.03Å; H528-K530 VanDerWaalsContact C-N 3.34Å; H528-K530 PolarHBondContact O-N 2.78Å; H528-R531 PolarHBondContact O-N 3.08Å; H528-R531 VanDerWaalsContact O-N 3.12Å; H528-Y532 HydrophobicContact CB-CD2 4.47Å; H528-Y532 AromaticContact CD2-CD2 3.67Å; H528-Y532 AromaticContact CE1-CD2 3.99Å; H528-Y532 AromaticContact CG-CD2 3.81Å; H528-Y532 AromaticContact ND1-CD2 4Å; H528-Y532 AromaticContact NE2-CD2 3.81Å; H528-Y532 WeakPolarHBondContact O-CD2 3.3Å; H528-Y532 PolarHBondContact O-N 2.96Å
529	C	82.1	Confident	75.4	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.369	C	S	.	.	I	π-helix	trans	-60.8	-43.6	179.8	-61.6	0	0	0	0	112.3	W513 C514 A520 T525 V526 A527 R531 V533 W534	W513-C529 WeakPolarHBondContact CZ3-SG 3.46Å; C514-C529 WeakPolarHBondContact CA-SG 3.4Å; C514-C529 HydrophobicContact CB-CB 3.75Å; C514-C529 WeakPolarHBondContact CB-SG 3.44Å; C514-C529 WeakPolarHBondContact SG-CA 3.33Å; C514-C529 WeakPolarHBondContact SG-CB 3.43Å; C514-C529 CovalentContact SG-SG 2.05Å; C514-C529 PolarHBondContact SG-SG 2.6Å; A520-C529 HydrophobicContact CB-CB 4.48Å; T525-C529 PolarHBondContact O-N 3.48Å; T525-C529 PolarHBondContact O-SG 3.12Å; T525-C529 VanDerWaalsContact O-SG 3.39Å; V526-C529 PolarHBondContact O-N 2.91Å; A527-C529 PolarHBondContact O-N 3.04Å; C529-R531 VanDerWaalsContact C-N 3.3Å; C529-R531 PolarHBondContact O-N 3.45Å; C529-V533 CarbonylContact O-C 3.33Å; C529-V533 WeakPolarHBondContact O-CA 3.36Å; C529-V533 PolarHBondContact O-N 3.16Å; C529-W534 HydrophobicContact CB-CD2 3.62Å; C529-W534 HydrophobicContact CB-CE3 3.56Å; C529-W534 HydrophobicContact CB-CG 4.34Å; C529-W534 HydrophobicContact CB-CH2 3.61Å; C529-W534 HydrophobicContact CB-CZ2 3.68Å; C529-W534 HydrophobicContact CB-CZ3 3.57Å; C529-W534 PolarHBondContact O-N 2.83Å
530	K	82.5	Confident	75.2	Confident	118 Å²	118	79.1 Å²	79.1	51%	0.513	39%	0.386	S	S	.	.	I	π-helix	trans	-61.9	-36.8	174.6	-74.2	-178.3	174.9	-167.5	0	113.2	V526 A527 H528 W534	V526-K530 HydrophobicContact CG1-CD 4.26Å; V526-K530 HydrophobicContact CG1-CG 4.5Å; V526-K530 WeakPolarHBondContact O-CB 3.28Å; V526-K530 WeakPolarHBondContact O-CG 3.34Å; V526-K530 PolarHBondContact O-N 3.08Å; A527-K530 PolarHBondContact O-N 3.49Å; H528-K530 VanDerWaalsContact C-N 3.34Å; H528-K530 PolarHBondContact O-N 2.78Å; K530-W534 HydrophobicContact CG-CE3 3.92Å; K530-W534 HydrophobicContact CG-CZ3 4.37Å; K530-W534 VanDerWaalsContact O-O 3.09Å
531	R	75.4	Confident	75	Confident	181 Å²	181	84 Å²	84	68%	0.683	41%	0.41	S	S	*	.	I	π-helix	trans	-79.1	-39.7	-175.3	-174.6	174.3	-109.2	178.8	-10	112.8	A527 H528 C529	A527-R531 WeakPolarHBondContact O-CB 3.26Å; A527-R531 PolarHBondContact O-N 2.98Å; H528-R531 PolarHBondContact O-N 3.08Å; H528-R531 VanDerWaalsContact O-N 3.12Å; C529-R531 VanDerWaalsContact C-N 3.3Å; C529-R531 PolarHBondContact O-N 3.45Å
532	Y	72.1	Confident	74.8	Confident	106 Å²	106	82.8 Å²	82.8	42%	0.416	41%	0.406	S	S	.	.	I	π-helix	trans	-114.9	-20.9	-168.3	-58.5	-75.3	0	0	0	114.7	E435 H528	E435-Y532 PolarHBondContact OE1-OH 3.27Å; H528-Y532 HydrophobicContact CB-CD2 4.47Å; H528-Y532 AromaticContact CD2-CD2 3.67Å; H528-Y532 AromaticContact CE1-CD2 3.99Å; H528-Y532 AromaticContact CG-CD2 3.81Å; H528-Y532 AromaticContact ND1-CD2 4Å; H528-Y532 AromaticContact NE2-CD2 3.81Å; H528-Y532 WeakPolarHBondContact O-CD2 3.3Å; H528-Y532 PolarHBondContact O-N 2.96Å
533	V	75.6	Confident	74.9	Confident	74 Å²	74	84.4 Å²	84.4	45%	0.448	41%	0.412	S	S	.	.	I	π-helix	trans	-122.9	-57.4	-170.6	-174.6	0	0	0	0	113.1	C514 C529 K535	C514-V533 HydrophobicContact CB-CB 3.85Å; C514-V533 HydrophobicContact CB-CG1 3.76Å; C514-V533 HydrophobicContact CB-CG2 3.91Å; C529-V533 CarbonylContact O-C 3.33Å; C529-V533 WeakPolarHBondContact O-CA 3.36Å; C529-V533 PolarHBondContact O-N 3.16Å; V533-K535 VanDerWaalsContact C-N 3.34Å; V533-K535 PolarHBondContact O-N 3.04Å
534	W	83.9	Confident	75	Confident	69 Å²	69	90.3 Å²	90.3	26%	0.261	44%	0.44	S	S	.	.	S	Bend	trans	-79.6	81.5	174.2	-54.7	-25.1	0	0	0	109.3	C514 K517 A520 V526 C529 K530 E536	C514-W534 PolarHBondContact O-NE1 3.33Å; K517-W534 HydrophobicContact CB-CH2 4.13Å; K517-W534 HydrophobicContact CG-CH2 4.11Å; K517-W534 HydrophobicContact CG-CZ3 4.23Å; A520-W534 HydrophobicContact CB-CH2 3.41Å; A520-W534 VanDerWaalsContact CB-CH2 3.41Å; A520-W534 HydrophobicContact CB-CZ2 4.1Å; A520-W534 HydrophobicContact CB-CZ3 4.28Å; V526-W534 HydrophobicContact CG1-CZ3 4.34Å; C529-W534 HydrophobicContact CB-CD2 3.62Å; C529-W534 HydrophobicContact CB-CE3 3.56Å; C529-W534 HydrophobicContact CB-CG 4.34Å; C529-W534 HydrophobicContact CB-CH2 3.61Å; C529-W534 HydrophobicContact CB-CZ2 3.68Å; C529-W534 HydrophobicContact CB-CZ3 3.57Å; C529-W534 PolarHBondContact O-N 2.83Å; K530-W534 HydrophobicContact CG-CE3 3.92Å; K530-W534 HydrophobicContact CG-CZ3 4.37Å; K530-W534 VanDerWaalsContact O-O 3.09Å; W534-E536 PolarHBondContact O-N 2.72Å
535	K	69.6	Low	75.4	Confident	196 Å²	196	94.3 Å²	94.3	85%	0.852	44%	0.44	S	S	*	.			trans	-62.3	126.9	167	-66.7	-176.5	178.2	-179.6	0	108.6	V533	V533-K535 VanDerWaalsContact C-N 3.34Å; V533-K535 PolarHBondContact O-N 3.04Å
536	E	54	Low	75.1	Confident	251 Å²	251	102.7 Å²	102.7	100%	1.173	48%	0.479	S	S	*	.			trans	-68.3	0	165	-73.7	-173.4	167.5	0	0	111.4	W534	W534-E536 PolarHBondContact O-N 2.72Å

Retrieved 536 of 536 residues in 1986 ms (Link to these results)

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