A0A087YAL2_POEFO Loading...

Serine incorporator 1

Enhances the incorporation of serine into phosphatidylserine and sphingolipids.

AlphaFold DB , UniProt , Accession A0A087YAL2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	35.2	Very low	221 Å²	221	102.5 Å²	102.5	100%	1.089	65%	0.647	S	S	*	*				0	14.1	0	-67.5	170.8	70.8	0	0	114
2	G	35.1	Very low	36.2	Very low	69 Å²	69	99.6 Å²	99.6	71%	0.711	63%	0.633	S	S	*	*			trans	-91	-14.2	175.8	0	0	0	0	0	115.4
3	A	30.5	Very low	36.9	Very low	79 Å²	79	102 Å²	102	65%	0.653	62%	0.623	S	S	*	*	S	Bend	trans	-85	-17	-178.5	0	0	0	0	0	114
4	V	31.9	Very low	37.5	Very low	102 Å²	102	102 Å²	102	62%	0.618	62%	0.615	S	S	*	*	H	α-helix	trans	-88.9	-23.2	-176.9	-179.2	0	0	0	0	112.1
5	L	32.3	Very low	38.3	Very low	141 Å²	141	101.3 Å²	101.3	74%	0.738	61%	0.614	S	S	*	*	H	α-helix	trans	-81.3	-21.3	177.6	-72.1	166.5	0	0	0	113.5
6	G	32.1	Very low	39	Very low	47 Å²	47	96.4 Å²	96.4	49%	0.485	59%	0.585	S	S	.	*	H	α-helix	trans	-76.5	-32.7	172.3	0	0	0	0	0	113.6	S9	G6-S9 PolarHBondContact O-N 3.13Å
7	L	30.8	Very low	39.8	Very low	129 Å²	129	94.5 Å²	94.5	68%	0.675	57%	0.571	S	S	*	*	H	α-helix	trans	-74.9	-31.4	179.1	-83.1	155.5	0	0	0	112.8	S9 A11	L7-S9 VanDerWaalsContact C-N 3.31Å; L7-S9 PolarHBondContact O-N 3.14Å; L7-A11 PolarHBondContact O-N 2.99Å
8	C	34	Very low	40.2	Very low	87 Å²	87	91.7 Å²	91.7	59%	0.588	56%	0.555	S	S	*	*	H	α-helix	trans	-73.7	-19.6	174.7	-69.8	0	0	0	0	113.8
9	S	47	Very low	41	Very low	61 Å²	61	88 Å²	88	43%	0.427	54%	0.538	S	S	.	.	H	α-helix	trans	-73.8	-49.5	173.8	-161.5	0	0	0	0	110.5	G6 L7 A11 S12 W13	G6-S9 PolarHBondContact O-N 3.13Å; L7-S9 VanDerWaalsContact C-N 3.31Å; L7-S9 PolarHBondContact O-N 3.14Å; S9-A11 PolarHBondContact O-N 3.28Å; S9-S12 PolarHBondContact O-N 3Å; S9-S12 PolarHBondContact O-OG 2.9Å; S9-W13 PolarHBondContact O-NE1 3.28Å
10	M	39.1	Very low	41.5	Very low	132 Å²	132	87.3 Å²	87.3	65%	0.65	54%	0.537	S	S	*	.	H	α-helix	trans	-62.2	-35.8	179	-71.2	-81.8	-73.8	0	0	113.7	S12 W13 I14	M10-S12 VanDerWaalsContact C-N 3.27Å; M10-S12 PolarHBondContact O-N 3.03Å; M10-W13 PolarHBondContact O-N 3.31Å; M10-I14 WeakPolarHBondContact O-CG1 3.1Å
11	A	41.4	Very low	41.9	Very low	59 Å²	59	84.8 Å²	84.8	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-66.6	-26.7	179.4	0	0	0	0	0	113.5	L7 S9 W13 P15	L7-A11 PolarHBondContact O-N 2.99Å; S9-A11 PolarHBondContact O-N 3.28Å; A11-W13 VanDerWaalsContact C-N 3.32Å; A11-P15 WeakPolarHBondContact O-CD 3.18Å
12	S	47.2	Very low	42.9	Very low	68 Å²	68	75.9 Å²	75.9	48%	0.476	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.4	176.8	67.8	0	0	0	0	114.1	S9 M10	S9-S12 PolarHBondContact O-N 3Å; S9-S12 PolarHBondContact O-OG 2.9Å; M10-S12 VanDerWaalsContact C-N 3.27Å; M10-S12 PolarHBondContact O-N 3.03Å
13	W	45.4	Very low	43.7	Very low	131 Å²	131	73.6 Å²	73.6	50%	0.496	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-28.1	-179.5	-66	39.6	0	0	0	111.8	S9 M10 A11 C16 L17	S9-W13 PolarHBondContact O-NE1 3.28Å; M10-W13 PolarHBondContact O-N 3.31Å; A11-W13 VanDerWaalsContact C-N 3.32Å; W13-C16 PolarHBondContact O-N 3.08Å; W13-L17 HydrophobicContact CB-CD1 3.91Å; W13-L17 HydrophobicContact CE3-CD1 4.44Å; W13-L17 WeakPolarHBondContact O-CB 3.34Å; W13-L17 WeakPolarHBondContact O-CG 3.39Å; W13-L17 PolarHBondContact O-N 2.95Å
14	I	45.1	Very low	44.6	Very low	102 Å²	102	71.6 Å²	71.6	52%	0.523	44%	0.435	S	S	.	.	H	α-helix	trans	-60.1	-42.4	-175.1	-63.2	169.2	0	0	0	112.2	M10 C18	M10-I14 WeakPolarHBondContact O-CG1 3.1Å; I14-C18 VanDerWaalsContact O-CB 3.24Å; I14-C18 WeakPolarHBondContact O-CB 3.28Å; I14-C18 PolarHBondContact O-N 3.38Å; I14-C18 PolarHBondContact O-SG 3.47Å; I14-C18 VanDerWaalsContact O-SG 3.41Å
15	P	48.8	Very low	45.3	Very low	92 Å²	92	72.7 Å²	72.7	60%	0.597	44%	0.436	S	S	*	.	H	α-helix	trans	-68.4	-34.3	176.1	-19.1	32.6	0	0	0	113.5	A11 G19	A11-P15 WeakPolarHBondContact O-CD 3.18Å; P15-G19 PolarHBondContact O-N 2.95Å
16	C	50.7	Low	46.1	Very low	22 Å²	22	67.4 Å²	67.4	15%	0.149	41%	0.411	C	S	.	.	H	α-helix	trans	-74.2	-31.6	178	-62.4	0	0	0	0	112.8	W13 C26	W13-C16 PolarHBondContact O-N 3.08Å; C16-C26 HydrophobicContact CB-CB 4.06Å; C16-C26 WeakPolarHBondContact CB-SG 3.2Å; C16-C26 WeakPolarHBondContact SG-CB 3.47Å; C16-C26 CovalentContact SG-SG 2.06Å; C16-C26 PolarHBondContact SG-SG 2.87Å
17	L	52	Low	46.7	Very low	65 Å²	65	77 Å²	77	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-84.8	-32.8	-179.9	-72.9	162.7	0	0	0	112.2	W13 W134 F135	W13-L17 HydrophobicContact CB-CD1 3.91Å; W13-L17 HydrophobicContact CE3-CD1 4.44Å; W13-L17 WeakPolarHBondContact O-CB 3.34Å; W13-L17 WeakPolarHBondContact O-CG 3.39Å; W13-L17 PolarHBondContact O-N 2.95Å; L17-W134 HydrophobicContact CD2-CB 3.89Å; L17-W134 PolarHBondContact O-N 3.48Å; L17-W134 VanDerWaalsContact O-N 3.16Å; L17-F135 HydrophobicContact CB-CB 4.11Å; L17-F135 VanDerWaalsContact O-CB 3.28Å; L17-F135 WeakPolarHBondContact O-CB 3.19Å; L17-F135 PolarHBondContact O-N 3.26Å
18	C	46.9	Very low	47.4	Very low	43 Å²	43	76 Å²	76	29%	0.291	44%	0.435	S	S	.	.	H	α-helix	trans	-95.8	-7.5	-176.4	-63.7	0	0	0	0	114.7	I14 F135	I14-C18 VanDerWaalsContact O-CB 3.24Å; I14-C18 WeakPolarHBondContact O-CB 3.28Å; I14-C18 PolarHBondContact O-N 3.38Å; I14-C18 PolarHBondContact O-SG 3.47Å; I14-C18 VanDerWaalsContact O-SG 3.41Å; C18-F135 VanDerWaalsContact SG-CB 3.57Å; C18-F135 VanDerWaalsContact SG-CG 3.54Å
19	G	54.7	Low	48.2	Very low	22 Å²	22	73.4 Å²	73.4	23%	0.227	42%	0.418	C	S	.	.	S	Bend	trans	-87.7	163.1	-177.6	0	0	0	0	0	115.2	P15 F133	P15-G19 PolarHBondContact O-N 2.95Å; G19-F133 PolarHBondContact O-N 3.04Å
20	S	51.2	Low	48.6	Very low	74 Å²	74	74.9 Å²	74.9	52%	0.517	43%	0.426	S	S	.	.	S	Bend	trans	-73.6	-15.7	166.6	54.5	0	0	0	0	113
21	A	50	Low	49.4	Very low	35 Å²	35	73 Å²	73	29%	0.289	43%	0.425	S	S	.	.	S	Bend	trans	-69.6	134.4	179.1	0	0	0	0	0	109.6	L25	A21-L25 HydrophobicContact CB-CD1 3.62Å
22	P	54.2	Low	50.5	Low	33 Å²	33	71.7 Å²	71.7	21%	0.214	42%	0.418	C	S	.	.			trans	-61.6	163.6	172.8	-5	18	0	0	0	109.3	L24 N131	P22-L24 HydrophobicContact CB-CD1 3.81Å; P22-L24 HydrophobicContact CB-CG 3.85Å; P22-L24 HydrophobicContact CG-CD1 3.63Å; P22-L24 HydrophobicContact CG-CG 4.24Å; P22-L24 PolarHBondContact O-N 3.07Å; P22-N131 HydrophobicContact CB-CB 4.3Å
23	C	51.5	Low	51.9	Low	22 Å²	22	71.2 Å²	71.2	15%	0.149	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-54.5	-3.3	-174.8	-74.1	0	0	0	0	115.9	L25 C26 C29 I41 W134	C23-L25 PolarHBondContact O-N 3.11Å; C23-L25 VanDerWaalsContact O-N 3.11Å; C23-C26 PolarHBondContact O-N 3.44Å; C23-C26 VanDerWaalsContact O-N 3.11Å; C23-C29 PolarHBondContact O-SG 2.96Å; C23-C29 VanDerWaalsContact O-SG 3.41Å; C23-I41 HydrophobicContact CB-CD1 4.26Å; C23-I41 WeakPolarHBondContact SG-CD1 3.33Å; C23-W134 PolarHBondContact SG-NE1 3.18Å
24	L	49.5	Very low	53.4	Low	37 Å²	37	65.2 Å²	65.2	19%	0.194	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-46.1	-26.7	174.2	-56.2	173.4	0	0	0	116.1	P22 A379	P22-L24 HydrophobicContact CB-CD1 3.81Å; P22-L24 HydrophobicContact CB-CG 3.85Å; P22-L24 HydrophobicContact CG-CD1 3.63Å; P22-L24 HydrophobicContact CG-CG 4.24Å; P22-L24 PolarHBondContact O-N 3.07Å; L24-A379 HydrophobicContact CD2-CB 3.24Å; L24-A379 WeakPolarHBondContact CD2-O 3.5Å
25	L	46.5	Very low	55.1	Low	124 Å²	124	60.4 Å²	60.4	65%	0.649	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-89.4	-8.4	-178.3	-88.2	151.4	0	0	0	113.9	A21 C23	A21-L25 HydrophobicContact CB-CD1 3.62Å; C23-L25 PolarHBondContact O-N 3.11Å; C23-L25 VanDerWaalsContact O-N 3.11Å
26	C	49.5	Very low	56.6	Low	31 Å²	31	57.3 Å²	57.3	21%	0.209	34%	0.343	C	S	.	.	S	Bend	trans	-92.4	119.1	179.8	-102.3	0	0	0	0	110.7	C16 C23 C28 C29	C16-C26 HydrophobicContact CB-CB 4.06Å; C16-C26 WeakPolarHBondContact CB-SG 3.2Å; C16-C26 WeakPolarHBondContact SG-CB 3.47Å; C16-C26 CovalentContact SG-SG 2.06Å; C16-C26 PolarHBondContact SG-SG 2.87Å; C23-C26 PolarHBondContact O-N 3.44Å; C23-C26 VanDerWaalsContact O-N 3.11Å; C26-C28 PolarHBondContact O-N 3.36Å; C26-C29 PolarHBondContact O-N 3.27Å
27	R	45.6	Very low	58.2	Low	248 Å²	248	57.7 Å²	57.7	94%	0.936	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-6	-178	-150.1	-179.8	-171.8	-170	2.1	115.3
28	C	45.3	Very low	59.9	Low	109 Å²	109	54.7 Å²	54.7	74%	0.736	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-1.7	-178.4	-59.7	0	0	0	0	113.7	C26	C26-C28 PolarHBondContact O-N 3.36Å
29	C	51.3	Low	61.9	Low	32 Å²	32	53.2 Å²	53.2	22%	0.216	32%	0.315	C	S	.	.	S	Bend	trans	-79.4	129.9	176.7	-79.3	0	0	0	0	110.9	C23 C26 M37	C23-C29 PolarHBondContact O-SG 2.96Å; C23-C29 VanDerWaalsContact O-SG 3.41Å; C26-C29 PolarHBondContact O-N 3.27Å; C29-M37 HydrophobicContact CB-CE 4.04Å
30	P	53.8	Low	63.5	Low	92 Å²	92	54.6 Å²	54.6	60%	0.597	32%	0.317	S	S	*	.			trans	-58.2	145.8	172.2	5	-8.4	0	0	0	111.2	G32 M37	P30-G32 PolarHBondContact O-N 3.26Å; P30-G32 VanDerWaalsContact O-N 3.13Å; P30-M37 HydrophobicContact CG-CE 3.85Å; P30-M37 WeakPolarHBondContact O-CE 3.3Å
31	S	57	Low	65.3	Low	91 Å²	91	53.2 Å²	53.2	64%	0.636	30%	0.304	S	S	*	.	S	Bend	trans	-63.1	110	172	53.9	0	0	0	0	109.5
32	G	65.2	Low	67.4	Low	33 Å²	33	51.6 Å²	51.6	34%	0.34	29%	0.29	S	S	.	.			trans	-164	178.9	-179.8	0	0	0	0	0	112.8	P30 A379 V380	P30-G32 PolarHBondContact O-N 3.26Å; P30-G32 VanDerWaalsContact O-N 3.13Å; G32-A379 WeakPolarHBondContact O-CA 3.32Å; G32-A379 WeakPolarHBondContact O-CB 3.47Å; G32-V380 PolarHBondContact O-N 2.91Å
33	N	76.3	Confident	69.2	Low	58 Å²	58	50 Å²	50	31%	0.31	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-71.9	139.2	177.3	-68	-13.1	0	0	0	111	S35 T36 M37	N33-S35 VanDerWaalsContact C-N 3.31Å; N33-S35 PolarHBondContact O-N 3.44Å; N33-T36 PolarHBondContact O-N 3.34Å; N33-M37 PolarHBondContact O-N 3.45Å
34	N	76.2	Confident	71.1	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.027	30%	0.297	C	S	.	.	H	α-helix	trans	-55.2	-45.4	179.1	-173.1	29.5	0	0	0	112.1	T36 M37 T38 V380 D381	N34-T36 PolarHBondContact O-N 2.9Å; N34-M37 PolarHBondContact O-N 2.86Å; N34-T38 PolarHBondContact O-N 3.44Å; N34-T38 PolarHBondContact O-OG1 2.86Å; N34-V380 PolarHBondContact N-O 3.17Å; N34-D381 PolarHBondContact ND2-OD1 3.33Å
35	S	80.2	Confident	73.1	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-51.7	-47.2	174.7	47.8	0	0	0	0	113.7	N33 R39 N382 T388	N33-S35 VanDerWaalsContact C-N 3.31Å; N33-S35 PolarHBondContact O-N 3.44Å; S35-R39 VanDerWaalsContact O-CG 3.32Å; S35-R39 WeakPolarHBondContact O-CG 3.45Å; S35-R39 PolarHBondContact O-N 3.21Å; S35-R39 PolarHBondContact O-NE 2.73Å; S35-N382 WeakPolarHBondContact CB-OD1 3.5Å; S35-N382 PolarHBondContact N-OD1 3.12Å; S35-N382 PolarHBondContact OG-ND2 3.2Å; S35-N382 PolarHBondContact OG-OD1 3.27Å; S35-T388 WeakPolarHBondContact CB-OG1 3.31Å
36	T	81.9	Confident	75.4	Confident	27 Å²	27	47 Å²	47	17%	0.166	27%	0.266	C	S	.	.	H	α-helix	trans	-70.8	-40.8	179.1	-60.1	0	0	0	0	111.6	N33 N34 R39 L40	N33-T36 PolarHBondContact O-N 3.34Å; N34-T36 PolarHBondContact O-N 2.9Å; T36-R39 PolarHBondContact O-N 3.32Å; T36-R39 PolarHBondContact OG1-NH2 3.4Å; T36-R39 VanDerWaalsContact OG1-NH2 3.17Å; T36-L40 HydrophobicContact CG2-CD1 4.14Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 2.88Å
37	M	83.2	Confident	77.5	Confident	30 Å²	30	47.7 Å²	47.7	15%	0.148	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-48	177.6	-170.8	64.7	75.6	0	0	111.6	C29 P30 N33 N34 R39 L40 I41	C29-M37 HydrophobicContact CB-CE 4.04Å; P30-M37 HydrophobicContact CG-CE 3.85Å; P30-M37 WeakPolarHBondContact O-CE 3.3Å; N33-M37 PolarHBondContact O-N 3.45Å; N34-M37 PolarHBondContact O-N 2.86Å; M37-R39 VanDerWaalsContact C-N 3.33Å; M37-R39 PolarHBondContact O-N 3.02Å; M37-L40 PolarHBondContact O-N 3.28Å; M37-I41 HydrophobicContact CG-CD1 4.06Å; M37-I41 WeakPolarHBondContact O-CG1 3.34Å; M37-I41 PolarHBondContact O-N 3.49Å
38	T	86.9	Confident	79.8	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-43.8	178.4	-63.1	0	0	0	0	111.3	N34 L40 I41 Y42 N131 W134	N34-T38 PolarHBondContact O-N 3.44Å; N34-T38 PolarHBondContact O-OG1 2.86Å; T38-L40 PolarHBondContact O-N 2.86Å; T38-I41 PolarHBondContact O-N 3.27Å; T38-Y42 HydrophobicContact CG2-CD2 3.78Å; T38-Y42 HydrophobicContact CG2-CE2 3.63Å; T38-Y42 VanDerWaalsContact O-CD2 3.26Å; T38-Y42 WeakPolarHBondContact O-CD2 3.35Å; T38-Y42 PolarHBondContact O-N 3.48Å; T38-Y42 VanDerWaalsContact O-N 3.08Å; T38-N131 WeakPolarHBondContact CB-OD1 3.48Å; T38-N131 WeakPolarHBondContact CG2-OD1 3.2Å; T38-N131 PolarHBondContact OG1-OD1 3.07Å; T38-W134 HydrophobicContact CG2-CH2 4.03Å; T38-W134 HydrophobicContact CG2-CZ2 4.08Å
39	R	89.1	Confident	82.1	Confident	13 Å²	13	35.6 Å²	35.6	5%	0.049	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-43.3	176	-72	-175.9	-64.8	158.6	-3.3	112.1	S35 T36 M37 Y42 A43 S338 S339 R341 Y389 F394	S35-R39 VanDerWaalsContact O-CG 3.32Å; S35-R39 WeakPolarHBondContact O-CG 3.45Å; S35-R39 PolarHBondContact O-N 3.21Å; S35-R39 PolarHBondContact O-NE 2.73Å; T36-R39 PolarHBondContact O-N 3.32Å; T36-R39 PolarHBondContact OG1-NH2 3.4Å; T36-R39 VanDerWaalsContact OG1-NH2 3.17Å; M37-R39 VanDerWaalsContact C-N 3.33Å; M37-R39 PolarHBondContact O-N 3.02Å; R39-Y42 PolarHBondContact O-N 3.18Å; R39-A43 WeakPolarHBondContact O-CB 3.34Å; R39-A43 PolarHBondContact O-N 3.07Å; R39-S338 PolarHBondContact NH1-O 3.24Å; R39-S339 PolarHBondContact NE-O 3.22Å; R39-S339 PolarHBondContact NH2-O 2.89Å; R39-S339 PolarHBondContact O-OG 2.73Å; R39-R341 PolarHBondContact NH1-O 2.92Å; R39-R341 PolarHBondContact NH2-O 2.73Å; R39-Y389 HydrophobicContact CG-CE1 4.01Å; R39-Y389 HydrophobicContact CG-CE2 4Å; R39-Y389 WeakPolarHBondContact CG-OH 3.12Å; R39-F394 HydrophobicContact CB-CE2 4.01Å; R39-F394 HydrophobicContact CB-CZ 3.83Å; R39-F394 HydrophobicContact CG-CD2 4.16Å; R39-F394 HydrophobicContact CG-CE1 4.2Å; R39-F394 HydrophobicContact CG-CE2 3.75Å; R39-F394 HydrophobicContact CG-CZ 3.76Å
40	L	89.1	Confident	84.1	Confident	51 Å²	51	34.7 Å²	34.7	27%	0.267	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-40.3	176.9	-75.9	172.1	0	0	0	112.3	T36 M37 T38 A43 C44 I340	T36-L40 HydrophobicContact CG2-CD1 4.14Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 2.88Å; M37-L40 PolarHBondContact O-N 3.28Å; T38-L40 PolarHBondContact O-N 2.86Å; L40-A43 PolarHBondContact O-N 2.93Å; L40-C44 WeakPolarHBondContact O-CB 3.23Å; L40-C44 PolarHBondContact O-N 3.4Å; L40-C44 PolarHBondContact O-SG 2.9Å; L40-C44 VanDerWaalsContact O-SG 3.32Å; L40-I340 HydrophobicContact CD2-CG1 3.96Å
41	I	89.8	Confident	86	Confident	45 Å²	45	32.4 Å²	32.4	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-43.4	177.1	-63	164.1	0	0	0	110.5	C23 M37 T38 A43 C44 F45 W134	C23-I41 HydrophobicContact CB-CD1 4.26Å; C23-I41 WeakPolarHBondContact SG-CD1 3.33Å; M37-I41 HydrophobicContact CG-CD1 4.06Å; M37-I41 WeakPolarHBondContact O-CG1 3.34Å; M37-I41 PolarHBondContact O-N 3.49Å; T38-I41 PolarHBondContact O-N 3.27Å; I41-A43 VanDerWaalsContact C-N 3.35Å; I41-A43 PolarHBondContact O-N 3.49Å; I41-C44 PolarHBondContact O-N 3.22Å; I41-F45 WeakPolarHBondContact O-CB 3.25Å; I41-F45 PolarHBondContact O-N 2.97Å; I41-W134 HydrophobicContact CB-CH2 3.58Å; I41-W134 HydrophobicContact CB-CZ2 3.86Å; I41-W134 HydrophobicContact CB-CZ3 3.97Å; I41-W134 HydrophobicContact CD1-CH2 4.27Å; I41-W134 HydrophobicContact CD1-CZ2 3.62Å; I41-W134 HydrophobicContact CG1-CZ2 4.36Å; I41-W134 HydrophobicContact CG2-CD2 3.84Å; I41-W134 HydrophobicContact CG2-CE3 3.5Å; I41-W134 VanDerWaalsContact CG2-CE3 3.5Å; I41-W134 HydrophobicContact CG2-CH2 3.43Å; I41-W134 VanDerWaalsContact CG2-CH2 3.43Å; I41-W134 HydrophobicContact CG2-CZ2 3.78Å; I41-W134 HydrophobicContact CG2-CZ3 3.3Å
42	Y	93	Very high	87.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.7	-36.9	175	-81.1	-64.8	0	0	0	113	T38 R39 F45 L46 F108 F109 F112 H130 W134 K137 F394 H395	T38-Y42 HydrophobicContact CG2-CD2 3.78Å; T38-Y42 HydrophobicContact CG2-CE2 3.63Å; T38-Y42 VanDerWaalsContact O-CD2 3.26Å; T38-Y42 WeakPolarHBondContact O-CD2 3.35Å; T38-Y42 PolarHBondContact O-N 3.48Å; T38-Y42 VanDerWaalsContact O-N 3.08Å; R39-Y42 PolarHBondContact O-N 3.18Å; Y42-F45 WeakPolarHBondContact O-CB 3.31Å; Y42-F45 PolarHBondContact O-N 3.22Å; Y42-L46 PolarHBondContact O-N 2.75Å; Y42-F108 HydrophobicContact CE1-CE1 4.42Å; Y42-F109 HydrophobicContact CD1-CE1 4Å; Y42-F112 WeakPolarHBondContact OH-CE1 3.4Å; Y42-H130 AromaticContact CE2-CE1 3.63Å; Y42-H130 AromaticContact CE2-ND1 3.62Å; Y42-H130 WeakPolarHBondContact CE2-O 3.24Å; Y42-H130 PolarHBondContact OH-O 3.15Å; Y42-W134 HydrophobicContact CD1-CH2 4.46Å; Y42-W134 HydrophobicContact CD1-CZ3 4.04Å; Y42-W134 AromaticContact CD2-CH2 3.69Å; Y42-W134 HydrophobicContact CD2-CH2 3.69Å; Y42-W134 HydrophobicContact CD2-CZ3 4.1Å; Y42-W134 HydrophobicContact CE1-CH2 4.37Å; Y42-W134 AromaticContact CE1-CZ3 3.89Å; Y42-W134 HydrophobicContact CE1-CZ3 3.89Å; Y42-W134 AromaticContact CE2-CH2 3.55Å; Y42-W134 HydrophobicContact CE2-CH2 3.55Å; Y42-W134 AromaticContact CE2-CZ3 3.92Å; Y42-W134 HydrophobicContact CE2-CZ3 3.92Å; Y42-W134 HydrophobicContact CG-CH2 4.15Å; Y42-W134 HydrophobicContact CG-CZ3 4.16Å; Y42-W134 AromaticContact CZ-CH2 3.93Å; Y42-W134 AromaticContact CZ-CZ3 3.82Å; Y42-K137 HydrophobicContact CE1-CD 4.32Å; Y42-K137 WeakPolarHBondContact OH-CE 3.49Å; Y42-K137 PolarHBondContact OH-NZ 2.96Å; Y42-F394 HydrophobicContact CD2-CE1 4.01Å; Y42-F394 HydrophobicContact CG-CE1 4.16Å; Y42-H395 AromaticContact CD1-CE1 3.86Å; Y42-H395 AromaticContact CD2-CE1 3.88Å; Y42-H395 AromaticContact CE1-CE1 3.55Å; Y42-H395 AromaticContact CE2-CE1 3.59Å; Y42-H395 AromaticContact CE2-NE2 4Å; Y42-H395 AromaticContact CZ-CE1 3.4Å; Y42-H395 VanDerWaalsContact CZ-CE1 3.4Å; Y42-H395 AromaticContact CZ-NE2 3.94Å
43	A	91.9	Very high	88.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-48.2	171.8	0	0	0	0	0	111.8	R39 L40 I41 F45 L46 L47 V335 S339	R39-A43 WeakPolarHBondContact O-CB 3.34Å; R39-A43 PolarHBondContact O-N 3.07Å; L40-A43 PolarHBondContact O-N 2.93Å; I41-A43 VanDerWaalsContact C-N 3.35Å; I41-A43 PolarHBondContact O-N 3.49Å; A43-F45 PolarHBondContact O-N 3.35Å; A43-L46 PolarHBondContact O-N 3.17Å; A43-L47 VanDerWaalsContact O-CG 3.29Å; A43-L47 WeakPolarHBondContact O-CG 3.37Å; A43-L47 PolarHBondContact O-N 3.08Å; A43-V335 HydrophobicContact CB-CG1 3.56Å; A43-S339 WeakPolarHBondContact CB-OG 3.49Å
44	C	91.1	Very high	89.6	Confident	76 Å²	76	27.6 Å²	27.6	51%	0.514	16%	0.162	S	C	.	.	H	α-helix	trans	-57.2	-37.4	173.2	-73	0	0	0	0	111.8	L40 I41 L47 L48	L40-C44 WeakPolarHBondContact O-CB 3.23Å; L40-C44 PolarHBondContact O-N 3.4Å; L40-C44 PolarHBondContact O-SG 2.9Å; L40-C44 VanDerWaalsContact O-SG 3.32Å; I41-C44 PolarHBondContact O-N 3.22Å; C44-L47 PolarHBondContact O-N 3.09Å; C44-L48 WeakPolarHBondContact O-CB 3.42Å; C44-L48 PolarHBondContact O-N 3.26Å
45	F	91.8	Very high	90.2	Very high	44 Å²	44	31.1 Å²	31.1	19%	0.193	18%	0.18	C	C	.	.	H	α-helix	trans	-66.1	-44.6	178.2	-174.3	-132.7	0	0	0	112.4	I41 Y42 A43 L48 G49 F108 F109 F138 A141	I41-F45 WeakPolarHBondContact O-CB 3.25Å; I41-F45 PolarHBondContact O-N 2.97Å; Y42-F45 WeakPolarHBondContact O-CB 3.31Å; Y42-F45 PolarHBondContact O-N 3.22Å; A43-F45 PolarHBondContact O-N 3.35Å; F45-L48 PolarHBondContact O-N 3Å; F45-G49 PolarHBondContact O-N 3.47Å; F45-F108 AromaticContact CD1-CE1 3.96Å; F45-F108 HydrophobicContact CD1-CE1 3.96Å; F45-F108 AromaticContact CE1-CD1 3.83Å; F45-F108 HydrophobicContact CE1-CD1 3.83Å; F45-F108 AromaticContact CE1-CE1 3.49Å; F45-F108 HydrophobicContact CE1-CE1 3.49Å; F45-F108 VanDerWaalsContact CE1-CE1 3.49Å; F45-F108 AromaticContact CE1-CZ 3.88Å; F45-F108 HydrophobicContact CE1-CZ 3.88Å; F45-F109 HydrophobicContact CD1-CE1 4.49Å; F45-F109 HydrophobicContact CD1-CZ 4.01Å; F45-F138 HydrophobicContact CD2-CD2 4.4Å; F45-F138 AromaticContact CE2-CD2 3.75Å; F45-F138 HydrophobicContact CE2-CD2 3.75Å; F45-F138 HydrophobicContact CE2-CE2 4.19Å; F45-A141 HydrophobicContact CE1-CB 3.83Å; F45-A141 HydrophobicContact CE2-CB 4.49Å; F45-A141 HydrophobicContact CZ-CB 3.34Å
46	L	94.6	Very high	90.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-46.6	171.3	176.9	65.3	0	0	0	111.1	Y42 A43 L48 G49 V50 M105 F109 F331 V335 L398 A401	Y42-L46 PolarHBondContact O-N 2.75Å; A43-L46 PolarHBondContact O-N 3.17Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.2Å; L46-G49 PolarHBondContact O-N 3.1Å; L46-G49 VanDerWaalsContact O-N 3.12Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.05Å; L46-V50 PolarHBondContact O-N 3.44Å; L46-M105 HydrophobicContact CD1-SD 4.35Å; L46-F109 HydrophobicContact CB-CE2 4.17Å; L46-F109 HydrophobicContact CB-CZ 4.07Å; L46-F109 HydrophobicContact CD1-CE2 3.85Å; L46-F331 HydrophobicContact CD2-CE2 4.31Å; L46-F331 HydrophobicContact CD2-CZ 3.71Å; L46-F331 HydrophobicContact CG-CZ 4.12Å; L46-V335 HydrophobicContact CD2-CG2 4.31Å; L46-L398 HydrophobicContact CD2-CD2 3.78Å; L46-A401 HydrophobicContact CD2-CB 3.88Å
47	L	94.1	Very high	90.3	Very high	45 Å²	45	32.3 Å²	32.3	24%	0.236	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-35.9	179.4	-69	175.4	0	0	0	113	A43 C44 G49 V50 A51 F331 L332	A43-L47 VanDerWaalsContact O-CG 3.29Å; A43-L47 WeakPolarHBondContact O-CG 3.37Å; A43-L47 PolarHBondContact O-N 3.08Å; C44-L47 PolarHBondContact O-N 3.09Å; L47-G49 VanDerWaalsContact C-N 3.34Å; L47-V50 WeakPolarHBondContact O-CB 3.1Å; L47-V50 PolarHBondContact O-N 3Å; L47-A51 WeakPolarHBondContact O-CB 3.49Å; L47-A51 PolarHBondContact O-N 2.87Å; L47-F331 HydrophobicContact CD2-CE1 3.96Å; L47-L332 HydrophobicContact CD1-CD1 3.63Å; L47-L332 HydrophobicContact CD2-CD1 3.62Å; L47-L332 HydrophobicContact CG-CD1 4.29Å
48	L	93.4	Very high	90.2	Very high	89 Å²	89	35.4 Å²	35.4	47%	0.466	20%	0.2	S	C	.	.	H	α-helix	trans	-62	-44.4	173.2	178.9	64.1	0	0	0	111	C44 F45 L46 A51 V52 F138	C44-L48 WeakPolarHBondContact O-CB 3.42Å; C44-L48 PolarHBondContact O-N 3.26Å; F45-L48 PolarHBondContact O-N 3Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.2Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 3.49Å; L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 2.81Å; L48-F138 HydrophobicContact CD2-CE2 3.98Å
49	G	93.7	Very high	89.4	Confident	13 Å²	13	38.5 Å²	38.5	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-35.8	176.3	0	0	0	0	0	113.3	F45 L46 L47 V52 A53 M105	F45-G49 PolarHBondContact O-N 3.47Å; L46-G49 PolarHBondContact O-N 3.1Å; L46-G49 VanDerWaalsContact O-N 3.12Å; L47-G49 VanDerWaalsContact C-N 3.34Å; G49-V52 PolarHBondContact O-N 2.95Å; G49-A53 PolarHBondContact O-N 3.09Å; G49-M105 WeakPolarHBondContact CA-SD 3.32Å
50	V	94.3	Very high	88.4	Confident	13 Å²	13	41 Å²	41	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-45.6	169.6	177.3	0	0	0	0	110.6	L46 L47 V52 A53 C54 L328 F331 I405	L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.05Å; L46-V50 PolarHBondContact O-N 3.44Å; L47-V50 WeakPolarHBondContact O-CB 3.1Å; L47-V50 PolarHBondContact O-N 3Å; V50-V52 VanDerWaalsContact C-N 3.33Å; V50-V52 PolarHBondContact O-N 2.91Å; V50-A53 WeakPolarHBondContact O-CB 3.47Å; V50-A53 PolarHBondContact O-N 3.02Å; V50-A53 VanDerWaalsContact O-N 3.16Å; V50-C54 PolarHBondContact O-N 2.89Å; V50-C54 PolarHBondContact O-SG 3.45Å; V50-C54 VanDerWaalsContact O-SG 3.34Å; V50-L328 HydrophobicContact CG1-CD2 4.4Å; V50-F331 HydrophobicContact CG2-CE1 4.11Å; V50-F331 HydrophobicContact CG2-CZ 4.26Å; V50-I405 HydrophobicContact CG1-CD1 4.47Å; V50-I405 HydrophobicContact CG1-CG2 4.29Å; V50-I405 HydrophobicContact CG2-CB 4.49Å; V50-I405 HydrophobicContact CG2-CD1 4.35Å; V50-I405 HydrophobicContact CG2-CG1 3.95Å; V50-I405 HydrophobicContact CG2-CG2 3.97Å
51	A	93.3	Very high	87.7	Confident	45 Å²	45	41.5 Å²	41.5	37%	0.372	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-42	178.2	0	0	0	0	0	111.6	L47 L48 C54 I55	L47-A51 WeakPolarHBondContact O-CB 3.49Å; L47-A51 PolarHBondContact O-N 2.87Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 3.49Å; A51-C54 PolarHBondContact O-N 3.34Å; A51-I55 WeakPolarHBondContact O-CD1 3.31Å; A51-I55 WeakPolarHBondContact O-CG1 3.49Å; A51-I55 PolarHBondContact O-N 3.15Å
52	V	92.1	Very high	86.7	Confident	55 Å²	55	41.8 Å²	41.8	33%	0.333	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-44.6	173.6	173.2	0	0	0	0	111.3	L48 G49 V50 C54 I55 M56 V101	L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 2.81Å; G49-V52 PolarHBondContact O-N 2.95Å; V50-V52 VanDerWaalsContact C-N 3.33Å; V50-V52 PolarHBondContact O-N 2.91Å; V52-C54 PolarHBondContact O-N 2.88Å; V52-I55 PolarHBondContact O-N 3.41Å; V52-M56 HydrophobicContact CG1-CE 3.93Å; V52-M56 WeakPolarHBondContact O-CG 3.36Å; V52-M56 PolarHBondContact O-N 2.92Å; V52-V101 HydrophobicContact CG1-CG1 4.44Å
53	A	92	Very high	85.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-42.2	176.7	0	0	0	0	0	112.1	G49 V50 I55 M56 L57 V98 V101 L409	G49-A53 PolarHBondContact O-N 3.09Å; V50-A53 WeakPolarHBondContact O-CB 3.47Å; V50-A53 PolarHBondContact O-N 3.02Å; V50-A53 VanDerWaalsContact O-N 3.16Å; A53-I55 VanDerWaalsContact C-N 3.35Å; A53-I55 PolarHBondContact O-N 2.91Å; A53-M56 PolarHBondContact O-N 3.24Å; A53-L57 PolarHBondContact O-N 3.43Å; A53-V98 HydrophobicContact CB-CG2 4.42Å; A53-V101 HydrophobicContact CB-CG1 4.36Å; A53-L409 HydrophobicContact CB-CD1 3.63Å
54	C	89.8	Confident	84.3	Confident	25 Å²	25	49.1 Å²	49.1	17%	0.169	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-41	173.5	-69.6	0	0	0	0	112.1	V50 A51 V52 M56 L57 M58	V50-C54 PolarHBondContact O-N 2.89Å; V50-C54 PolarHBondContact O-SG 3.45Å; V50-C54 VanDerWaalsContact O-SG 3.34Å; A51-C54 PolarHBondContact O-N 3.34Å; V52-C54 PolarHBondContact O-N 2.88Å; C54-M56 VanDerWaalsContact C-N 3.32Å; C54-M56 PolarHBondContact O-N 3.3Å; C54-L57 PolarHBondContact O-N 2.7Å; C54-L57 VanDerWaalsContact O-N 3.14Å; C54-M58 PolarHBondContact O-N 3.06Å
55	I	88.4	Confident	83.3	Confident	80 Å²	80	45.9 Å²	45.9	41%	0.41	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-42.9	176.1	-69.5	159.8	0	0	0	110.5	A51 V52 A53 L57 M58 M61	A51-I55 WeakPolarHBondContact O-CD1 3.31Å; A51-I55 WeakPolarHBondContact O-CG1 3.49Å; A51-I55 PolarHBondContact O-N 3.15Å; V52-I55 PolarHBondContact O-N 3.41Å; A53-I55 VanDerWaalsContact C-N 3.35Å; A53-I55 PolarHBondContact O-N 2.91Å; I55-L57 PolarHBondContact O-N 3.15Å; I55-M58 HydrophobicContact CB-CE 4.01Å; I55-M58 HydrophobicContact CG1-CE 3.83Å; I55-M58 HydrophobicContact CG2-CE 3.92Å; I55-M58 WeakPolarHBondContact O-CB 3.26Å; I55-M58 PolarHBondContact O-N 3.28Å; I55-M58 VanDerWaalsContact O-N 3.1Å; I55-M61 HydrophobicContact CG2-CG 4.34Å; I55-M61 WeakPolarHBondContact O-CG 3.2Å
56	M	84.3	Confident	82.2	Confident	37 Å²	37	48 Å²	48	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-20.1	177.6	-69.6	-175.7	177.2	0	0	113.7	V52 A53 C54 L65 A97 V101 F149	V52-M56 HydrophobicContact CG1-CE 3.93Å; V52-M56 WeakPolarHBondContact O-CG 3.36Å; V52-M56 PolarHBondContact O-N 2.92Å; A53-M56 PolarHBondContact O-N 3.24Å; C54-M56 VanDerWaalsContact C-N 3.32Å; C54-M56 PolarHBondContact O-N 3.3Å; M56-L65 WeakPolarHBondContact O-CD1 3.39Å; M56-A97 HydrophobicContact CB-CB 4.12Å; M56-A97 HydrophobicContact CG-CB 4.46Å; M56-A97 HydrophobicContact SD-CB 3.75Å; M56-V101 HydrophobicContact CE-CG2 3.69Å; M56-V101 HydrophobicContact SD-CG2 3.43Å; M56-V101 WeakPolarHBondContact SD-CG2 2.96Å; M56-F149 HydrophobicContact CE-CZ 4.06Å; M56-F149 HydrophobicContact SD-CZ 4.28Å
57	L	81	Confident	81	Confident	14 Å²	14	55 Å²	55	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-88.7	-14	176	-169.2	60.9	0	0	0	113.3	A53 C54 I55 Y95 W319 L409	A53-L57 PolarHBondContact O-N 3.43Å; C54-L57 PolarHBondContact O-N 2.7Å; C54-L57 VanDerWaalsContact O-N 3.14Å; I55-L57 PolarHBondContact O-N 3.15Å; L57-Y95 HydrophobicContact CD1-CD1 3.64Å; L57-Y95 HydrophobicContact CD1-CE1 3.53Å; L57-W319 WeakPolarHBondContact CD2-O 3.49Å; L57-L409 WeakPolarHBondContact CD2-O 3.45Å
58	M	79.8	Confident	79.7	Confident	96 Å²	96	55.5 Å²	55.5	47%	0.473	32%	0.317	S	S	.	.	S	Bend	trans	-68.2	142.4	-177.7	-71.3	-164.5	-68.8	0	0	112.5	C54 I55 G60 M61	C54-M58 PolarHBondContact O-N 3.06Å; I55-M58 HydrophobicContact CB-CE 4.01Å; I55-M58 HydrophobicContact CG1-CE 3.83Å; I55-M58 HydrophobicContact CG2-CE 3.92Å; I55-M58 WeakPolarHBondContact O-CB 3.26Å; I55-M58 PolarHBondContact O-N 3.28Å; I55-M58 VanDerWaalsContact O-N 3.1Å; M58-G60 PolarHBondContact O-N 3.18Å; M58-M61 PolarHBondContact O-N 3.01Å
59	P	70.8	Confident	78.1	Confident	66 Å²	66	56.1 Å²	56.1	43%	0.429	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	135	173.1	29.1	-38.9	0	0	0	111.2	W319	P59-W319 HydrophobicContact CB-CE3 3.68Å; P59-W319 HydrophobicContact CB-CH2 3.92Å; P59-W319 HydrophobicContact CB-CZ3 3.24Å; P59-W319 HydrophobicContact CG-CD2 4.3Å; P59-W319 HydrophobicContact CG-CE3 3.69Å; P59-W319 HydrophobicContact CG-CH2 3.48Å; P59-W319 VanDerWaalsContact CG-CH2 3.48Å; P59-W319 HydrophobicContact CG-CZ2 4.06Å; P59-W319 HydrophobicContact CG-CZ3 3.28Å
60	G	69.4	Low	76.5	Confident	65 Å²	65	56.7 Å²	56.7	67%	0.67	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.2	-17.5	-178.2	0	0	0	0	0	114.9	M58 E62	M58-G60 PolarHBondContact O-N 3.18Å; G60-E62 VanDerWaalsContact C-N 3.27Å
61	M	73.9	Confident	75	Confident	62 Å²	62	56.2 Å²	56.2	31%	0.305	33%	0.329	S	S	.	.			trans	-75.7	-17.4	170.2	-79.9	-59.5	-53.2	0	0	113.3	I55 M58 G63 Q64 L65	I55-M61 HydrophobicContact CG2-CG 4.34Å; I55-M61 WeakPolarHBondContact O-CG 3.2Å; M58-M61 PolarHBondContact O-N 3.01Å; M61-G63 VanDerWaalsContact C-N 3.28Å; M61-G63 PolarHBondContact O-N 3.46Å; M61-Q64 HydrophobicContact CE-CB 4.27Å; M61-Q64 PolarHBondContact O-N 3.31Å; M61-L65 HydrophobicContact CB-CD1 4.01Å; M61-L65 PolarHBondContact O-N 3.3Å
62	E	67.7	Low	73.4	Confident	52 Å²	52	56.1 Å²	56.1	24%	0.243	33%	0.325	C	S	.	.	H	α-helix	trans	-54.1	-41	-178.5	-59.7	168.3	-165.1	0	0	112.8	G60 Q64 L65 K66 D90	G60-E62 VanDerWaalsContact C-N 3.27Å; E62-Q64 PolarHBondContact O-N 3.11Å; E62-L65 PolarHBondContact O-N 3.18Å; E62-K66 WeakPolarHBondContact O-CB 3.35Å; E62-K66 WeakPolarHBondContact O-CG 3.43Å; E62-K66 PolarHBondContact O-N 2.89Å; E62-D90 HydrophobicContact CG-CB 4.45Å; E62-D90 VanDerWaalsContact OE2-CB 3.27Å; E62-D90 WeakPolarHBondContact OE2-CB 3.37Å; E62-D90 VanDerWaalsContact OE2-CG 3.3Å
63	G	65.3	Low	71.5	Confident	43 Å²	43	61.2 Å²	61.2	44%	0.443	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-24.8	-179.7	0	0	0	0	0	113.8	M61 K67	M61-G63 VanDerWaalsContact C-N 3.28Å; M61-G63 PolarHBondContact O-N 3.46Å; G63-K67 WeakPolarHBondContact O-CE 3.29Å
64	Q	70.4	Confident	69.5	Low	112 Å²	112	64.5 Å²	64.5	52%	0.523	38%	0.379	S	S	.	.	H	α-helix	trans	-87.3	-39.3	173.4	-60	-62	-10.5	0	0	111.3	M61 E62 K67	M61-Q64 HydrophobicContact CE-CB 4.27Å; M61-Q64 PolarHBondContact O-N 3.31Å; E62-Q64 PolarHBondContact O-N 3.11Å; Q64-K67 WeakPolarHBondContact O-CB 3.33Å; Q64-K67 PolarHBondContact O-N 3.47Å
65	L	70.1	Confident	67.3	Low	7 Å²	7	66.5 Å²	66.5	4%	0.037	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-35.6	179.5	-71.7	155.7	0	0	0	112.4	M56 M61 E62 K67 I68 V93 A97	M56-L65 WeakPolarHBondContact O-CD1 3.39Å; M61-L65 HydrophobicContact CB-CD1 4.01Å; M61-L65 PolarHBondContact O-N 3.3Å; E62-L65 PolarHBondContact O-N 3.18Å; L65-K67 PolarHBondContact O-N 2.96Å; L65-I68 HydrophobicContact CD2-CD1 4.29Å; L65-I68 WeakPolarHBondContact O-CB 3.48Å; L65-I68 PolarHBondContact O-N 2.81Å; L65-I68 VanDerWaalsContact O-N 3.07Å; L65-V93 HydrophobicContact CB-CG1 3.26Å; L65-V93 HydrophobicContact CD1-CG1 4.21Å; L65-V93 HydrophobicContact CG-CG1 4.25Å; L65-A97 HydrophobicContact CD2-CB 3.67Å
66	K	67.8	Low	64.9	Low	90 Å²	90	71.2 Å²	71.2	39%	0.391	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.2	174.6	-75.6	171.5	-176.8	175.1	0	113.9	E62 D90	E62-K66 WeakPolarHBondContact O-CB 3.35Å; E62-K66 WeakPolarHBondContact O-CG 3.43Å; E62-K66 PolarHBondContact O-N 2.89Å; K66-D90 WeakPolarHBondContact CE-OD1 3.29Å; K66-D90 IonicContact NZ-OD1 2.77Å; K66-D90 PolarHBondContact NZ-OD1 2.86Å; K66-D90 IonicContact NZ-OD2 2.73Å
67	K	69.9	Low	62.5	Low	146 Å²	146	73.1 Å²	73.1	64%	0.635	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.2	176.7	-62.6	175.3	-174.5	168.9	0	112.6	G63 Q64 L65 P69	G63-K67 WeakPolarHBondContact O-CE 3.29Å; Q64-K67 WeakPolarHBondContact O-CB 3.33Å; Q64-K67 PolarHBondContact O-N 3.47Å; L65-K67 PolarHBondContact O-N 2.96Å; K67-P69 WeakPolarHBondContact O-CD 3.5Å
68	I	67.3	Low	60.2	Low	55 Å²	55	77 Å²	77	28%	0.282	49%	0.485	S	S	.	.	S	Bend	trans	-79.2	119.6	177.6	-56.4	176.6	0	0	0	107.7	L65 F71 F149	L65-I68 HydrophobicContact CD2-CD1 4.29Å; L65-I68 WeakPolarHBondContact O-CB 3.48Å; L65-I68 PolarHBondContact O-N 2.81Å; L65-I68 VanDerWaalsContact O-N 3.07Å; I68-F71 HydrophobicContact CB-CD2 4.3Å; I68-F71 HydrophobicContact CG2-CD2 3.94Å; I68-F71 HydrophobicContact CG2-CE2 4.12Å; I68-F71 PolarHBondContact O-N 2.97Å; I68-F149 HydrophobicContact CD1-CD1 4.31Å; I68-F149 HydrophobicContact CD1-CE1 4.29Å
69	P	58.5	Low	58.1	Low	102 Å²	102	78.2 Å²	78.2	66%	0.662	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	143.4	178.4	23.5	-31.5	0	0	0	110.7	K67	K67-P69 WeakPolarHBondContact O-CD 3.5Å
70	G	60.8	Low	56.3	Low	25 Å²	25	82.3 Å²	82.3	26%	0.258	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	-29	-174.6	0	0	0	0	0	116.5	E73	G70-E73 PolarHBondContact N-OE2 3.43Å
71	F	62.9	Low	54.5	Low	4 Å²	4	84.3 Å²	84.3	2%	0.018	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-33.5	-171.9	-87.4	-120.2	0	0	0	114.6	I68 V93 K96 A97 R100 F149	I68-F71 HydrophobicContact CB-CD2 4.3Å; I68-F71 HydrophobicContact CG2-CD2 3.94Å; I68-F71 HydrophobicContact CG2-CE2 4.12Å; I68-F71 PolarHBondContact O-N 2.97Å; F71-V93 HydrophobicContact CB-CG2 4.38Å; F71-V93 HydrophobicContact CD1-CG1 4.05Å; F71-K96 HydrophobicContact CD1-CB 3.8Å; F71-K96 HydrophobicContact CD1-CD 4.32Å; F71-K96 HydrophobicContact CE1-CB 3.58Å; F71-K96 HydrophobicContact CZ-CB 4.3Å; F71-K96 PolarHBondContact O-NZ 3.32Å; F71-A97 HydrophobicContact CE1-CB 3.88Å; F71-R100 HydrophobicContact CZ-CG 4.02Å; F71-F149 HydrophobicContact CE1-CE1 4.39Å; F71-F149 AromaticContact CE2-CD1 3.77Å; F71-F149 HydrophobicContact CE2-CD1 3.77Å; F71-F149 HydrophobicContact CE2-CE1 4.26Å; F71-F149 AromaticContact CZ-CD1 3.6Å; F71-F149 HydrophobicContact CZ-CD1 3.6Å; F71-F149 AromaticContact CZ-CE1 3.63Å; F71-F149 HydrophobicContact CZ-CE1 3.63Å
72	C	59.3	Low	52.7	Low	43 Å²	43	86.2 Å²	86.2	29%	0.291	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	52.4	171.3	-70.6	0	0	0	0	110.4	G74 C89 V93	C72-G74 VanDerWaalsContact C-N 3.28Å; C72-G74 PolarHBondContact O-N 3Å; C72-G74 VanDerWaalsContact O-N 3.13Å; C72-C89 WeakPolarHBondContact CB-SG 3.4Å; C72-C89 WeakPolarHBondContact SG-CB 3.48Å; C72-C89 CovalentContact SG-SG 2.06Å; C72-C89 PolarHBondContact SG-SG 3.02Å; C72-V93 WeakPolarHBondContact SG-CG2 3.32Å
73	E	52.8	Low	51.4	Low	162 Å²	162	91.9 Å²	91.9	76%	0.757	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	71.1	172.5	-122.1	168.6	166.2	0	0	110.1	G70	G70-E73 PolarHBondContact N-OE2 3.43Å
74	G	49.1	Very low	49.9	Very low	68 Å²	68	98 Å²	98	70%	0.701	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162	14.2	179.5	0	0	0	0	0	114.6	C72	C72-G74 VanDerWaalsContact C-N 3.28Å; C72-G74 PolarHBondContact O-N 3Å; C72-G74 VanDerWaalsContact O-N 3.13Å
75	G	43	Very low	48.4	Very low	67 Å²	67	95.7 Å²	95.7	69%	0.691	61%	0.61	S	S	*	*	S	Bend	trans	-132	11.4	-174.7	0	0	0	0	0	115.5
76	I	38.1	Very low	46.9	Very low	179 Å²	179	105.2 Å²	105.2	92%	0.918	65%	0.651	S	S	*	*	S	Bend	trans	-138	76.6	174.9	-52.3	176.6	0	0	0	107.5
77	G	34.7	Very low	46	Very low	77 Å²	77	104.3 Å²	104.3	79%	0.794	65%	0.653	S	S	*	*	S	Bend	trans	153	-7.9	168.6	0	0	0	0	0	119.2	S79	G77-S79 PolarHBondContact O-N 3.22Å
78	S	33.6	Very low	45.3	Very low	96 Å²	96	101 Å²	101	67%	0.671	64%	0.642	S	S	*	*			trans	-91.7	92.3	170.9	46.1	0	0	0	0	110.2	L80	S78-L80 PolarHBondContact O-N 2.93Å
79	S	34.1	Very low	45.1	Very low	121 Å²	121	100.4 Å²	100.4	85%	0.846	64%	0.642	S	S	*	*			trans	-67.6	68.1	160.9	55.6	0	0	0	0	110.2	G77	G77-S79 PolarHBondContact O-N 3.22Å
80	L	33.8	Very low	45.1	Very low	152 Å²	152	98.2 Å²	98.2	80%	0.796	63%	0.625	S	S	*	*			trans	-138.6	93	167.3	-153.1	85.7	0	0	0	109.3	S78	S78-L80 PolarHBondContact O-N 2.93Å
81	S	30.8	Very low	45	Very low	108 Å²	108	98.6 Å²	98.6	76%	0.755	62%	0.622	S	S	*	*			trans	33	107.2	151.1	-55.5	0	0	0	0	118	L83	S81-L83 PolarHBondContact O-N 3.39Å; S81-L83 VanDerWaalsContact O-N 3.07Å
82	A	36.9	Very low	45.3	Very low	101 Å²	101	99.2 Å²	99.2	84%	0.835	63%	0.625	S	S	*	*			trans	-26.5	106.8	146.2	0	0	0	0	0	113
83	L	39.8	Very low	46.1	Very low	171 Å²	171	97.1 Å²	97.1	90%	0.895	61%	0.612	S	S	*	*			trans	-172.1	118.5	146.5	-95.2	157.7	0	0	0	106.6	S81	S81-L83 PolarHBondContact O-N 3.39Å; S81-L83 VanDerWaalsContact O-N 3.07Å
84	D	34.5	Very low	47.4	Very low	173 Å²	173	89.7 Å²	89.7	93%	0.925	58%	0.578	S	S	*	*	S	Bend	trans	84.2	119.1	173.3	-107.5	5.6	0	0	0	120.5
85	G	38.6	Very low	49	Very low	63 Å²	63	86.5 Å²	86.5	65%	0.649	55%	0.545	S	S	*	.			trans	82.7	77.8	156.1	0	0	0	0	0	117.9	V87	G85-V87 VanDerWaalsContact C-N 3.32Å; G85-V87 PolarHBondContact O-N 3.34Å
86	K	39.4	Very low	50.9	Low	207 Å²	207	83.7 Å²	83.7	90%	0.9	51%	0.514	S	S	*	.			trans	-63.8	93.8	158	-86.5	-176.1	176.8	179.6	0	109.1
87	V	49.1	Very low	53.2	Low	70 Å²	70	75.2 Å²	75.2	42%	0.424	47%	0.47	S	S	.	.			trans	-72.2	125.6	168	-176.6	0	0	0	0	108.5	G85 C89 E420	G85-V87 VanDerWaalsContact C-N 3.32Å; G85-V87 PolarHBondContact O-N 3.34Å; V87-C89 VanDerWaalsContact C-N 3.35Å; V87-C89 PolarHBondContact O-N 2.61Å; V87-E420 WeakPolarHBondContact CG1-O 3.47Å; V87-E420 HydrophobicContact CG2-CB 4.32Å
88	N	54.3	Low	55.9	Low	78 Å²	78	71.5 Å²	71.5	42%	0.417	43%	0.432	S	S	.	.			trans	-66.8	88.3	175.2	-76.4	-38.6	0	0	0	110.1	D90 H315	N88-D90 PolarHBondContact O-N 3.27Å; N88-D90 VanDerWaalsContact O-N 3.08Å; N88-H315 PolarHBondContact ND2-O 3.25Å
89	C	62.1	Low	58.6	Low	42 Å²	42	67 Å²	67	28%	0.284	40%	0.4	S	S	.	.	H	α-helix	trans	-55.8	-25.5	173.9	-141.5	0	0	0	0	111.2	C72 V87 L92 V93	C72-C89 WeakPolarHBondContact CB-SG 3.4Å; C72-C89 WeakPolarHBondContact SG-CB 3.48Å; C72-C89 CovalentContact SG-SG 2.06Å; C72-C89 PolarHBondContact SG-SG 3.02Å; V87-C89 VanDerWaalsContact C-N 3.35Å; V87-C89 PolarHBondContact O-N 2.61Å; C89-L92 PolarHBondContact O-N 2.95Å; C89-V93 WeakPolarHBondContact O-CB 3.46Å; C89-V93 WeakPolarHBondContact O-CG2 3.38Å; C89-V93 PolarHBondContact O-N 3.42Å
90	D	58.4	Low	61.3	Low	56 Å²	56	61.4 Å²	61.4	30%	0.299	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-55.1	-174.7	-66.5	2.4	0	0	0	113.3	E62 K66 N88	E62-D90 HydrophobicContact CG-CB 4.45Å; E62-D90 VanDerWaalsContact OE2-CB 3.27Å; E62-D90 WeakPolarHBondContact OE2-CB 3.37Å; E62-D90 VanDerWaalsContact OE2-CG 3.3Å; K66-D90 WeakPolarHBondContact CE-OD1 3.29Å; K66-D90 IonicContact NZ-OD1 2.77Å; K66-D90 PolarHBondContact NZ-OD1 2.86Å; K66-D90 IonicContact NZ-OD2 2.73Å; N88-D90 PolarHBondContact O-N 3.27Å; N88-D90 VanDerWaalsContact O-N 3.08Å
91	V	60	Low	64.1	Low	33 Å²	33	54.3 Å²	54.3	20%	0.2	32%	0.324	C	S	.	.	H	α-helix	trans	-74.4	-32.5	179.3	-176.4	0	0	0	0	111.4	V93 G94 Y95 V317	V91-V93 PolarHBondContact O-N 2.75Å; V91-G94 PolarHBondContact O-N 3.33Å; V91-Y95 HydrophobicContact CG1-CE2 4.31Å; V91-Y95 PolarHBondContact O-N 3.17Å; V91-V317 HydrophobicContact CB-CB 4.35Å; V91-V317 HydrophobicContact CG1-CB 3.86Å; V91-V317 HydrophobicContact CG1-CG1 3.57Å; V91-V317 HydrophobicContact CG2-CB 4.37Å
92	L	68.5	Low	67.2	Low	16 Å²	16	49.2 Å²	49.2	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-67.3	-38.2	-177	-173.3	63	0	0	0	112.8	C89 G94 Y95 K96 Y419 M422	C89-L92 PolarHBondContact O-N 2.95Å; L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.36Å; L92-Y95 PolarHBondContact O-N 3.23Å; L92-K96 WeakPolarHBondContact O-CG 3.38Å; L92-K96 PolarHBondContact O-N 3.48Å; L92-Y419 HydrophobicContact CD1-CD1 4.18Å; L92-Y419 WeakPolarHBondContact CD1-O 3.3Å; L92-Y419 WeakPolarHBondContact CD2-O 3.11Å; L92-Y419 WeakPolarHBondContact CG-O 3.36Å; L92-M422 HydrophobicContact CD1-CE 3.42Å; L92-M422 VanDerWaalsContact CD1-CE 3.42Å; L92-M422 HydrophobicContact CD1-CG 4.05Å
93	V	76.8	Confident	70	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-40	175.3	164.9	0	0	0	0	111.3	L65 F71 C72 C89 V91 K96 A97	L65-V93 HydrophobicContact CB-CG1 3.26Å; L65-V93 HydrophobicContact CD1-CG1 4.21Å; L65-V93 HydrophobicContact CG-CG1 4.25Å; F71-V93 HydrophobicContact CB-CG2 4.38Å; F71-V93 HydrophobicContact CD1-CG1 4.05Å; C72-V93 WeakPolarHBondContact SG-CG2 3.32Å; C89-V93 WeakPolarHBondContact O-CB 3.46Å; C89-V93 WeakPolarHBondContact O-CG2 3.38Å; C89-V93 PolarHBondContact O-N 3.42Å; V91-V93 PolarHBondContact O-N 2.75Å; V93-K96 PolarHBondContact O-N 2.99Å; V93-A97 WeakPolarHBondContact O-CB 3.45Å; V93-A97 PolarHBondContact O-N 3.04Å
94	G	80.3	Confident	72.6	Confident	5 Å²	5	37.8 Å²	37.8	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-49.1	175.2	0	0	0	0	0	112	V91 L92 K96 A97 V98	V91-G94 PolarHBondContact O-N 3.33Å; L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.36Å; G94-K96 PolarHBondContact O-N 3.3Å; G94-A97 WeakPolarHBondContact O-CB 3.28Å; G94-A97 PolarHBondContact O-N 3.5Å; G94-A97 VanDerWaalsContact O-N 3.14Å; G94-V98 WeakPolarHBondContact O-CG2 3.48Å; G94-V98 PolarHBondContact O-N 2.75Å
95	Y	82.3	Confident	75.5	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-44.7	176.6	-70.1	-12.4	0	0	0	112.5	L57 V91 L92 A97 V98 Y99 V317 L409 T410 N411 Y413 M422	L57-Y95 HydrophobicContact CD1-CD1 3.64Å; L57-Y95 HydrophobicContact CD1-CE1 3.53Å; V91-Y95 HydrophobicContact CG1-CE2 4.31Å; V91-Y95 PolarHBondContact O-N 3.17Å; L92-Y95 PolarHBondContact O-N 3.23Å; Y95-A97 PolarHBondContact O-N 2.94Å; Y95-V98 PolarHBondContact O-N 2.89Å; Y95-Y99 VanDerWaalsContact O-CD2 3.3Å; Y95-Y99 WeakPolarHBondContact O-CD2 3.44Å; Y95-Y99 PolarHBondContact O-N 3.36Å; Y95-V317 HydrophobicContact CE2-CG1 4.09Å; Y95-L409 WeakPolarHBondContact CE1-O 3.41Å; Y95-T410 HydrophobicContact CD1-CG2 4.07Å; Y95-T410 HydrophobicContact CG-CG2 4.16Å; Y95-N411 PolarHBondContact OH-ND2 3.49Å; Y95-Y413 AromaticContact CE2-CD2 3.95Å; Y95-Y413 HydrophobicContact CE2-CD2 3.95Å; Y95-M422 HydrophobicContact CD2-CE 4.15Å; Y95-M422 HydrophobicContact CD2-CG 4.13Å; Y95-M422 HydrophobicContact CD2-SD 4.16Å; Y95-M422 HydrophobicContact CE2-CG 4.46Å
96	K	82.9	Confident	78.3	Confident	9 Å²	9	27.3 Å²	27.3	4%	0.039	14%	0.141	C	C	.	.	H	α-helix	trans	-53.2	-42.9	173.5	-75.1	177.1	174.7	-166.9	0	111.4	F71 L92 V93 G94 Y99 R100 E153 Y419	F71-K96 HydrophobicContact CD1-CB 3.8Å; F71-K96 HydrophobicContact CD1-CD 4.32Å; F71-K96 HydrophobicContact CE1-CB 3.58Å; F71-K96 HydrophobicContact CZ-CB 4.3Å; F71-K96 PolarHBondContact O-NZ 3.32Å; L92-K96 WeakPolarHBondContact O-CG 3.38Å; L92-K96 PolarHBondContact O-N 3.48Å; V93-K96 PolarHBondContact O-N 2.99Å; G94-K96 PolarHBondContact O-N 3.3Å; K96-Y99 WeakPolarHBondContact O-CB 3.47Å; K96-Y99 PolarHBondContact O-N 3.35Å; K96-R100 WeakPolarHBondContact O-CG 3.38Å; K96-R100 PolarHBondContact O-N 3.02Å; K96-E153 WeakPolarHBondContact CD-OE1 3.3Å; K96-E153 WeakPolarHBondContact CE-OE1 3.41Å; K96-E153 IonicContact NZ-OE1 2.66Å; K96-E153 PolarHBondContact NZ-OE1 3.44Å; K96-E153 IonicContact NZ-OE2 3.05Å; K96-E153 PolarHBondContact NZ-OE2 3.23Å; K96-Y419 HydrophobicContact CD-CD1 4.4Å; K96-Y419 HydrophobicContact CD-CG 4.42Å; K96-Y419 VanDerWaalsContact CE-CB 3.43Å; K96-Y419 HydrophobicContact CG-CD1 3.8Å; K96-Y419 HydrophobicContact CG-CE1 3.69Å; K96-Y419 HydrophobicContact CG-CG 4.31Å
97	A	87.2	Confident	81	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.5	-43.9	-179	0	0	0	0	0	111.7	M56 L65 F71 V93 G94 Y95 Y99 R100 V101	M56-A97 HydrophobicContact CB-CB 4.12Å; M56-A97 HydrophobicContact CG-CB 4.46Å; M56-A97 HydrophobicContact SD-CB 3.75Å; L65-A97 HydrophobicContact CD2-CB 3.67Å; F71-A97 HydrophobicContact CE1-CB 3.88Å; V93-A97 WeakPolarHBondContact O-CB 3.45Å; V93-A97 PolarHBondContact O-N 3.04Å; G94-A97 WeakPolarHBondContact O-CB 3.28Å; G94-A97 PolarHBondContact O-N 3.5Å; G94-A97 VanDerWaalsContact O-N 3.14Å; Y95-A97 PolarHBondContact O-N 2.94Å; A97-Y99 VanDerWaalsContact C-N 3.33Å; A97-Y99 PolarHBondContact O-N 3.23Å; A97-R100 PolarHBondContact O-N 3.37Å; A97-R100 VanDerWaalsContact O-N 3.12Å; A97-V101 PolarHBondContact O-N 2.92Å
98	V	90.2	Very high	83.3	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.3	-46.3	174.4	172.4	0	0	0	0	110.9	A53 G94 Y95 R100 V101 C102 L409 T410	A53-V98 HydrophobicContact CB-CG2 4.42Å; G94-V98 WeakPolarHBondContact O-CG2 3.48Å; G94-V98 PolarHBondContact O-N 2.75Å; Y95-V98 PolarHBondContact O-N 2.89Å; V98-R100 VanDerWaalsContact C-N 3.29Å; V98-R100 PolarHBondContact O-N 2.85Å; V98-V101 PolarHBondContact O-N 2.96Å; V98-C102 VanDerWaalsContact O-CB 3.31Å; V98-C102 WeakPolarHBondContact O-CB 3.31Å; V98-C102 PolarHBondContact O-N 3.17Å; V98-C102 PolarHBondContact O-SG 3.44Å; V98-C102 VanDerWaalsContact O-SG 3.39Å; V98-L409 HydrophobicContact CG1-CB 3.85Å; V98-L409 HydrophobicContact CG1-CD1 4.18Å; V98-T410 HydrophobicContact CB-CG2 4.26Å; V98-T410 HydrophobicContact CG1-CG2 3.93Å
99	Y	90.1	Very high	85.3	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-55.5	-42.8	175.5	-92.4	-89.6	0	0	0	112.2	Y95 K96 A97 F103 W160 F161 M406 T410	Y95-Y99 VanDerWaalsContact O-CD2 3.3Å; Y95-Y99 WeakPolarHBondContact O-CD2 3.44Å; Y95-Y99 PolarHBondContact O-N 3.36Å; K96-Y99 WeakPolarHBondContact O-CB 3.47Å; K96-Y99 PolarHBondContact O-N 3.35Å; A97-Y99 VanDerWaalsContact C-N 3.33Å; A97-Y99 PolarHBondContact O-N 3.23Å; Y99-F103 WeakPolarHBondContact O-CB 3.34Å; Y99-F103 PolarHBondContact O-N 3.44Å; Y99-W160 HydrophobicContact CD1-CB 4.49Å; Y99-W160 AromaticContact CD1-CD1 3.83Å; Y99-F161 WeakPolarHBondContact OH-CD2 3.41Å; Y99-M406 HydrophobicContact CD1-CE 4.33Å; Y99-M406 HydrophobicContact CD1-CG 4.21Å; Y99-M406 HydrophobicContact CD1-SD 3.59Å; Y99-M406 VanDerWaalsContact CD1-SD 3.59Å; Y99-M406 HydrophobicContact CE1-CE 3.96Å; Y99-M406 HydrophobicContact CE1-CG 4.28Å; Y99-M406 HydrophobicContact CE1-SD 3.81Å; Y99-M406 HydrophobicContact CG-CG 4.41Å; Y99-M406 HydrophobicContact CG-SD 4.24Å; Y99-T410 HydrophobicContact CD2-CG2 3.86Å; Y99-T410 HydrophobicContact CE2-CG2 3.58Å
100	R	91.2	Very high	87	Confident	4 Å²	4	13.7 Å²	13.7	2%	0.015	7%	0.071	C	C	.	.	H	α-helix	trans	-69.4	-45.3	179.3	-61.3	-45.5	-177	166.2	4.1	112.9	F71 K96 A97 V98 F103 G104 S148 F149 I151	F71-R100 HydrophobicContact CZ-CG 4.02Å; K96-R100 WeakPolarHBondContact O-CG 3.38Å; K96-R100 PolarHBondContact O-N 3.02Å; A97-R100 PolarHBondContact O-N 3.37Å; A97-R100 VanDerWaalsContact O-N 3.12Å; V98-R100 VanDerWaalsContact C-N 3.29Å; V98-R100 PolarHBondContact O-N 2.85Å; R100-F103 PolarHBondContact O-N 2.96Å; R100-G104 PolarHBondContact O-N 2.74Å; R100-S148 WeakPolarHBondContact CB-OG 3.47Å; R100-S148 WeakPolarHBondContact CD-O 3.45Å; R100-S148 PolarHBondContact O-OG 2.82Å; R100-F149 HydrophobicContact CB-CD1 4.32Å; R100-F149 HydrophobicContact CB-CD2 4.18Å; R100-F149 HydrophobicContact CB-CE1 4.14Å; R100-F149 HydrophobicContact CB-CE2 3.98Å; R100-F149 HydrophobicContact CB-CG 4.33Å; R100-F149 HydrophobicContact CB-CZ 3.96Å; R100-F149 HydrophobicContact CG-CD1 4.28Å; R100-F149 HydrophobicContact CG-CE1 4.38Å; R100-F149 HydrophobicContact CG-CG 4.5Å; R100-I151 VanDerWaalsContact CZ-O 3.26Å; R100-I151 VanDerWaalsContact NH1-CG2 3.3Å; R100-I151 PolarHBondContact NH1-O 3.48Å; R100-I151 PolarHBondContact NH2-O 3.38Å
101	V	93.5	Very high	88.8	Confident	4 Å²	4	15 Å²	15	2%	0.024	8%	0.078	C	C	.	.	H	α-helix	trans	-65.6	-47.6	180	174.7	0	0	0	0	110.8	V52 A53 M56 A97 V98 F103 G104 M105 T145 F149	V52-V101 HydrophobicContact CG1-CG1 4.44Å; A53-V101 HydrophobicContact CB-CG1 4.36Å; M56-V101 HydrophobicContact CE-CG2 3.69Å; M56-V101 HydrophobicContact SD-CG2 3.43Å; M56-V101 WeakPolarHBondContact SD-CG2 2.96Å; A97-V101 PolarHBondContact O-N 2.92Å; V98-V101 PolarHBondContact O-N 2.96Å; V101-F103 PolarHBondContact O-N 2.96Å; V101-G104 PolarHBondContact O-N 3.37Å; V101-G104 VanDerWaalsContact O-N 3.16Å; V101-M105 HydrophobicContact CG1-CE 4.19Å; V101-M105 PolarHBondContact O-N 3.48Å; V101-T145 HydrophobicContact CB-CG2 4.46Å; V101-T145 HydrophobicContact CG1-CG2 4.42Å; V101-T145 HydrophobicContact CG2-CG2 4.22Å; V101-F149 HydrophobicContact CG2-CE2 4.05Å; V101-F149 HydrophobicContact CG2-CZ 3.91Å
102	C	95.1	Very high	90.4	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-66.9	-35.6	177.9	-65.3	0	0	0	0	112.8	V98 G104 M105 A106 M406	V98-C102 VanDerWaalsContact O-CB 3.31Å; V98-C102 WeakPolarHBondContact O-CB 3.31Å; V98-C102 PolarHBondContact O-N 3.17Å; V98-C102 PolarHBondContact O-SG 3.44Å; V98-C102 VanDerWaalsContact O-SG 3.39Å; C102-G104 VanDerWaalsContact C-N 3.33Å; C102-G104 PolarHBondContact O-N 2.99Å; C102-M105 HydrophobicContact CB-CE 4.13Å; C102-M105 PolarHBondContact O-N 3.27Å; C102-A106 VanDerWaalsContact O-CB 3.26Å; C102-A106 WeakPolarHBondContact O-CB 3.28Å; C102-A106 PolarHBondContact O-N 2.76Å; C102-M406 HydrophobicContact CB-CB 3.55Å; C102-M406 HydrophobicContact CB-CG 3.8Å; C102-M406 HydrophobicContact CB-SD 4.16Å
103	F	95.3	Very high	91.6	Very high	33 Å²	33	13.6 Å²	13.6	15%	0.145	7%	0.069	C	C	.	.	H	α-helix	trans	-58.1	-46.3	169.5	173.7	-89.3	0	0	0	111.4	Y99 R100 V101 M105 A106 M107 I151 F156 W160	Y99-F103 WeakPolarHBondContact O-CB 3.34Å; Y99-F103 PolarHBondContact O-N 3.44Å; R100-F103 PolarHBondContact O-N 2.96Å; V101-F103 PolarHBondContact O-N 2.96Å; F103-M105 PolarHBondContact O-N 3.02Å; F103-A106 PolarHBondContact O-N 3.49Å; F103-M107 HydrophobicContact CD1-CG 4.11Å; F103-M107 HydrophobicContact CD2-CG 4.28Å; F103-M107 HydrophobicContact CE1-CG 3.7Å; F103-M107 HydrophobicContact CE2-CG 3.86Å; F103-M107 HydrophobicContact CE2-SD 4.12Å; F103-M107 HydrophobicContact CG-CG 4.4Å; F103-M107 HydrophobicContact CZ-CG 3.55Å; F103-M107 HydrophobicContact CZ-SD 4.16Å; F103-M107 WeakPolarHBondContact O-CG 3.38Å; F103-M107 PolarHBondContact O-N 3.26Å; F103-I151 HydrophobicContact CD1-CD1 4.34Å; F103-I151 HydrophobicContact CE1-CD1 3.79Å; F103-I151 HydrophobicContact CZ-CD1 4.17Å; F103-F156 HydrophobicContact CB-CZ 4.18Å; F103-F156 AromaticContact CD2-CE2 3.85Å; F103-F156 HydrophobicContact CD2-CE2 3.85Å; F103-F156 AromaticContact CD2-CZ 3.73Å; F103-F156 HydrophobicContact CD2-CZ 3.73Å; F103-F156 AromaticContact CE2-CE2 3.91Å; F103-F156 HydrophobicContact CE2-CE2 3.91Å; F103-F156 HydrophobicContact CE2-CZ 4.26Å; F103-F156 HydrophobicContact CG-CE2 4.33Å; F103-F156 AromaticContact CG-CZ 3.88Å; F103-F156 HydrophobicContact CG-CZ 3.88Å; F103-F156 HydrophobicContact CZ-CE2 4.39Å; F103-W160 HydrophobicContact CB-CZ2 4.46Å; F103-W160 AromaticContact CD2-CD2 3.79Å; F103-W160 HydrophobicContact CD2-CD2 3.79Å; F103-W160 AromaticContact CD2-CE2 3.49Å; F103-W160 VanDerWaalsContact CD2-CE2 3.49Å; F103-W160 HydrophobicContact CD2-CE3 4.01Å; F103-W160 HydrophobicContact CD2-CG 4.49Å; F103-W160 AromaticContact CD2-CH2 3.7Å; F103-W160 HydrophobicContact CD2-CH2 3.7Å; F103-W160 AromaticContact CD2-CZ2 3.45Å; F103-W160 HydrophobicContact CD2-CZ2 3.45Å; F103-W160 VanDerWaalsContact CD2-CZ2 3.45Å; F103-W160 AromaticContact CD2-CZ3 3.98Å; F103-W160 HydrophobicContact CD2-CZ3 3.98Å; F103-W160 AromaticContact CD2-NE1 4Å; F103-W160 HydrophobicContact CE2-CD2 4.38Å; F103-W160 HydrophobicContact CE2-CE3 4.13Å; F103-W160 AromaticContact CE2-CH2 3.83Å; F103-W160 HydrophobicContact CE2-CH2 3.83Å; F103-W160 HydrophobicContact CE2-CZ2 4.08Å; F103-W160 AromaticContact CE2-CZ3 3.86Å; F103-W160 HydrophobicContact CE2-CZ3 3.86Å; F103-W160 HydrophobicContact CG-CZ2 4.34Å
104	G	95.4	Very high	92.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.1	-45.4	179.2	0	0	0	0	0	112.8	R100 V101 C102 M107 F108	R100-G104 PolarHBondContact O-N 2.74Å; V101-G104 PolarHBondContact O-N 3.37Å; V101-G104 VanDerWaalsContact O-N 3.16Å; C102-G104 VanDerWaalsContact C-N 3.33Å; C102-G104 PolarHBondContact O-N 2.99Å; G104-M107 PolarHBondContact O-N 3.37Å; G104-F108 PolarHBondContact O-N 2.95Å
105	M	95.3	Very high	93.1	Very high	16 Å²	16	22.1 Å²	22.1	8%	0.079	11%	0.113	C	C	.	.	H	α-helix	trans	-60.9	-47	173.6	-68.4	-171.1	-71.8	0	0	112.2	L46 G49 V101 C102 F103 M107 F108 F109	L46-M105 HydrophobicContact CD1-SD 4.35Å; G49-M105 WeakPolarHBondContact CA-SD 3.32Å; V101-M105 HydrophobicContact CG1-CE 4.19Å; V101-M105 PolarHBondContact O-N 3.48Å; C102-M105 HydrophobicContact CB-CE 4.13Å; C102-M105 PolarHBondContact O-N 3.27Å; F103-M105 PolarHBondContact O-N 3.02Å; M105-M107 PolarHBondContact O-N 3.14Å; M105-F108 WeakPolarHBondContact O-CB 3.3Å; M105-F108 PolarHBondContact O-N 3.45Å; M105-F109 WeakPolarHBondContact O-CD2 3.32Å; M105-F109 PolarHBondContact O-N 3.29Å
106	A	97	Very high	93.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.9	-49.2	179.6	0	0	0	0	0	110.9	C102 F103 F108 F109 L110 W160 F399 S402 L403	C102-A106 VanDerWaalsContact O-CB 3.26Å; C102-A106 WeakPolarHBondContact O-CB 3.28Å; C102-A106 PolarHBondContact O-N 2.76Å; F103-A106 PolarHBondContact O-N 3.49Å; A106-F108 VanDerWaalsContact C-N 3.31Å; A106-F108 PolarHBondContact O-N 3.48Å; A106-F109 PolarHBondContact O-N 2.93Å; A106-L110 VanDerWaalsContact O-CB 3.26Å; A106-L110 WeakPolarHBondContact O-CB 3.39Å; A106-L110 PolarHBondContact O-N 3.05Å; A106-W160 HydrophobicContact CB-CZ2 4.12Å; A106-F399 HydrophobicContact CB-CD2 3.77Å; A106-F399 HydrophobicContact CB-CE2 3.9Å; A106-F399 VanDerWaalsContact O-CD2 3.27Å; A106-F399 WeakPolarHBondContact O-CD2 3.4Å; A106-S402 WeakPolarHBondContact CA-OG 3.39Å; A106-S402 WeakPolarHBondContact CB-OG 3.43Å; A106-S402 PolarHBondContact N-OG 3.14Å; A106-L403 HydrophobicContact CB-CD2 4.1Å
107	M	96.6	Very high	93.9	Very high	65 Å²	65	25.5 Å²	25.5	32%	0.32	13%	0.13	S	C	.	.	H	α-helix	trans	-64.5	-35.9	179.4	-66.6	-50.7	-60.8	0	0	112.6	F103 G104 M105 L110 L111 I144 W160	F103-M107 HydrophobicContact CD1-CG 4.11Å; F103-M107 HydrophobicContact CD2-CG 4.28Å; F103-M107 HydrophobicContact CE1-CG 3.7Å; F103-M107 HydrophobicContact CE2-CG 3.86Å; F103-M107 HydrophobicContact CE2-SD 4.12Å; F103-M107 HydrophobicContact CG-CG 4.4Å; F103-M107 HydrophobicContact CZ-CG 3.55Å; F103-M107 HydrophobicContact CZ-SD 4.16Å; F103-M107 WeakPolarHBondContact O-CG 3.38Å; F103-M107 PolarHBondContact O-N 3.26Å; G104-M107 PolarHBondContact O-N 3.37Å; M105-M107 PolarHBondContact O-N 3.14Å; M107-L110 HydrophobicContact CE-CD2 4.34Å; M107-L110 HydrophobicContact SD-CD2 4.34Å; M107-L111 VanDerWaalsContact O-CB 3.29Å; M107-L111 WeakPolarHBondContact O-CB 3.39Å; M107-L111 PolarHBondContact O-N 2.91Å; M107-I144 HydrophobicContact CB-CG2 4.04Å; M107-W160 HydrophobicContact SD-CH2 4.25Å
108	F	96.8	Very high	93.8	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-51.3	173.8	173.1	-92.9	0	0	0	112	Y42 F45 G104 M105 A106 L111 F112 K137 A141 I144	Y42-F108 HydrophobicContact CE1-CE1 4.42Å; F45-F108 AromaticContact CD1-CE1 3.96Å; F45-F108 HydrophobicContact CD1-CE1 3.96Å; F45-F108 AromaticContact CE1-CD1 3.83Å; F45-F108 HydrophobicContact CE1-CD1 3.83Å; F45-F108 AromaticContact CE1-CE1 3.49Å; F45-F108 HydrophobicContact CE1-CE1 3.49Å; F45-F108 VanDerWaalsContact CE1-CE1 3.49Å; F45-F108 AromaticContact CE1-CZ 3.88Å; F45-F108 HydrophobicContact CE1-CZ 3.88Å; G104-F108 PolarHBondContact O-N 2.95Å; M105-F108 WeakPolarHBondContact O-CB 3.3Å; M105-F108 PolarHBondContact O-N 3.45Å; A106-F108 VanDerWaalsContact C-N 3.31Å; A106-F108 PolarHBondContact O-N 3.48Å; F108-L111 PolarHBondContact O-N 3.39Å; F108-F112 HydrophobicContact CD1-CD2 4.5Å; F108-F112 HydrophobicContact CD2-CD2 4.18Å; F108-F112 HydrophobicContact CD2-CE2 4.2Å; F108-F112 HydrophobicContact CE1-CD2 4.01Å; F108-F112 HydrophobicContact CE1-CE2 4.33Å; F108-F112 AromaticContact CE2-CD2 3.69Å; F108-F112 HydrophobicContact CE2-CD2 3.69Å; F108-F112 AromaticContact CE2-CE2 3.38Å; F108-F112 HydrophobicContact CE2-CE2 3.38Å; F108-F112 HydrophobicContact CE2-CZ 4.37Å; F108-F112 AromaticContact CZ-CD2 3.58Å; F108-F112 HydrophobicContact CZ-CD2 3.58Å; F108-F112 AromaticContact CZ-CE2 3.46Å; F108-F112 HydrophobicContact CZ-CE2 3.46Å; F108-F112 VanDerWaalsContact CZ-CE2 3.46Å; F108-F112 HydrophobicContact CZ-CG 4.42Å; F108-F112 HydrophobicContact CZ-CZ 4.2Å; F108-F112 PolarHBondContact O-N 2.92Å; F108-K137 HydrophobicContact CE2-CB 4.37Å; F108-K137 HydrophobicContact CZ-CB 4.12Å; F108-A141 HydrophobicContact CB-CB 4.39Å; F108-A141 HydrophobicContact CD1-CB 4.49Å; F108-A141 HydrophobicContact CD2-CB 3.55Å; F108-A141 HydrophobicContact CE2-CB 3.87Å; F108-A141 HydrophobicContact CG-CB 3.88Å; F108-A141 HydrophobicContact CZ-CB 4.5Å; F108-I144 HydrophobicContact CB-CD1 4.26Å; F108-I144 HydrophobicContact CD2-CD1 4.34Å
109	F	97	Very high	93.7	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-35	-179.8	-73.2	-62.7	0	0	0	112.4	Y42 F45 L46 M105 A106 F112 S113 H395 L398 F399	Y42-F109 HydrophobicContact CD1-CE1 4Å; F45-F109 HydrophobicContact CD1-CE1 4.49Å; F45-F109 HydrophobicContact CD1-CZ 4.01Å; L46-F109 HydrophobicContact CB-CE2 4.17Å; L46-F109 HydrophobicContact CB-CZ 4.07Å; L46-F109 HydrophobicContact CD1-CE2 3.85Å; M105-F109 WeakPolarHBondContact O-CD2 3.32Å; M105-F109 PolarHBondContact O-N 3.29Å; A106-F109 PolarHBondContact O-N 2.93Å; F109-F112 PolarHBondContact O-N 3.48Å; F109-S113 WeakPolarHBondContact O-CB 3.39Å; F109-S113 PolarHBondContact O-N 3.21Å; F109-H395 AromaticContact CD1-ND1 3.88Å; F109-L398 HydrophobicContact CB-CB 4.27Å; F109-L398 HydrophobicContact CD1-CB 3.64Å; F109-L398 HydrophobicContact CD1-CD1 3.79Å; F109-L398 HydrophobicContact CD1-CG 4.39Å; F109-L398 HydrophobicContact CD2-CB 4.12Å; F109-L398 HydrophobicContact CE1-CB 3.93Å; F109-L398 HydrophobicContact CE1-CD1 3.45Å; F109-L398 VanDerWaalsContact CE1-CD1 3.45Å; F109-L398 HydrophobicContact CE1-CG 4.34Å; F109-L398 HydrophobicContact CE2-CB 4.39Å; F109-L398 HydrophobicContact CG-CB 3.75Å; F109-L398 HydrophobicContact CZ-CB 4.3Å; F109-L398 HydrophobicContact CZ-CD1 4.12Å; F109-F399 HydrophobicContact CB-CB 3.99Å
110	L	97	Very high	93.4	Very high	43 Å²	43	40.9 Å²	40.9	23%	0.225	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-44.9	173.7	-176.8	61.4	0	0	0	111.3	A106 M107 F112 S113 L114 F399	A106-L110 VanDerWaalsContact O-CB 3.26Å; A106-L110 WeakPolarHBondContact O-CB 3.39Å; A106-L110 PolarHBondContact O-N 3.05Å; M107-L110 HydrophobicContact CE-CD2 4.34Å; M107-L110 HydrophobicContact SD-CD2 4.34Å; L110-F112 VanDerWaalsContact C-N 3.34Å; L110-F112 PolarHBondContact O-N 3.13Å; L110-S113 WeakPolarHBondContact O-CB 3.39Å; L110-S113 PolarHBondContact O-N 3.3Å; L110-L114 WeakPolarHBondContact O-CG 3.47Å; L110-L114 PolarHBondContact O-N 3.17Å; L110-F399 HydrophobicContact CB-CD2 3.83Å; L110-F399 HydrophobicContact CB-CE2 4.17Å; L110-F399 HydrophobicContact CB-CG 4.2Å; L110-F399 HydrophobicContact CD1-CD1 4.36Å; L110-F399 HydrophobicContact CD1-CE1 4.4Å; L110-F399 HydrophobicContact CD1-CG 4.43Å; L110-F399 HydrophobicContact CD2-CE2 4.17Å; L110-F399 HydrophobicContact CD2-CZ 4.37Å
111	L	96	Very high	92.9	Very high	84 Å²	84	41.7 Å²	41.7	44%	0.44	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-46.7	175.2	178.5	65.4	0	0	0	111.1	M107 F108 S113 L114 L115	M107-L111 VanDerWaalsContact O-CB 3.29Å; M107-L111 WeakPolarHBondContact O-CB 3.39Å; M107-L111 PolarHBondContact O-N 2.91Å; F108-L111 PolarHBondContact O-N 3.39Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 3.33Å; L111-L114 PolarHBondContact O-N 2.78Å; L111-L115 HydrophobicContact CD1-CD1 4.38Å; L111-L115 HydrophobicContact CD1-CG 4.43Å; L111-L115 HydrophobicContact CG-CD1 4.08Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 2.79Å
112	F	94.2	Very high	92.4	Very high	12 Å²	12	42.4 Å²	42.4	5%	0.053	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-38.2	176.9	-97.1	-95.9	0	0	0	112.7	Y42 F108 F109 L110 L114 L115 M116 L129 K137 H395	Y42-F112 WeakPolarHBondContact OH-CE1 3.4Å; F108-F112 HydrophobicContact CD1-CD2 4.5Å; F108-F112 HydrophobicContact CD2-CD2 4.18Å; F108-F112 HydrophobicContact CD2-CE2 4.2Å; F108-F112 HydrophobicContact CE1-CD2 4.01Å; F108-F112 HydrophobicContact CE1-CE2 4.33Å; F108-F112 AromaticContact CE2-CD2 3.69Å; F108-F112 HydrophobicContact CE2-CD2 3.69Å; F108-F112 AromaticContact CE2-CE2 3.38Å; F108-F112 HydrophobicContact CE2-CE2 3.38Å; F108-F112 HydrophobicContact CE2-CZ 4.37Å; F108-F112 AromaticContact CZ-CD2 3.58Å; F108-F112 HydrophobicContact CZ-CD2 3.58Å; F108-F112 AromaticContact CZ-CE2 3.46Å; F108-F112 HydrophobicContact CZ-CE2 3.46Å; F108-F112 VanDerWaalsContact CZ-CE2 3.46Å; F108-F112 HydrophobicContact CZ-CG 4.42Å; F108-F112 HydrophobicContact CZ-CZ 4.2Å; F108-F112 PolarHBondContact O-N 2.92Å; F109-F112 PolarHBondContact O-N 3.48Å; L110-F112 VanDerWaalsContact C-N 3.34Å; L110-F112 PolarHBondContact O-N 3.13Å; F112-L114 VanDerWaalsContact C-N 3.33Å; F112-L114 PolarHBondContact O-N 3.08Å; F112-L115 PolarHBondContact O-N 2.94Å; F112-M116 HydrophobicContact CD1-CE 4.16Å; F112-M116 HydrophobicContact CE1-CE 4.23Å; F112-M116 WeakPolarHBondContact O-CB 3.32Å; F112-M116 WeakPolarHBondContact O-CG 3.31Å; F112-M116 PolarHBondContact O-N 3.46Å; F112-M116 VanDerWaalsContact O-N 3.07Å; F112-L129 HydrophobicContact CE1-CD2 4.44Å; F112-L129 HydrophobicContact CE1-CG 4.24Å; F112-L129 HydrophobicContact CZ-CG 4.43Å; F112-K137 HydrophobicContact CE1-CD 4.33Å; F112-K137 HydrophobicContact CE1-CG 4.45Å; F112-K137 HydrophobicContact CE2-CG 4.43Å; F112-K137 HydrophobicContact CZ-CD 4.1Å; F112-K137 HydrophobicContact CZ-CG 3.75Å; F112-H395 HydrophobicContact CB-CB 4.32Å
113	S	94.4	Very high	91.8	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-44.6	174.2	-179.1	0	0	0	0	111.8	F109 L110 L111 M116 S392	F109-S113 WeakPolarHBondContact O-CB 3.39Å; F109-S113 PolarHBondContact O-N 3.21Å; L110-S113 WeakPolarHBondContact O-CB 3.39Å; L110-S113 PolarHBondContact O-N 3.3Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 3.33Å; S113-M116 PolarHBondContact O-N 3.41Å; S113-S392 WeakPolarHBondContact O-CB 3.3Å; S113-S392 PolarHBondContact O-OG 2.83Å; S113-S392 PolarHBondContact OG-O 3.36Å; S113-S392 PolarHBondContact OG-OG 3.45Å
114	L	95.1	Very high	91.3	Very high	105 Å²	105	50 Å²	50	55%	0.55	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-40.1	177.5	-65.4	174.8	0	0	0	112.7	L110 L111 F112 M116 I117	L110-L114 WeakPolarHBondContact O-CG 3.47Å; L110-L114 PolarHBondContact O-N 3.17Å; L111-L114 PolarHBondContact O-N 2.78Å; F112-L114 VanDerWaalsContact C-N 3.33Å; F112-L114 PolarHBondContact O-N 3.08Å; L114-M116 VanDerWaalsContact C-N 3.28Å; L114-M116 PolarHBondContact O-N 3Å; L114-I117 HydrophobicContact CD2-CD1 4.05Å; L114-I117 WeakPolarHBondContact O-CD1 3.36Å; L114-I117 WeakPolarHBondContact O-CG1 3.49Å; L114-I117 PolarHBondContact O-N 3.34Å
115	L	93.4	Very high	90.8	Very high	80 Å²	80	55.5 Å²	55.5	42%	0.419	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-31.4	178.2	-71.2	173	0	0	0	112.8	L111 F112 L129	L111-L115 HydrophobicContact CD1-CD1 4.38Å; L111-L115 HydrophobicContact CD1-CG 4.43Å; L111-L115 HydrophobicContact CG-CD1 4.08Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 2.79Å; F112-L115 PolarHBondContact O-N 2.94Å; L115-L129 HydrophobicContact CD1-CD2 4.44Å
116	M	90.9	Very high	90.5	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.015	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	12.8	-175.8	-60.7	-57	152.9	0	0	114.2	F112 S113 L114 K118 V119 R126 L129 H130	F112-M116 HydrophobicContact CD1-CE 4.16Å; F112-M116 HydrophobicContact CE1-CE 4.23Å; F112-M116 WeakPolarHBondContact O-CB 3.32Å; F112-M116 WeakPolarHBondContact O-CG 3.31Å; F112-M116 PolarHBondContact O-N 3.46Å; F112-M116 VanDerWaalsContact O-N 3.07Å; S113-M116 PolarHBondContact O-N 3.41Å; L114-M116 VanDerWaalsContact C-N 3.28Å; L114-M116 PolarHBondContact O-N 3Å; M116-K118 PolarHBondContact O-N 2.88Å; M116-V119 HydrophobicContact SD-CG2 4.23Å; M116-R126 WeakPolarHBondContact CE-O 3.47Å; M116-R126 HydrophobicContact SD-CB 4.33Å; M116-L129 HydrophobicContact CE-CB 4.12Å; M116-L129 HydrophobicContact CE-CD2 3.92Å; M116-L129 HydrophobicContact CE-CG 4.13Å; M116-H130 HydrophobicContact CE-CB 4.08Å; M116-H130 HydrophobicContact SD-CB 3.96Å
117	I	90.2	Very high	89.9	Confident	77 Å²	77	59.7 Å²	59.7	40%	0.395	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	129.6	175.7	-67.4	172.4	0	0	0	110.4	L114 V119 R126	L114-I117 HydrophobicContact CD2-CD1 4.05Å; L114-I117 WeakPolarHBondContact O-CD1 3.36Å; L114-I117 WeakPolarHBondContact O-CG1 3.49Å; L114-I117 PolarHBondContact O-N 3.34Å; I117-V119 VanDerWaalsContact C-N 3.34Å; I117-V119 PolarHBondContact O-N 3.12Å; I117-R126 PolarHBondContact O-NH1 3.47Å
118	K	86.2	Confident	89.4	Confident	176 Å²	176	58.4 Å²	58.4	77%	0.765	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	40.1	177.5	-63.6	177	176.1	-178.9	0	113.8	M116 R126	M116-K118 PolarHBondContact O-N 2.88Å; K118-R126 PolarHBondContact O-NH2 3.33Å; K118-R126 VanDerWaalsContact O-NH2 3.13Å
119	V	86.6	Confident	88.9	Confident	11 Å²	11	61.2 Å²	61.2	7%	0.067	31%	0.312	C	S	.	.			trans	-82.4	126.2	162.8	175.9	0	0	0	0	107.5	M116 I117 D124 R126 A127 V387 Y391	M116-V119 HydrophobicContact SD-CG2 4.23Å; I117-V119 VanDerWaalsContact C-N 3.34Å; I117-V119 PolarHBondContact O-N 3.12Å; V119-D124 HydrophobicContact CG1-CB 4.16Å; V119-R126 HydrophobicContact CG2-CB 3.96Å; V119-A127 HydrophobicContact CG1-CB 4.14Å; V119-V387 HydrophobicContact CG1-CG1 4.36Å; V119-Y391 HydrophobicContact CB-CD2 4.08Å; V119-Y391 HydrophobicContact CG1-CD2 3.73Å; V119-Y391 HydrophobicContact CG1-CE2 3.71Å
120	K	83.3	Confident	88.5	Confident	136 Å²	136	61.1 Å²	61.1	59%	0.591	31%	0.312	S	S	*	.			trans	-113.2	-23.4	-173.3	-71	-166.7	173.1	-162.6	0	113.8	D124 G386 V387	K120-D124 PolarHBondContact N-OD2 3.46Å; K120-D124 VanDerWaalsContact N-OD2 3.15Å; K120-G386 CarbonylContact O-C 3.56Å; K120-G386 WeakPolarHBondContact O-CA 3.13Å; K120-V387 PolarHBondContact O-N 3.22Å
121	S	82.3	Confident	88	Confident	22 Å²	22	59.4 Å²	59.4	15%	0.154	30%	0.303	C	S	.	.	S	Bend	trans	-142.5	155	-177.9	160.5	0	0	0	0	110.8	Q123 D124 K384	S121-Q123 PolarHBondContact O-N 3.01Å; S121-Q123 PolarHBondContact OG-N 3.43Å; S121-Q123 VanDerWaalsContact OG-N 3.09Å; S121-D124 WeakPolarHBondContact O-CB 3.41Å; S121-D124 PolarHBondContact O-N 2.92Å; S121-K384 PolarHBondContact OG-O 3.39Å
122	S	81.8	Confident	87.4	Confident	19 Å²	19	55.4 Å²	55.4	13%	0.133	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.7	172.9	76.6	0	0	0	0	113.6	D124 A127 D381 E383 K384	S122-D124 VanDerWaalsContact C-N 3.31Å; S122-A127 WeakPolarHBondContact O-CB 3.43Å; S122-D381 PolarHBondContact OG-OD2 3.45Å; S122-E383 VanDerWaalsContact CB-O 3.29Å; S122-E383 WeakPolarHBondContact CB-O 3.4Å; S122-E383 PolarHBondContact N-O 3.48Å; S122-E383 PolarHBondContact OG-O 3.25Å; S122-K384 WeakPolarHBondContact OG-CA 3.35Å; S122-K384 PolarHBondContact OG-N 3.18Å
123	Q	82.4	Confident	86.9	Confident	144 Å²	144	57.8 Å²	57.8	67%	0.673	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.3	176.9	-58.8	-176.2	10.5	0	0	113.2	S121	S121-Q123 PolarHBondContact O-N 3.01Å; S121-Q123 PolarHBondContact OG-N 3.43Å; S121-Q123 VanDerWaalsContact OG-N 3.09Å
124	D	85.6	Confident	86.5	Confident	47 Å²	47	58.5 Å²	58.5	25%	0.251	30%	0.295	S	S	.	.	S	Bend	trans	-60.5	135.3	175.3	-78.8	-33.3	0	0	0	109.9	V119 K120 S121 S122 R126 A127	V119-D124 HydrophobicContact CG1-CB 4.16Å; K120-D124 PolarHBondContact N-OD2 3.46Å; K120-D124 VanDerWaalsContact N-OD2 3.15Å; S121-D124 WeakPolarHBondContact O-CB 3.41Å; S121-D124 PolarHBondContact O-N 2.92Å; S122-D124 VanDerWaalsContact C-N 3.31Å; D124-R126 PolarHBondContact O-N 3.06Å; D124-A127 HydrophobicContact CB-CB 4.34Å; D124-A127 WeakPolarHBondContact O-CA 3.3Å; D124-A127 VanDerWaalsContact O-CB 3.29Å; D124-A127 WeakPolarHBondContact O-CB 3.35Å; D124-A127 PolarHBondContact O-N 2.91Å
125	P	85.1	Confident	86.1	Confident	116 Å²	116	58.1 Å²	58.1	75%	0.753	29%	0.289	S	S	*	.	H	α-helix	trans	-55.8	-27.8	177.4	-26.7	33.7	0	0	0	113.5	A128	P125-A128 WeakPolarHBondContact O-CB 3.42Å; P125-A128 PolarHBondContact O-N 2.93Å
126	R	88.5	Confident	85.9	Confident	103 Å²	103	59.8 Å²	59.8	39%	0.389	29%	0.293	S	S	.	.	H	α-helix	trans	-70.7	-31	175.4	-65	176.8	-69.5	161.3	5.7	112.4	M116 I117 K118 V119 D124 A128 L129 H130	M116-R126 WeakPolarHBondContact CE-O 3.47Å; M116-R126 HydrophobicContact SD-CB 4.33Å; I117-R126 PolarHBondContact O-NH1 3.47Å; K118-R126 PolarHBondContact O-NH2 3.33Å; K118-R126 VanDerWaalsContact O-NH2 3.13Å; V119-R126 HydrophobicContact CG2-CB 3.96Å; D124-R126 PolarHBondContact O-N 3.06Å; R126-A128 VanDerWaalsContact C-N 3.29Å; R126-A128 PolarHBondContact O-N 3.44Å; R126-L129 WeakPolarHBondContact O-CB 3.23Å; R126-L129 PolarHBondContact O-N 3.25Å; R126-L129 VanDerWaalsContact O-N 3.14Å; R126-H130 PolarHBondContact O-N 2.92Å; R126-H130 VanDerWaalsContact O-N 3.09Å
127	A	85.3	Confident	85.8	Confident	1 Å²	1	60 Å²	60	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-68.1	-30.5	175.1	0	0	0	0	0	111.9	V119 S122 D124 L129 H130 N131 Y391	V119-A127 HydrophobicContact CG1-CB 4.14Å; S122-A127 WeakPolarHBondContact O-CB 3.43Å; D124-A127 HydrophobicContact CB-CB 4.34Å; D124-A127 WeakPolarHBondContact O-CA 3.3Å; D124-A127 VanDerWaalsContact O-CB 3.29Å; D124-A127 WeakPolarHBondContact O-CB 3.35Å; D124-A127 PolarHBondContact O-N 2.91Å; A127-L129 VanDerWaalsContact C-N 3.29Å; A127-L129 PolarHBondContact O-N 3.43Å; A127-H130 PolarHBondContact O-N 2.84Å; A127-H130 VanDerWaalsContact O-N 3.14Å; A127-N131 WeakPolarHBondContact O-CB 3.4Å; A127-N131 PolarHBondContact O-N 2.96Å; A127-Y391 HydrophobicContact CB-CE2 4Å
128	A	84.6	Confident	85.8	Confident	38 Å²	38	61 Å²	61	31%	0.314	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-36.4	170.3	0	0	0	0	0	112	P125 R126 G132	P125-A128 WeakPolarHBondContact O-CB 3.42Å; P125-A128 PolarHBondContact O-N 2.93Å; R126-A128 VanDerWaalsContact C-N 3.29Å; R126-A128 PolarHBondContact O-N 3.44Å; A128-G132 WeakPolarHBondContact O-CA 3.43Å; A128-G132 PolarHBondContact O-N 3.18Å
129	L	87.6	Confident	86	Confident	61 Å²	61	56 Å²	56	32%	0.319	28%	0.28	S	S	.	.	H	α-helix	trans	-66.9	-38.2	171.7	-176.3	69	0	0	0	111.5	F112 L115 M116 R126 A127 F133 K137	F112-L129 HydrophobicContact CE1-CD2 4.44Å; F112-L129 HydrophobicContact CE1-CG 4.24Å; F112-L129 HydrophobicContact CZ-CG 4.43Å; L115-L129 HydrophobicContact CD1-CD2 4.44Å; M116-L129 HydrophobicContact CE-CB 4.12Å; M116-L129 HydrophobicContact CE-CD2 3.92Å; M116-L129 HydrophobicContact CE-CG 4.13Å; R126-L129 WeakPolarHBondContact O-CB 3.23Å; R126-L129 PolarHBondContact O-N 3.25Å; R126-L129 VanDerWaalsContact O-N 3.14Å; A127-L129 VanDerWaalsContact C-N 3.29Å; A127-L129 PolarHBondContact O-N 3.43Å; L129-F133 HydrophobicContact CD1-CD2 4.49Å; L129-K137 WeakPolarHBondContact O-CE 3.12Å; L129-K137 PolarHBondContact O-NZ 3.48Å
130	H	88.6	Confident	86.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-45.6	177.2	-178.6	68	0	0	0	113	Y42 M116 R126 A127 K137 Y389 Y391 H395	Y42-H130 AromaticContact CE2-CE1 3.63Å; Y42-H130 AromaticContact CE2-ND1 3.62Å; Y42-H130 WeakPolarHBondContact CE2-O 3.24Å; Y42-H130 PolarHBondContact OH-O 3.15Å; M116-H130 HydrophobicContact CE-CB 4.08Å; M116-H130 HydrophobicContact SD-CB 3.96Å; R126-H130 PolarHBondContact O-N 2.92Å; R126-H130 VanDerWaalsContact O-N 3.09Å; A127-H130 PolarHBondContact O-N 2.84Å; A127-H130 VanDerWaalsContact O-N 3.14Å; H130-K137 PolarHBondContact O-NZ 3.47Å; H130-Y389 AromaticContact NE2-CZ 3.86Å; H130-Y389 PolarHBondContact NE2-OH 3.39Å; H130-Y391 HydrophobicContact CB-CD2 4.15Å; H130-Y391 HydrophobicContact CB-CE2 4.27Å; H130-Y391 AromaticContact CD2-CD1 3.91Å; H130-Y391 AromaticContact CD2-CD2 3.7Å; H130-Y391 AromaticContact CD2-CE1 3.84Å; H130-Y391 AromaticContact CD2-CE2 3.66Å; H130-Y391 AromaticContact CD2-CG 3.84Å; H130-Y391 AromaticContact CD2-CZ 3.73Å; H130-Y391 AromaticContact CG-CD2 3.88Å; H130-Y391 AromaticContact NE2-CD1 3.7Å; H130-Y391 AromaticContact NE2-CE1 3.89Å; H130-Y391 AromaticContact NE2-CG 3.86Å; H130-H395 AromaticContact CE1-CE1 3.94Å; H130-H395 AromaticContact CE1-NE2 3.21Å; H130-H395 PolarHBondContact CE1-NE2 3.39Å; H130-H395 AromaticContact ND1-CD2 3.92Å; H130-H395 AromaticContact ND1-CE1 3.86Å; H130-H395 AromaticContact ND1-NE2 2.95Å; H130-H395 PolarHBondContact ND1-NE2 3.38Å
131	N	85.3	Confident	86.7	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.032	27%	0.269	C	S	.	.	H	α-helix	trans	-88.8	-15.7	-173.7	-69.8	-36.6	0	0	0	114.4	P22 T38 A127 W134	P22-N131 HydrophobicContact CB-CB 4.3Å; T38-N131 WeakPolarHBondContact CB-OD1 3.48Å; T38-N131 WeakPolarHBondContact CG2-OD1 3.2Å; T38-N131 PolarHBondContact OG1-OD1 3.07Å; A127-N131 WeakPolarHBondContact O-CB 3.4Å; A127-N131 PolarHBondContact O-N 2.96Å; N131-W134 PolarHBondContact O-NE1 3.4Å
132	G	83.1	Confident	87.2	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.01	29%	0.285	C	S	.	.	S	Bend	trans	-127.6	-160.1	-175.6	0	0	0	0	0	114.7	A128 W134 K137	A128-G132 WeakPolarHBondContact O-CA 3.43Å; A128-G132 PolarHBondContact O-N 3.18Å; G132-W134 VanDerWaalsContact C-N 3.3Å; G132-W134 PolarHBondContact O-N 3.35Å; G132-K137 WeakPolarHBondContact O-CE 3.1Å; G132-K137 PolarHBondContact O-NZ 2.9Å
133	F	85.4	Confident	87.8	Confident	62 Å²	62	56.1 Å²	56.1	27%	0.272	30%	0.301	S	S	.	.			trans	51.7	38.5	173.5	-60.8	-75.2	0	0	0	115.9	G19 L129 F135 F136 K137	G19-F133 PolarHBondContact O-N 3.04Å; L129-F133 HydrophobicContact CD1-CD2 4.49Å; F133-F135 VanDerWaalsContact C-N 3.33Å; F133-F135 PolarHBondContact O-N 3.5Å; F133-F136 HydrophobicContact CB-CD2 4.24Å; F133-F136 AromaticContact CD1-CD2 3.89Å; F133-F136 HydrophobicContact CD1-CD2 3.89Å; F133-F136 HydrophobicContact CD1-CE2 4.14Å; F133-F136 PolarHBondContact O-N 3.24Å; F133-K137 WeakPolarHBondContact O-CG 3.26Å; F133-K137 PolarHBondContact O-N 2.81Å
134	W	85.6	Confident	88.4	Confident	20 Å²	20	51.9 Å²	51.9	8%	0.076	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-37.2	-174.7	-65.7	106	0	0	0	114.5	L17 C23 T38 I41 Y42 N131 G132 K137 F138	L17-W134 HydrophobicContact CD2-CB 3.89Å; L17-W134 PolarHBondContact O-N 3.48Å; L17-W134 VanDerWaalsContact O-N 3.16Å; C23-W134 PolarHBondContact SG-NE1 3.18Å; T38-W134 HydrophobicContact CG2-CH2 4.03Å; T38-W134 HydrophobicContact CG2-CZ2 4.08Å; I41-W134 HydrophobicContact CB-CH2 3.58Å; I41-W134 HydrophobicContact CB-CZ2 3.86Å; I41-W134 HydrophobicContact CB-CZ3 3.97Å; I41-W134 HydrophobicContact CD1-CH2 4.27Å; I41-W134 HydrophobicContact CD1-CZ2 3.62Å; I41-W134 HydrophobicContact CG1-CZ2 4.36Å; I41-W134 HydrophobicContact CG2-CD2 3.84Å; I41-W134 HydrophobicContact CG2-CE3 3.5Å; I41-W134 VanDerWaalsContact CG2-CE3 3.5Å; I41-W134 HydrophobicContact CG2-CH2 3.43Å; I41-W134 VanDerWaalsContact CG2-CH2 3.43Å; I41-W134 HydrophobicContact CG2-CZ2 3.78Å; I41-W134 HydrophobicContact CG2-CZ3 3.3Å; Y42-W134 HydrophobicContact CD1-CH2 4.46Å; Y42-W134 HydrophobicContact CD1-CZ3 4.04Å; Y42-W134 AromaticContact CD2-CH2 3.69Å; Y42-W134 HydrophobicContact CD2-CH2 3.69Å; Y42-W134 HydrophobicContact CD2-CZ3 4.1Å; Y42-W134 HydrophobicContact CE1-CH2 4.37Å; Y42-W134 AromaticContact CE1-CZ3 3.89Å; Y42-W134 HydrophobicContact CE1-CZ3 3.89Å; Y42-W134 AromaticContact CE2-CH2 3.55Å; Y42-W134 HydrophobicContact CE2-CH2 3.55Å; Y42-W134 AromaticContact CE2-CZ3 3.92Å; Y42-W134 HydrophobicContact CE2-CZ3 3.92Å; Y42-W134 HydrophobicContact CG-CH2 4.15Å; Y42-W134 HydrophobicContact CG-CZ3 4.16Å; Y42-W134 AromaticContact CZ-CH2 3.93Å; Y42-W134 AromaticContact CZ-CZ3 3.82Å; N131-W134 PolarHBondContact O-NE1 3.4Å; G132-W134 VanDerWaalsContact C-N 3.3Å; G132-W134 PolarHBondContact O-N 3.35Å; W134-K137 HydrophobicContact CE3-CD 3.87Å; W134-K137 HydrophobicContact CZ3-CD 4.16Å; W134-K137 WeakPolarHBondContact O-CB 3.48Å; W134-K137 PolarHBondContact O-N 2.66Å; W134-F138 PolarHBondContact O-N 3.34Å
135	F	86.1	Confident	88.7	Confident	97 Å²	97	50.7 Å²	50.7	43%	0.425	28%	0.277	S	S	.	.	H	α-helix	trans	-60.1	-49.4	176.7	177.3	-101.5	0	0	0	111.7	L17 C18 F133 K137 F138 V139	L17-F135 HydrophobicContact CB-CB 4.11Å; L17-F135 VanDerWaalsContact O-CB 3.28Å; L17-F135 WeakPolarHBondContact O-CB 3.19Å; L17-F135 PolarHBondContact O-N 3.26Å; C18-F135 VanDerWaalsContact SG-CB 3.57Å; C18-F135 VanDerWaalsContact SG-CG 3.54Å; F133-F135 VanDerWaalsContact C-N 3.33Å; F133-F135 PolarHBondContact O-N 3.5Å; F135-K137 VanDerWaalsContact C-N 3.3Å; F135-K137 PolarHBondContact O-N 3.13Å; F135-F138 PolarHBondContact O-N 3.27Å; F135-V139 HydrophobicContact CD1-CG2 4.35Å; F135-V139 HydrophobicContact CE1-CG2 3.91Å; F135-V139 HydrophobicContact CE2-CG2 4.17Å; F135-V139 HydrophobicContact CZ-CG2 3.81Å; F135-V139 WeakPolarHBondContact O-CG2 3.38Å; F135-V139 PolarHBondContact O-N 2.87Å
136	F	88.8	Confident	89	Confident	116 Å²	116	48.8 Å²	48.8	51%	0.509	26%	0.263	S	S	.	.	H	α-helix	trans	-64.8	-36	-179.8	-65.4	-72.9	0	0	0	111.8	F133 V139 A140	F133-F136 HydrophobicContact CB-CD2 4.24Å; F133-F136 AromaticContact CD1-CD2 3.89Å; F133-F136 HydrophobicContact CD1-CD2 3.89Å; F133-F136 HydrophobicContact CD1-CE2 4.14Å; F133-F136 PolarHBondContact O-N 3.24Å; F136-V139 PolarHBondContact O-N 2.95Å; F136-A140 VanDerWaalsContact O-CB 3.28Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.81Å
137	K	90.4	Very high	89.1	Confident	8 Å²	8	45.6 Å²	45.6	4%	0.035	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-46.1	172.6	-68	174.7	-173.9	167	0	112	Y42 F108 F112 L129 H130 G132 F133 W134 F135 A140 A141	Y42-K137 HydrophobicContact CE1-CD 4.32Å; Y42-K137 WeakPolarHBondContact OH-CE 3.49Å; Y42-K137 PolarHBondContact OH-NZ 2.96Å; F108-K137 HydrophobicContact CE2-CB 4.37Å; F108-K137 HydrophobicContact CZ-CB 4.12Å; F112-K137 HydrophobicContact CE1-CD 4.33Å; F112-K137 HydrophobicContact CE1-CG 4.45Å; F112-K137 HydrophobicContact CE2-CG 4.43Å; F112-K137 HydrophobicContact CZ-CD 4.1Å; F112-K137 HydrophobicContact CZ-CG 3.75Å; L129-K137 WeakPolarHBondContact O-CE 3.12Å; L129-K137 PolarHBondContact O-NZ 3.48Å; H130-K137 PolarHBondContact O-NZ 3.47Å; G132-K137 WeakPolarHBondContact O-CE 3.1Å; G132-K137 PolarHBondContact O-NZ 2.9Å; F133-K137 WeakPolarHBondContact O-CG 3.26Å; F133-K137 PolarHBondContact O-N 2.81Å; W134-K137 HydrophobicContact CE3-CD 3.87Å; W134-K137 HydrophobicContact CZ3-CD 4.16Å; W134-K137 WeakPolarHBondContact O-CB 3.48Å; W134-K137 PolarHBondContact O-N 2.66Å; F135-K137 VanDerWaalsContact C-N 3.3Å; F135-K137 PolarHBondContact O-N 3.13Å; K137-A140 PolarHBondContact O-N 3.34Å; K137-A141 WeakPolarHBondContact O-CB 3.47Å; K137-A141 PolarHBondContact O-N 3.3Å
138	F	89	Confident	89.3	Confident	97 Å²	97	45.7 Å²	45.7	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-46.1	178.9	-174.5	-94.8	0	0	0	111.4	F45 L48 W134 F135 A140 A141 L142	F45-F138 HydrophobicContact CD2-CD2 4.4Å; F45-F138 AromaticContact CE2-CD2 3.75Å; F45-F138 HydrophobicContact CE2-CD2 3.75Å; F45-F138 HydrophobicContact CE2-CE2 4.19Å; L48-F138 HydrophobicContact CD2-CE2 3.98Å; W134-F138 PolarHBondContact O-N 3.34Å; F135-F138 PolarHBondContact O-N 3.27Å; F138-A140 PolarHBondContact O-N 2.87Å; F138-A141 PolarHBondContact O-N 3.44Å; F138-L142 HydrophobicContact CE1-CD2 4.41Å; F138-L142 VanDerWaalsContact O-CB 3.31Å; F138-L142 WeakPolarHBondContact O-CB 3.39Å; F138-L142 PolarHBondContact O-N 3.17Å
139	V	91.5	Very high	89.4	Confident	72 Å²	72	45.8 Å²	45.8	44%	0.436	26%	0.256	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.2	173.1	0	0	0	0	111.2	F135 F136 L142 G143	F135-V139 HydrophobicContact CD1-CG2 4.35Å; F135-V139 HydrophobicContact CE1-CG2 3.91Å; F135-V139 HydrophobicContact CE2-CG2 4.17Å; F135-V139 HydrophobicContact CZ-CG2 3.81Å; F135-V139 WeakPolarHBondContact O-CG2 3.38Å; F135-V139 PolarHBondContact O-N 2.87Å; F136-V139 PolarHBondContact O-N 2.95Å; V139-L142 PolarHBondContact O-N 3.05Å; V139-G143 PolarHBondContact O-N 2.99Å
140	A	92.6	Very high	89.4	Confident	48 Å²	48	50.8 Å²	50.8	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-47.4	178.6	0	0	0	0	0	111.7	F136 K137 F138 G143 I144	F136-A140 VanDerWaalsContact O-CB 3.28Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.81Å; K137-A140 PolarHBondContact O-N 3.34Å; F138-A140 PolarHBondContact O-N 2.87Å; A140-G143 PolarHBondContact O-N 3.18Å; A140-I144 VanDerWaalsContact O-CG1 3.29Å; A140-I144 WeakPolarHBondContact O-CG1 3.16Å; A140-I144 PolarHBondContact O-N 3.45Å
141	A	92.1	Very high	89.1	Confident	5 Å²	5	53.6 Å²	53.6	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-39.7	178.6	0	0	0	0	0	113.1	F45 F108 K137 F138 G143 I144 T145	F45-A141 HydrophobicContact CE1-CB 3.83Å; F45-A141 HydrophobicContact CE2-CB 4.49Å; F45-A141 HydrophobicContact CZ-CB 3.34Å; F108-A141 HydrophobicContact CB-CB 4.39Å; F108-A141 HydrophobicContact CD1-CB 4.49Å; F108-A141 HydrophobicContact CD2-CB 3.55Å; F108-A141 HydrophobicContact CE2-CB 3.87Å; F108-A141 HydrophobicContact CG-CB 3.88Å; F108-A141 HydrophobicContact CZ-CB 4.5Å; K137-A141 WeakPolarHBondContact O-CB 3.47Å; K137-A141 PolarHBondContact O-N 3.3Å; F138-A141 PolarHBondContact O-N 3.44Å; A141-G143 VanDerWaalsContact C-N 3.33Å; A141-I144 PolarHBondContact O-N 3.25Å; A141-T145 WeakPolarHBondContact O-CB 3.35Å; A141-T145 PolarHBondContact O-N 3.07Å; A141-T145 PolarHBondContact O-OG1 3.3Å
142	L	92	Very high	88.6	Confident	91 Å²	91	58.3 Å²	58.3	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-43.3	173.3	-178.2	63.5	0	0	0	110.5	F138 V139 T145 V146	F138-L142 HydrophobicContact CE1-CD2 4.41Å; F138-L142 VanDerWaalsContact O-CB 3.31Å; F138-L142 WeakPolarHBondContact O-CB 3.39Å; F138-L142 PolarHBondContact O-N 3.17Å; V139-L142 PolarHBondContact O-N 3.05Å; L142-T145 PolarHBondContact O-N 3.24Å; L142-V146 HydrophobicContact CD1-CG2 4.18Å; L142-V146 HydrophobicContact CG-CG2 4.39Å; L142-V146 WeakPolarHBondContact O-CB 3.4Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.26Å; L142-V146 PolarHBondContact O-N 2.97Å
143	G	94.4	Very high	87.9	Confident	46 Å²	46	60.7 Å²	60.7	47%	0.474	33%	0.334	S	S	.	.	H	α-helix	trans	-60.2	-45.9	175.6	0	0	0	0	0	112.9	V139 A140 A141 T145 V146 G147	V139-G143 PolarHBondContact O-N 2.99Å; A140-G143 PolarHBondContact O-N 3.18Å; A141-G143 VanDerWaalsContact C-N 3.33Å; G143-T145 VanDerWaalsContact C-N 3.33Å; G143-T145 PolarHBondContact O-N 2.88Å; G143-V146 PolarHBondContact O-N 3.39Å; G143-G147 PolarHBondContact O-N 3.39Å
144	I	94.8	Very high	87.1	Confident	54 Å²	54	59.7 Å²	59.7	28%	0.277	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-42.2	175.5	-66.1	165.2	0	0	0	110.6	M107 F108 A140 A141 G147 S148	M107-I144 HydrophobicContact CB-CG2 4.04Å; F108-I144 HydrophobicContact CB-CD1 4.26Å; F108-I144 HydrophobicContact CD2-CD1 4.34Å; A140-I144 VanDerWaalsContact O-CG1 3.29Å; A140-I144 WeakPolarHBondContact O-CG1 3.16Å; A140-I144 PolarHBondContact O-N 3.45Å; A141-I144 PolarHBondContact O-N 3.25Å; I144-G147 PolarHBondContact O-N 3.26Å; I144-S148 PolarHBondContact O-N 2.87Å
145	T	92	Very high	86.7	Confident	23 Å²	23	63.7 Å²	63.7	14%	0.141	37%	0.37	C	S	.	.	H	α-helix	trans	-67	-45.5	179.6	-58.6	0	0	0	0	111.8	V101 A141 L142 G143 G147 S148 F149	V101-T145 HydrophobicContact CB-CG2 4.46Å; V101-T145 HydrophobicContact CG1-CG2 4.42Å; V101-T145 HydrophobicContact CG2-CG2 4.22Å; A141-T145 WeakPolarHBondContact O-CB 3.35Å; A141-T145 PolarHBondContact O-N 3.07Å; A141-T145 PolarHBondContact O-OG1 3.3Å; L142-T145 PolarHBondContact O-N 3.24Å; G143-T145 VanDerWaalsContact C-N 3.33Å; G143-T145 PolarHBondContact O-N 2.88Å; T145-G147 VanDerWaalsContact C-N 3.31Å; T145-G147 PolarHBondContact O-N 3.43Å; T145-S148 PolarHBondContact O-N 3.27Å; T145-S148 PolarHBondContact O-OG 3Å; T145-F149 HydrophobicContact CG2-CE2 4.41Å; T145-F149 VanDerWaalsContact O-CD2 3.24Å; T145-F149 WeakPolarHBondContact O-CD2 3.34Å
146	V	91.1	Very high	86.6	Confident	76 Å²	76	60.4 Å²	60.4	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-40.2	174.8	170.1	0	0	0	0	110.4	L142 G143 S148 F149 F150	L142-V146 HydrophobicContact CD1-CG2 4.18Å; L142-V146 HydrophobicContact CG-CG2 4.39Å; L142-V146 WeakPolarHBondContact O-CB 3.4Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.26Å; L142-V146 PolarHBondContact O-N 2.97Å; G143-V146 PolarHBondContact O-N 3.39Å; V146-S148 PolarHBondContact O-N 3.4Å; V146-F149 PolarHBondContact O-N 3.09Å; V146-F150 HydrophobicContact CG1-CE2 4.05Å; V146-F150 VanDerWaalsContact O-CD2 3.32Å; V146-F150 WeakPolarHBondContact O-CD2 3.23Å
147	G	91	Very high	86.1	Confident	36 Å²	36	54.9 Å²	54.9	37%	0.371	33%	0.331	S	S	.	.	H	α-helix	trans	-57.3	-34.5	174.8	0	0	0	0	0	113.4	G143 I144 T145 F149 F150	G143-G147 PolarHBondContact O-N 3.39Å; I144-G147 PolarHBondContact O-N 3.26Å; T145-G147 VanDerWaalsContact C-N 3.31Å; T145-G147 PolarHBondContact O-N 3.43Å; G147-F149 VanDerWaalsContact C-N 3.26Å; G147-F149 PolarHBondContact O-N 3.46Å; G147-F150 PolarHBondContact O-N 3.33Å
148	S	90.5	Very high	85.8	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.014	34%	0.341	C	S	.	.	H	α-helix	trans	-67.9	-24.7	-179.3	79.6	0	0	0	0	113.5	R100 I144 T145 V146 F150 I151	R100-S148 WeakPolarHBondContact CB-OG 3.47Å; R100-S148 WeakPolarHBondContact CD-O 3.45Å; R100-S148 PolarHBondContact O-OG 2.82Å; I144-S148 PolarHBondContact O-N 2.87Å; T145-S148 PolarHBondContact O-N 3.27Å; T145-S148 PolarHBondContact O-OG 3Å; V146-S148 PolarHBondContact O-N 3.4Å; S148-F150 PolarHBondContact O-N 2.89Å; S148-I151 WeakPolarHBondContact O-CB 3.49Å; S148-I151 PolarHBondContact O-N 2.66Å
149	F	86.8	Confident	85.8	Confident	40 Å²	40	55.7 Å²	55.7	18%	0.175	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.7	175.5	-76.2	-94.6	0	0	0	113.2	M56 I68 F71 R100 V101 T145 V146 G147 I151	M56-F149 HydrophobicContact CE-CZ 4.06Å; M56-F149 HydrophobicContact SD-CZ 4.28Å; I68-F149 HydrophobicContact CD1-CD1 4.31Å; I68-F149 HydrophobicContact CD1-CE1 4.29Å; F71-F149 HydrophobicContact CE1-CE1 4.39Å; F71-F149 AromaticContact CE2-CD1 3.77Å; F71-F149 HydrophobicContact CE2-CD1 3.77Å; F71-F149 HydrophobicContact CE2-CE1 4.26Å; F71-F149 AromaticContact CZ-CD1 3.6Å; F71-F149 HydrophobicContact CZ-CD1 3.6Å; F71-F149 AromaticContact CZ-CE1 3.63Å; F71-F149 HydrophobicContact CZ-CE1 3.63Å; R100-F149 HydrophobicContact CB-CD1 4.32Å; R100-F149 HydrophobicContact CB-CD2 4.18Å; R100-F149 HydrophobicContact CB-CE1 4.14Å; R100-F149 HydrophobicContact CB-CE2 3.98Å; R100-F149 HydrophobicContact CB-CG 4.33Å; R100-F149 HydrophobicContact CB-CZ 3.96Å; R100-F149 HydrophobicContact CG-CD1 4.28Å; R100-F149 HydrophobicContact CG-CE1 4.38Å; R100-F149 HydrophobicContact CG-CG 4.5Å; V101-F149 HydrophobicContact CG2-CE2 4.05Å; V101-F149 HydrophobicContact CG2-CZ 3.91Å; T145-F149 HydrophobicContact CG2-CE2 4.41Å; T145-F149 VanDerWaalsContact O-CD2 3.24Å; T145-F149 WeakPolarHBondContact O-CD2 3.34Å; V146-F149 PolarHBondContact O-N 3.09Å; G147-F149 VanDerWaalsContact C-N 3.26Å; G147-F149 PolarHBondContact O-N 3.46Å; F149-I151 VanDerWaalsContact C-N 3.34Å
150	F	86	Confident	85.7	Confident	166 Å²	166	53.4 Å²	53.4	73%	0.728	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.7	177.8	-65.4	-82.5	0	0	0	113.8	V146 G147 S148	V146-F150 HydrophobicContact CG1-CE2 4.05Å; V146-F150 VanDerWaalsContact O-CD2 3.32Å; V146-F150 WeakPolarHBondContact O-CD2 3.23Å; G147-F150 PolarHBondContact O-N 3.33Å; S148-F150 PolarHBondContact O-N 2.89Å
151	I	83.5	Confident	85.6	Confident	60 Å²	60	51.2 Å²	51.2	31%	0.308	31%	0.31	S	S	.	.	S	Bend	trans	-76.8	125.4	179.6	-62	169.3	0	0	0	109.2	R100 F103 S148 F149 F156	R100-I151 VanDerWaalsContact CZ-O 3.26Å; R100-I151 VanDerWaalsContact NH1-CG2 3.3Å; R100-I151 PolarHBondContact NH1-O 3.48Å; R100-I151 PolarHBondContact NH2-O 3.38Å; F103-I151 HydrophobicContact CD1-CD1 4.34Å; F103-I151 HydrophobicContact CE1-CD1 3.79Å; F103-I151 HydrophobicContact CZ-CD1 4.17Å; S148-I151 WeakPolarHBondContact O-CB 3.49Å; S148-I151 PolarHBondContact O-N 2.66Å; F149-I151 VanDerWaalsContact C-N 3.34Å; I151-F156 HydrophobicContact CD1-CE2 4.09Å; I151-F156 HydrophobicContact CG2-CB 4.5Å; I151-F156 HydrophobicContact CG2-CD2 3.77Å; I151-F156 HydrophobicContact CG2-CE2 4.2Å; I151-F156 HydrophobicContact CG2-CG 4.13Å
152	S	74	Confident	85.5	Confident	105 Å²	105	57.3 Å²	57.3	73%	0.734	33%	0.332	S	S	*	.			trans	-59.3	150.6	178.6	-52	0	0	0	0	113.5	G154	S152-G154 PolarHBondContact O-N 3.2Å
153	E	67.9	Low	85.6	Confident	50 Å²	50	56.2 Å²	56.2	23%	0.234	33%	0.327	C	S	.	.	S	Bend	trans	-71.6	-20.8	-166.2	-62.1	-150.8	137.9	0	0	116.3	K96 Y419	K96-E153 WeakPolarHBondContact CD-OE1 3.3Å; K96-E153 WeakPolarHBondContact CE-OE1 3.41Å; K96-E153 IonicContact NZ-OE1 2.66Å; K96-E153 PolarHBondContact NZ-OE1 3.44Å; K96-E153 IonicContact NZ-OE2 3.05Å; K96-E153 PolarHBondContact NZ-OE2 3.23Å; E153-Y419 HydrophobicContact CB-CE2 4.34Å
154	G	68.8	Low	85.6	Confident	42 Å²	42	54 Å²	54	43%	0.433	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.4	-112	-165.5	0	0	0	0	0	118.2	S152 F156	S152-G154 PolarHBondContact O-N 3.2Å; G154-F156 PolarHBondContact O-N 2.93Å
155	P	78	Confident	85.5	Confident	103 Å²	103	52 Å²	52	67%	0.669	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.1	-178.4	31.5	-35.3	0	0	0	113.4	A157 T158 V159	P155-A157 PolarHBondContact O-N 3.29Å; P155-T158 PolarHBondContact O-N 3.03Å; P155-V159 HydrophobicContact CB-CG2 4.42Å; P155-V159 WeakPolarHBondContact O-CB 3.13Å; P155-V159 VanDerWaalsContact O-CG2 3.29Å; P155-V159 WeakPolarHBondContact O-CG2 3.39Å; P155-V159 PolarHBondContact O-N 2.82Å
156	F	83.4	Confident	85.7	Confident	29 Å²	29	53.7 Å²	53.7	13%	0.127	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-47.8	-172.2	176.4	-93.6	0	0	0	112	F103 I151 G154 T158 W160	F103-F156 HydrophobicContact CB-CZ 4.18Å; F103-F156 AromaticContact CD2-CE2 3.85Å; F103-F156 HydrophobicContact CD2-CE2 3.85Å; F103-F156 AromaticContact CD2-CZ 3.73Å; F103-F156 HydrophobicContact CD2-CZ 3.73Å; F103-F156 AromaticContact CE2-CE2 3.91Å; F103-F156 HydrophobicContact CE2-CE2 3.91Å; F103-F156 HydrophobicContact CE2-CZ 4.26Å; F103-F156 HydrophobicContact CG-CE2 4.33Å; F103-F156 AromaticContact CG-CZ 3.88Å; F103-F156 HydrophobicContact CG-CZ 3.88Å; F103-F156 HydrophobicContact CZ-CE2 4.39Å; I151-F156 HydrophobicContact CD1-CE2 4.09Å; I151-F156 HydrophobicContact CG2-CB 4.5Å; I151-F156 HydrophobicContact CG2-CD2 3.77Å; I151-F156 HydrophobicContact CG2-CE2 4.2Å; I151-F156 HydrophobicContact CG2-CG 4.13Å; G154-F156 PolarHBondContact O-N 2.93Å; F156-T158 PolarHBondContact O-N 2.67Å; F156-W160 HydrophobicContact CZ-CG 4.45Å; F156-W160 WeakPolarHBondContact O-CB 2.91Å; F156-W160 PolarHBondContact O-N 2.76Å
157	A	79.2	Confident	85.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-52.9	-53.5	179.7	0	0	0	0	0	112.8	P155 W160 F161 P415 Y419	P155-A157 PolarHBondContact O-N 3.29Å; A157-W160 PolarHBondContact O-N 2.83Å; A157-F161 VanDerWaalsContact O-CB 3.25Å; A157-F161 WeakPolarHBondContact O-CB 3.18Å; A157-F161 PolarHBondContact O-N 2.84Å; A157-P415 HydrophobicContact CB-CB 3.89Å; A157-P415 HydrophobicContact CB-CG 3.65Å; A157-Y419 WeakPolarHBondContact CA-OH 3.14Å; A157-Y419 HydrophobicContact CB-CD1 4.35Å; A157-Y419 HydrophobicContact CB-CD2 4.31Å; A157-Y419 HydrophobicContact CB-CE1 3.49Å; A157-Y419 VanDerWaalsContact CB-CE1 3.49Å; A157-Y419 HydrophobicContact CB-CE2 3.45Å; A157-Y419 VanDerWaalsContact CB-CE2 3.45Å; A157-Y419 WeakPolarHBondContact CB-OH 3.23Å
158	T	83.1	Confident	86.1	Confident	40 Å²	40	48.6 Å²	48.6	25%	0.245	27%	0.272	C	S	.	.	H	α-helix	trans	-72.4	-44.9	-169.1	-53.4	0	0	0	0	109.3	P155 F156 W160 F161 Y162	P155-T158 PolarHBondContact O-N 3.03Å; F156-T158 PolarHBondContact O-N 2.67Å; T158-W160 VanDerWaalsContact C-N 3.34Å; T158-W160 PolarHBondContact O-N 3.25Å; T158-F161 WeakPolarHBondContact O-CB 3.43Å; T158-F161 PolarHBondContact O-N 3.33Å; T158-Y162 HydrophobicContact CG2-CD2 4.27Å; T158-Y162 HydrophobicContact CG2-CE2 3.75Å; T158-Y162 WeakPolarHBondContact O-CD2 3.43Å; T158-Y162 PolarHBondContact O-N 3.34Å
159	V	88.4	Confident	86.2	Confident	81 Å²	81	51 Å²	51	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-46.8	175.4	173.4	0	0	0	0	110.5	P155 F161 Y162 I163	P155-V159 HydrophobicContact CB-CG2 4.42Å; P155-V159 WeakPolarHBondContact O-CB 3.13Å; P155-V159 VanDerWaalsContact O-CG2 3.29Å; P155-V159 WeakPolarHBondContact O-CG2 3.39Å; P155-V159 PolarHBondContact O-N 2.82Å; V159-F161 VanDerWaalsContact C-N 3.32Å; V159-F161 PolarHBondContact O-N 3.49Å; V159-Y162 PolarHBondContact O-N 3.2Å; V159-I163 HydrophobicContact CG1-CD1 3.86Å; V159-I163 WeakPolarHBondContact O-CG1 3.34Å; V159-I163 PolarHBondContact O-N 3.49Å
160	W	90.1	Very high	86.6	Confident	24 Å²	24	51.6 Å²	51.6	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-73.2	-24.9	-177.8	-155.9	-109.3	0	0	0	113.1	Y99 F103 A106 M107 F156 A157 T158 I163 G164 L403 M406	Y99-W160 HydrophobicContact CD1-CB 4.49Å; Y99-W160 AromaticContact CD1-CD1 3.83Å; F103-W160 HydrophobicContact CB-CZ2 4.46Å; F103-W160 AromaticContact CD2-CD2 3.79Å; F103-W160 HydrophobicContact CD2-CD2 3.79Å; F103-W160 AromaticContact CD2-CE2 3.49Å; F103-W160 VanDerWaalsContact CD2-CE2 3.49Å; F103-W160 HydrophobicContact CD2-CE3 4.01Å; F103-W160 HydrophobicContact CD2-CG 4.49Å; F103-W160 AromaticContact CD2-CH2 3.7Å; F103-W160 HydrophobicContact CD2-CH2 3.7Å; F103-W160 AromaticContact CD2-CZ2 3.45Å; F103-W160 HydrophobicContact CD2-CZ2 3.45Å; F103-W160 VanDerWaalsContact CD2-CZ2 3.45Å; F103-W160 AromaticContact CD2-CZ3 3.98Å; F103-W160 HydrophobicContact CD2-CZ3 3.98Å; F103-W160 AromaticContact CD2-NE1 4Å; F103-W160 HydrophobicContact CE2-CD2 4.38Å; F103-W160 HydrophobicContact CE2-CE3 4.13Å; F103-W160 AromaticContact CE2-CH2 3.83Å; F103-W160 HydrophobicContact CE2-CH2 3.83Å; F103-W160 HydrophobicContact CE2-CZ2 4.08Å; F103-W160 AromaticContact CE2-CZ3 3.86Å; F103-W160 HydrophobicContact CE2-CZ3 3.86Å; F103-W160 HydrophobicContact CG-CZ2 4.34Å; A106-W160 HydrophobicContact CB-CZ2 4.12Å; M107-W160 HydrophobicContact SD-CH2 4.25Å; F156-W160 HydrophobicContact CZ-CG 4.45Å; F156-W160 WeakPolarHBondContact O-CB 2.91Å; F156-W160 PolarHBondContact O-N 2.76Å; A157-W160 PolarHBondContact O-N 2.83Å; T158-W160 VanDerWaalsContact C-N 3.34Å; T158-W160 PolarHBondContact O-N 3.25Å; W160-I163 HydrophobicContact CD2-CG2 4.49Å; W160-I163 HydrophobicContact CE3-CB 4.17Å; W160-I163 HydrophobicContact CE3-CD1 3.64Å; W160-I163 HydrophobicContact CE3-CG2 4.08Å; W160-I163 HydrophobicContact CH2-CG2 4.18Å; W160-I163 HydrophobicContact CZ3-CB 4.45Å; W160-I163 HydrophobicContact CZ3-CD1 3.79Å; W160-I163 HydrophobicContact CZ3-CG2 3.91Å; W160-G164 WeakPolarHBondContact O-CA 3.38Å; W160-G164 PolarHBondContact O-N 3.48Å; W160-L403 HydrophobicContact CH2-CD2 4.44Å; W160-L403 HydrophobicContact CZ2-CD2 3.57Å; W160-M406 VanDerWaalsContact CD1-CE 3.4Å; W160-M406 HydrophobicContact CG-CE 4.38Å; W160-M406 HydrophobicContact CG-SD 4.46Å; W160-M406 PolarHBondContact NE1-SD 3.21Å
161	F	89.6	Confident	87	Confident	3 Å²	3	44 Å²	44	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-47	167.8	171.1	-96.9	0	0	0	111.2	Y99 A157 T158 V159 G164 M165 M407 Y413 P415	Y99-F161 WeakPolarHBondContact OH-CD2 3.41Å; A157-F161 VanDerWaalsContact O-CB 3.25Å; A157-F161 WeakPolarHBondContact O-CB 3.18Å; A157-F161 PolarHBondContact O-N 2.84Å; T158-F161 WeakPolarHBondContact O-CB 3.43Å; T158-F161 PolarHBondContact O-N 3.33Å; V159-F161 VanDerWaalsContact C-N 3.32Å; V159-F161 PolarHBondContact O-N 3.49Å; F161-G164 PolarHBondContact O-N 3.29Å; F161-M165 HydrophobicContact CD1-CE 3.56Å; F161-M165 HydrophobicContact CD1-SD 4.19Å; F161-M165 HydrophobicContact CE1-CE 3.16Å; F161-M165 HydrophobicContact CE1-CG 4.27Å; F161-M165 HydrophobicContact CE1-SD 3.43Å; F161-M165 WeakPolarHBondContact CE1-SD 3.19Å; F161-M165 HydrophobicContact CE2-CG 4.3Å; F161-M165 HydrophobicContact CE2-SD 4.16Å; F161-M165 HydrophobicContact CZ-CE 3.83Å; F161-M165 HydrophobicContact CZ-CG 4.1Å; F161-M165 HydrophobicContact CZ-SD 3.38Å; F161-M165 WeakPolarHBondContact CZ-SD 3.28Å; F161-M165 WeakPolarHBondContact O-CG 3.34Å; F161-M165 PolarHBondContact O-N 2.89Å; F161-M407 HydrophobicContact CD2-CE 3.6Å; F161-M407 HydrophobicContact CD2-SD 4.32Å; F161-M407 HydrophobicContact CE2-CE 3.52Å; F161-M407 HydrophobicContact CZ-CE 4.42Å; F161-Y413 WeakPolarHBondContact CD2-O 2.97Å; F161-Y413 WeakPolarHBondContact CE2-O 3.32Å; F161-P415 HydrophobicContact CB-CG 4.22Å
162	Y	91.4	Very high	87.4	Confident	132 Å²	132	41.4 Å²	41.4	52%	0.518	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-42.3	176.7	-70.7	-70.9	0	0	0	113	T158 V159 G164 M165 A166	T158-Y162 HydrophobicContact CG2-CD2 4.27Å; T158-Y162 HydrophobicContact CG2-CE2 3.75Å; T158-Y162 WeakPolarHBondContact O-CD2 3.43Å; T158-Y162 PolarHBondContact O-N 3.34Å; V159-Y162 PolarHBondContact O-N 3.2Å; Y162-G164 VanDerWaalsContact C-N 3.32Å; Y162-M165 HydrophobicContact CD1-CE 3.23Å; Y162-M165 HydrophobicContact CE1-CE 3.65Å; Y162-M165 HydrophobicContact CG-CE 4.05Å; Y162-M165 PolarHBondContact O-N 3.08Å; Y162-A166 PolarHBondContact O-N 3.06Å
163	I	94.1	Very high	88.3	Confident	69 Å²	69	38.5 Å²	38.5	35%	0.354	22%	0.221	S	C	.	.	H	α-helix	trans	-62.3	-43.3	174.2	-67.6	169.7	0	0	0	110.3	V159 W160 A166 G167 L403	V159-I163 HydrophobicContact CG1-CD1 3.86Å; V159-I163 WeakPolarHBondContact O-CG1 3.34Å; V159-I163 PolarHBondContact O-N 3.49Å; W160-I163 HydrophobicContact CD2-CG2 4.49Å; W160-I163 HydrophobicContact CE3-CB 4.17Å; W160-I163 HydrophobicContact CE3-CD1 3.64Å; W160-I163 HydrophobicContact CE3-CG2 4.08Å; W160-I163 HydrophobicContact CH2-CG2 4.18Å; W160-I163 HydrophobicContact CZ3-CB 4.45Å; W160-I163 HydrophobicContact CZ3-CD1 3.79Å; W160-I163 HydrophobicContact CZ3-CG2 3.91Å; I163-A166 PolarHBondContact O-N 2.82Å; I163-G167 PolarHBondContact O-N 3.03Å; I163-L403 HydrophobicContact CG2-CD1 4.27Å
164	G	94.4	Very high	89.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-47.5	176.3	0	0	0	0	0	112.3	W160 F161 Y162 G167 A168 M407	W160-G164 WeakPolarHBondContact O-CA 3.38Å; W160-G164 PolarHBondContact O-N 3.48Å; F161-G164 PolarHBondContact O-N 3.29Å; Y162-G164 VanDerWaalsContact C-N 3.32Å; G164-G167 PolarHBondContact O-N 3.3Å; G164-A168 WeakPolarHBondContact O-CB 3.44Å; G164-A168 PolarHBondContact O-N 3.13Å; G164-M407 VanDerWaalsContact C-CG 3.46Å; G164-M407 WeakPolarHBondContact O-CG 3.44Å
165	M	92.9	Very high	90.4	Very high	10 Å²	10	36 Å²	36	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-46.6	175.7	-76.3	-168.8	-60.1	0	0	112.2	F161 Y162 A168 F169 M407 W412 P427	F161-M165 HydrophobicContact CD1-CE 3.56Å; F161-M165 HydrophobicContact CD1-SD 4.19Å; F161-M165 HydrophobicContact CE1-CE 3.16Å; F161-M165 HydrophobicContact CE1-CG 4.27Å; F161-M165 HydrophobicContact CE1-SD 3.43Å; F161-M165 WeakPolarHBondContact CE1-SD 3.19Å; F161-M165 HydrophobicContact CE2-CG 4.3Å; F161-M165 HydrophobicContact CE2-SD 4.16Å; F161-M165 HydrophobicContact CZ-CE 3.83Å; F161-M165 HydrophobicContact CZ-CG 4.1Å; F161-M165 HydrophobicContact CZ-SD 3.38Å; F161-M165 WeakPolarHBondContact CZ-SD 3.28Å; F161-M165 WeakPolarHBondContact O-CG 3.34Å; F161-M165 PolarHBondContact O-N 2.89Å; Y162-M165 HydrophobicContact CD1-CE 3.23Å; Y162-M165 HydrophobicContact CE1-CE 3.65Å; Y162-M165 HydrophobicContact CG-CE 4.05Å; Y162-M165 PolarHBondContact O-N 3.08Å; M165-A168 PolarHBondContact O-N 3.04Å; M165-F169 WeakPolarHBondContact O-CB 3.35Å; M165-F169 PolarHBondContact O-N 3.38Å; M165-M407 HydrophobicContact CG-CE 3.47Å; M165-M407 VanDerWaalsContact CG-CE 3.47Å; M165-M407 HydrophobicContact CG-SD 4.37Å; M165-W412 HydrophobicContact CG-CE3 4.3Å; M165-W412 HydrophobicContact CG-CZ3 4.2Å; M165-P427 HydrophobicContact CE-CB 4.41Å; M165-P427 HydrophobicContact SD-CB 4.18Å
166	A	94.8	Very high	90.9	Very high	59 Å²	59	31 Å²	31	49%	0.488	17%	0.167	S	C	.	.	H	α-helix	trans	-63.6	-44.3	178.4	0	0	0	0	0	111.6	Y162 I163 F169 C170	Y162-A166 PolarHBondContact O-N 3.06Å; I163-A166 PolarHBondContact O-N 2.82Å; A166-F169 PolarHBondContact O-N 3.2Å; A166-C170 PolarHBondContact O-N 2.67Å; A166-C170 VanDerWaalsContact O-N 3.1Å; A166-C170 PolarHBondContact O-SG 2.72Å; A166-C170 VanDerWaalsContact O-SG 3.36Å
167	G	95.6	Very high	91.1	Very high	5 Å²	5	31.4 Å²	31.4	5%	0.052	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-40.5	176.7	0	0	0	0	0	113	I163 G164 C170 F171	I163-G167 PolarHBondContact O-N 3.03Å; G164-G167 PolarHBondContact O-N 3.3Å; G167-C170 PolarHBondContact O-N 3.07Å; G167-F171 PolarHBondContact O-N 3.14Å
168	A	94.8	Very high	91.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-40.9	176	0	0	0	0	0	111.7	G164 M165 F171 I172 Y404 M407 W412	G164-A168 WeakPolarHBondContact O-CB 3.44Å; G164-A168 PolarHBondContact O-N 3.13Å; M165-A168 PolarHBondContact O-N 3.04Å; A168-F171 PolarHBondContact O-N 2.82Å; A168-I172 VanDerWaalsContact O-CG1 3.23Å; A168-I172 WeakPolarHBondContact O-CG1 3.35Å; A168-I172 PolarHBondContact O-N 2.93Å; A168-Y404 HydrophobicContact CB-CD2 4.16Å; A168-M407 HydrophobicContact CB-CB 4.25Å; A168-M407 HydrophobicContact CB-CG 3.96Å; A168-W412 HydrophobicContact CB-CH2 3.42Å; A168-W412 VanDerWaalsContact CB-CH2 3.42Å; A168-W412 HydrophobicContact CB-CZ2 3.8Å; A168-W412 HydrophobicContact CB-CZ3 4.27Å
169	F	94.3	Very high	91.9	Very high	52 Å²	52	31.4 Å²	31.4	23%	0.228	17%	0.17	C	C	.	.	H	α-helix	trans	-57.3	-50.9	172	174.6	-108.3	0	0	0	111.3	M165 A166 F171 I172 L173 V431 S435 I438	M165-F169 WeakPolarHBondContact O-CB 3.35Å; M165-F169 PolarHBondContact O-N 3.38Å; A166-F169 PolarHBondContact O-N 3.2Å; F169-F171 VanDerWaalsContact C-N 3.3Å; F169-F171 PolarHBondContact O-N 3.34Å; F169-I172 PolarHBondContact O-N 3.38Å; F169-L173 HydrophobicContact CD1-CD1 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.8Å; F169-L173 HydrophobicContact CE1-CG 4.45Å; F169-L173 HydrophobicContact CE2-CD2 4.4Å; F169-L173 HydrophobicContact CZ-CD1 3.92Å; F169-L173 HydrophobicContact CZ-CD2 4.38Å; F169-L173 HydrophobicContact CZ-CG 4.34Å; F169-L173 WeakPolarHBondContact O-CG 3.36Å; F169-L173 PolarHBondContact O-N 3.01Å; F169-V431 HydrophobicContact CB-CG1 3.82Å; F169-V431 HydrophobicContact CD2-CG1 3.97Å; F169-V431 HydrophobicContact CG-CG1 4.35Å; F169-S435 VanDerWaalsContact CD2-OG 3.23Å; F169-S435 WeakPolarHBondContact CD2-OG 3.43Å; F169-S435 WeakPolarHBondContact CE2-OG 3.31Å; F169-I438 HydrophobicContact CE2-CD1 4.22Å; F169-I438 HydrophobicContact CZ-CD1 3.85Å
170	C	94	Very high	91.8	Very high	54 Å²	54	28 Å²	28	37%	0.365	15%	0.148	S	C	.	.	H	α-helix	trans	-58.9	-41.6	176.5	-67	0	0	0	0	112.2	A166 G167 L173 I174 L400	A166-C170 PolarHBondContact O-N 2.67Å; A166-C170 VanDerWaalsContact O-N 3.1Å; A166-C170 PolarHBondContact O-SG 2.72Å; A166-C170 VanDerWaalsContact O-SG 3.36Å; G167-C170 PolarHBondContact O-N 3.07Å; C170-L173 WeakPolarHBondContact O-CB 3.28Å; C170-L173 PolarHBondContact O-N 3.05Å; C170-I174 WeakPolarHBondContact O-CG1 3.36Å; C170-I174 PolarHBondContact O-N 3.26Å; C170-I174 VanDerWaalsContact O-N 3.1Å; C170-L400 HydrophobicContact CB-CD1 3.88Å; C170-L400 HydrophobicContact CB-CD2 4.1Å
171	F	94.6	Very high	91.6	Very high	7 Å²	7	27.5 Å²	27.5	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-40.2	176.6	-173.7	-100.8	0	0	0	112.4	G167 A168 F169 L173 I174 Q175 F331 L400 A401 Y404	G167-F171 PolarHBondContact O-N 3.14Å; A168-F171 PolarHBondContact O-N 2.82Å; F169-F171 VanDerWaalsContact C-N 3.3Å; F169-F171 PolarHBondContact O-N 3.34Å; F171-L173 VanDerWaalsContact C-N 3.26Å; F171-L173 PolarHBondContact O-N 2.92Å; F171-I174 PolarHBondContact O-N 3.47Å; F171-I174 VanDerWaalsContact O-N 3.15Å; F171-Q175 HydrophobicContact CE1-CB 4.4Å; F171-Q175 WeakPolarHBondContact O-CB 3.46Å; F171-Q175 PolarHBondContact O-N 2.94Å; F171-F331 AromaticContact CE1-CD2 3.75Å; F171-F331 HydrophobicContact CE1-CD2 3.75Å; F171-F331 HydrophobicContact CE1-CE2 4.36Å; F171-F331 AromaticContact CZ-CD2 3.81Å; F171-F331 HydrophobicContact CZ-CD2 3.81Å; F171-F331 HydrophobicContact CZ-CE2 4.11Å; F171-L400 HydrophobicContact CB-CB 4.03Å; F171-L400 HydrophobicContact CD2-CB 4.22Å; F171-A401 VanDerWaalsContact CD2-CA 3.49Å; F171-A401 HydrophobicContact CD2-CB 3.84Å; F171-A401 HydrophobicContact CE2-CB 3.47Å; F171-A401 VanDerWaalsContact CE2-CB 3.47Å; F171-A401 HydrophobicContact CZ-CB 3.96Å; F171-Y404 AromaticContact CD1-CD1 3.79Å; F171-Y404 HydrophobicContact CD1-CD1 3.79Å; F171-Y404 AromaticContact CD1-CD2 3.86Å; F171-Y404 HydrophobicContact CD1-CD2 3.86Å; F171-Y404 AromaticContact CD1-CG 3.42Å; F171-Y404 HydrophobicContact CD1-CG 3.42Å; F171-Y404 VanDerWaalsContact CD1-CG 3.42Å; F171-Y404 AromaticContact CE1-CD1 3.87Å; F171-Y404 HydrophobicContact CE1-CD1 3.87Å; F171-Y404 HydrophobicContact CE1-CE1 4.4Å; F171-Y404 HydrophobicContact CE1-CG 4.01Å; F171-Y404 HydrophobicContact CG-CG 4.25Å
172	I	92.7	Very high	91.5	Very high	4 Å²	4	31 Å²	31	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.2	-41.1	174.6	-69.5	162.8	0	0	0	109.8	A168 F169 I174 Q175 L176 Y404 W412	A168-I172 VanDerWaalsContact O-CG1 3.23Å; A168-I172 WeakPolarHBondContact O-CG1 3.35Å; A168-I172 PolarHBondContact O-N 2.93Å; F169-I172 PolarHBondContact O-N 3.38Å; I172-I174 PolarHBondContact O-N 3.47Å; I172-Q175 PolarHBondContact O-N 2.92Å; I172-L176 HydrophobicContact CG2-CD1 4.06Å; I172-L176 HydrophobicContact CG2-CG 4.32Å; I172-L176 WeakPolarHBondContact O-CB 3.48Å; I172-L176 WeakPolarHBondContact O-CG 3.25Å; I172-L176 PolarHBondContact O-N 2.97Å; I172-Y404 HydrophobicContact CD1-CD2 4.37Å; I172-Y404 HydrophobicContact CD1-CE2 4.14Å; I172-Y404 HydrophobicContact CG1-CD2 3.95Å; I172-Y404 HydrophobicContact CG1-CE2 3.76Å; I172-W412 HydrophobicContact CD1-CH2 4.11Å; I172-W412 HydrophobicContact CD1-CZ2 4.15Å
173	L	91.3	Very high	91.4	Very high	44 Å²	44	24.9 Å²	24.9	23%	0.23	14%	0.139	C	C	.	.	H	α-helix	trans	-62.5	-40.8	175.1	-62.1	-176	0	0	0	112.9	F169 C170 F171 L176 V177 I438	F169-L173 HydrophobicContact CD1-CD1 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.8Å; F169-L173 HydrophobicContact CE1-CG 4.45Å; F169-L173 HydrophobicContact CE2-CD2 4.4Å; F169-L173 HydrophobicContact CZ-CD1 3.92Å; F169-L173 HydrophobicContact CZ-CD2 4.38Å; F169-L173 HydrophobicContact CZ-CG 4.34Å; F169-L173 WeakPolarHBondContact O-CG 3.36Å; F169-L173 PolarHBondContact O-N 3.01Å; C170-L173 WeakPolarHBondContact O-CB 3.28Å; C170-L173 PolarHBondContact O-N 3.05Å; F171-L173 VanDerWaalsContact C-N 3.26Å; F171-L173 PolarHBondContact O-N 2.92Å; L173-L176 HydrophobicContact CD2-CD1 4.19Å; L173-L176 WeakPolarHBondContact O-CB 3.4Å; L173-L176 PolarHBondContact O-N 3.5Å; L173-V177 WeakPolarHBondContact O-CG2 3.34Å; L173-V177 PolarHBondContact O-N 2.62Å; L173-V177 VanDerWaalsContact O-N 3.12Å; L173-I438 HydrophobicContact CD2-CB 4.12Å; L173-I438 HydrophobicContact CD2-CD1 4.02Å; L173-I438 HydrophobicContact CD2-CG2 3.69Å
174	I	89.8	Confident	91	Very high	35 Å²	35	23 Å²	23	18%	0.179	13%	0.129	C	C	.	.	H	α-helix	trans	-66.1	-45.3	175.4	-65.2	172	0	0	0	110.5	C170 F171 I172 L176 V177 L178 M397 L400	C170-I174 WeakPolarHBondContact O-CG1 3.36Å; C170-I174 PolarHBondContact O-N 3.26Å; C170-I174 VanDerWaalsContact O-N 3.1Å; F171-I174 PolarHBondContact O-N 3.47Å; F171-I174 VanDerWaalsContact O-N 3.15Å; I172-I174 PolarHBondContact O-N 3.47Å; I174-L176 PolarHBondContact O-N 3.07Å; I174-V177 PolarHBondContact O-N 2.8Å; I174-L178 HydrophobicContact CG2-CD1 4.01Å; I174-L178 HydrophobicContact CG2-CG 4.49Å; I174-L178 WeakPolarHBondContact O-CG 3.26Å; I174-L178 PolarHBondContact O-N 3.38Å; I174-M397 HydrophobicContact CD1-CG 4.05Å; I174-M397 HydrophobicContact CG2-SD 3.89Å; I174-L400 HydrophobicContact CD1-CD1 3.71Å
175	Q	91.6	Very high	90.6	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.019	14%	0.14	C	C	.	.	H	α-helix	trans	-57.2	-39.2	175.5	178	179.2	83.8	0	0	111.2	F171 I172 L178 L179 Y278 C334	F171-Q175 HydrophobicContact CE1-CB 4.4Å; F171-Q175 WeakPolarHBondContact O-CB 3.46Å; F171-Q175 PolarHBondContact O-N 2.94Å; I172-Q175 PolarHBondContact O-N 2.92Å; Q175-L178 PolarHBondContact O-N 3.24Å; Q175-L179 VanDerWaalsContact O-CB 3.26Å; Q175-L179 WeakPolarHBondContact O-CB 3.16Å; Q175-L179 PolarHBondContact O-N 3.49Å; Q175-Y278 PolarHBondContact OE1-OH 3.47Å; Q175-C334 HydrophobicContact CG-CB 4.15Å
176	L	89.4	Confident	90.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.5	-47.7	177	-81.5	173.7	0	0	0	113.1	I172 L173 I174 L178 L179 I180 Y278 S435 C439	I172-L176 HydrophobicContact CG2-CD1 4.06Å; I172-L176 HydrophobicContact CG2-CG 4.32Å; I172-L176 WeakPolarHBondContact O-CB 3.48Å; I172-L176 WeakPolarHBondContact O-CG 3.25Å; I172-L176 PolarHBondContact O-N 2.97Å; L173-L176 HydrophobicContact CD2-CD1 4.19Å; L173-L176 WeakPolarHBondContact O-CB 3.4Å; L173-L176 PolarHBondContact O-N 3.5Å; I174-L176 PolarHBondContact O-N 3.07Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L176-L178 PolarHBondContact O-N 3.47Å; L176-L179 PolarHBondContact O-N 3.48Å; L176-I180 WeakPolarHBondContact O-CG1 3.38Å; L176-I180 PolarHBondContact O-N 3.19Å; L176-Y278 HydrophobicContact CD2-CD1 3.56Å; L176-Y278 HydrophobicContact CD2-CE1 3.08Å; L176-Y278 HydrophobicContact CG-CE1 4Å; L176-S435 WeakPolarHBondContact CD1-O 3.38Å; L176-C439 HydrophobicContact CD1-CB 3.64Å; L176-C439 HydrophobicContact CD2-CB 3.38Å; L176-C439 WeakPolarHBondContact CD2-SG 3.43Å; L176-C439 HydrophobicContact CG-CB 4.08Å
177	V	87.7	Confident	90.2	Very high	37 Å²	37	25.1 Å²	25.1	22%	0.224	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-46.1	176.5	172.3	0	0	0	0	110.3	L173 I174 L179 I180 D181 L351 L442	L173-V177 WeakPolarHBondContact O-CG2 3.34Å; L173-V177 PolarHBondContact O-N 2.62Å; L173-V177 VanDerWaalsContact O-N 3.12Å; I174-V177 PolarHBondContact O-N 2.8Å; V177-L179 VanDerWaalsContact C-N 3.3Å; V177-L179 PolarHBondContact O-N 2.87Å; V177-I180 PolarHBondContact O-N 3.12Å; V177-D181 WeakPolarHBondContact O-CB 3.33Å; V177-D181 PolarHBondContact O-N 3.35Å; V177-L351 HydrophobicContact CG1-CD2 4.17Å; V177-L351 HydrophobicContact CG2-CD2 4.23Å; V177-L442 HydrophobicContact CG2-CD1 4.22Å
178	L	88.3	Confident	89.8	Confident	16 Å²	16	28.1 Å²	28.1	8%	0.084	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-33.9	178	-69.9	173.9	0	0	0	112.7	I174 Q175 L176 F182 C334 Y337	I174-L178 HydrophobicContact CG2-CD1 4.01Å; I174-L178 HydrophobicContact CG2-CG 4.49Å; I174-L178 WeakPolarHBondContact O-CG 3.26Å; I174-L178 PolarHBondContact O-N 3.38Å; Q175-L178 PolarHBondContact O-N 3.24Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L176-L178 PolarHBondContact O-N 3.47Å; L178-F182 VanDerWaalsContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CB 3.48Å; L178-F182 PolarHBondContact O-N 3.46Å; L178-C334 WeakPolarHBondContact CD1-SG 3.45Å; L178-Y337 HydrophobicContact CB-CD1 4.37Å; L178-Y337 HydrophobicContact CD2-CD1 4.32Å; L178-Y337 HydrophobicContact CD2-CE1 4.42Å
179	L	89	Confident	89.5	Confident	24 Å²	24	30 Å²	30	13%	0.126	16%	0.155	C	C	.	.	H	α-helix	trans	-70.5	-44.6	176.9	-176.7	151.4	0	0	0	112.1	Q175 L176 V177 D181 F182 A183 L274 Y278	Q175-L179 VanDerWaalsContact O-CB 3.26Å; Q175-L179 WeakPolarHBondContact O-CB 3.16Å; Q175-L179 PolarHBondContact O-N 3.49Å; L176-L179 PolarHBondContact O-N 3.48Å; V177-L179 VanDerWaalsContact C-N 3.3Å; V177-L179 PolarHBondContact O-N 2.87Å; L179-D181 VanDerWaalsContact C-N 3.31Å; L179-F182 PolarHBondContact O-N 2.88Å; L179-A183 WeakPolarHBondContact O-CB 3.34Å; L179-A183 PolarHBondContact O-N 3.02Å; L179-L274 HydrophobicContact CD2-CD2 3.82Å; L179-L274 HydrophobicContact CD2-CG 4.35Å; L179-L274 HydrophobicContact CG-CD2 4.18Å; L179-Y278 HydrophobicContact CD1-CD1 4.48Å; L179-Y278 HydrophobicContact CD1-CD2 3.3Å; L179-Y278 HydrophobicContact CD1-CE2 3.74Å; L179-Y278 HydrophobicContact CD1-CG 3.7Å
180	I	87.4	Confident	89.3	Confident	8 Å²	8	29.7 Å²	29.7	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-60.8	-46.4	176.5	-71.9	167	0	0	0	109.8	L176 V177 A183 H184 V275 L442 Y443 T446	L176-I180 WeakPolarHBondContact O-CG1 3.38Å; L176-I180 PolarHBondContact O-N 3.19Å; V177-I180 PolarHBondContact O-N 3.12Å; I180-A183 VanDerWaalsContact O-CB 3.32Å; I180-A183 WeakPolarHBondContact O-CB 3.35Å; I180-A183 PolarHBondContact O-N 3.34Å; I180-A183 VanDerWaalsContact O-N 3.13Å; I180-H184 PolarHBondContact O-CD2 3.25Å; I180-H184 PolarHBondContact O-N 2.89Å; I180-V275 HydrophobicContact CG1-CG2 4.18Å; I180-L442 HydrophobicContact CD1-CB 4.18Å; I180-Y443 HydrophobicContact CG2-CD2 4.39Å; I180-T446 HydrophobicContact CG2-CG2 4.4Å
181	D	85.5	Confident	89	Confident	14 Å²	14	28.1 Å²	28.1	8%	0.075	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-43.6	178.3	173.8	91.7	0	0	0	112.6	V177 L179 A183 H184 S185 Y337 R341	V177-D181 WeakPolarHBondContact O-CB 3.33Å; V177-D181 PolarHBondContact O-N 3.35Å; L179-D181 VanDerWaalsContact C-N 3.31Å; D181-A183 VanDerWaalsContact C-N 3.31Å; D181-A183 PolarHBondContact O-N 3.43Å; D181-H184 PolarHBondContact O-N 3.29Å; D181-S185 PolarHBondContact O-N 3.15Å; D181-S185 PolarHBondContact O-OG 2.8Å; D181-Y337 WeakPolarHBondContact OD2-CE1 3.28Å; D181-Y337 PolarHBondContact OD2-OH 3.35Å; D181-R341 IonicContact OD1-CZ 2.82Å; D181-R341 IonicContact OD1-NH1 3.03Å; D181-R341 PolarHBondContact OD1-NH1 3.32Å; D181-R341 IonicContact OD1-NH2 2.72Å; D181-R341 PolarHBondContact OD1-NH2 2.93Å; D181-R341 IonicContact OD2-CZ 2.67Å; D181-R341 IonicContact OD2-NE 2.6Å; D181-R341 PolarHBondContact OD2-NE 3.33Å; D181-R341 IonicContact OD2-NH1 3.93Å; D181-R341 PolarHBondContact OD2-NH1 2.68Å; D181-R341 IonicContact OD2-NH2 3.25Å; D181-R341 PolarHBondContact OD2-NH2 3.23Å
182	F	88.4	Confident	88.7	Confident	77 Å²	77	31.6 Å²	31.6	34%	0.338	16%	0.157	S	C	.	.	H	α-helix	trans	-57.4	-42.9	169.6	167.9	-105.6	0	0	0	112.2	L178 L179 H184 S185 W186 L274 Y337	L178-F182 VanDerWaalsContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CB 3.48Å; L178-F182 PolarHBondContact O-N 3.46Å; L179-F182 PolarHBondContact O-N 2.88Å; F182-H184 VanDerWaalsContact C-N 3.33Å; F182-H184 PolarHBondContact O-N 2.91Å; F182-S185 PolarHBondContact O-N 2.94Å; F182-W186 HydrophobicContact CD1-CE3 4.34Å; F182-W186 HydrophobicContact CE1-CD2 4.49Å; F182-W186 AromaticContact CE1-CE3 3.32Å; F182-W186 HydrophobicContact CE1-CE3 3.32Å; F182-W186 AromaticContact CE1-CZ3 3.63Å; F182-W186 HydrophobicContact CE1-CZ3 3.63Å; F182-W186 HydrophobicContact CE2-CE3 4.17Å; F182-W186 HydrophobicContact CZ-CD2 4.14Å; F182-W186 AromaticContact CZ-CE3 3.21Å; F182-W186 HydrophobicContact CZ-CE3 3.21Å; F182-W186 AromaticContact CZ-CZ3 3.53Å; F182-W186 HydrophobicContact CZ-CZ3 3.53Å; F182-W186 VanDerWaalsContact O-CB 3.29Å; F182-W186 WeakPolarHBondContact O-CB 3.4Å; F182-W186 PolarHBondContact O-N 3.41Å; F182-L274 HydrophobicContact CD1-CD2 4.21Å; F182-L274 HydrophobicContact CE1-CD2 4.48Å; F182-Y337 HydrophobicContact CB-CD1 4.49Å; F182-Y337 HydrophobicContact CB-CE1 4.04Å; F182-Y337 HydrophobicContact CB-CE2 4.16Å; F182-Y337 HydrophobicContact CD2-CD2 4.02Å; F182-Y337 AromaticContact CD2-CE2 3.76Å; F182-Y337 HydrophobicContact CD2-CE2 3.76Å; F182-Y337 HydrophobicContact CG-CE2 4.44Å
183	A	89.3	Confident	88.5	Confident	3 Å²	3	35.6 Å²	35.6	3%	0.025	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-40.6	177.9	0	0	0	0	0	111.9	L179 I180 D181 N187 Q271 L274	L179-A183 WeakPolarHBondContact O-CB 3.34Å; L179-A183 PolarHBondContact O-N 3.02Å; I180-A183 VanDerWaalsContact O-CB 3.32Å; I180-A183 WeakPolarHBondContact O-CB 3.35Å; I180-A183 PolarHBondContact O-N 3.34Å; I180-A183 VanDerWaalsContact O-N 3.13Å; D181-A183 VanDerWaalsContact C-N 3.31Å; D181-A183 PolarHBondContact O-N 3.43Å; A183-N187 WeakPolarHBondContact O-CB 3.47Å; A183-N187 PolarHBondContact O-N 2.75Å; A183-Q271 HydrophobicContact CB-CB 4.36Å; A183-Q271 HydrophobicContact CB-CG 4.21Å; A183-L274 HydrophobicContact CB-CB 4.5Å; A183-L274 HydrophobicContact CB-CD2 3.6Å
184	H	85.7	Confident	88.4	Confident	30 Å²	30	35.5 Å²	35.5	14%	0.139	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-52.9	175.7	-77.2	-68.7	0	0	0	111.4	I180 D181 F182 W186 N187 E188 Q271 T446	I180-H184 PolarHBondContact O-CD2 3.25Å; I180-H184 PolarHBondContact O-N 2.89Å; D181-H184 PolarHBondContact O-N 3.29Å; F182-H184 VanDerWaalsContact C-N 3.33Å; F182-H184 PolarHBondContact O-N 2.91Å; H184-W186 VanDerWaalsContact C-N 3.3Å; H184-W186 PolarHBondContact O-N 3.06Å; H184-N187 PolarHBondContact O-N 3.5Å; H184-E188 WeakPolarHBondContact O-CB 3.44Å; H184-E188 PolarHBondContact O-N 3.25Å; H184-Q271 PolarHBondContact CE1-OE1 2.65Å; H184-Q271 VanDerWaalsContact CE1-OE1 3.31Å; H184-Q271 PolarHBondContact ND1-NE2 3.41Å; H184-Q271 PolarHBondContact ND1-OE1 3.26Å; H184-T446 PolarHBondContact NE2-OG1 3.19Å
185	S	86.3	Confident	88.2	Confident	32 Å²	32	40.4 Å²	40.4	22%	0.224	20%	0.196	C	C	.	.	H	α-helix	trans	-62	-35.3	178.6	-61	0	0	0	0	113	D181 F182 S189	D181-S185 PolarHBondContact O-N 3.15Å; D181-S185 PolarHBondContact O-OG 2.8Å; F182-S185 PolarHBondContact O-N 2.94Å; S185-S189 WeakPolarHBondContact O-CB 3.24Å; S185-S189 PolarHBondContact O-N 3.36Å
186	W	88.2	Confident	88	Confident	78 Å²	78	47.7 Å²	47.7	30%	0.295	23%	0.23	S	C	.	.	H	α-helix	trans	-65.5	-51.3	174.7	-171.2	-11.6	0	0	0	110.4	F182 H184 E188 S189 W190 L270	F182-W186 HydrophobicContact CD1-CE3 4.34Å; F182-W186 HydrophobicContact CE1-CD2 4.49Å; F182-W186 AromaticContact CE1-CE3 3.32Å; F182-W186 HydrophobicContact CE1-CE3 3.32Å; F182-W186 AromaticContact CE1-CZ3 3.63Å; F182-W186 HydrophobicContact CE1-CZ3 3.63Å; F182-W186 HydrophobicContact CE2-CE3 4.17Å; F182-W186 HydrophobicContact CZ-CD2 4.14Å; F182-W186 AromaticContact CZ-CE3 3.21Å; F182-W186 HydrophobicContact CZ-CE3 3.21Å; F182-W186 AromaticContact CZ-CZ3 3.53Å; F182-W186 HydrophobicContact CZ-CZ3 3.53Å; F182-W186 VanDerWaalsContact O-CB 3.29Å; F182-W186 WeakPolarHBondContact O-CB 3.4Å; F182-W186 PolarHBondContact O-N 3.41Å; H184-W186 VanDerWaalsContact C-N 3.3Å; H184-W186 PolarHBondContact O-N 3.06Å; W186-E188 VanDerWaalsContact C-N 3.32Å; W186-E188 PolarHBondContact O-N 3.12Å; W186-S189 PolarHBondContact O-N 2.88Å; W186-W190 AromaticContact CD1-CD1 3.6Å; W186-W190 AromaticContact CD1-CD2 3.82Å; W186-W190 AromaticContact CD1-CE2 3.67Å; W186-W190 AromaticContact CD1-CG 3.82Å; W186-W190 AromaticContact CD1-NE1 3.49Å; W186-W190 AromaticContact CE2-CZ2 3.88Å; W186-W190 HydrophobicContact CZ2-CH2 4.12Å; W186-W190 AromaticContact CZ2-CZ2 3.95Å; W186-W190 HydrophobicContact CZ2-CZ2 3.95Å; W186-W190 AromaticContact NE1-CD1 3.73Å; W186-W190 AromaticContact NE1-CD2 3.39Å; W186-W190 AromaticContact NE1-CE2 2.96Å; W186-W190 AromaticContact NE1-CE3 3.93Å; W186-W190 AromaticContact NE1-CG 3.89Å; W186-W190 AromaticContact NE1-CH2 3.76Å; W186-W190 AromaticContact NE1-CZ2 3.18Å; W186-W190 AromaticContact NE1-NE1 3.17Å; W186-W190 VanDerWaalsContact NE1-NE1 3.17Å; W186-W190 PolarHBondContact O-N 2.87Å; W186-L270 HydrophobicContact CD2-CD2 4.49Å; W186-L270 HydrophobicContact CG-CD2 4.19Å
187	N	89.8	Confident	87.6	Confident	3 Å²	3	50 Å²	50	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-56.9	-48.4	179.2	-171.9	71.6	0	0	0	111.4	A183 H184 S189 W190 V191 R266 L270 Q271	A183-N187 WeakPolarHBondContact O-CB 3.47Å; A183-N187 PolarHBondContact O-N 2.75Å; H184-N187 PolarHBondContact O-N 3.5Å; N187-S189 PolarHBondContact O-N 3.46Å; N187-W190 PolarHBondContact O-N 2.99Å; N187-V191 WeakPolarHBondContact O-CB 3.35Å; N187-V191 VanDerWaalsContact O-CG2 3.24Å; N187-V191 WeakPolarHBondContact O-CG2 3.02Å; N187-V191 PolarHBondContact O-N 2.97Å; N187-R266 PolarHBondContact ND2-O 3.22Å; N187-L270 HydrophobicContact CB-CD2 4.19Å; N187-Q271 HydrophobicContact CB-CG 3.96Å; N187-Q271 PolarHBondContact ND2-NE2 2.89Å
188	E	87.4	Confident	87.3	Confident	69 Å²	69	53.1 Å²	53.1	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-56.4	-50	177.3	176.4	170.2	-133.2	0	0	112.3	H184 W186 W190 V191 E192 R266	H184-E188 WeakPolarHBondContact O-CB 3.44Å; H184-E188 PolarHBondContact O-N 3.25Å; W186-E188 VanDerWaalsContact C-N 3.32Å; W186-E188 PolarHBondContact O-N 3.12Å; E188-W190 VanDerWaalsContact C-N 3.27Å; E188-W190 PolarHBondContact O-N 3.32Å; E188-V191 PolarHBondContact O-N 3.32Å; E188-E192 WeakPolarHBondContact O-CB 3.24Å; E188-E192 PolarHBondContact O-N 3.11Å; E188-R266 WeakPolarHBondContact OE1-CD 3.48Å; E188-R266 IonicContact OE1-CZ 3.58Å; E188-R266 IonicContact OE1-NE 3.89Å; E188-R266 IonicContact OE1-NH1 2.61Å; E188-R266 PolarHBondContact OE1-NH1 3.28Å
189	S	88.4	Confident	87	Confident	39 Å²	39	55.3 Å²	55.3	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-34.3	179	-176.6	0	0	0	0	113.2	S185 W186 N187 K193	S185-S189 WeakPolarHBondContact O-CB 3.24Å; S185-S189 PolarHBondContact O-N 3.36Å; W186-S189 PolarHBondContact O-N 2.88Å; N187-S189 PolarHBondContact O-N 3.46Å; S189-K193 WeakPolarHBondContact O-CB 3.18Å; S189-K193 WeakPolarHBondContact O-CD 3.37Å; S189-K193 VanDerWaalsContact O-CG 3.23Å; S189-K193 WeakPolarHBondContact O-CG 3.5Å; S189-K193 PolarHBondContact O-N 3.4Å; S189-K193 PolarHBondContact OG-NZ 2.83Å
190	W	90.4	Very high	87	Confident	45 Å²	45	64.3 Å²	64.3	17%	0.17	32%	0.318	C	S	.	.	H	α-helix	trans	-81	-35.2	179.5	-81.1	27.1	0	0	0	112.6	W186 N187 E188 M194 W202 A205 L206 V209	W186-W190 AromaticContact CD1-CD1 3.6Å; W186-W190 AromaticContact CD1-CD2 3.82Å; W186-W190 AromaticContact CD1-CE2 3.67Å; W186-W190 AromaticContact CD1-CG 3.82Å; W186-W190 AromaticContact CD1-NE1 3.49Å; W186-W190 AromaticContact CE2-CZ2 3.88Å; W186-W190 HydrophobicContact CZ2-CH2 4.12Å; W186-W190 AromaticContact CZ2-CZ2 3.95Å; W186-W190 HydrophobicContact CZ2-CZ2 3.95Å; W186-W190 AromaticContact NE1-CD1 3.73Å; W186-W190 AromaticContact NE1-CD2 3.39Å; W186-W190 AromaticContact NE1-CE2 2.96Å; W186-W190 AromaticContact NE1-CE3 3.93Å; W186-W190 AromaticContact NE1-CG 3.89Å; W186-W190 AromaticContact NE1-CH2 3.76Å; W186-W190 AromaticContact NE1-CZ2 3.18Å; W186-W190 AromaticContact NE1-NE1 3.17Å; W186-W190 VanDerWaalsContact NE1-NE1 3.17Å; W186-W190 PolarHBondContact O-N 2.87Å; N187-W190 PolarHBondContact O-N 2.99Å; E188-W190 VanDerWaalsContact C-N 3.27Å; E188-W190 PolarHBondContact O-N 3.32Å; W190-M194 VanDerWaalsContact O-CB 3.32Å; W190-M194 WeakPolarHBondContact O-CB 3.46Å; W190-M194 PolarHBondContact O-N 2.99Å; W190-W202 AromaticContact CD1-CZ3 3.8Å; W190-W202 HydrophobicContact CD2-CE3 4.1Å; W190-W202 HydrophobicContact CD2-CZ3 4.03Å; W190-W202 AromaticContact CE2-CZ3 3.73Å; W190-W202 HydrophobicContact CG-CE3 4.04Å; W190-W202 HydrophobicContact CG-CZ3 4.05Å; W190-W202 HydrophobicContact CZ2-CZ3 4.34Å; W190-W202 AromaticContact NE1-CZ3 3.6Å; W190-A205 HydrophobicContact CE3-CB 4.32Å; W190-A205 HydrophobicContact CH2-CB 4.23Å; W190-A205 HydrophobicContact CZ3-CB 3.85Å; W190-L206 HydrophobicContact CB-CD1 4.41Å; W190-L206 HydrophobicContact CE3-CB 4.15Å; W190-L206 HydrophobicContact CE3-CD1 4.02Å; W190-V209 HydrophobicContact CH2-CG2 3.72Å; W190-V209 HydrophobicContact CZ3-CB 4.31Å; W190-V209 HydrophobicContact CZ3-CG2 3.76Å
191	V	88.3	Confident	87.1	Confident	21 Å²	21	67.5 Å²	67.5	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-44.9	173.7	170	0	0	0	0	110.3	N187 E188 K193 M194 E195 L206	N187-V191 WeakPolarHBondContact O-CB 3.35Å; N187-V191 VanDerWaalsContact O-CG2 3.24Å; N187-V191 WeakPolarHBondContact O-CG2 3.02Å; N187-V191 PolarHBondContact O-N 2.97Å; E188-V191 PolarHBondContact O-N 3.32Å; V191-K193 PolarHBondContact O-N 3.43Å; V191-M194 HydrophobicContact CG1-CE 4.25Å; V191-M194 WeakPolarHBondContact O-CA 3.25Å; V191-M194 VanDerWaalsContact O-CB 3.3Å; V191-M194 WeakPolarHBondContact O-CB 3.43Å; V191-M194 PolarHBondContact O-N 3.5Å; V191-E195 WeakPolarHBondContact O-CG 3.4Å; V191-E195 PolarHBondContact O-N 3.38Å; V191-L206 HydrophobicContact CG2-CD2 4.33Å
192	E	87.7	Confident	87.3	Confident	81 Å²	81	70.5 Å²	70.5	38%	0.379	35%	0.35	S	S	.	.	H	α-helix	trans	-58.5	-47.6	175.1	-176.6	-178.6	-150.9	0	0	111.4	E188 M194 E195 E196	E188-E192 WeakPolarHBondContact O-CB 3.24Å; E188-E192 PolarHBondContact O-N 3.11Å; E192-M194 PolarHBondContact O-N 3.19Å; E192-E195 PolarHBondContact O-N 3.23Å; E192-E195 VanDerWaalsContact O-N 3.11Å; E192-E196 PolarHBondContact O-N 2.89Å
193	K	89.2	Confident	87.3	Confident	87 Å²	87	73.4 Å²	73.4	38%	0.378	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-25	175.7	-72.5	172.9	-173.7	163	0	113.9	S189 V191 G197 W202	S189-K193 WeakPolarHBondContact O-CB 3.18Å; S189-K193 WeakPolarHBondContact O-CD 3.37Å; S189-K193 VanDerWaalsContact O-CG 3.23Å; S189-K193 WeakPolarHBondContact O-CG 3.5Å; S189-K193 PolarHBondContact O-N 3.4Å; S189-K193 PolarHBondContact OG-NZ 2.83Å; V191-K193 PolarHBondContact O-N 3.43Å; K193-G197 WeakPolarHBondContact O-CA 3.26Å; K193-G197 PolarHBondContact O-N 3.44Å; K193-W202 HydrophobicContact CB-CD2 3.86Å; K193-W202 HydrophobicContact CB-CE3 4.45Å; K193-W202 HydrophobicContact CB-CG 4.02Å; K193-W202 HydrophobicContact CB-CZ2 4.28Å; K193-W202 HydrophobicContact CD-CD2 4.44Å; K193-W202 HydrophobicContact CD-CH2 3.75Å; K193-W202 HydrophobicContact CD-CZ2 3.6Å; K193-W202 HydrophobicContact CD-CZ3 4.22Å; K193-W202 HydrophobicContact CG-CZ2 4.46Å
194	M	87.6	Confident	87.5	Confident	42 Å²	42	75.9 Å²	75.9	21%	0.207	38%	0.381	C	S	.	.	H	α-helix	trans	-73.7	-38.5	173.1	177.3	-163.2	71	0	0	110.9	W190 V191 E192 S199 W202 Y203	W190-M194 VanDerWaalsContact O-CB 3.32Å; W190-M194 WeakPolarHBondContact O-CB 3.46Å; W190-M194 PolarHBondContact O-N 2.99Å; V191-M194 HydrophobicContact CG1-CE 4.25Å; V191-M194 WeakPolarHBondContact O-CA 3.25Å; V191-M194 VanDerWaalsContact O-CB 3.3Å; V191-M194 WeakPolarHBondContact O-CB 3.43Å; V191-M194 PolarHBondContact O-N 3.5Å; E192-M194 PolarHBondContact O-N 3.19Å; M194-S199 WeakPolarHBondContact O-CA 3.49Å; M194-S199 WeakPolarHBondContact O-CB 3.37Å; M194-W202 HydrophobicContact CB-CB 3.81Å; M194-W202 HydrophobicContact CG-CB 4.46Å; M194-Y203 HydrophobicContact SD-CD2 3.9Å
195	E	86.8	Confident	87.8	Confident	138 Å²	138	75.7 Å²	75.7	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-73.9	-43.3	179	-70.5	177	174.5	0	0	112.3	V191 E192	V191-E195 WeakPolarHBondContact O-CG 3.4Å; V191-E195 PolarHBondContact O-N 3.38Å; E192-E195 PolarHBondContact O-N 3.23Å; E192-E195 VanDerWaalsContact O-N 3.11Å
196	E	87.3	Confident	88.1	Confident	158 Å²	158	75.4 Å²	75.4	74%	0.738	38%	0.38	S	S	*	.	H	α-helix	trans	-93.3	-23	-175	-60.8	-174.5	162.1	0	0	114.2	E192	E192-E196 PolarHBondContact O-N 2.89Å
197	G	80.4	Confident	88.2	Confident	48 Å²	48	76.2 Å²	76.2	50%	0.495	39%	0.389	S	S	.	.	S	Bend	trans	-109.3	-145.2	-171.9	0	0	0	0	0	114.3	K193 S199	K193-G197 WeakPolarHBondContact O-CA 3.26Å; K193-G197 PolarHBondContact O-N 3.44Å; G197-S199 PolarHBondContact O-N 3.49Å
198	N	80.9	Confident	88.5	Confident	103 Å²	103	79.4 Å²	79.4	55%	0.551	41%	0.412	S	S	*	.			trans	-77.9	88.6	174.6	-176.4	3.6	0	0	0	110.5	R200 C201 W202	N198-R200 VanDerWaalsContact C-N 3.26Å; N198-R200 PolarHBondContact O-N 3.29Å; N198-R200 VanDerWaalsContact O-N 3.14Å; N198-C201 HydrophobicContact CB-CB 4.37Å; N198-C201 PolarHBondContact O-N 3.39Å; N198-C201 VanDerWaalsContact O-N 3.13Å; N198-W202 PolarHBondContact O-N 2.92Å
199	S	82.7	Confident	88.8	Confident	62 Å²	62	77.6 Å²	77.6	43%	0.434	41%	0.405	S	S	.	.	H	α-helix	trans	-50.4	-40.1	-174.3	61.6	0	0	0	0	114.3	M194 G197 Y203	M194-S199 WeakPolarHBondContact O-CA 3.49Å; M194-S199 WeakPolarHBondContact O-CB 3.37Å; G197-S199 PolarHBondContact O-N 3.49Å; S199-Y203 WeakPolarHBondContact O-CB 3.39Å; S199-Y203 PolarHBondContact O-N 3.45Å
200	R	88.3	Confident	89.1	Confident	212 Å²	212	76 Å²	76	80%	0.8	39%	0.394	S	S	*	.	H	α-helix	trans	-69.7	-38.4	-177.6	-65.2	-174.2	-178.7	-177.2	0.9	113.5	N198 A204	N198-R200 VanDerWaalsContact C-N 3.26Å; N198-R200 PolarHBondContact O-N 3.29Å; N198-R200 VanDerWaalsContact O-N 3.14Å; R200-A204 WeakPolarHBondContact O-CB 3.48Å; R200-A204 PolarHBondContact O-N 3.41Å; R200-A204 VanDerWaalsContact O-N 3.08Å
201	C	90.9	Very high	89.4	Confident	75 Å²	75	76.5 Å²	76.5	51%	0.507	41%	0.408	S	S	.	.	H	α-helix	trans	-71.3	-47.8	-178.7	-174.2	0	0	0	0	110.9	N198 A204 A205	N198-C201 HydrophobicContact CB-CB 4.37Å; N198-C201 PolarHBondContact O-N 3.39Å; N198-C201 VanDerWaalsContact O-N 3.13Å; C201-A204 PolarHBondContact O-N 3.47Å; C201-A205 WeakPolarHBondContact O-CB 3.36Å; C201-A205 PolarHBondContact O-N 3.49Å
202	W	90	Very high	89.8	Confident	78 Å²	78	80.6 Å²	80.6	30%	0.295	43%	0.428	S	S	.	.	H	α-helix	trans	-67.8	-36.6	179.5	-72.2	110.3	0	0	0	112.5	W190 K193 M194 N198 A205 L206	W190-W202 AromaticContact CD1-CZ3 3.8Å; W190-W202 HydrophobicContact CD2-CE3 4.1Å; W190-W202 HydrophobicContact CD2-CZ3 4.03Å; W190-W202 AromaticContact CE2-CZ3 3.73Å; W190-W202 HydrophobicContact CG-CE3 4.04Å; W190-W202 HydrophobicContact CG-CZ3 4.05Å; W190-W202 HydrophobicContact CZ2-CZ3 4.34Å; W190-W202 AromaticContact NE1-CZ3 3.6Å; K193-W202 HydrophobicContact CB-CD2 3.86Å; K193-W202 HydrophobicContact CB-CE3 4.45Å; K193-W202 HydrophobicContact CB-CG 4.02Å; K193-W202 HydrophobicContact CB-CZ2 4.28Å; K193-W202 HydrophobicContact CD-CD2 4.44Å; K193-W202 HydrophobicContact CD-CH2 3.75Å; K193-W202 HydrophobicContact CD-CZ2 3.6Å; K193-W202 HydrophobicContact CD-CZ3 4.22Å; K193-W202 HydrophobicContact CG-CZ2 4.46Å; M194-W202 HydrophobicContact CB-CB 3.81Å; M194-W202 HydrophobicContact CG-CB 4.46Å; N198-W202 PolarHBondContact O-N 2.92Å; W202-A205 PolarHBondContact O-N 2.89Å; W202-L206 WeakPolarHBondContact O-CB 3.06Å; W202-L206 PolarHBondContact O-N 3.17Å
203	Y	88.7	Confident	90.2	Very high	138 Å²	138	77.6 Å²	77.6	54%	0.541	42%	0.415	S	S	.	.	H	α-helix	trans	-61.6	-46.5	171.4	-177.2	-96.9	0	0	0	112	M194 S199 A205 L206 L207	M194-Y203 HydrophobicContact SD-CD2 3.9Å; S199-Y203 WeakPolarHBondContact O-CB 3.39Å; S199-Y203 PolarHBondContact O-N 3.45Å; Y203-A205 VanDerWaalsContact C-N 3.34Å; Y203-A205 PolarHBondContact O-N 2.84Å; Y203-L206 PolarHBondContact O-N 3.25Å; Y203-L207 HydrophobicContact CE1-CD2 4.47Å; Y203-L207 WeakPolarHBondContact O-CB 3.41Å; Y203-L207 PolarHBondContact O-N 3.35Å
204	A	92.4	Very high	90.5	Very high	55 Å²	55	76.2 Å²	76.2	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-40.1	176.6	0	0	0	0	0	112	R200 C201 S208	R200-A204 WeakPolarHBondContact O-CB 3.48Å; R200-A204 PolarHBondContact O-N 3.41Å; R200-A204 VanDerWaalsContact O-N 3.08Å; C201-A204 PolarHBondContact O-N 3.47Å; A204-S208 VanDerWaalsContact O-CB 3.28Å; A204-S208 WeakPolarHBondContact O-CB 3.34Å; A204-S208 PolarHBondContact O-N 2.94Å; A204-S208 PolarHBondContact O-OG 3.23Å
205	A	92.2	Very high	91	Very high	25 Å²	25	79.2 Å²	79.2	21%	0.207	42%	0.424	C	S	.	.	H	α-helix	trans	-60.4	-52.1	174.9	0	0	0	0	0	111	W190 C201 W202 Y203 L207 S208 V209	W190-A205 HydrophobicContact CE3-CB 4.32Å; W190-A205 HydrophobicContact CH2-CB 4.23Å; W190-A205 HydrophobicContact CZ3-CB 3.85Å; C201-A205 WeakPolarHBondContact O-CB 3.36Å; C201-A205 PolarHBondContact O-N 3.49Å; W202-A205 PolarHBondContact O-N 2.89Å; Y203-A205 VanDerWaalsContact C-N 3.34Å; Y203-A205 PolarHBondContact O-N 2.84Å; A205-L207 PolarHBondContact O-N 3.06Å; A205-S208 PolarHBondContact O-N 3.19Å; A205-S208 PolarHBondContact O-OG 3.01Å; A205-V209 PolarHBondContact O-N 2.9Å
206	L	91.6	Very high	91.4	Very high	26 Å²	26	76.7 Å²	76.7	14%	0.136	42%	0.415	C	S	.	.	H	α-helix	trans	-56.5	-47.7	179	-173.4	68.6	0	0	0	111.7	W190 V191 W202 Y203 T210 L270	W190-L206 HydrophobicContact CB-CD1 4.41Å; W190-L206 HydrophobicContact CE3-CB 4.15Å; W190-L206 HydrophobicContact CE3-CD1 4.02Å; V191-L206 HydrophobicContact CG2-CD2 4.33Å; W202-L206 WeakPolarHBondContact O-CB 3.06Å; W202-L206 PolarHBondContact O-N 3.17Å; Y203-L206 PolarHBondContact O-N 3.25Å; L206-T210 WeakPolarHBondContact O-CB 3.37Å; L206-T210 PolarHBondContact O-N 3.48Å; L206-T210 VanDerWaalsContact O-N 3.07Å; L206-T210 PolarHBondContact O-OG1 2.95Å; L206-L270 HydrophobicContact CD1-CB 3.89Å; L206-L270 HydrophobicContact CD1-CD1 4.44Å; L206-L270 HydrophobicContact CD1-CD2 3.76Å; L206-L270 HydrophobicContact CD1-CG 4.23Å
207	L	91.9	Very high	91.9	Very high	96 Å²	96	69.4 Å²	69.4	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-63.6	-42.7	178	-175.4	64.3	0	0	0	111.7	Y203 A205 T210 A211	Y203-L207 HydrophobicContact CE1-CD2 4.47Å; Y203-L207 WeakPolarHBondContact O-CB 3.41Å; Y203-L207 PolarHBondContact O-N 3.35Å; A205-L207 PolarHBondContact O-N 3.06Å; L207-T210 PolarHBondContact O-N 3.46Å; L207-A211 VanDerWaalsContact O-CB 3.25Å; L207-A211 WeakPolarHBondContact O-CB 3.37Å; L207-A211 PolarHBondContact O-N 3.4Å
208	S	94.6	Very high	92.6	Very high	70 Å²	70	72.1 Å²	72.1	49%	0.49	38%	0.384	S	S	.	.	H	α-helix	trans	-64.6	-43.8	-179.2	73	0	0	0	0	112.9	A204 A205 A211 L212	A204-S208 VanDerWaalsContact O-CB 3.28Å; A204-S208 WeakPolarHBondContact O-CB 3.34Å; A204-S208 PolarHBondContact O-N 2.94Å; A204-S208 PolarHBondContact O-OG 3.23Å; A205-S208 PolarHBondContact O-N 3.19Å; A205-S208 PolarHBondContact O-OG 3.01Å; S208-A211 PolarHBondContact O-N 3.44Å; S208-L212 VanDerWaalsContact O-CB 3.31Å; S208-L212 WeakPolarHBondContact O-CB 3.27Å; S208-L212 PolarHBondContact O-N 3.22Å
209	V	95.3	Very high	93.4	Very high	30 Å²	30	70.5 Å²	70.5	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-66.9	-42.9	178.3	176	0	0	0	0	110.2	W190 A205 A211 L212 N213 L270	W190-V209 HydrophobicContact CH2-CG2 3.72Å; W190-V209 HydrophobicContact CZ3-CB 4.31Å; W190-V209 HydrophobicContact CZ3-CG2 3.76Å; A205-V209 PolarHBondContact O-N 2.9Å; V209-A211 PolarHBondContact O-N 3.2Å; V209-L212 PolarHBondContact O-N 3.44Å; V209-N213 PolarHBondContact O-N 3.05Å; V209-N213 PolarHBondContact O-ND2 3.37Å; V209-L270 HydrophobicContact CB-CD1 4.04Å; V209-L270 HydrophobicContact CG1-CD1 3.58Å
210	T	94.8	Very high	93.9	Very high	6 Å²	6	68.7 Å²	68.7	4%	0.037	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-46.2	177.3	-56.3	0	0	0	0	111.3	L206 L207 N213 Y214 L269 L270	L206-T210 WeakPolarHBondContact O-CB 3.37Å; L206-T210 PolarHBondContact O-N 3.48Å; L206-T210 VanDerWaalsContact O-N 3.07Å; L206-T210 PolarHBondContact O-OG1 2.95Å; L207-T210 PolarHBondContact O-N 3.46Å; T210-N213 PolarHBondContact O-N 2.93Å; T210-Y214 HydrophobicContact CG2-CD2 4.02Å; T210-Y214 HydrophobicContact CG2-CE2 3.91Å; T210-Y214 WeakPolarHBondContact O-CD2 3.49Å; T210-Y214 PolarHBondContact O-N 2.9Å; T210-Y214 VanDerWaalsContact O-N 3.15Å; T210-L269 HydrophobicContact CG2-CB 4.02Å; T210-L269 HydrophobicContact CG2-CD2 3.66Å; T210-L269 HydrophobicContact CG2-CG 3.59Å; T210-L270 WeakPolarHBondContact OG1-CA 3Å
211	A	95.7	Very high	94.2	Very high	55 Å²	55	59.6 Å²	59.6	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-41.4	177.4	0	0	0	0	0	112	L207 S208 V209 Y214 L215	L207-A211 VanDerWaalsContact O-CB 3.25Å; L207-A211 WeakPolarHBondContact O-CB 3.37Å; L207-A211 PolarHBondContact O-N 3.4Å; S208-A211 PolarHBondContact O-N 3.44Å; V209-A211 PolarHBondContact O-N 3.2Å; A211-Y214 PolarHBondContact O-N 2.88Å; A211-L215 VanDerWaalsContact O-CB 3.29Å; A211-L215 WeakPolarHBondContact O-CB 3.14Å; A211-L215 PolarHBondContact O-N 2.77Å
212	L	96.6	Very high	94.4	Very high	108 Å²	108	59.8 Å²	59.8	57%	0.565	33%	0.331	S	S	*	.	H	α-helix	trans	-62	-44.8	177.2	-179.3	64.8	0	0	0	111.8	S208 V209 L215 L216	S208-L212 VanDerWaalsContact O-CB 3.31Å; S208-L212 WeakPolarHBondContact O-CB 3.27Å; S208-L212 PolarHBondContact O-N 3.22Å; V209-L212 PolarHBondContact O-N 3.44Å; L212-L215 PolarHBondContact O-N 3.05Å; L212-L216 WeakPolarHBondContact O-CB 3.32Å; L212-L216 PolarHBondContact O-N 3.2Å
213	N	96.4	Very high	94.6	Very high	18 Å²	18	59.8 Å²	59.8	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-62.1	-44.4	178.8	-74.7	-23.3	0	0	0	112	V209 T210 L216 S217 S273	V209-N213 PolarHBondContact O-N 3.05Å; V209-N213 PolarHBondContact O-ND2 3.37Å; T210-N213 PolarHBondContact O-N 2.93Å; N213-L216 PolarHBondContact O-N 2.98Å; N213-S217 WeakPolarHBondContact O-CB 3.39Å; N213-S217 PolarHBondContact O-N 3.42Å; N213-S217 PolarHBondContact O-OG 3.36Å; N213-S273 WeakPolarHBondContact CB-OG 3.15Å; N213-S273 PolarHBondContact ND2-OG 2.86Å; N213-S273 VanDerWaalsContact ND2-OG 3.15Å
214	Y	96.3	Very high	94.8	Very high	58 Å²	58	53.7 Å²	53.7	23%	0.227	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-39	176.2	-80.9	-60.1	0	0	0	112.7	T210 A211 S217 L218 S252 L269 S272 S273 T276	T210-Y214 HydrophobicContact CG2-CD2 4.02Å; T210-Y214 HydrophobicContact CG2-CE2 3.91Å; T210-Y214 WeakPolarHBondContact O-CD2 3.49Å; T210-Y214 PolarHBondContact O-N 2.9Å; T210-Y214 VanDerWaalsContact O-N 3.15Å; A211-Y214 PolarHBondContact O-N 2.88Å; Y214-S217 PolarHBondContact O-N 3Å; Y214-L218 WeakPolarHBondContact O-CB 3.27Å; Y214-L218 PolarHBondContact O-N 3.17Å; Y214-S252 WeakPolarHBondContact CE1-OG 3.33Å; Y214-S252 VanDerWaalsContact OH-CB 3.31Å; Y214-S252 WeakPolarHBondContact OH-CB 3.32Å; Y214-S252 PolarHBondContact OH-OG 3.36Å; Y214-L269 HydrophobicContact CE2-CD1 3.95Å; Y214-L269 HydrophobicContact CE2-CD2 4.26Å; Y214-L269 HydrophobicContact CE2-CG 3.86Å; Y214-S272 WeakPolarHBondContact OH-CB 3.3Å; Y214-S272 PolarHBondContact OH-OG 3.09Å; Y214-S273 PolarHBondContact OH-N 2.7Å; Y214-T276 HydrophobicContact CE1-CG2 4.41Å
215	L	97	Very high	94.8	Very high	104 Å²	104	54.7 Å²	54.7	55%	0.545	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-47	175.2	179.7	63.6	0	0	0	110.9	A211 L212 S217 L218 V219	A211-L215 VanDerWaalsContact O-CB 3.29Å; A211-L215 WeakPolarHBondContact O-CB 3.14Å; A211-L215 PolarHBondContact O-N 2.77Å; L212-L215 PolarHBondContact O-N 3.05Å; L215-S217 VanDerWaalsContact C-N 3.3Å; L215-S217 PolarHBondContact O-N 3.49Å; L215-L218 PolarHBondContact O-N 3.49Å; L215-V219 WeakPolarHBondContact O-CG2 3.42Å; L215-V219 PolarHBondContact O-N 3.48Å
216	L	96.4	Very high	94.7	Very high	86 Å²	86	57.7 Å²	57.7	45%	0.45	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-37.6	177.7	-176.1	58.8	0	0	0	111.9	L212 N213 S220 L277	L212-L216 WeakPolarHBondContact O-CB 3.32Å; L212-L216 PolarHBondContact O-N 3.2Å; N213-L216 PolarHBondContact O-N 2.98Å; L216-S220 WeakPolarHBondContact O-CB 3.32Å; L216-S220 PolarHBondContact O-N 3.36Å; L216-S220 PolarHBondContact O-OG 2.97Å; L216-L277 HydrophobicContact CB-CD1 4.06Å; L216-L277 HydrophobicContact CD2-CD1 3.63Å; L216-L277 HydrophobicContact CD2-CD2 3.98Å; L216-L277 HydrophobicContact CD2-CG 4.45Å; L216-L277 HydrophobicContact CG-CD1 3.66Å
217	S	96.3	Very high	94.5	Very high	5 Å²	5	60.8 Å²	60.8	4%	0.035	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-42.2	175.1	-58.6	0	0	0	0	111.7	N213 Y214 L215 S220 L221 L277	N213-S217 WeakPolarHBondContact O-CB 3.39Å; N213-S217 PolarHBondContact O-N 3.42Å; N213-S217 PolarHBondContact O-OG 3.36Å; Y214-S217 PolarHBondContact O-N 3Å; L215-S217 VanDerWaalsContact C-N 3.3Å; L215-S217 PolarHBondContact O-N 3.49Å; S217-S220 PolarHBondContact O-N 3.4Å; S217-L221 WeakPolarHBondContact O-CB 3.02Å; S217-L221 PolarHBondContact O-N 3.38Å; S217-L277 VanDerWaalsContact OG-CA 3.32Å; S217-L277 WeakPolarHBondContact OG-CA 3.32Å; S217-L277 PolarHBondContact OG-N 3.18Å
218	L	96.1	Very high	94.4	Very high	104 Å²	104	56.6 Å²	56.6	55%	0.545	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-45.5	177.1	-178.7	65.6	0	0	0	111.6	Y214 L215 S220 L221 V222	Y214-L218 WeakPolarHBondContact O-CB 3.27Å; Y214-L218 PolarHBondContact O-N 3.17Å; L215-L218 PolarHBondContact O-N 3.49Å; L218-S220 VanDerWaalsContact C-N 3.33Å; L218-S220 PolarHBondContact O-N 3.32Å; L218-L221 WeakPolarHBondContact O-CB 3.34Å; L218-L221 PolarHBondContact O-N 3.23Å; L218-V222 WeakPolarHBondContact O-CG2 3.46Å; L218-V222 PolarHBondContact O-N 3.21Å
219	V	96.4	Very high	94.2	Very high	70 Å²	70	54.1 Å²	54.1	42%	0.424	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-47	174.7	170.7	0	0	0	0	110.3	L215 L221 V222 L223	L215-V219 WeakPolarHBondContact O-CG2 3.42Å; L215-V219 PolarHBondContact O-N 3.48Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 2.79Å; V219-V222 PolarHBondContact O-N 3.07Å; V219-L223 HydrophobicContact CG1-CD1 3.93Å; V219-L223 HydrophobicContact CG1-CG 4.37Å; V219-L223 VanDerWaalsContact O-CG 3.28Å; V219-L223 WeakPolarHBondContact O-CG 3.01Å; V219-L223 PolarHBondContact O-N 3.49Å
220	S	94.2	Very high	93.8	Very high	24 Å²	24	57.4 Å²	57.4	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-45	177.4	-57.3	0	0	0	0	111.6	L216 S217 L218 V222 L223 F224	L216-S220 WeakPolarHBondContact O-CB 3.32Å; L216-S220 PolarHBondContact O-N 3.36Å; L216-S220 PolarHBondContact O-OG 2.97Å; S217-S220 PolarHBondContact O-N 3.4Å; L218-S220 VanDerWaalsContact C-N 3.33Å; L218-S220 PolarHBondContact O-N 3.32Å; S220-V222 PolarHBondContact O-N 3.26Å; S220-L223 WeakPolarHBondContact O-CB 3.32Å; S220-L223 PolarHBondContact O-N 3.2Å; S220-F224 WeakPolarHBondContact O-CD1 3.39Å; S220-F224 WeakPolarHBondContact O-CE1 3.46Å; S220-F224 WeakPolarHBondContact O-CG 3.45Å; S220-F224 PolarHBondContact O-N 3.41Å
221	L	95.3	Very high	93.1	Very high	21 Å²	21	61.9 Å²	61.9	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-43.7	177.9	-177.1	124.2	0	0	0	113	S217 L218 V219 L223 F224 Y225 I241 L245	S217-L221 WeakPolarHBondContact O-CB 3.02Å; S217-L221 PolarHBondContact O-N 3.38Å; L218-L221 WeakPolarHBondContact O-CB 3.34Å; L218-L221 PolarHBondContact O-N 3.23Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 2.79Å; L221-L223 VanDerWaalsContact C-N 3.32Å; L221-L223 PolarHBondContact O-N 2.94Å; L221-F224 PolarHBondContact O-N 2.94Å; L221-Y225 HydrophobicContact CD2-CD2 4.22Å; L221-Y225 HydrophobicContact CD2-CE2 4.15Å; L221-Y225 HydrophobicContact CG-CD2 4.26Å; L221-Y225 HydrophobicContact CG-CE2 4.15Å; L221-Y225 WeakPolarHBondContact O-CD2 3.23Å; L221-Y225 PolarHBondContact O-N 3.11Å; L221-I241 HydrophobicContact CD1-CG2 4.29Å; L221-I241 HydrophobicContact CG-CG2 4.49Å; L221-L245 HydrophobicContact CD1-CB 3.81Å; L221-L245 HydrophobicContact CD1-CD1 3.69Å; L221-L245 HydrophobicContact CD1-CD2 4.08Å; L221-L245 HydrophobicContact CD1-CG 4.04Å
222	V	94.9	Very high	92.4	Very high	79 Å²	79	67 Å²	67	48%	0.479	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-44.8	175.6	173.6	0	0	0	0	110.2	L218 V219 S220 F224 Y225 V226	L218-V222 WeakPolarHBondContact O-CG2 3.46Å; L218-V222 PolarHBondContact O-N 3.21Å; V219-V222 PolarHBondContact O-N 3.07Å; S220-V222 PolarHBondContact O-N 3.26Å; V222-F224 VanDerWaalsContact C-N 3.3Å; V222-F224 PolarHBondContact O-N 3.03Å; V222-Y225 PolarHBondContact O-N 3.11Å; V222-V226 HydrophobicContact CG1-CG2 4.36Å; V222-V226 VanDerWaalsContact O-CG2 3.3Å; V222-V226 WeakPolarHBondContact O-CG2 3.39Å; V222-V226 PolarHBondContact O-N 3.33Å
223	L	92.6	Very high	91.8	Very high	77 Å²	77	63 Å²	63	40%	0.403	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-37.2	177.3	-64.5	171.5	0	0	0	112	V219 S220 L221 V226 Y227	V219-L223 HydrophobicContact CG1-CD1 3.93Å; V219-L223 HydrophobicContact CG1-CG 4.37Å; V219-L223 VanDerWaalsContact O-CG 3.28Å; V219-L223 WeakPolarHBondContact O-CG 3.01Å; V219-L223 PolarHBondContact O-N 3.49Å; S220-L223 WeakPolarHBondContact O-CB 3.32Å; S220-L223 PolarHBondContact O-N 3.2Å; L221-L223 VanDerWaalsContact C-N 3.32Å; L221-L223 PolarHBondContact O-N 2.94Å; L223-V226 PolarHBondContact O-N 3.32Å; L223-Y227 HydrophobicContact CB-CD2 4.3Å; L223-Y227 HydrophobicContact CD2-CD2 4.14Å; L223-Y227 HydrophobicContact CD2-CE2 3.66Å; L223-Y227 WeakPolarHBondContact O-CD2 3.49Å; L223-Y227 PolarHBondContact O-N 3.21Å
224	F	93.7	Very high	91.4	Very high	10 Å²	10	62.9 Å²	62.9	4%	0.044	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-46.9	177.2	-60.8	-16.4	0	0	0	112	S220 L221 V222 V226 Y228 I241 M280 T283 W284 M287	S220-F224 WeakPolarHBondContact O-CD1 3.39Å; S220-F224 WeakPolarHBondContact O-CE1 3.46Å; S220-F224 WeakPolarHBondContact O-CG 3.45Å; S220-F224 PolarHBondContact O-N 3.41Å; L221-F224 PolarHBondContact O-N 2.94Å; V222-F224 VanDerWaalsContact C-N 3.3Å; V222-F224 PolarHBondContact O-N 3.03Å; F224-V226 VanDerWaalsContact C-N 3.35Å; F224-V226 PolarHBondContact O-N 3.39Å; F224-Y228 WeakPolarHBondContact O-CA 3.12Å; F224-Y228 WeakPolarHBondContact O-CB 3.49Å; F224-Y228 PolarHBondContact O-N 2.67Å; F224-I241 HydrophobicContact CB-CD1 3.64Å; F224-I241 HydrophobicContact CB-CG1 4Å; F224-I241 HydrophobicContact CB-CG2 4.42Å; F224-I241 HydrophobicContact CD2-CG1 4.46Å; F224-M280 HydrophobicContact CE2-CB 4.06Å; F224-M280 HydrophobicContact CE2-SD 3.96Å; F224-M280 HydrophobicContact CZ-CB 4.24Å; F224-M280 VanDerWaalsContact CZ-O 3.26Å; F224-M280 WeakPolarHBondContact CZ-O 3.34Å; F224-T283 HydrophobicContact CE2-CG2 4.49Å; F224-W284 HydrophobicContact CE1-CB 3.59Å; F224-W284 AromaticContact CE1-CG 3.95Å; F224-W284 HydrophobicContact CE1-CG 3.95Å; F224-W284 HydrophobicContact CZ-CB 3.61Å; F224-W284 HydrophobicContact CZ-CG 4.42Å; F224-M287 HydrophobicContact CB-CE 3.92Å; F224-M287 HydrophobicContact CD1-CE 3.71Å; F224-M287 HydrophobicContact CD2-CE 3.96Å; F224-M287 HydrophobicContact CE1-CE 4.24Å; F224-M287 HydrophobicContact CE2-CE 4.44Å; F224-M287 HydrophobicContact CG-CE 3.59Å
225	Y	92.5	Very high	91.2	Very high	77 Å²	77	64.3 Å²	64.3	30%	0.302	36%	0.355	S	S	.	.	H	α-helix	trans	-66.1	-36.2	176.7	-80.9	-67.9	0	0	0	112.9	L221 V222 T229 I241 S242	L221-Y225 HydrophobicContact CD2-CD2 4.22Å; L221-Y225 HydrophobicContact CD2-CE2 4.15Å; L221-Y225 HydrophobicContact CG-CD2 4.26Å; L221-Y225 HydrophobicContact CG-CE2 4.15Å; L221-Y225 WeakPolarHBondContact O-CD2 3.23Å; L221-Y225 PolarHBondContact O-N 3.11Å; V222-Y225 PolarHBondContact O-N 3.11Å; Y225-T229 HydrophobicContact CD1-CG2 4.12Å; Y225-T229 PolarHBondContact O-OG1 3.27Å; Y225-I241 HydrophobicContact CD2-CG2 4Å; Y225-I241 HydrophobicContact CE1-CG2 4.26Å; Y225-I241 HydrophobicContact CE2-CB 4.47Å; Y225-I241 HydrophobicContact CE2-CG2 3.41Å; Y225-I241 VanDerWaalsContact CE2-CG2 3.41Å; Y225-S242 PolarHBondContact OH-OG 3.17Å
226	V	90.8	Very high	90.9	Very high	88 Å²	88	63.7 Å²	63.7	53%	0.533	35%	0.349	S	S	.	.	H	α-helix	trans	-72.4	-41.8	-178.6	171.3	0	0	0	0	112.4	V222 L223 F224	V222-V226 HydrophobicContact CG1-CG2 4.36Å; V222-V226 VanDerWaalsContact O-CG2 3.3Å; V222-V226 WeakPolarHBondContact O-CG2 3.39Å; V222-V226 PolarHBondContact O-N 3.33Å; L223-V226 PolarHBondContact O-N 3.32Å; F224-V226 VanDerWaalsContact C-N 3.35Å; F224-V226 PolarHBondContact O-N 3.39Å
227	Y	87.8	Confident	90.8	Very high	90 Å²	90	59.6 Å²	59.6	35%	0.353	33%	0.328	S	S	.	.	H	α-helix	trans	-103.8	-33.3	-171	-66.5	-65.9	0	0	0	114.4	L223 P297 I302	L223-Y227 HydrophobicContact CB-CD2 4.3Å; L223-Y227 HydrophobicContact CD2-CD2 4.14Å; L223-Y227 HydrophobicContact CD2-CE2 3.66Å; L223-Y227 WeakPolarHBondContact O-CD2 3.49Å; L223-Y227 PolarHBondContact O-N 3.21Å; Y227-P297 VanDerWaalsContact O-CG 3.26Å; Y227-P297 WeakPolarHBondContact O-CG 3.47Å; Y227-I302 HydrophobicContact CD1-CB 4.49Å; Y227-I302 HydrophobicContact CD1-CD1 4.28Å; Y227-I302 HydrophobicContact CD1-CG1 3.98Å; Y227-I302 HydrophobicContact CD1-CG2 3.89Å; Y227-I302 HydrophobicContact CD2-CG2 4.18Å; Y227-I302 HydrophobicContact CE1-CB 4.47Å; Y227-I302 HydrophobicContact CE1-CG1 4.44Å; Y227-I302 HydrophobicContact CE1-CG2 3.58Å; Y227-I302 HydrophobicContact CE2-CG2 3.88Å; Y227-I302 HydrophobicContact CG-CD1 4.02Å; Y227-I302 HydrophobicContact CG-CG1 4.24Å; Y227-I302 HydrophobicContact CG-CG2 4.19Å
228	Y	88.6	Confident	90.6	Very high	8 Å²	8	62 Å²	62	3%	0.031	34%	0.338	C	S	.	.	S	Bend	trans	-101.3	5.2	-174.7	-69.6	-93.3	0	0	0	113	F224 N237 W284 M287 T288	F224-Y228 WeakPolarHBondContact O-CA 3.12Å; F224-Y228 WeakPolarHBondContact O-CB 3.49Å; F224-Y228 PolarHBondContact O-N 2.67Å; Y228-N237 WeakPolarHBondContact O-CB 3.38Å; Y228-N237 PolarHBondContact O-ND2 3.23Å; Y228-W284 AromaticContact CE2-CD1 3.87Å; Y228-W284 AromaticContact CZ-CD1 3.76Å; Y228-W284 AromaticContact CZ-NE1 3.73Å; Y228-W284 PolarHBondContact OH-NE1 3.23Å; Y228-M287 HydrophobicContact CD1-CB 3.69Å; Y228-M287 HydrophobicContact CD2-CE 4.3Å; Y228-M287 HydrophobicContact CE1-CB 4.09Å; Y228-M287 HydrophobicContact CG-CB 4.29Å; Y228-M287 HydrophobicContact CG-CE 4.12Å; Y228-M287 HydrophobicContact CG-SD 4.32Å; Y228-T288 PolarHBondContact OH-OG1 2.89Å
229	T	90	Very high	90.6	Very high	18 Å²	18	60 Å²	60	11%	0.11	33%	0.33	C	S	.	.			trans	-134	146	176.8	84.9	0	0	0	0	112.3	Y225 N237 K238 I241	Y225-T229 HydrophobicContact CD1-CG2 4.12Å; Y225-T229 PolarHBondContact O-OG1 3.27Å; T229-N237 HydrophobicContact CG2-CB 4.38Å; T229-K238 HydrophobicContact CG2-CG 3.68Å; T229-I241 HydrophobicContact CG2-CD1 3.63Å
230	H	86.4	Confident	90.5	Very high	99 Å²	99	56.8 Å²	56.8	46%	0.458	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-126	154.7	176.9	-75.2	-74.3	0	0	0	110.7	D232 G233 K238 D294	H230-D232 VanDerWaalsContact C-N 3.31Å; H230-D232 PolarHBondContact O-N 3.33Å; H230-G233 VanDerWaalsContact O-O 3.04Å; H230-K238 WeakPolarHBondContact O-CE 3.39Å; H230-K238 PolarHBondContact O-NZ 3.34Å; H230-D294 PolarHBondContact NE2-O 2.96Å
231	S	81.8	Confident	90.6	Very high	101 Å²	101	55.8 Å²	55.8	71%	0.706	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-48	178.7	44.8	0	0	0	0	112.1	K238	S231-K238 PolarHBondContact O-NZ 3.07Å
232	D	79.8	Confident	90.6	Very high	161 Å²	161	57.3 Å²	57.3	86%	0.861	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	15.4	-168.8	-54.3	-62.9	0	0	0	113.8	H230	H230-D232 VanDerWaalsContact C-N 3.31Å; H230-D232 PolarHBondContact O-N 3.33Å
233	G	84.4	Confident	90.7	Very high	24 Å²	24	56.6 Å²	56.6	25%	0.247	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-165.4	-165.7	-177.6	0	0	0	0	0	114.7	H230 T235 K238	H230-G233 VanDerWaalsContact O-O 3.04Å; G233-T235 VanDerWaalsContact C-N 3.3Å; G233-T235 PolarHBondContact O-N 2.96Å; G233-K238 VanDerWaalsContact O-CE 3.32Å; G233-K238 WeakPolarHBondContact O-CE 3.47Å; G233-K238 PolarHBondContact O-NZ 3.21Å; G233-K238 VanDerWaalsContact O-NZ 3.07Å
234	C	88.7	Confident	90.9	Very high	17 Å²	17	53 Å²	53	12%	0.115	29%	0.289	C	S	.	.			trans	53.6	39.7	176.6	-46.9	0	0	0	0	114.6	E236 N237 K238 C295	C234-E236 VanDerWaalsContact C-N 3.26Å; C234-E236 PolarHBondContact O-N 2.03Å; C234-N237 PolarHBondContact O-N 2.87Å; C234-K238 PolarHBondContact O-N 3Å; C234-C295 WeakPolarHBondContact CA-SG 3.09Å; C234-C295 HydrophobicContact CB-CB 3.79Å; C234-C295 WeakPolarHBondContact CB-SG 3.39Å; C234-C295 WeakPolarHBondContact SG-CA 3.37Å; C234-C295 WeakPolarHBondContact SG-CB 3.41Å; C234-C295 CovalentContact SG-SG 2.03Å; C234-C295 PolarHBondContact SG-SG 3.42Å
235	T	91.3	Very high	91	Very high	88 Å²	88	55.5 Å²	55.5	54%	0.54	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-37.3	-177.2	-53.6	0	0	0	0	112.2	G233 K238 V239	G233-T235 VanDerWaalsContact C-N 3.3Å; G233-T235 PolarHBondContact O-N 2.96Å; T235-K238 WeakPolarHBondContact O-CB 3.46Å; T235-K238 PolarHBondContact O-N 2.98Å; T235-V239 HydrophobicContact CG2-CG2 4.35Å; T235-V239 VanDerWaalsContact O-CG2 3.32Å; T235-V239 WeakPolarHBondContact O-CG2 3.47Å; T235-V239 PolarHBondContact O-N 3.35Å
236	E	91.4	Very high	91.2	Very high	90 Å²	90	57.4 Å²	57.4	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-48	179.7	-57.6	-61.8	165.7	0	0	111.6	C234 K238 V239 F240 W426	C234-E236 VanDerWaalsContact C-N 3.26Å; C234-E236 PolarHBondContact O-N 2.03Å; E236-K238 VanDerWaalsContact C-N 3.34Å; E236-K238 PolarHBondContact O-N 3.3Å; E236-V239 PolarHBondContact O-N 2.8Å; E236-V239 VanDerWaalsContact O-N 3.14Å; E236-F240 HydrophobicContact CB-CE2 4.15Å; E236-F240 HydrophobicContact CB-CZ 4.4Å; E236-F240 WeakPolarHBondContact O-CD2 3.23Å; E236-F240 VanDerWaalsContact O-CG 3.27Å; E236-F240 WeakPolarHBondContact O-CG 3.44Å; E236-F240 PolarHBondContact O-N 3.42Å; E236-W426 HydrophobicContact CB-CH2 3.73Å; E236-W426 HydrophobicContact CB-CZ3 4.29Å; E236-W426 HydrophobicContact CG-CH2 3.63Å; E236-W426 HydrophobicContact CG-CZ2 4.32Å; E236-W426 HydrophobicContact CG-CZ3 4.42Å
237	N	93.4	Very high	91.4	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-43.5	174.4	-71.9	-8.1	0	0	0	111.7	Y228 T229 C234 V239 F240 I241 M287 C295	Y228-N237 WeakPolarHBondContact O-CB 3.38Å; Y228-N237 PolarHBondContact O-ND2 3.23Å; T229-N237 HydrophobicContact CG2-CB 4.38Å; C234-N237 PolarHBondContact O-N 2.87Å; N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 PolarHBondContact O-N 3.35Å; N237-F240 PolarHBondContact O-N 2.93Å; N237-I241 WeakPolarHBondContact O-CD1 3.36Å; N237-I241 WeakPolarHBondContact O-CG1 3.39Å; N237-I241 PolarHBondContact O-N 3.34Å; N237-M287 HydrophobicContact CB-CG 4.46Å; N237-M287 HydrophobicContact CB-SD 4.13Å; N237-C295 PolarHBondContact ND2-O 3.27Å
238	K	93.5	Very high	91.8	Very high	56 Å²	56	51.8 Å²	51.8	24%	0.243	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-43.6	175.8	-67.5	174.2	-174.3	165	0	111.6	T229 H230 S231 G233 C234 T235 E236 S242	T229-K238 HydrophobicContact CG2-CG 3.68Å; H230-K238 WeakPolarHBondContact O-CE 3.39Å; H230-K238 PolarHBondContact O-NZ 3.34Å; S231-K238 PolarHBondContact O-NZ 3.07Å; G233-K238 VanDerWaalsContact O-CE 3.32Å; G233-K238 WeakPolarHBondContact O-CE 3.47Å; G233-K238 PolarHBondContact O-NZ 3.21Å; G233-K238 VanDerWaalsContact O-NZ 3.07Å; C234-K238 PolarHBondContact O-N 3Å; T235-K238 WeakPolarHBondContact O-CB 3.46Å; T235-K238 PolarHBondContact O-N 2.98Å; E236-K238 VanDerWaalsContact C-N 3.34Å; E236-K238 PolarHBondContact O-N 3.3Å; K238-S242 VanDerWaalsContact O-CB 3.28Å; K238-S242 WeakPolarHBondContact O-CB 3.19Å; K238-S242 PolarHBondContact O-N 3.06Å; K238-S242 PolarHBondContact O-OG 3.46Å
239	V	94.9	Very high	92.1	Very high	62 Å²	62	55 Å²	55	38%	0.376	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-47.3	179.3	170.6	0	0	0	0	110.6	T235 E236 N237 I241 S242 I243	T235-V239 HydrophobicContact CG2-CG2 4.35Å; T235-V239 VanDerWaalsContact O-CG2 3.32Å; T235-V239 WeakPolarHBondContact O-CG2 3.47Å; T235-V239 PolarHBondContact O-N 3.35Å; E236-V239 PolarHBondContact O-N 2.8Å; E236-V239 VanDerWaalsContact O-N 3.14Å; N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 PolarHBondContact O-N 3.35Å; V239-I241 PolarHBondContact O-N 3.43Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-I243 HydrophobicContact CG1-CD1 3.6Å; V239-I243 HydrophobicContact CG1-CG1 4.31Å; V239-I243 WeakPolarHBondContact O-CG1 3.32Å; V239-I243 PolarHBondContact O-N 2.96Å
240	F	95.4	Very high	92.3	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.009	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-47.2	178.5	-62.4	-30.5	0	0	0	112.5	E236 N237 S242 N244 W426 V429 W430 I433	E236-F240 HydrophobicContact CB-CE2 4.15Å; E236-F240 HydrophobicContact CB-CZ 4.4Å; E236-F240 WeakPolarHBondContact O-CD2 3.23Å; E236-F240 VanDerWaalsContact O-CG 3.27Å; E236-F240 WeakPolarHBondContact O-CG 3.44Å; E236-F240 PolarHBondContact O-N 3.42Å; N237-F240 PolarHBondContact O-N 2.93Å; F240-S242 VanDerWaalsContact C-N 3.34Å; F240-S242 PolarHBondContact O-N 2.9Å; F240-N244 WeakPolarHBondContact O-CB 3.36Å; F240-N244 PolarHBondContact O-N 3.07Å; F240-W426 HydrophobicContact CE2-CZ3 4.14Å; F240-W426 HydrophobicContact CZ-CZ3 4.26Å; F240-V429 HydrophobicContact CE2-CG1 3.85Å; F240-V429 HydrophobicContact CZ-CG1 4.5Å; F240-W430 AromaticContact CE1-CH2 3.96Å; F240-W430 HydrophobicContact CE1-CH2 3.96Å; F240-W430 HydrophobicContact CE1-CZ2 4.28Å; F240-W430 HydrophobicContact CE1-CZ3 4.3Å; F240-W430 HydrophobicContact CZ-CH2 4.32Å; F240-W430 HydrophobicContact CZ-CZ2 4.19Å; F240-I433 HydrophobicContact CB-CD1 3.97Å; F240-I433 HydrophobicContact CD1-CG1 4.27Å; F240-I433 HydrophobicContact CD1-CG2 4.02Å; F240-I433 HydrophobicContact CD2-CD1 4.23Å; F240-I433 HydrophobicContact CD2-CG1 4.09Å; F240-I433 HydrophobicContact CE1-CG2 4.27Å; F240-I433 HydrophobicContact CE2-CG1 4.34Å; F240-I433 HydrophobicContact CG-CD1 4.01Å; F240-I433 HydrophobicContact CG-CG1 4.06Å
241	I	96.1	Very high	92.6	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-44.4	177.7	-60.8	158.6	0	0	0	110.3	L221 F224 Y225 T229 N237 V239 N244 L245 T283 M287	L221-I241 HydrophobicContact CD1-CG2 4.29Å; L221-I241 HydrophobicContact CG-CG2 4.49Å; F224-I241 HydrophobicContact CB-CD1 3.64Å; F224-I241 HydrophobicContact CB-CG1 4Å; F224-I241 HydrophobicContact CB-CG2 4.42Å; F224-I241 HydrophobicContact CD2-CG1 4.46Å; Y225-I241 HydrophobicContact CD2-CG2 4Å; Y225-I241 HydrophobicContact CE1-CG2 4.26Å; Y225-I241 HydrophobicContact CE2-CB 4.47Å; Y225-I241 HydrophobicContact CE2-CG2 3.41Å; Y225-I241 VanDerWaalsContact CE2-CG2 3.41Å; T229-I241 HydrophobicContact CG2-CD1 3.63Å; N237-I241 WeakPolarHBondContact O-CD1 3.36Å; N237-I241 WeakPolarHBondContact O-CG1 3.39Å; N237-I241 PolarHBondContact O-N 3.34Å; V239-I241 PolarHBondContact O-N 3.43Å; I241-N244 PolarHBondContact O-N 2.91Å; I241-L245 WeakPolarHBondContact O-CB 3.29Å; I241-L245 PolarHBondContact O-N 3.1Å; I241-T283 HydrophobicContact CG1-CG2 4.33Å; I241-M287 HydrophobicContact CD1-CE 4.41Å; I241-M287 HydrophobicContact CD1-SD 3.68Å; I241-M287 HydrophobicContact CG1-CE 4.25Å; I241-M287 HydrophobicContact CG1-SD 3.61Å
242	S	95.6	Very high	93.1	Very high	54 Å²	54	48.7 Å²	48.7	38%	0.378	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-44.4	-178.3	-61.7	0	0	0	0	112.6	Y225 K238 V239 F240 L246	Y225-S242 PolarHBondContact OH-OG 3.17Å; K238-S242 VanDerWaalsContact O-CB 3.28Å; K238-S242 WeakPolarHBondContact O-CB 3.19Å; K238-S242 PolarHBondContact O-N 3.06Å; K238-S242 PolarHBondContact O-OG 3.46Å; V239-S242 PolarHBondContact O-N 3.39Å; F240-S242 VanDerWaalsContact C-N 3.34Å; F240-S242 PolarHBondContact O-N 2.9Å; S242-L246 PolarHBondContact O-N 3.05Å
243	I	96.4	Very high	93.7	Very high	63 Å²	63	45 Å²	45	32%	0.323	26%	0.26	S	S	.	.	H	α-helix	trans	-63.6	-48.4	177.8	-69.3	171.5	0	0	0	110	V239 L245 L246 L247 W437	V239-I243 HydrophobicContact CG1-CD1 3.6Å; V239-I243 HydrophobicContact CG1-CG1 4.31Å; V239-I243 WeakPolarHBondContact O-CG1 3.32Å; V239-I243 PolarHBondContact O-N 2.96Å; I243-L245 VanDerWaalsContact C-N 3.34Å; I243-L245 PolarHBondContact O-N 3.49Å; I243-L246 PolarHBondContact O-N 3.4Å; I243-L247 HydrophobicContact CG2-CD1 3.8Å; I243-L247 HydrophobicContact CG2-CG 4.24Å; I243-L247 VanDerWaalsContact O-CG 3.31Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 2.78Å; I243-W437 HydrophobicContact CD1-CZ2 4.27Å; I243-W437 HydrophobicContact CG2-CZ2 4.26Å
244	N	96.6	Very high	94	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-36.8	-178.5	-77.4	-2.7	0	0	0	112.3	F240 I241 L247 C248 T279 T283 S436 W437	F240-N244 WeakPolarHBondContact O-CB 3.36Å; F240-N244 PolarHBondContact O-N 3.07Å; I241-N244 PolarHBondContact O-N 2.91Å; N244-L247 PolarHBondContact O-N 2.82Å; N244-C248 WeakPolarHBondContact O-CB 3.43Å; N244-C248 PolarHBondContact O-N 2.66Å; N244-C248 PolarHBondContact O-SG 3.2Å; N244-T279 HydrophobicContact CB-CG2 3.96Å; N244-T283 PolarHBondContact ND2-OG1 2.87Å; N244-S436 PolarHBondContact ND2-OG 3.42Å; N244-S436 VanDerWaalsContact ND2-OG 3.07Å; N244-S436 PolarHBondContact OD1-OG 2.9Å; N244-W437 PolarHBondContact OD1-NE1 3.07Å
245	L	95.7	Very high	94	Very high	64 Å²	64	44.9 Å²	44.9	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-56.8	-51.7	170.1	170.7	61	0	0	0	111.4	L221 I241 I243 L247 C248 V249	L221-L245 HydrophobicContact CD1-CB 3.81Å; L221-L245 HydrophobicContact CD1-CD1 3.69Å; L221-L245 HydrophobicContact CD1-CD2 4.08Å; L221-L245 HydrophobicContact CD1-CG 4.04Å; I241-L245 WeakPolarHBondContact O-CB 3.29Å; I241-L245 PolarHBondContact O-N 3.1Å; I243-L245 VanDerWaalsContact C-N 3.34Å; I243-L245 PolarHBondContact O-N 3.49Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 2.98Å; L245-C248 PolarHBondContact O-N 2.66Å; L245-V249 HydrophobicContact CD1-CG2 3.86Å; L245-V249 VanDerWaalsContact O-CG2 3.32Å; L245-V249 WeakPolarHBondContact O-CG2 3.45Å; L245-V249 PolarHBondContact O-N 3.17Å
246	L	96.2	Very high	93.9	Very high	116 Å²	116	44.1 Å²	44.1	61%	0.607	25%	0.246	S	C	*	.	H	α-helix	trans	-60.3	-44.2	-178.8	178.5	63.4	0	0	0	111.5	S242 I243 V249 T250	S242-L246 PolarHBondContact O-N 3.05Å; I243-L246 PolarHBondContact O-N 3.4Å; L246-V249 PolarHBondContact O-N 2.84Å; L246-T250 WeakPolarHBondContact O-CB 3.46Å; L246-T250 PolarHBondContact O-N 3.47Å; L246-T250 PolarHBondContact O-OG1 3.39Å
247	L	96	Very high	93.8	Very high	57 Å²	57	43.2 Å²	43.2	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-64.5	-43.9	178.4	-69	176.7	0	0	0	112	I243 N244 L245 T250 A251 W437 I440	I243-L247 HydrophobicContact CG2-CD1 3.8Å; I243-L247 HydrophobicContact CG2-CG 4.24Å; I243-L247 VanDerWaalsContact O-CG 3.31Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 2.78Å; N244-L247 PolarHBondContact O-N 2.82Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 2.98Å; L247-T250 PolarHBondContact O-N 3.15Å; L247-A251 WeakPolarHBondContact O-CB 3.48Å; L247-A251 PolarHBondContact O-N 3.27Å; L247-W437 HydrophobicContact CD1-CG 4.3Å; L247-I440 HydrophobicContact CB-CD1 3.55Å; L247-I440 HydrophobicContact CB-CG2 4.09Å; L247-I440 HydrophobicContact CD1-CD1 4.1Å; L247-I440 HydrophobicContact CG-CD1 4.49Å
248	C	95.9	Very high	93.5	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.027	27%	0.269	C	S	.	.	H	α-helix	trans	-65.7	-40.3	177.3	-72.1	0	0	0	0	112.9	N244 L245 S252 T276 M280	N244-C248 WeakPolarHBondContact O-CB 3.43Å; N244-C248 PolarHBondContact O-N 2.66Å; N244-C248 PolarHBondContact O-SG 3.2Å; L245-C248 PolarHBondContact O-N 2.66Å; C248-S252 WeakPolarHBondContact O-CB 3.47Å; C248-S252 PolarHBondContact O-N 3.16Å; C248-S252 PolarHBondContact O-OG 3.3Å; C248-T276 HydrophobicContact CB-CG2 3.8Å; C248-M280 HydrophobicContact CB-CE 4.31Å
249	V	94.8	Very high	93.1	Very high	75 Å²	75	51 Å²	51	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-46.4	174.7	170.1	0	0	0	0	109.9	L245 L246 A251 S252 V253	L245-V249 HydrophobicContact CD1-CG2 3.86Å; L245-V249 VanDerWaalsContact O-CG2 3.32Å; L245-V249 WeakPolarHBondContact O-CG2 3.45Å; L245-V249 PolarHBondContact O-N 3.17Å; L246-V249 PolarHBondContact O-N 2.84Å; V249-A251 PolarHBondContact O-N 3.32Å; V249-S252 PolarHBondContact O-N 2.79Å; V249-V253 HydrophobicContact CG1-CG2 4.45Å; V249-V253 WeakPolarHBondContact O-CG2 3.45Å; V249-V253 PolarHBondContact O-N 3.47Å
250	T	93.6	Very high	92.7	Very high	65 Å²	65	48.4 Å²	48.4	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-60.1	-48.3	178.3	-56	0	0	0	0	111.2	L246 L247 S252 V253 M254	L246-T250 WeakPolarHBondContact O-CB 3.46Å; L246-T250 PolarHBondContact O-N 3.47Å; L246-T250 PolarHBondContact O-OG1 3.39Å; L247-T250 PolarHBondContact O-N 3.15Å; T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 3.1Å; T250-V253 PolarHBondContact O-N 3.35Å; T250-M254 HydrophobicContact CG2-SD 4.09Å; T250-M254 VanDerWaalsContact O-CG 3.28Å; T250-M254 WeakPolarHBondContact O-CG 3.29Å; T250-M254 PolarHBondContact O-N 3.44Å
251	A	92.8	Very high	92.1	Very high	2 Å²	2	52 Å²	52	2%	0.017	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-37.5	177.6	0	0	0	0	0	112.8	L247 V249 M254 S255 I440 Y443 V444	L247-A251 WeakPolarHBondContact O-CB 3.48Å; L247-A251 PolarHBondContact O-N 3.27Å; V249-A251 PolarHBondContact O-N 3.32Å; A251-M254 PolarHBondContact O-N 3.24Å; A251-S255 PolarHBondContact O-N 3Å; A251-S255 VanDerWaalsContact O-N 3.08Å; A251-I440 HydrophobicContact CB-CG2 4.03Å; A251-Y443 HydrophobicContact CB-CD1 4.12Å; A251-Y443 HydrophobicContact CB-CE1 4.23Å; A251-V444 HydrophobicContact CB-CG2 3.87Å
252	S	93	Very high	91.5	Very high	19 Å²	19	59.5 Å²	59.5	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-72	-33.7	176.8	-60	0	0	0	0	113	Y214 C248 V249 T250 S255	Y214-S252 WeakPolarHBondContact CE1-OG 3.33Å; Y214-S252 VanDerWaalsContact OH-CB 3.31Å; Y214-S252 WeakPolarHBondContact OH-CB 3.32Å; Y214-S252 PolarHBondContact OH-OG 3.36Å; C248-S252 WeakPolarHBondContact O-CB 3.47Å; C248-S252 PolarHBondContact O-N 3.16Å; C248-S252 PolarHBondContact O-OG 3.3Å; V249-S252 PolarHBondContact O-N 2.79Å; T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 3.1Å; S252-S255 PolarHBondContact O-OG 3.05Å
253	V	92.4	Very high	90.7	Very high	84 Å²	84	59.8 Å²	59.8	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-68.2	-44.1	172.8	170.3	0	0	0	0	109.9	V249 T250 S255 V256 L257	V249-V253 HydrophobicContact CG1-CG2 4.45Å; V249-V253 WeakPolarHBondContact O-CG2 3.45Å; V249-V253 PolarHBondContact O-N 3.47Å; T250-V253 PolarHBondContact O-N 3.35Å; V253-S255 VanDerWaalsContact C-N 3.33Å; V253-S255 PolarHBondContact O-N 3.35Å; V253-V256 PolarHBondContact O-N 3.31Å; V253-V256 VanDerWaalsContact O-N 3.17Å; V253-L257 PolarHBondContact O-N 3.27Å
254	M	90.8	Very high	89.6	Confident	38 Å²	38	59 Å²	59	19%	0.187	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-39.4	178.9	-70.4	179.3	73	0	0	112.5	T250 A251 V256 L257 I260 V444 V448	T250-M254 HydrophobicContact CG2-SD 4.09Å; T250-M254 VanDerWaalsContact O-CG 3.28Å; T250-M254 WeakPolarHBondContact O-CG 3.29Å; T250-M254 PolarHBondContact O-N 3.44Å; A251-M254 PolarHBondContact O-N 3.24Å; M254-V256 PolarHBondContact O-N 3.44Å; M254-V256 VanDerWaalsContact O-N 3.1Å; M254-L257 HydrophobicContact CG-CD1 4.38Å; M254-L257 PolarHBondContact O-N 3.47Å; M254-I260 HydrophobicContact CB-CD1 4.02Å; M254-I260 HydrophobicContact CE-CD1 4.34Å; M254-I260 WeakPolarHBondContact O-CD1 3.47Å; M254-V444 HydrophobicContact CE-CG1 3.57Å; M254-V444 HydrophobicContact SD-CG1 3.77Å; M254-V444 HydrophobicContact SD-CG2 4.31Å; M254-V448 HydrophobicContact CE-CG2 3.29Å
255	S	89	Confident	88.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.5	179.1	67.6	0	0	0	0	114.5	A251 S252 V253 S272	A251-S255 PolarHBondContact O-N 3Å; A251-S255 VanDerWaalsContact O-N 3.08Å; S252-S255 PolarHBondContact O-OG 3.05Å; V253-S255 VanDerWaalsContact C-N 3.33Å; V253-S255 PolarHBondContact O-N 3.35Å; S255-S272 WeakPolarHBondContact OG-CB 3.46Å; S255-S272 PolarHBondContact OG-OG 3.39Å
256	V	89.4	Confident	87	Confident	72 Å²	72	67 Å²	67	44%	0.436	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-4.3	179.8	-171.5	0	0	0	0	112.7	V253 M254 L269	V253-V256 PolarHBondContact O-N 3.31Å; V253-V256 VanDerWaalsContact O-N 3.17Å; M254-V256 PolarHBondContact O-N 3.44Å; M254-V256 VanDerWaalsContact O-N 3.1Å; V256-L269 HydrophobicContact CG2-CD1 3.71Å
257	L	88.9	Confident	85.8	Confident	70 Å²	70	61.8 Å²	61.8	37%	0.366	34%	0.335	S	S	.	.			trans	-63.9	130.3	179.6	-75.9	172.3	0	0	0	110.6	V253 M254 Q259 I260 Q261	V253-L257 PolarHBondContact O-N 3.27Å; M254-L257 HydrophobicContact CG-CD1 4.38Å; M254-L257 PolarHBondContact O-N 3.47Å; L257-Q259 PolarHBondContact O-N 3.33Å; L257-I260 HydrophobicContact CB-CD1 4.33Å; L257-I260 HydrophobicContact CD1-CD1 4.34Å; L257-I260 PolarHBondContact O-N 3.31Å; L257-Q261 PolarHBondContact O-N 3.46Å; L257-Q261 VanDerWaalsContact O-N 3.09Å
258	P	85.9	Confident	84.9	Confident	83 Å²	83	59.6 Å²	59.6	54%	0.539	33%	0.326	S	S	.	.	H	α-helix	trans	-54.8	-39.1	-178.2	-27.9	34.3	0	0	0	113.3	I260 Q261 E262	P258-I260 VanDerWaalsContact C-N 3.3Å; P258-I260 PolarHBondContact O-N 2.78Å; P258-Q261 PolarHBondContact O-N 3.39Å; P258-E262 WeakPolarHBondContact O-CB 3.37Å; P258-E262 WeakPolarHBondContact O-CG 3.41Å; P258-E262 PolarHBondContact O-N 2.93Å
259	Q	85.9	Confident	84.5	Confident	138 Å²	138	62.9 Å²	62.9	65%	0.645	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-38.7	178.3	-63	-174.4	-62.2	0	0	112.8	L257 S263	L257-Q259 PolarHBondContact O-N 3.33Å; Q259-S263 PolarHBondContact O-N 2.9Å; Q259-S263 PolarHBondContact O-OG 2.79Å
260	I	85.6	Confident	84.3	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-73	-42.1	177.8	-72.2	169.3	0	0	0	109.9	M254 L257 P258 E262 S263 Q264 L447 L451	M254-I260 HydrophobicContact CB-CD1 4.02Å; M254-I260 HydrophobicContact CE-CD1 4.34Å; M254-I260 WeakPolarHBondContact O-CD1 3.47Å; L257-I260 HydrophobicContact CB-CD1 4.33Å; L257-I260 HydrophobicContact CD1-CD1 4.34Å; L257-I260 PolarHBondContact O-N 3.31Å; P258-I260 VanDerWaalsContact C-N 3.3Å; P258-I260 PolarHBondContact O-N 2.78Å; I260-E262 VanDerWaalsContact C-N 3.32Å; I260-E262 PolarHBondContact O-N 3.34Å; I260-S263 PolarHBondContact O-N 2.87Å; I260-Q264 PolarHBondContact O-N 3.11Å; I260-L447 HydrophobicContact CG2-CB 4.15Å; I260-L447 HydrophobicContact CG2-CD2 4.32Å; I260-L451 HydrophobicContact CB-CD1 4.47Å; I260-L451 HydrophobicContact CG1-CD1 3.49Å; I260-L451 VanDerWaalsContact CG1-CD1 3.49Å
261	Q	83.6	Confident	84.2	Confident	79 Å²	79	56.6 Å²	56.6	37%	0.369	30%	0.304	S	S	.	.	H	α-helix	trans	-66.2	-32.7	178.6	-67.9	-175	-18.1	0	0	112.9	L257 P258 Q264 P265	L257-Q261 PolarHBondContact O-N 3.46Å; L257-Q261 VanDerWaalsContact O-N 3.09Å; P258-Q261 PolarHBondContact O-N 3.39Å; Q261-Q264 CarbonylContact O-C 3.26Å; Q261-Q264 VanDerWaalsContact O-C 3.26Å; Q261-P265 WeakPolarHBondContact O-CA 3.48Å; Q261-P265 VanDerWaalsContact O-N 3.14Å
262	E	83.6	Confident	84.3	Confident	158 Å²	158	56.6 Å²	56.6	74%	0.738	30%	0.304	S	S	*	.	H	α-helix	trans	-66.1	-37.4	174.5	-77.4	174.3	-172	0	0	112.2	P258 I260	P258-E262 WeakPolarHBondContact O-CB 3.37Å; P258-E262 WeakPolarHBondContact O-CG 3.41Å; P258-E262 PolarHBondContact O-N 2.93Å; I260-E262 VanDerWaalsContact C-N 3.32Å; I260-E262 PolarHBondContact O-N 3.34Å
263	S	78.7	Confident	84.4	Confident	60 Å²	60	55.7 Å²	55.7	42%	0.42	30%	0.297	S	S	.	.	H	α-helix	trans	-85.8	-21.3	179.1	-62.2	0	0	0	0	113.5	Q259 I260 L451	Q259-S263 PolarHBondContact O-N 2.9Å; Q259-S263 PolarHBondContact O-OG 2.79Å; I260-S263 PolarHBondContact O-N 2.87Å; S263-L451 WeakPolarHBondContact OG-CD2 3.37Å
264	Q	74.5	Confident	84.5	Confident	48 Å²	48	53.1 Å²	53.1	22%	0.224	28%	0.281	C	S	.	.			trans	-141.4	81.7	177.2	-161.8	174.2	8.3	0	0	109.6	I260 Q261 R266 S267 T446	I260-Q264 PolarHBondContact O-N 3.11Å; Q261-Q264 CarbonylContact O-C 3.26Å; Q261-Q264 VanDerWaalsContact O-C 3.26Å; Q264-R266 PolarHBondContact O-N 3.35Å; Q264-R266 VanDerWaalsContact O-N 3.09Å; Q264-S267 WeakPolarHBondContact CB-OG 3Å; Q264-S267 WeakPolarHBondContact CG-OG 3.1Å; Q264-S267 VanDerWaalsContact O-CB 3.26Å; Q264-S267 WeakPolarHBondContact O-CB 3.5Å; Q264-S267 PolarHBondContact O-N 2.89Å; Q264-S267 PolarHBondContact OE1-OG 2.97Å; Q264-T446 PolarHBondContact OE1-O 3.07Å
265	P	68.8	Low	84.6	Confident	112 Å²	112	51.5 Å²	51.5	73%	0.727	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.2	-174.4	24.1	-33.7	0	0	0	113.3	Q261	Q261-P265 WeakPolarHBondContact O-CA 3.48Å; Q261-P265 VanDerWaalsContact O-N 3.14Å
266	R	68.7	Low	85	Confident	120 Å²	120	51.9 Å²	51.9	45%	0.453	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	2.2	175	-63.8	-174.8	172.3	179.7	0.3	113.7	N187 E188 Q264 Q271	N187-R266 PolarHBondContact ND2-O 3.22Å; E188-R266 WeakPolarHBondContact OE1-CD 3.48Å; E188-R266 IonicContact OE1-CZ 3.58Å; E188-R266 IonicContact OE1-NE 3.89Å; E188-R266 IonicContact OE1-NH1 2.61Å; E188-R266 PolarHBondContact OE1-NH1 3.28Å; Q264-R266 PolarHBondContact O-N 3.35Å; Q264-R266 VanDerWaalsContact O-N 3.09Å; R266-Q271 PolarHBondContact O-NE2 2.83Å
267	S	69.8	Low	85.3	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.049	26%	0.263	C	S	.	.			trans	-73.7	125.5	168.7	-75.9	0	0	0	0	110	Q264 L447	Q264-S267 WeakPolarHBondContact CB-OG 3Å; Q264-S267 WeakPolarHBondContact CG-OG 3.1Å; Q264-S267 VanDerWaalsContact O-CB 3.26Å; Q264-S267 WeakPolarHBondContact O-CB 3.5Å; Q264-S267 PolarHBondContact O-N 2.89Å; Q264-S267 PolarHBondContact OE1-OG 2.97Å; S267-L447 WeakPolarHBondContact OG-CD2 2.93Å
268	G	78	Confident	85.6	Confident	11 Å²	11	47.2 Å²	47.2	11%	0.113	25%	0.247	C	C	.	.			trans	-134.8	155.1	-170.8	0	0	0	0	0	113.3	L270 Q271	G268-L270 PolarHBondContact O-N 3.5Å; G268-Q271 WeakPolarHBondContact O-CB 2.99Å; G268-Q271 PolarHBondContact O-N 2.86Å; G268-Q271 VanDerWaalsContact O-N 3.11Å
269	L	87.6	Confident	86	Confident	72 Å²	72	43.3 Å²	43.3	38%	0.377	22%	0.222	S	C	.	.	H	α-helix	trans	-62.4	-22.8	178.4	-169	70.2	0	0	0	112.6	T210 Y214 V256 Q271 S272 S273	T210-L269 HydrophobicContact CG2-CB 4.02Å; T210-L269 HydrophobicContact CG2-CD2 3.66Å; T210-L269 HydrophobicContact CG2-CG 3.59Å; Y214-L269 HydrophobicContact CE2-CD1 3.95Å; Y214-L269 HydrophobicContact CE2-CD2 4.26Å; Y214-L269 HydrophobicContact CE2-CG 3.86Å; V256-L269 HydrophobicContact CG2-CD1 3.71Å; L269-Q271 VanDerWaalsContact C-N 3.32Å; L269-Q271 PolarHBondContact O-N 3.28Å; L269-S272 PolarHBondContact O-OG 2.88Å; L269-S273 WeakPolarHBondContact O-CB 3.34Å; L269-S273 PolarHBondContact O-N 2.92Å
270	L	90.5	Very high	86.5	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-44.6	173.7	-177.1	71.9	0	0	0	111.2	W186 N187 L206 V209 T210 G268 S273 L274	W186-L270 HydrophobicContact CD2-CD2 4.49Å; W186-L270 HydrophobicContact CG-CD2 4.19Å; N187-L270 HydrophobicContact CB-CD2 4.19Å; L206-L270 HydrophobicContact CD1-CB 3.89Å; L206-L270 HydrophobicContact CD1-CD1 4.44Å; L206-L270 HydrophobicContact CD1-CD2 3.76Å; L206-L270 HydrophobicContact CD1-CG 4.23Å; V209-L270 HydrophobicContact CB-CD1 4.04Å; V209-L270 HydrophobicContact CG1-CD1 3.58Å; T210-L270 WeakPolarHBondContact OG1-CA 3Å; G268-L270 PolarHBondContact O-N 3.5Å; L270-S273 PolarHBondContact O-N 3.29Å; L270-S273 PolarHBondContact O-OG 3.34Å; L270-L274 PolarHBondContact O-N 3.36Å
271	Q	91.5	Very high	87	Confident	2 Å²	2	38 Å²	38	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-49.6	-177.9	-64.5	154.6	-2.7	0	0	110.6	A183 H184 N187 R266 G268 L269 S273 L274 V275 Y443	A183-Q271 HydrophobicContact CB-CB 4.36Å; A183-Q271 HydrophobicContact CB-CG 4.21Å; H184-Q271 PolarHBondContact CE1-OE1 2.65Å; H184-Q271 VanDerWaalsContact CE1-OE1 3.31Å; H184-Q271 PolarHBondContact ND1-NE2 3.41Å; H184-Q271 PolarHBondContact ND1-OE1 3.26Å; N187-Q271 HydrophobicContact CB-CG 3.96Å; N187-Q271 PolarHBondContact ND2-NE2 2.89Å; R266-Q271 PolarHBondContact O-NE2 2.83Å; G268-Q271 WeakPolarHBondContact O-CB 2.99Å; G268-Q271 PolarHBondContact O-N 2.86Å; G268-Q271 VanDerWaalsContact O-N 3.11Å; L269-Q271 VanDerWaalsContact C-N 3.32Å; L269-Q271 PolarHBondContact O-N 3.28Å; Q271-S273 VanDerWaalsContact C-N 3.29Å; Q271-S273 PolarHBondContact O-N 2.86Å; Q271-L274 PolarHBondContact O-N 2.85Å; Q271-V275 WeakPolarHBondContact O-CG2 3.2Å; Q271-V275 PolarHBondContact O-N 3.3Å; Q271-Y443 HydrophobicContact CB-CE2 3.93Å
272	S	93.4	Very high	87.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-34	178	52.9	0	0	0	0	112.5	Y214 S255 L269 T276 Y443	Y214-S272 WeakPolarHBondContact OH-CB 3.3Å; Y214-S272 PolarHBondContact OH-OG 3.09Å; S255-S272 WeakPolarHBondContact OG-CB 3.46Å; S255-S272 PolarHBondContact OG-OG 3.39Å; L269-S272 PolarHBondContact O-OG 2.88Å; S272-T276 VanDerWaalsContact O-CB 3.3Å; S272-T276 WeakPolarHBondContact O-CB 3.29Å; S272-T276 PolarHBondContact O-N 3.03Å; S272-T276 PolarHBondContact O-OG1 3.21Å; S272-Y443 WeakPolarHBondContact CA-OH 2.98Å; S272-Y443 WeakPolarHBondContact CB-OH 3.35Å; S272-Y443 PolarHBondContact N-OH 3.4Å
273	S	95.4	Very high	88	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-40.7	176.4	80.7	0	0	0	0	112.5	N213 Y214 L269 L270 Q271 T276 L277	N213-S273 WeakPolarHBondContact CB-OG 3.15Å; N213-S273 PolarHBondContact ND2-OG 2.86Å; N213-S273 VanDerWaalsContact ND2-OG 3.15Å; Y214-S273 PolarHBondContact OH-N 2.7Å; L269-S273 WeakPolarHBondContact O-CB 3.34Å; L269-S273 PolarHBondContact O-N 2.92Å; L270-S273 PolarHBondContact O-N 3.29Å; L270-S273 PolarHBondContact O-OG 3.34Å; Q271-S273 VanDerWaalsContact C-N 3.29Å; Q271-S273 PolarHBondContact O-N 2.86Å; S273-T276 PolarHBondContact O-N 3.25Å; S273-L277 PolarHBondContact O-N 2.06Å
274	L	94.6	Very high	88.7	Confident	31 Å²	31	26 Å²	26	16%	0.162	13%	0.132	C	C	.	.	H	α-helix	trans	-69.7	-44.1	178.7	-167.2	83.9	0	0	0	111	L179 F182 A183 L270 Q271 T276 L277 Y278	L179-L274 HydrophobicContact CD2-CD2 3.82Å; L179-L274 HydrophobicContact CD2-CG 4.35Å; L179-L274 HydrophobicContact CG-CD2 4.18Å; F182-L274 HydrophobicContact CD1-CD2 4.21Å; F182-L274 HydrophobicContact CE1-CD2 4.48Å; A183-L274 HydrophobicContact CB-CB 4.5Å; A183-L274 HydrophobicContact CB-CD2 3.6Å; L270-L274 PolarHBondContact O-N 3.36Å; Q271-L274 PolarHBondContact O-N 2.85Å; L274-T276 VanDerWaalsContact C-N 3.32Å; L274-T276 PolarHBondContact O-N 3.36Å; L274-L277 PolarHBondContact O-N 3.18Å; L274-Y278 PolarHBondContact O-N 3.08Å
275	V	94	Very high	89.6	Confident	3 Å²	3	24 Å²	24	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-59.9	-44.9	175.5	171.7	0	0	0	0	110.2	I180 Q271 L277 Y278 T279 Y443	I180-V275 HydrophobicContact CG1-CG2 4.18Å; Q271-V275 WeakPolarHBondContact O-CG2 3.2Å; Q271-V275 PolarHBondContact O-N 3.3Å; V275-L277 PolarHBondContact O-N 3.48Å; V275-Y278 PolarHBondContact O-N 2.88Å; V275-T279 PolarHBondContact O-N 3.32Å; V275-T279 PolarHBondContact O-OG1 3.21Å; V275-T279 VanDerWaalsContact O-OG1 3.07Å; V275-Y443 HydrophobicContact CB-CD1 4.41Å; V275-Y443 HydrophobicContact CB-CG 4.39Å; V275-Y443 HydrophobicContact CG1-CD1 4.14Å; V275-Y443 HydrophobicContact CG1-CG 4.15Å; V275-Y443 HydrophobicContact CG2-CD1 4.35Å; V275-Y443 HydrophobicContact CG2-CD2 3.88Å; V275-Y443 HydrophobicContact CG2-CE2 4.36Å; V275-Y443 HydrophobicContact CG2-CG 3.87Å
276	T	95.9	Very high	90.7	Very high	8 Å²	8	18.7 Å²	18.7	5%	0.049	9%	0.088	C	C	.	.	H	α-helix	trans	-59	-47.2	176.5	-62	0	0	0	0	111.7	Y214 C248 S272 S273 L274 Y278 T279 M280	Y214-T276 HydrophobicContact CE1-CG2 4.41Å; C248-T276 HydrophobicContact CB-CG2 3.8Å; S272-T276 VanDerWaalsContact O-CB 3.3Å; S272-T276 WeakPolarHBondContact O-CB 3.29Å; S272-T276 PolarHBondContact O-N 3.03Å; S272-T276 PolarHBondContact O-OG1 3.21Å; S273-T276 PolarHBondContact O-N 3.25Å; L274-T276 VanDerWaalsContact C-N 3.32Å; L274-T276 PolarHBondContact O-N 3.36Å; T276-Y278 VanDerWaalsContact C-N 3.33Å; T276-Y278 PolarHBondContact O-N 3.35Å; T276-T279 WeakPolarHBondContact O-CB 3.44Å; T276-T279 PolarHBondContact O-N 2.73Å; T276-M280 HydrophobicContact CG2-CE 4.12Å; T276-M280 WeakPolarHBondContact O-CG 3.39Å; T276-M280 PolarHBondContact O-N 3.33Å
277	L	96.1	Very high	91.7	Very high	36 Å²	36	13 Å²	13	19%	0.188	7%	0.067	C	C	.	.	H	α-helix	trans	-62.2	-41.6	178.9	-179.6	61.3	0	0	0	111.9	L216 S217 S273 L274 V275 M280 Y281	L216-L277 HydrophobicContact CB-CD1 4.06Å; L216-L277 HydrophobicContact CD2-CD1 3.63Å; L216-L277 HydrophobicContact CD2-CD2 3.98Å; L216-L277 HydrophobicContact CD2-CG 4.45Å; L216-L277 HydrophobicContact CG-CD1 3.66Å; S217-L277 VanDerWaalsContact OG-CA 3.32Å; S217-L277 WeakPolarHBondContact OG-CA 3.32Å; S217-L277 PolarHBondContact OG-N 3.18Å; S273-L277 PolarHBondContact O-N 2.06Å; L274-L277 PolarHBondContact O-N 3.18Å; V275-L277 PolarHBondContact O-N 3.48Å; L277-M280 WeakPolarHBondContact O-CB 3.39Å; L277-M280 PolarHBondContact O-N 3.08Å; L277-Y281 PolarHBondContact O-N 3.4Å
278	Y	95.1	Very high	92.5	Very high	9 Å²	9	12.9 Å²	12.9	4%	0.035	7%	0.066	C	C	.	.	H	α-helix	trans	-66.3	-38.5	176.4	-175.8	-91.6	0	0	0	112.2	Q175 L176 L179 L274 V275 T276 M280 Y281 L282 L330	Q175-Y278 PolarHBondContact OE1-OH 3.47Å; L176-Y278 HydrophobicContact CD2-CD1 3.56Å; L176-Y278 HydrophobicContact CD2-CE1 3.08Å; L176-Y278 HydrophobicContact CG-CE1 4Å; L179-Y278 HydrophobicContact CD1-CD1 4.48Å; L179-Y278 HydrophobicContact CD1-CD2 3.3Å; L179-Y278 HydrophobicContact CD1-CE2 3.74Å; L179-Y278 HydrophobicContact CD1-CG 3.7Å; L274-Y278 PolarHBondContact O-N 3.08Å; V275-Y278 PolarHBondContact O-N 2.88Å; T276-Y278 VanDerWaalsContact C-N 3.33Å; T276-Y278 PolarHBondContact O-N 3.35Å; Y278-M280 VanDerWaalsContact C-N 3.31Å; Y278-M280 PolarHBondContact O-N 2.94Å; Y278-Y281 HydrophobicContact CD2-CD1 4.22Å; Y278-Y281 HydrophobicContact CE2-CD1 4.08Å; Y278-Y281 HydrophobicContact CE2-CE1 4.38Å; Y278-Y281 WeakPolarHBondContact O-CB 3.46Å; Y278-Y281 PolarHBondContact O-N 3.44Å; Y278-L282 HydrophobicContact CD1-CD1 4.1Å; Y278-L282 HydrophobicContact CD1-CG 4.12Å; Y278-L282 HydrophobicContact CE1-CD1 3.4Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.4Å; Y278-L282 HydrophobicContact CE1-CD2 4.13Å; Y278-L282 HydrophobicContact CE1-CG 3.52Å; Y278-L282 PolarHBondContact O-N 3.11Å; Y278-L330 HydrophobicContact CD2-CD1 4.18Å; Y278-L330 HydrophobicContact CD2-CD2 4.38Å; Y278-L330 HydrophobicContact CE2-CD1 3.87Å; Y278-L330 HydrophobicContact CE2-CD2 4.42Å
279	T	95.6	Very high	92.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-59.9	-41.7	171.8	-60.9	0	0	0	0	111.3	N244 V275 T276 Y281 L282 T283 I440	N244-T279 HydrophobicContact CB-CG2 3.96Å; V275-T279 PolarHBondContact O-N 3.32Å; V275-T279 PolarHBondContact O-OG1 3.21Å; V275-T279 VanDerWaalsContact O-OG1 3.07Å; T276-T279 WeakPolarHBondContact O-CB 3.44Å; T276-T279 PolarHBondContact O-N 2.73Å; T279-Y281 VanDerWaalsContact C-N 3.31Å; T279-Y281 PolarHBondContact O-N 2.69Å; T279-L282 PolarHBondContact O-N 3.43Å; T279-T283 WeakPolarHBondContact O-CB 3.42Å; T279-T283 PolarHBondContact O-N 3.37Å; T279-T283 PolarHBondContact O-OG1 2.95Å; T279-I440 HydrophobicContact CG2-CD1 3.68Å; T279-I440 HydrophobicContact CG2-CG1 4.4Å
280	M	95.9	Very high	92.9	Very high	8 Å²	8	9.5 Å²	9.5	4%	0.039	5%	0.045	C	C	.	.	H	α-helix	trans	-61.2	-41.8	175.2	-63.2	-55.3	145.2	0	0	111.2	F224 C248 T276 L277 Y278 T283 W284	F224-M280 HydrophobicContact CE2-CB 4.06Å; F224-M280 HydrophobicContact CE2-SD 3.96Å; F224-M280 HydrophobicContact CZ-CB 4.24Å; F224-M280 VanDerWaalsContact CZ-O 3.26Å; F224-M280 WeakPolarHBondContact CZ-O 3.34Å; C248-M280 HydrophobicContact CB-CE 4.31Å; T276-M280 HydrophobicContact CG2-CE 4.12Å; T276-M280 WeakPolarHBondContact O-CG 3.39Å; T276-M280 PolarHBondContact O-N 3.33Å; L277-M280 WeakPolarHBondContact O-CB 3.39Å; L277-M280 PolarHBondContact O-N 3.08Å; Y278-M280 VanDerWaalsContact C-N 3.31Å; Y278-M280 PolarHBondContact O-N 2.94Å; M280-T283 PolarHBondContact O-N 3.07Å; M280-W284 WeakPolarHBondContact O-CB 3.12Å; M280-W284 PolarHBondContact O-N 2.78Å
281	Y	94.9	Very high	92.7	Very high	25 Å²	25	11.3 Å²	11.3	10%	0.098	6%	0.058	C	C	.	.	H	α-helix	trans	-60.2	-47.6	173.7	162.8	-102.6	0	0	0	112.7	L277 Y278 T279 T283 W284 S285 Q323 V326 G327 L330	L277-Y281 PolarHBondContact O-N 3.4Å; Y278-Y281 HydrophobicContact CD2-CD1 4.22Å; Y278-Y281 HydrophobicContact CE2-CD1 4.08Å; Y278-Y281 HydrophobicContact CE2-CE1 4.38Å; Y278-Y281 WeakPolarHBondContact O-CB 3.46Å; Y278-Y281 PolarHBondContact O-N 3.44Å; T279-Y281 VanDerWaalsContact C-N 3.31Å; T279-Y281 PolarHBondContact O-N 2.69Å; Y281-T283 VanDerWaalsContact C-N 3.31Å; Y281-T283 PolarHBondContact O-N 3.14Å; Y281-W284 HydrophobicContact CD2-CE3 4.18Å; Y281-W284 PolarHBondContact O-N 2.85Å; Y281-S285 WeakPolarHBondContact O-CB 3.48Å; Y281-S285 PolarHBondContact O-N 3.28Å; Y281-Q323 PolarHBondContact OH-O 3.44Å; Y281-V326 HydrophobicContact CD2-CB 4.07Å; Y281-V326 HydrophobicContact CD2-CG1 3.5Å; Y281-V326 VanDerWaalsContact CD2-CG1 3.5Å; Y281-V326 HydrophobicContact CE2-CB 3.69Å; Y281-V326 HydrophobicContact CE2-CG1 3.49Å; Y281-V326 VanDerWaalsContact CE2-CG1 3.49Å; Y281-V326 HydrophobicContact CG-CG1 4.26Å; Y281-G327 WeakPolarHBondContact OH-CA 3.47Å; Y281-G327 PolarHBondContact OH-N 3.33Å; Y281-L330 HydrophobicContact CD1-CD1 3.55Å; Y281-L330 HydrophobicContact CD2-CD1 4.47Å; Y281-L330 HydrophobicContact CE1-CD1 3.36Å; Y281-L330 HydrophobicContact CE2-CD1 4.33Å; Y281-L330 HydrophobicContact CG-CD1 4.12Å
282	L	94.6	Very high	92.3	Very high	4 Å²	4	14.9 Å²	14.9	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-63.3	-38	177.2	-76.9	-172.7	0	0	0	112.3	Y278 T279 S285 A286	Y278-L282 HydrophobicContact CD1-CD1 4.1Å; Y278-L282 HydrophobicContact CD1-CG 4.12Å; Y278-L282 HydrophobicContact CE1-CD1 3.4Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.4Å; Y278-L282 HydrophobicContact CE1-CD2 4.13Å; Y278-L282 HydrophobicContact CE1-CG 3.52Å; Y278-L282 PolarHBondContact O-N 3.11Å; T279-L282 PolarHBondContact O-N 3.43Å; L282-S285 PolarHBondContact O-N 3.26Å; L282-A286 WeakPolarHBondContact O-CB 3.43Å; L282-A286 PolarHBondContact O-N 2.78Å
283	T	95.4	Very high	91.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-48.7	176.4	-48.7	0	0	0	0	110.2	F224 I241 N244 T279 M280 Y281 S285 A286 M287 I433	F224-T283 HydrophobicContact CE2-CG2 4.49Å; I241-T283 HydrophobicContact CG1-CG2 4.33Å; N244-T283 PolarHBondContact ND2-OG1 2.87Å; T279-T283 WeakPolarHBondContact O-CB 3.42Å; T279-T283 PolarHBondContact O-N 3.37Å; T279-T283 PolarHBondContact O-OG1 2.95Å; M280-T283 PolarHBondContact O-N 3.07Å; Y281-T283 VanDerWaalsContact C-N 3.31Å; Y281-T283 PolarHBondContact O-N 3.14Å; T283-S285 PolarHBondContact O-N 3.41Å; T283-A286 PolarHBondContact O-N 3.49Å; T283-M287 HydrophobicContact CG2-CE 4.12Å; T283-M287 HydrophobicContact CG2-SD 4.33Å; T283-M287 WeakPolarHBondContact O-CG 3.48Å; T283-M287 PolarHBondContact O-N 3.38Å; T283-I433 HydrophobicContact CG2-CD1 4.5Å
284	W	93.2	Very high	90.6	Very high	42 Å²	42	28.7 Å²	28.7	16%	0.159	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-45.7	175.9	178.1	43.3	0	0	0	112.6	F224 Y228 M280 Y281 A286 M287 T288 L299 A322 Q323 V326	F224-W284 HydrophobicContact CE1-CB 3.59Å; F224-W284 AromaticContact CE1-CG 3.95Å; F224-W284 HydrophobicContact CE1-CG 3.95Å; F224-W284 HydrophobicContact CZ-CB 3.61Å; F224-W284 HydrophobicContact CZ-CG 4.42Å; Y228-W284 AromaticContact CE2-CD1 3.87Å; Y228-W284 AromaticContact CZ-CD1 3.76Å; Y228-W284 AromaticContact CZ-NE1 3.73Å; Y228-W284 PolarHBondContact OH-NE1 3.23Å; M280-W284 WeakPolarHBondContact O-CB 3.12Å; M280-W284 PolarHBondContact O-N 2.78Å; Y281-W284 HydrophobicContact CD2-CE3 4.18Å; Y281-W284 PolarHBondContact O-N 2.85Å; W284-A286 PolarHBondContact O-N 3.36Å; W284-M287 PolarHBondContact O-N 3.33Å; W284-T288 PolarHBondContact NE1-OG1 2.9Å; W284-T288 WeakPolarHBondContact O-CB 3.33Å; W284-T288 PolarHBondContact O-N 3.17Å; W284-T288 PolarHBondContact O-OG1 3.41Å; W284-L299 HydrophobicContact CZ2-CD1 4.34Å; W284-A322 HydrophobicContact CH2-CB 3.69Å; W284-A322 HydrophobicContact CZ2-CB 4.12Å; W284-Q323 HydrophobicContact CE3-CB 4.17Å; W284-Q323 HydrophobicContact CH2-CB 4.01Å; W284-Q323 VanDerWaalsContact CH2-N 3.25Å; W284-Q323 HydrophobicContact CZ2-CB 4.32Å; W284-Q323 HydrophobicContact CZ3-CB 3.92Å; W284-V326 HydrophobicContact CZ3-CG2 4.31Å
285	S	91.8	Very high	90.1	Very high	5 Å²	5	27.4 Å²	27.4	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-30.9	179.5	-170.5	0	0	0	0	112.3	Y281 L282 T283 N289 Q323 K432	Y281-S285 WeakPolarHBondContact O-CB 3.48Å; Y281-S285 PolarHBondContact O-N 3.28Å; L282-S285 PolarHBondContact O-N 3.26Å; T283-S285 PolarHBondContact O-N 3.41Å; S285-N289 PolarHBondContact O-OD1 3.41Å; S285-Q323 VanDerWaalsContact CA-OE1 3.27Å; S285-Q323 PolarHBondContact O-OE1 3.27Å; S285-Q323 PolarHBondContact OG-OE1 3.1Å; S285-K432 WeakPolarHBondContact O-CD 3.2Å; S285-K432 PolarHBondContact O-NZ 3.27Å; S285-K432 WeakPolarHBondContact OG-CE 3.35Å; S285-K432 PolarHBondContact OG-NZ 2.8Å
286	A	92.4	Very high	89.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71.5	-50.1	174	0	0	0	0	0	112	L282 T283 W284 T288 N289 E290 V429 K432 I433	L282-A286 WeakPolarHBondContact O-CB 3.43Å; L282-A286 PolarHBondContact O-N 2.78Å; T283-A286 PolarHBondContact O-N 3.49Å; W284-A286 PolarHBondContact O-N 3.36Å; A286-T288 PolarHBondContact O-N 2.88Å; A286-N289 CarbonylContact O-C 3.49Å; A286-N289 WeakPolarHBondContact O-CA 3.4Å; A286-N289 PolarHBondContact O-N 2.89Å; A286-E290 PolarHBondContact O-N 3.36Å; A286-V429 HydrophobicContact CB-CG1 4.08Å; A286-K432 HydrophobicContact CB-CB 3.72Å; A286-K432 HydrophobicContact CB-CD 4.42Å; A286-I433 HydrophobicContact CB-CD1 3.48Å; A286-I433 VanDerWaalsContact CB-CD1 3.48Å; A286-I433 HydrophobicContact CB-CG1 3.58Å
287	M	90.4	Very high	88.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-29.9	-179.1	-63.7	-178.1	-59	0	0	112.5	F224 Y228 N237 I241 T283 W284 N289 E290	F224-M287 HydrophobicContact CB-CE 3.92Å; F224-M287 HydrophobicContact CD1-CE 3.71Å; F224-M287 HydrophobicContact CD2-CE 3.96Å; F224-M287 HydrophobicContact CE1-CE 4.24Å; F224-M287 HydrophobicContact CE2-CE 4.44Å; F224-M287 HydrophobicContact CG-CE 3.59Å; Y228-M287 HydrophobicContact CD1-CB 3.69Å; Y228-M287 HydrophobicContact CD2-CE 4.3Å; Y228-M287 HydrophobicContact CE1-CB 4.09Å; Y228-M287 HydrophobicContact CG-CB 4.29Å; Y228-M287 HydrophobicContact CG-CE 4.12Å; Y228-M287 HydrophobicContact CG-SD 4.32Å; N237-M287 HydrophobicContact CB-CG 4.46Å; N237-M287 HydrophobicContact CB-SD 4.13Å; I241-M287 HydrophobicContact CD1-CE 4.41Å; I241-M287 HydrophobicContact CD1-SD 3.68Å; I241-M287 HydrophobicContact CG1-CE 4.25Å; I241-M287 HydrophobicContact CG1-SD 3.61Å; T283-M287 HydrophobicContact CG2-CE 4.12Å; T283-M287 HydrophobicContact CG2-SD 4.33Å; T283-M287 WeakPolarHBondContact O-CG 3.48Å; T283-M287 PolarHBondContact O-N 3.38Å; W284-M287 PolarHBondContact O-N 3.33Å; M287-N289 PolarHBondContact O-N 3.1Å; M287-E290 WeakPolarHBondContact O-CB 3.45Å; M287-E290 PolarHBondContact O-N 3.08Å
288	T	86.9	Confident	87.1	Confident	6 Å²	6	31 Å²	31	4%	0.037	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-9.2	174.4	-48.4	0	0	0	0	112.6	Y228 W284 A286 N296 D321 Q323	Y228-T288 PolarHBondContact OH-OG1 2.89Å; W284-T288 PolarHBondContact NE1-OG1 2.9Å; W284-T288 WeakPolarHBondContact O-CB 3.33Å; W284-T288 PolarHBondContact O-N 3.17Å; W284-T288 PolarHBondContact O-OG1 3.41Å; A286-T288 PolarHBondContact O-N 2.88Å; T288-N296 VanDerWaalsContact C-ND2 3.29Å; T288-N296 WeakPolarHBondContact CA-OD1 3.5Å; T288-N296 PolarHBondContact O-ND2 2.92Å; T288-N296 PolarHBondContact O-OD1 3.46Å; T288-D321 WeakPolarHBondContact CG2-OD2 3.46Å; T288-Q323 HydrophobicContact CG2-CG 4.22Å; T288-Q323 VanDerWaalsContact CG2-NE2 3.32Å
289	N	86.6	Confident	85.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	12.9	170.7	-74.6	116.8	0	0	0	113.3	S285 A286 M287 N411 S424 V429 K432	S285-N289 PolarHBondContact O-OD1 3.41Å; A286-N289 CarbonylContact O-C 3.49Å; A286-N289 WeakPolarHBondContact O-CA 3.4Å; A286-N289 PolarHBondContact O-N 2.89Å; M287-N289 PolarHBondContact O-N 3.1Å; N289-N411 PolarHBondContact ND2-O 3.48Å; N289-S424 WeakPolarHBondContact O-CB 3.5Å; N289-V429 VanDerWaalsContact C-CG2 3.45Å; N289-V429 HydrophobicContact CB-CG2 4.22Å; N289-V429 WeakPolarHBondContact O-CG2 3.41Å; N289-K432 PolarHBondContact OD1-NZ 3.49Å
290	E	87.4	Confident	83.4	Confident	11 Å²	11	38.3 Å²	38.3	5%	0.051	20%	0.197	C	C	.	.			trans	-60.1	129.7	170.2	-179.9	55.8	-146.7	0	0	109.5	A286 M287 D292 C295 N296 W426	A286-E290 PolarHBondContact O-N 3.36Å; M287-E290 WeakPolarHBondContact O-CB 3.45Å; M287-E290 PolarHBondContact O-N 3.08Å; E290-D292 VanDerWaalsContact C-N 3.32Å; E290-D292 HydrophobicContact CG-CB 4.34Å; E290-C295 HydrophobicContact CG-CB 4.13Å; E290-N296 HydrophobicContact CB-CB 4.26Å; E290-N296 PolarHBondContact O-ND2 2.84Å; E290-W426 WeakPolarHBondContact OE1-CH2 3.27Å; E290-W426 WeakPolarHBondContact OE1-CZ2 3.35Å; E290-W426 WeakPolarHBondContact OE2-CH2 3.06Å; E290-W426 WeakPolarHBondContact OE2-CZ3 3.14Å
291	P	84.8	Confident	81.7	Confident	46 Å²	46	40.3 Å²	40.3	30%	0.299	22%	0.219	S	C	.	.	S	Bend	trans	-67.8	-28.6	-179.7	22.9	-33.6	0	0	0	113.9	R293 W426	P291-R293 PolarHBondContact O-N 3.12Å; P291-W426 HydrophobicContact CG-CD2 4.06Å; P291-W426 HydrophobicContact CG-CG 4.05Å; P291-W426 HydrophobicContact CG-CZ2 4.2Å; P291-W426 VanDerWaalsContact CG-NE1 3.32Å
292	D	83.1	Confident	80	Confident	77 Å²	77	41.2 Å²	41.2	41%	0.412	23%	0.225	S	C	.	.			trans	-73.8	116.6	174.7	-167.6	-15.8	0	0	0	110.5	E290 D294 C295 N296	E290-D292 VanDerWaalsContact C-N 3.32Å; E290-D292 HydrophobicContact CG-CB 4.34Å; D292-D294 VanDerWaalsContact C-N 3.33Å; D292-D294 PolarHBondContact OD1-N 3.04Å; D292-D294 VanDerWaalsContact OD1-N 3.08Å; D292-C295 HydrophobicContact CB-CB 4.2Å; D292-C295 PolarHBondContact O-N 3.31Å; D292-N296 WeakPolarHBondContact O-CB 3.4Å; D292-N296 PolarHBondContact O-N 3.31Å
293	R	75.1	Confident	78.3	Confident	162 Å²	162	46 Å²	46	61%	0.611	25%	0.25	S	C	*	.	S	Bend	trans	-73.7	-25.6	-175.8	-57.8	-169.4	106.6	162.4	3.4	112.5	P291 C295 N296 D314	P291-R293 PolarHBondContact O-N 3.12Å; R293-C295 PolarHBondContact O-N 3.4Å; R293-N296 CarbonylContact O-C 3.55Å; R293-N296 PolarHBondContact O-N 2.84Å; R293-D314 PolarHBondContact NH1-O 3.18Å; R293-D314 VanDerWaalsContact NH1-O 3.1Å
294	D	79.7	Confident	76.1	Confident	128 Å²	128	48.7 Å²	48.7	68%	0.684	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-28.4	175.2	-68.9	-19.9	0	0	0	110.5	H230 D292	H230-D294 PolarHBondContact NE2-O 2.96Å; D292-D294 VanDerWaalsContact C-N 3.33Å; D292-D294 PolarHBondContact OD1-N 3.04Å; D292-D294 VanDerWaalsContact OD1-N 3.08Å
295	C	83.5	Confident	74.1	Confident	4 Å²	4	52 Å²	52	3%	0.027	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-0.9	177.1	-57.9	0	0	0	0	114	C234 N237 E290 D292 R293	C234-C295 WeakPolarHBondContact CA-SG 3.09Å; C234-C295 HydrophobicContact CB-CB 3.79Å; C234-C295 WeakPolarHBondContact CB-SG 3.39Å; C234-C295 WeakPolarHBondContact SG-CA 3.37Å; C234-C295 WeakPolarHBondContact SG-CB 3.41Å; C234-C295 CovalentContact SG-SG 2.03Å; C234-C295 PolarHBondContact SG-SG 3.42Å; N237-C295 PolarHBondContact ND2-O 3.27Å; E290-C295 HydrophobicContact CG-CB 4.13Å; D292-C295 HydrophobicContact CB-CB 4.2Å; D292-C295 PolarHBondContact O-N 3.31Å; R293-C295 PolarHBondContact O-N 3.4Å
296	N	81.4	Confident	71.8	Confident	26 Å²	26	58.6 Å²	58.6	14%	0.139	33%	0.333	C	S	.	.			trans	-133.5	72	-175.8	-176.8	4.8	0	0	0	110.9	T288 E290 D292 R293 S298	T288-N296 VanDerWaalsContact C-ND2 3.29Å; T288-N296 WeakPolarHBondContact CA-OD1 3.5Å; T288-N296 PolarHBondContact O-ND2 2.92Å; T288-N296 PolarHBondContact O-OD1 3.46Å; E290-N296 HydrophobicContact CB-CB 4.26Å; E290-N296 PolarHBondContact O-ND2 2.84Å; D292-N296 WeakPolarHBondContact O-CB 3.4Å; D292-N296 PolarHBondContact O-N 3.31Å; R293-N296 CarbonylContact O-C 3.55Å; R293-N296 PolarHBondContact O-N 2.84Å; N296-S298 PolarHBondContact O-N 3.21Å
297	P	75.6	Confident	69.3	Low	36 Å²	36	63.5 Å²	63.5	23%	0.234	37%	0.367	C	S	.	.			trans	-69.4	132.5	174.4	28.5	-33.3	0	0	0	110.3	Y227 I302	Y227-P297 VanDerWaalsContact O-CG 3.26Å; Y227-P297 WeakPolarHBondContact O-CG 3.47Å; P297-I302 HydrophobicContact CB-CD1 4.35Å; P297-I302 HydrophobicContact CB-CG1 4.05Å; P297-I302 HydrophobicContact CG-CD1 4.07Å; P297-I302 HydrophobicContact CG-CG1 4.22Å
298	S	65.9	Low	66.8	Low	62 Å²	62	70.6 Å²	70.6	43%	0.434	41%	0.411	S	S	.	.			trans	-66.5	146.6	172.3	69.2	0	0	0	0	110.6	N296 L300 G301 I302	N296-S298 PolarHBondContact O-N 3.21Å; S298-L300 PolarHBondContact O-N 3.29Å; S298-L300 VanDerWaalsContact O-N 3.1Å; S298-G301 WeakPolarHBondContact O-CA 3.46Å; S298-G301 PolarHBondContact O-N 3.45Å; S298-G301 PolarHBondContact OG-N 3.25Å; S298-I302 PolarHBondContact O-N 2.9Å
299	L	57.3	Low	64.3	Low	68 Å²	68	74.3 Å²	74.3	36%	0.356	44%	0.437	S	S	.	.	H	α-helix	trans	-53.5	-34.2	178.5	-169.9	102.9	0	0	0	112.5	W284 I302 I303 A322	W284-L299 HydrophobicContact CZ2-CD1 4.34Å; L299-I302 PolarHBondContact O-N 2.85Å; L299-I303 HydrophobicContact CD2-CD1 3.67Å; L299-I303 HydrophobicContact CG-CD1 3.81Å; L299-I303 WeakPolarHBondContact O-CG1 3.28Å; L299-I303 PolarHBondContact O-N 3.48Å; L299-A322 HydrophobicContact CD1-CB 4.25Å; L299-A322 HydrophobicContact CD2-CB 3.94Å
300	L	56.5	Low	61.8	Low	94 Å²	94	79.3 Å²	79.3	49%	0.492	47%	0.469	S	S	.	.	H	α-helix	trans	-67.4	-36.6	176.6	-150.6	92.5	0	0	0	112.2	S298 I302 G304	S298-L300 PolarHBondContact O-N 3.29Å; S298-L300 VanDerWaalsContact O-N 3.1Å; L300-I302 VanDerWaalsContact C-N 3.32Å; L300-G304 PolarHBondContact O-N 3.19Å
301	G	59.1	Low	59.2	Low	49 Å²	49	89.3 Å²	89.3	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-33.9	172.2	0	0	0	0	0	112.5	S298	S298-G301 WeakPolarHBondContact O-CA 3.46Å; S298-G301 PolarHBondContact O-N 3.45Å; S298-G301 PolarHBondContact OG-N 3.25Å
302	I	59.3	Low	56.9	Low	44 Å²	44	90.1 Å²	90.1	23%	0.226	53%	0.53	C	S	.	.	H	α-helix	trans	-71.7	-41.6	176.9	-63.9	172.2	0	0	0	111.9	Y227 P297 S298 L299 L300 G304	Y227-I302 HydrophobicContact CD1-CB 4.49Å; Y227-I302 HydrophobicContact CD1-CD1 4.28Å; Y227-I302 HydrophobicContact CD1-CG1 3.98Å; Y227-I302 HydrophobicContact CD1-CG2 3.89Å; Y227-I302 HydrophobicContact CD2-CG2 4.18Å; Y227-I302 HydrophobicContact CE1-CB 4.47Å; Y227-I302 HydrophobicContact CE1-CG1 4.44Å; Y227-I302 HydrophobicContact CE1-CG2 3.58Å; Y227-I302 HydrophobicContact CE2-CG2 3.88Å; Y227-I302 HydrophobicContact CG-CD1 4.02Å; Y227-I302 HydrophobicContact CG-CG1 4.24Å; Y227-I302 HydrophobicContact CG-CG2 4.19Å; P297-I302 HydrophobicContact CB-CD1 4.35Å; P297-I302 HydrophobicContact CB-CG1 4.05Å; P297-I302 HydrophobicContact CG-CD1 4.07Å; P297-I302 HydrophobicContact CG-CG1 4.22Å; S298-I302 PolarHBondContact O-N 2.9Å; L299-I302 PolarHBondContact O-N 2.85Å; L300-I302 VanDerWaalsContact C-N 3.32Å; I302-G304 PolarHBondContact O-N 3.4Å
303	I	59.8	Low	54.5	Low	104 Å²	104	93.5 Å²	93.5	53%	0.533	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-4.4	-177.4	-63.3	168.8	0	0	0	112	L299 L305	L299-I303 HydrophobicContact CD2-CD1 3.67Å; L299-I303 HydrophobicContact CG-CD1 3.81Å; L299-I303 WeakPolarHBondContact O-CG1 3.28Å; L299-I303 PolarHBondContact O-N 3.48Å; I303-L305 HydrophobicContact CG2-CD1 3.85Å; I303-L305 HydrophobicContact CG2-CG 4.36Å; I303-L305 PolarHBondContact O-N 3.42Å
304	G	49.3	Very low	52.7	Low	58 Å²	58	91.4 Å²	91.4	60%	0.598	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	12.4	173.8	0	0	0	0	0	114.5	L300 I302 N306	L300-G304 PolarHBondContact O-N 3.19Å; I302-G304 PolarHBondContact O-N 3.4Å; G304-N306 PolarHBondContact O-N 2.97Å
305	L	49.9	Very low	51	Low	113 Å²	113	90.5 Å²	90.5	59%	0.592	54%	0.535	S	S	*	.			trans	-77	57.4	170.5	-81.4	157.9	0	0	0	109.9	I303 S307	I303-L305 HydrophobicContact CG2-CD1 3.85Å; I303-L305 HydrophobicContact CG2-CG 4.36Å; I303-L305 PolarHBondContact O-N 3.42Å; L305-S307 PolarHBondContact O-N 3.28Å
306	N	44.1	Very low	49.1	Very low	142 Å²	142	95.7 Å²	95.7	76%	0.759	57%	0.567	S	S	*	*			trans	-73.7	96.3	163.8	-106	-9.7	0	0	0	107.5	G304 T308	G304-N306 PolarHBondContact O-N 2.97Å; N306-T308 PolarHBondContact O-N 3.5Å; N306-T308 VanDerWaalsContact O-N 3.17Å
307	S	39.4	Very low	47.6	Very low	104 Å²	104	96.4 Å²	96.4	73%	0.727	57%	0.572	S	S	*	*			trans	-48.8	120.3	144.6	-56	0	0	0	0	106.4	L305 S309	L305-S307 PolarHBondContact O-N 3.28Å; S307-S309 PolarHBondContact O-N 3.21Å
308	T	37.6	Very low	46.6	Very low	149 Å²	149	96.6 Å²	96.6	91%	0.914	57%	0.572	S	S	*	*			trans	-46.1	97.9	173.3	45.2	0	0	0	0	110.1	N306	N306-T308 PolarHBondContact O-N 3.5Å; N306-T308 VanDerWaalsContact O-N 3.17Å
309	S	34.4	Very low	46	Very low	84 Å²	84	100.6 Å²	100.6	59%	0.587	58%	0.578	S	S	*	*			trans	-127.9	136.8	170.9	-145	0	0	0	0	108.8	S307	S307-S309 PolarHBondContact O-N 3.21Å
310	P	34.1	Very low	46.3	Very low	104 Å²	104	102.6 Å²	102.6	68%	0.675	58%	0.581	S	S	*	*			trans	-67.1	146.1	-170.8	-9.3	25.2	0	0	0	110.6	G312	P310-G312 PolarHBondContact O-N 2.86Å; P310-G312 VanDerWaalsContact O-N 3.08Å
311	K	33.8	Very low	47	Very low	222 Å²	222	99 Å²	99	97%	0.965	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	115.5	165.4	-74.1	-177.9	172.9	-176.3	0	108.6
312	G	35.7	Very low	48	Very low	63 Å²	63	97.8 Å²	97.8	65%	0.649	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.3	12.1	175.9	0	0	0	0	0	117.8	P310	P310-G312 PolarHBondContact O-N 2.86Å; P310-G312 VanDerWaalsContact O-N 3.08Å
313	Q	33.9	Very low	49.3	Very low	148 Å²	148	96 Å²	96	69%	0.692	54%	0.538	S	S	*	.			trans	-118	83.6	166.9	-79.8	-172.3	-16.8	0	0	110.7	H315	Q313-H315 VanDerWaalsContact C-N 3.29Å; Q313-H315 PolarHBondContact O-N 3.48Å; Q313-H315 VanDerWaalsContact O-N 3.14Å
314	D	36.7	Very low	50.5	Low	117 Å²	117	91.4 Å²	91.4	63%	0.626	52%	0.517	S	S	*	.			trans	-79.6	17.1	-166	-73.6	-38.2	0	0	0	117.1	R293	R293-D314 PolarHBondContact NH1-O 3.18Å; R293-D314 VanDerWaalsContact NH1-O 3.1Å
315	H	43.5	Very low	52.4	Low	109 Å²	109	91.8 Å²	91.8	51%	0.505	50%	0.504	S	S	.	.			trans	-134.4	58.4	-178.1	-62.7	-65.5	0	0	0	113.2	N88 Q313 V317	N88-H315 PolarHBondContact ND2-O 3.25Å; Q313-H315 VanDerWaalsContact C-N 3.29Å; Q313-H315 PolarHBondContact O-N 3.48Å; Q313-H315 VanDerWaalsContact O-N 3.14Å; H315-V317 VanDerWaalsContact C-N 3.28Å; H315-V317 PolarHBondContact O-N 3.46Å; H315-V317 VanDerWaalsContact O-N 3.12Å
316	V	43.2	Very low	54.4	Low	114 Å²	114	89 Å²	89	69%	0.691	49%	0.492	S	S	*	.			trans	-81	82.5	161.8	-167.6	0	0	0	0	107.9	T318	V316-T318 HydrophobicContact CG1-CG2 4.42Å; V316-T318 PolarHBondContact O-N 3.14Å
317	V	50.4	Low	56.7	Low	40 Å²	40	82.3 Å²	82.3	24%	0.242	46%	0.456	C	S	.	.			trans	-73.1	103.6	167.9	-172.6	0	0	0	0	106.5	V91 Y95 H315 W319 Y413	V91-V317 HydrophobicContact CB-CB 4.35Å; V91-V317 HydrophobicContact CG1-CB 3.86Å; V91-V317 HydrophobicContact CG1-CG1 3.57Å; V91-V317 HydrophobicContact CG2-CB 4.37Å; Y95-V317 HydrophobicContact CE2-CG1 4.09Å; H315-V317 VanDerWaalsContact C-N 3.28Å; H315-V317 PolarHBondContact O-N 3.46Å; H315-V317 VanDerWaalsContact O-N 3.12Å; V317-W319 PolarHBondContact O-N 3.24Å; V317-Y413 HydrophobicContact CG1-CE2 4.25Å
318	T	53.9	Low	59.2	Low	41 Å²	41	78.5 Å²	78.5	25%	0.252	43%	0.428	S	S	.	.			trans	-68.5	128.4	177.8	46.6	0	0	0	0	110	V316 W320 N411	V316-T318 HydrophobicContact CG1-CG2 4.42Å; V316-T318 PolarHBondContact O-N 3.14Å; T318-W320 VanDerWaalsContact C-N 3.26Å; T318-W320 PolarHBondContact O-N 3.35Å; T318-N411 PolarHBondContact O-ND2 3.24Å
319	W	53.3	Low	61.9	Low	146 Å²	146	75.8 Å²	75.8	55%	0.553	41%	0.406	S	S	*	.	S	Bend	trans	-64.2	-29.9	-176.6	56.6	52	0	0	0	112.9	L57 P59 V317	L57-W319 WeakPolarHBondContact CD2-O 3.49Å; P59-W319 HydrophobicContact CB-CE3 3.68Å; P59-W319 HydrophobicContact CB-CH2 3.92Å; P59-W319 HydrophobicContact CB-CZ3 3.24Å; P59-W319 HydrophobicContact CG-CD2 4.3Å; P59-W319 HydrophobicContact CG-CE3 3.69Å; P59-W319 HydrophobicContact CG-CH2 3.48Å; P59-W319 VanDerWaalsContact CG-CH2 3.48Å; P59-W319 HydrophobicContact CG-CZ2 4.06Å; P59-W319 HydrophobicContact CG-CZ3 3.28Å; V317-W319 PolarHBondContact O-N 3.24Å
320	W	64	Low	64.7	Low	110 Å²	110	73.7 Å²	73.7	42%	0.417	39%	0.388	S	S	.	.			trans	-134.8	119.4	179.6	-87.6	41.4	0	0	0	108.3	T318 I325 L328	T318-W320 VanDerWaalsContact C-N 3.26Å; T318-W320 PolarHBondContact O-N 3.35Å; W320-I325 HydrophobicContact CD2-CG1 4.32Å; W320-I325 HydrophobicContact CE3-CD1 3.44Å; W320-I325 VanDerWaalsContact CE3-CD1 3.44Å; W320-I325 HydrophobicContact CE3-CG1 3.35Å; W320-I325 HydrophobicContact CZ3-CB 4.35Å; W320-I325 HydrophobicContact CZ3-CD1 3.86Å; W320-I325 HydrophobicContact CZ3-CG1 3.61Å; W320-I325 HydrophobicContact CZ3-CG2 4.13Å; W320-L328 HydrophobicContact CH2-CD1 4.2Å; W320-L328 HydrophobicContact CZ2-CD1 4.29Å
321	D	72.6	Confident	67.6	Low	18 Å²	18	68.9 Å²	68.9	10%	0.096	36%	0.357	C	S	.	.			trans	-93.6	141.1	168.4	-164.4	-2.2	0	0	0	109.1	T288 Q323 G324 I325	T288-D321 WeakPolarHBondContact CG2-OD2 3.46Å; D321-Q323 HydrophobicContact CB-CG 3.97Å; D321-Q323 VanDerWaalsContact CG-CG 3.44Å; D321-Q323 PolarHBondContact O-N 2.92Å; D321-Q323 WeakPolarHBondContact OD2-CG 3.49Å; D321-Q323 PolarHBondContact OD2-NE2 2.9Å; D321-G324 WeakPolarHBondContact O-CA 3.2Å; D321-G324 PolarHBondContact O-N 3.49Å; D321-I325 PolarHBondContact O-N 3.18Å
322	A	80.1	Confident	70.4	Confident	24 Å²	24	61.3 Å²	61.3	20%	0.198	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-31.8	-175.2	0	0	0	0	0	111.9	W284 L299 G324 I325 V326	W284-A322 HydrophobicContact CH2-CB 3.69Å; W284-A322 HydrophobicContact CZ2-CB 4.12Å; L299-A322 HydrophobicContact CD1-CB 4.25Å; L299-A322 HydrophobicContact CD2-CB 3.94Å; A322-G324 VanDerWaalsContact C-N 3.31Å; A322-G324 PolarHBondContact O-N 2.86Å; A322-I325 PolarHBondContact O-N 3.09Å; A322-V326 PolarHBondContact O-N 3.11Å
323	Q	85.4	Confident	73.1	Confident	5 Å²	5	64.1 Å²	64.1	2%	0.023	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-39	172.3	50.8	152.6	-17.2	0	0	112.6	Y281 W284 S285 T288 D321 I325 V326 G327	Y281-Q323 PolarHBondContact OH-O 3.44Å; W284-Q323 HydrophobicContact CE3-CB 4.17Å; W284-Q323 HydrophobicContact CH2-CB 4.01Å; W284-Q323 VanDerWaalsContact CH2-N 3.25Å; W284-Q323 HydrophobicContact CZ2-CB 4.32Å; W284-Q323 HydrophobicContact CZ3-CB 3.92Å; S285-Q323 VanDerWaalsContact CA-OE1 3.27Å; S285-Q323 PolarHBondContact O-OE1 3.27Å; S285-Q323 PolarHBondContact OG-OE1 3.1Å; T288-Q323 HydrophobicContact CG2-CG 4.22Å; T288-Q323 VanDerWaalsContact CG2-NE2 3.32Å; D321-Q323 HydrophobicContact CB-CG 3.97Å; D321-Q323 VanDerWaalsContact CG-CG 3.44Å; D321-Q323 PolarHBondContact O-N 2.92Å; D321-Q323 WeakPolarHBondContact OD2-CG 3.49Å; D321-Q323 PolarHBondContact OD2-NE2 2.9Å; Q323-I325 VanDerWaalsContact C-N 3.31Å; Q323-I325 PolarHBondContact O-N 2.99Å; Q323-V326 PolarHBondContact O-N 3.45Å; Q323-G327 PolarHBondContact O-N 3.15Å
324	G	85.7	Confident	75.9	Confident	9 Å²	9	57.6 Å²	57.6	9%	0.093	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-36.9	178.2	0	0	0	0	0	112	D321 A322 G327 L328	D321-G324 WeakPolarHBondContact O-CA 3.2Å; D321-G324 PolarHBondContact O-N 3.49Å; A322-G324 VanDerWaalsContact C-N 3.31Å; A322-G324 PolarHBondContact O-N 2.86Å; G324-G327 PolarHBondContact O-N 3.15Å; G324-L328 VanDerWaalsContact O-CG 3.32Å; G324-L328 WeakPolarHBondContact O-CG 3.26Å; G324-L328 PolarHBondContact O-N 3.41Å
325	I	88.7	Confident	78.5	Confident	65 Å²	65	52.4 Å²	52.4	33%	0.333	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-50.3	176.4	-50	-176.6	0	0	0	110.8	W320 D321 A322 Q323 G327 L328 I329	W320-I325 HydrophobicContact CD2-CG1 4.32Å; W320-I325 HydrophobicContact CE3-CD1 3.44Å; W320-I325 VanDerWaalsContact CE3-CD1 3.44Å; W320-I325 HydrophobicContact CE3-CG1 3.35Å; W320-I325 HydrophobicContact CZ3-CB 4.35Å; W320-I325 HydrophobicContact CZ3-CD1 3.86Å; W320-I325 HydrophobicContact CZ3-CG1 3.61Å; W320-I325 HydrophobicContact CZ3-CG2 4.13Å; D321-I325 PolarHBondContact O-N 3.18Å; A322-I325 PolarHBondContact O-N 3.09Å; Q323-I325 VanDerWaalsContact C-N 3.31Å; Q323-I325 PolarHBondContact O-N 2.99Å; I325-G327 VanDerWaalsContact C-N 3.27Å; I325-G327 PolarHBondContact O-N 3.4Å; I325-L328 PolarHBondContact O-N 2.94Å; I325-I329 HydrophobicContact CG2-CD1 4.28Å; I325-I329 WeakPolarHBondContact O-CG1 3.29Å; I325-I329 PolarHBondContact O-N 3.42Å
326	V	91.4	Very high	80.7	Confident	56 Å²	56	50 Å²	50	34%	0.339	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-40.7	178.3	178.9	0	0	0	0	110	Y281 W284 A322 Q323 L328 I329 L330	Y281-V326 HydrophobicContact CD2-CB 4.07Å; Y281-V326 HydrophobicContact CD2-CG1 3.5Å; Y281-V326 VanDerWaalsContact CD2-CG1 3.5Å; Y281-V326 HydrophobicContact CE2-CB 3.69Å; Y281-V326 HydrophobicContact CE2-CG1 3.49Å; Y281-V326 VanDerWaalsContact CE2-CG1 3.49Å; Y281-V326 HydrophobicContact CG-CG1 4.26Å; W284-V326 HydrophobicContact CZ3-CG2 4.31Å; A322-V326 PolarHBondContact O-N 3.11Å; Q323-V326 PolarHBondContact O-N 3.45Å; V326-L328 PolarHBondContact O-N 2.97Å; V326-I329 PolarHBondContact O-N 2.78Å; V326-L330 HydrophobicContact CG1-CD1 3.97Å; V326-L330 HydrophobicContact CG1-CG 4.46Å; V326-L330 WeakPolarHBondContact O-CG 3.41Å; V326-L330 PolarHBondContact O-N 3.16Å
327	G	92.4	Very high	82.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-42.4	173.6	0	0	0	0	0	113.9	Y281 Q323 G324 I325 L330 F331	Y281-G327 WeakPolarHBondContact OH-CA 3.47Å; Y281-G327 PolarHBondContact OH-N 3.33Å; Q323-G327 PolarHBondContact O-N 3.15Å; G324-G327 PolarHBondContact O-N 3.15Å; I325-G327 VanDerWaalsContact C-N 3.27Å; I325-G327 PolarHBondContact O-N 3.4Å; G327-L330 PolarHBondContact O-N 3.5Å; G327-F331 VanDerWaalsContact O-CB 3.25Å; G327-F331 WeakPolarHBondContact O-CB 3.47Å; G327-F331 PolarHBondContact O-N 3.33Å
328	L	92.9	Very high	84.5	Confident	25 Å²	25	45.9 Å²	45.9	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-38.4	175.2	-73.1	173.7	0	0	0	112.4	V50 W320 G324 I325 V326 F331 L332 I405 L409	V50-L328 HydrophobicContact CG1-CD2 4.4Å; W320-L328 HydrophobicContact CH2-CD1 4.2Å; W320-L328 HydrophobicContact CZ2-CD1 4.29Å; G324-L328 VanDerWaalsContact O-CG 3.32Å; G324-L328 WeakPolarHBondContact O-CG 3.26Å; G324-L328 PolarHBondContact O-N 3.41Å; I325-L328 PolarHBondContact O-N 2.94Å; V326-L328 PolarHBondContact O-N 2.97Å; L328-F331 WeakPolarHBondContact O-CB 3.46Å; L328-F331 PolarHBondContact O-N 2.85Å; L328-L332 WeakPolarHBondContact O-CB 3.21Å; L328-L332 PolarHBondContact O-N 3.25Å; L328-I405 HydrophobicContact CD2-CD1 3.54Å; L328-L409 HydrophobicContact CD1-CD2 3.94Å; L328-L409 HydrophobicContact CD2-CD2 4.12Å; L328-L409 HydrophobicContact CG-CD2 4.5Å
329	I	93.6	Very high	85.9	Confident	91 Å²	91	44 Å²	44	47%	0.467	22%	0.218	S	C	.	.	H	α-helix	trans	-64.9	-47.6	175.3	-67.3	168	0	0	0	110.2	I325 V326 F331 L332 M333	I325-I329 HydrophobicContact CG2-CD1 4.28Å; I325-I329 WeakPolarHBondContact O-CG1 3.29Å; I325-I329 PolarHBondContact O-N 3.42Å; V326-I329 PolarHBondContact O-N 2.78Å; I329-F331 VanDerWaalsContact C-N 3.31Å; I329-F331 PolarHBondContact O-N 3.16Å; I329-L332 PolarHBondContact O-N 3.35Å; I329-M333 HydrophobicContact CG2-CG 4.49Å; I329-M333 WeakPolarHBondContact O-CG 3.2Å; I329-M333 PolarHBondContact O-N 2.95Å
330	L	93.2	Very high	87.3	Confident	40 Å²	40	42 Å²	42	21%	0.209	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-40	177.9	-70.8	166.5	0	0	0	111.7	Y278 Y281 V326 G327 M333 C334	Y278-L330 HydrophobicContact CD2-CD1 4.18Å; Y278-L330 HydrophobicContact CD2-CD2 4.38Å; Y278-L330 HydrophobicContact CE2-CD1 3.87Å; Y278-L330 HydrophobicContact CE2-CD2 4.42Å; Y281-L330 HydrophobicContact CD1-CD1 3.55Å; Y281-L330 HydrophobicContact CD2-CD1 4.47Å; Y281-L330 HydrophobicContact CE1-CD1 3.36Å; Y281-L330 HydrophobicContact CE2-CD1 4.33Å; Y281-L330 HydrophobicContact CG-CD1 4.12Å; V326-L330 HydrophobicContact CG1-CD1 3.97Å; V326-L330 HydrophobicContact CG1-CG 4.46Å; V326-L330 WeakPolarHBondContact O-CG 3.41Å; V326-L330 PolarHBondContact O-N 3.16Å; G327-L330 PolarHBondContact O-N 3.5Å; L330-M333 PolarHBondContact O-N 3.27Å; L330-C334 WeakPolarHBondContact O-CB 3.33Å; L330-C334 PolarHBondContact O-N 3.49Å
331	F	94.8	Very high	87.8	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-49.2	172	166.5	-91.9	0	0	0	112.1	L46 L47 V50 F171 G327 L328 I329 M333 C334 V335 A401 Y404 I405	L46-F331 HydrophobicContact CD2-CE2 4.31Å; L46-F331 HydrophobicContact CD2-CZ 3.71Å; L46-F331 HydrophobicContact CG-CZ 4.12Å; L47-F331 HydrophobicContact CD2-CE1 3.96Å; V50-F331 HydrophobicContact CG2-CE1 4.11Å; V50-F331 HydrophobicContact CG2-CZ 4.26Å; F171-F331 AromaticContact CE1-CD2 3.75Å; F171-F331 HydrophobicContact CE1-CD2 3.75Å; F171-F331 HydrophobicContact CE1-CE2 4.36Å; F171-F331 AromaticContact CZ-CD2 3.81Å; F171-F331 HydrophobicContact CZ-CD2 3.81Å; F171-F331 HydrophobicContact CZ-CE2 4.11Å; G327-F331 VanDerWaalsContact O-CB 3.25Å; G327-F331 WeakPolarHBondContact O-CB 3.47Å; G327-F331 PolarHBondContact O-N 3.33Å; L328-F331 WeakPolarHBondContact O-CB 3.46Å; L328-F331 PolarHBondContact O-N 2.85Å; I329-F331 VanDerWaalsContact C-N 3.31Å; I329-F331 PolarHBondContact O-N 3.16Å; F331-M333 VanDerWaalsContact C-N 3.35Å; F331-M333 PolarHBondContact O-N 2.82Å; F331-C334 WeakPolarHBondContact O-CB 3.08Å; F331-C334 PolarHBondContact O-N 3.42Å; F331-V335 HydrophobicContact CD1-CG2 4.49Å; F331-V335 HydrophobicContact CD2-CG2 4.12Å; F331-V335 HydrophobicContact CE1-CG2 4.13Å; F331-V335 HydrophobicContact CE2-CG2 3.74Å; F331-V335 HydrophobicContact CG-CG2 4.49Å; F331-V335 HydrophobicContact CZ-CG2 3.76Å; F331-V335 WeakPolarHBondContact O-CG2 3.41Å; F331-V335 PolarHBondContact O-N 2.91Å; F331-A401 HydrophobicContact CE2-CB 3.72Å; F331-A401 HydrophobicContact CZ-CB 4.44Å; F331-Y404 HydrophobicContact CB-CD1 4.48Å; F331-Y404 HydrophobicContact CB-CE1 3.95Å; F331-Y404 AromaticContact CD2-CD1 3.86Å; F331-Y404 HydrophobicContact CD2-CD1 3.86Å; F331-Y404 HydrophobicContact CD2-CE1 4.18Å; F331-Y404 HydrophobicContact CG-CE1 4.43Å; F331-I405 HydrophobicContact CB-CD1 4.33Å; F331-I405 HydrophobicContact CD1-CD1 3.6Å; F331-I405 HydrophobicContact CD1-CG1 4.3Å; F331-I405 HydrophobicContact CD2-CD1 3.69Å; F331-I405 HydrophobicContact CD2-CG1 3.92Å; F331-I405 HydrophobicContact CE1-CD1 3.68Å; F331-I405 HydrophobicContact CE1-CG1 3.92Å; F331-I405 HydrophobicContact CE2-CD1 3.75Å; F331-I405 HydrophobicContact CE2-CG1 3.48Å; F331-I405 VanDerWaalsContact CE2-CG1 3.48Å; F331-I405 HydrophobicContact CG-CD1 3.59Å; F331-I405 HydrophobicContact CG-CG1 4.29Å; F331-I405 HydrophobicContact CZ-CD1 3.74Å; F331-I405 HydrophobicContact CZ-CG1 3.47Å; F331-I405 VanDerWaalsContact CZ-CG1 3.47Å
332	L	94.1	Very high	86.9	Confident	64 Å²	64	41.1 Å²	41.1	34%	0.335	22%	0.218	S	C	.	.	H	α-helix	trans	-59.6	-47.8	179.4	176.1	64.8	0	0	0	110.7	L47 L328 I329 C334 V335 L336	L47-L332 HydrophobicContact CD1-CD1 3.63Å; L47-L332 HydrophobicContact CD2-CD1 3.62Å; L47-L332 HydrophobicContact CG-CD1 4.29Å; L328-L332 WeakPolarHBondContact O-CB 3.21Å; L328-L332 PolarHBondContact O-N 3.25Å; I329-L332 PolarHBondContact O-N 3.35Å; L332-C334 VanDerWaalsContact C-N 3.32Å; L332-C334 PolarHBondContact O-N 3.12Å; L332-V335 PolarHBondContact O-N 3.39Å; L332-L336 HydrophobicContact CD1-CD1 3.82Å; L332-L336 HydrophobicContact CD1-CG 4.06Å; L332-L336 HydrophobicContact CG-CD1 3.92Å; L332-L336 HydrophobicContact CG-CG 4.48Å; L332-L336 WeakPolarHBondContact O-CB 3.44Å; L332-L336 VanDerWaalsContact O-CG 3.26Å; L332-L336 WeakPolarHBondContact O-CG 2.78Å; L332-L336 PolarHBondContact O-N 3.21Å
333	M	92.1	Very high	85.4	Confident	121 Å²	121	41.1 Å²	41.1	60%	0.596	22%	0.216	S	C	*	.	H	α-helix	trans	-60	-43.8	177	-68.2	-60.8	-177.2	0	0	111.4	I329 L330 F331 Y337	I329-M333 HydrophobicContact CG2-CG 4.49Å; I329-M333 WeakPolarHBondContact O-CG 3.2Å; I329-M333 PolarHBondContact O-N 2.95Å; L330-M333 PolarHBondContact O-N 3.27Å; F331-M333 VanDerWaalsContact C-N 3.35Å; F331-M333 PolarHBondContact O-N 2.82Å; M333-Y337 WeakPolarHBondContact O-CB 3.41Å; M333-Y337 PolarHBondContact O-N 2.88Å
334	C	91.5	Very high	83.3	Confident	12 Å²	12	44.7 Å²	44.7	8%	0.081	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-46.8	178.6	-178.6	0	0	0	0	112.6	Q175 L178 L330 F331 L332 Y337 S338	Q175-C334 HydrophobicContact CG-CB 4.15Å; L178-C334 WeakPolarHBondContact CD1-SG 3.45Å; L330-C334 WeakPolarHBondContact O-CB 3.33Å; L330-C334 PolarHBondContact O-N 3.49Å; F331-C334 WeakPolarHBondContact O-CB 3.08Å; F331-C334 PolarHBondContact O-N 3.42Å; L332-C334 VanDerWaalsContact C-N 3.32Å; L332-C334 PolarHBondContact O-N 3.12Å; C334-Y337 PolarHBondContact O-N 3.47Å; C334-S338 WeakPolarHBondContact O-CB 3.38Å; C334-S338 PolarHBondContact O-N 3.24Å
335	V	90.8	Very high	81.3	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-46.6	179.7	170.4	0	0	0	0	110.3	A43 L46 F331 L332 S338 S339	A43-V335 HydrophobicContact CB-CG1 3.56Å; L46-V335 HydrophobicContact CD2-CG2 4.31Å; F331-V335 HydrophobicContact CD1-CG2 4.49Å; F331-V335 HydrophobicContact CD2-CG2 4.12Å; F331-V335 HydrophobicContact CE1-CG2 4.13Å; F331-V335 HydrophobicContact CE2-CG2 3.74Å; F331-V335 HydrophobicContact CG-CG2 4.49Å; F331-V335 HydrophobicContact CZ-CG2 3.76Å; F331-V335 WeakPolarHBondContact O-CG2 3.41Å; F331-V335 PolarHBondContact O-N 2.91Å; L332-V335 PolarHBondContact O-N 3.39Å; V335-S338 PolarHBondContact O-N 3.25Å; V335-S339 WeakPolarHBondContact O-CB 3.45Å; V335-S339 PolarHBondContact O-N 3.31Å; V335-S339 PolarHBondContact O-OG 3.42Å; V335-S339 VanDerWaalsContact O-OG 3.05Å
336	L	90.3	Very high	79.1	Confident	59 Å²	59	47.9 Å²	47.9	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-44.8	177.1	-69.6	175.9	0	0	0	111.6	L332 S338 S339 I340	L332-L336 HydrophobicContact CD1-CD1 3.82Å; L332-L336 HydrophobicContact CD1-CG 4.06Å; L332-L336 HydrophobicContact CG-CD1 3.92Å; L332-L336 HydrophobicContact CG-CG 4.48Å; L332-L336 WeakPolarHBondContact O-CB 3.44Å; L332-L336 VanDerWaalsContact O-CG 3.26Å; L332-L336 WeakPolarHBondContact O-CG 2.78Å; L332-L336 PolarHBondContact O-N 3.21Å; L336-S338 PolarHBondContact O-N 3.1Å; L336-S339 PolarHBondContact O-N 3.3Å; L336-I340 HydrophobicContact CB-CD1 4.46Å; L336-I340 WeakPolarHBondContact O-CB 3.48Å; L336-I340 VanDerWaalsContact O-CG1 3.23Å; L336-I340 WeakPolarHBondContact O-CG1 3.38Å; L336-I340 PolarHBondContact O-N 3.23Å
337	Y	88.4	Confident	76.8	Confident	46 Å²	46	50.5 Å²	50.5	18%	0.18	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-47.8	176.9	-175.6	-107.1	0	0	0	111.1	L178 D181 F182 M333 C334 S339 I340 R341	L178-Y337 HydrophobicContact CB-CD1 4.37Å; L178-Y337 HydrophobicContact CD2-CD1 4.32Å; L178-Y337 HydrophobicContact CD2-CE1 4.42Å; D181-Y337 WeakPolarHBondContact OD2-CE1 3.28Å; D181-Y337 PolarHBondContact OD2-OH 3.35Å; F182-Y337 HydrophobicContact CB-CD1 4.49Å; F182-Y337 HydrophobicContact CB-CE1 4.04Å; F182-Y337 HydrophobicContact CB-CE2 4.16Å; F182-Y337 HydrophobicContact CD2-CD2 4.02Å; F182-Y337 AromaticContact CD2-CE2 3.76Å; F182-Y337 HydrophobicContact CD2-CE2 3.76Å; F182-Y337 HydrophobicContact CG-CE2 4.44Å; M333-Y337 WeakPolarHBondContact O-CB 3.41Å; M333-Y337 PolarHBondContact O-N 2.88Å; C334-Y337 PolarHBondContact O-N 3.47Å; Y337-S339 VanDerWaalsContact C-N 3.26Å; Y337-S339 PolarHBondContact O-N 2.96Å; Y337-I340 PolarHBondContact O-N 3Å; Y337-R341 WeakPolarHBondContact O-CB 3.39Å; Y337-R341 PolarHBondContact O-N 2.74Å; Y337-R341 WeakPolarHBondContact OH-CD 3.39Å; Y337-R341 PolarHBondContact OH-NE 2.98Å
338	S	85.1	Confident	74.7	Confident	22 Å²	22	51.7 Å²	51.7	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-29.8	177	-179.4	0	0	0	0	113.6	R39 C334 V335 L336	R39-S338 PolarHBondContact NH1-O 3.24Å; C334-S338 WeakPolarHBondContact O-CB 3.38Å; C334-S338 PolarHBondContact O-N 3.24Å; V335-S338 PolarHBondContact O-N 3.25Å; L336-S338 PolarHBondContact O-N 3.1Å
339	S	84.6	Confident	72.5	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-82.4	-34	178.4	-63.2	0	0	0	0	113.3	R39 A43 V335 L336 Y337	R39-S339 PolarHBondContact NE-O 3.22Å; R39-S339 PolarHBondContact NH2-O 2.89Å; R39-S339 PolarHBondContact O-OG 2.73Å; A43-S339 WeakPolarHBondContact CB-OG 3.49Å; V335-S339 WeakPolarHBondContact O-CB 3.45Å; V335-S339 PolarHBondContact O-N 3.31Å; V335-S339 PolarHBondContact O-OG 3.42Å; V335-S339 VanDerWaalsContact O-OG 3.05Å; L336-S339 PolarHBondContact O-N 3.3Å; Y337-S339 VanDerWaalsContact C-N 3.26Å; Y337-S339 PolarHBondContact O-N 2.96Å
340	I	82.5	Confident	70.1	Confident	103 Å²	103	54.5 Å²	54.5	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-85.7	-39.4	-177.6	-65.3	167.9	0	0	0	111.2	L40 L336 Y337 N342	L40-I340 HydrophobicContact CD2-CG1 3.96Å; L336-I340 HydrophobicContact CB-CD1 4.46Å; L336-I340 WeakPolarHBondContact O-CB 3.48Å; L336-I340 VanDerWaalsContact O-CG1 3.23Å; L336-I340 WeakPolarHBondContact O-CG1 3.38Å; L336-I340 PolarHBondContact O-N 3.23Å; Y337-I340 PolarHBondContact O-N 3Å; I340-N342 PolarHBondContact O-N 3.35Å; I340-N342 VanDerWaalsContact O-N 3.08Å
341	R	72.9	Confident	67.6	Low	35 Å²	35	57.8 Å²	57.8	13%	0.132	31%	0.31	C	S	.	.	S	Bend	trans	-56.1	121.2	-176.1	-167.4	-177.1	-169.4	-150.6	4.5	109.2	R39 D181 Y337 N345 V348	R39-R341 PolarHBondContact NH1-O 2.92Å; R39-R341 PolarHBondContact NH2-O 2.73Å; D181-R341 IonicContact OD1-CZ 2.82Å; D181-R341 IonicContact OD1-NH1 3.03Å; D181-R341 PolarHBondContact OD1-NH1 3.32Å; D181-R341 IonicContact OD1-NH2 2.72Å; D181-R341 PolarHBondContact OD1-NH2 2.93Å; D181-R341 IonicContact OD2-CZ 2.67Å; D181-R341 IonicContact OD2-NE 2.6Å; D181-R341 PolarHBondContact OD2-NE 3.33Å; D181-R341 IonicContact OD2-NH1 3.93Å; D181-R341 PolarHBondContact OD2-NH1 2.68Å; D181-R341 IonicContact OD2-NH2 3.25Å; D181-R341 PolarHBondContact OD2-NH2 3.23Å; Y337-R341 WeakPolarHBondContact O-CB 3.39Å; Y337-R341 PolarHBondContact O-N 2.74Å; Y337-R341 WeakPolarHBondContact OH-CD 3.39Å; Y337-R341 PolarHBondContact OH-NE 2.98Å; R341-N345 PolarHBondContact NH2-ND2 3.47Å; R341-V348 VanDerWaalsContact NH1-CG2 3.28Å
342	N	54.5	Low	65	Low	75 Å²	75	58.4 Å²	58.4	40%	0.401	31%	0.314	S	S	.	.			trans	-65.5	137	173.9	-155.4	26.8	0	0	0	107.3	I340 S344	I340-N342 PolarHBondContact O-N 3.35Å; I340-N342 VanDerWaalsContact O-N 3.08Å; N342-S344 PolarHBondContact O-N 3.09Å
343	S	49.5	Very low	62.6	Low	24 Å²	24	62.1 Å²	62.1	17%	0.168	33%	0.334	C	S	.	.	S	Bend	trans	-70.2	21.2	-175.6	57.1	0	0	0	0	114	N345 N349 T388	S343-N345 VanDerWaalsContact C-N 3.28Å; S343-N345 PolarHBondContact O-N 2.97Å; S343-N349 PolarHBondContact O-ND2 2.88Å; S343-N349 PolarHBondContact O-OD1 3.14Å; S343-T388 WeakPolarHBondContact CB-O 3.26Å; S343-T388 WeakPolarHBondContact OG-CB 3.31Å; S343-T388 PolarHBondContact OG-O 3.43Å
344	S	40.1	Very low	60.2	Low	81 Å²	81	57.8 Å²	57.8	57%	0.566	31%	0.314	S	S	*	.			trans	-84.7	9.7	-173.7	64.4	0	0	0	0	114.1	N342	N342-S344 PolarHBondContact O-N 3.09Å
345	N	43.4	Very low	57.7	Low	67 Å²	67	61.9 Å²	61.9	36%	0.358	34%	0.339	S	S	.	.			trans	-104.9	108.3	174.9	-116.1	-83	0	0	0	109.9	R341 S343 Q347 V348 N349	R341-N345 PolarHBondContact NH2-ND2 3.47Å; S343-N345 VanDerWaalsContact C-N 3.28Å; S343-N345 PolarHBondContact O-N 2.97Å; N345-Q347 PolarHBondContact O-N 2.99Å; N345-Q347 VanDerWaalsContact O-N 3.09Å; N345-V348 PolarHBondContact O-N 3.44Å; N345-N349 PolarHBondContact O-N 3.42Å
346	A	42.3	Very low	55.3	Low	74 Å²	74	67 Å²	67	61%	0.612	37%	0.366	S	S	*	.	H	α-helix	trans	-56.3	-27.3	-173.9	0	0	0	0	0	113.9	V348 K350	A346-V348 PolarHBondContact O-N 3.31Å; A346-K350 PolarHBondContact O-N 3Å; A346-K350 VanDerWaalsContact O-N 3.11Å
347	Q	43	Very low	52.9	Low	110 Å²	110	70.2 Å²	70.2	51%	0.514	38%	0.38	S	S	.	.	H	α-helix	trans	-70.6	-32.4	-174.9	-160.3	168.9	-52.4	0	0	113.7	N345	N345-Q347 PolarHBondContact O-N 2.99Å; N345-Q347 VanDerWaalsContact O-N 3.09Å
348	V	48.4	Very low	50.6	Low	25 Å²	25	71.1 Å²	71.1	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-90.9	-28	176.4	-178.8	0	0	0	0	111.5	R341 N345 A346 K350 L351 T352	R341-V348 VanDerWaalsContact NH1-CG2 3.28Å; N345-V348 PolarHBondContact O-N 3.44Å; A346-V348 PolarHBondContact O-N 3.31Å; V348-K350 VanDerWaalsContact C-N 3.3Å; V348-K350 PolarHBondContact O-N 2.81Å; V348-L351 CarbonylContact O-C 3.53Å; V348-L351 WeakPolarHBondContact O-CA 3.44Å; V348-L351 WeakPolarHBondContact O-CB 3.38Å; V348-L351 PolarHBondContact O-N 2.98Å; V348-T352 HydrophobicContact CG1-CG2 3.96Å; V348-T352 VanDerWaalsContact O-CG2 3.24Å; V348-T352 WeakPolarHBondContact O-CG2 3.2Å; V348-T352 PolarHBondContact O-N 3.35Å; V348-T352 PolarHBondContact O-OG1 3.18Å
349	N	46.5	Very low	48.3	Very low	39 Å²	39	73.9 Å²	73.9	21%	0.209	42%	0.417	C	S	.	.	H	α-helix	trans	-60.7	-37.3	170.5	-86	1.9	0	0	0	112.6	S343 N345 L351 T352 L353 T354	S343-N349 PolarHBondContact O-ND2 2.88Å; S343-N349 PolarHBondContact O-OD1 3.14Å; N345-N349 PolarHBondContact O-N 3.42Å; N349-L351 VanDerWaalsContact C-N 3.25Å; N349-L351 PolarHBondContact O-N 2.92Å; N349-T352 WeakPolarHBondContact CA-OG1 3.43Å; N349-T352 PolarHBondContact O-N 3.35Å; N349-T352 PolarHBondContact O-OG1 3.16Å; N349-L353 PolarHBondContact O-N 3.26Å; N349-T354 VanDerWaalsContact CB-OG1 3.24Å; N349-T354 WeakPolarHBondContact CB-OG1 3.37Å; N349-T354 PolarHBondContact O-N 3.05Å; N349-T354 PolarHBondContact O-OG1 2.99Å
350	K	44	Very low	46	Very low	136 Å²	136	80.9 Å²	80.9	59%	0.591	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.8	170.1	-83.7	-167.4	175.2	178.7	0	113.7	A346 V348	A346-K350 PolarHBondContact O-N 3Å; A346-K350 VanDerWaalsContact O-N 3.11Å; V348-K350 VanDerWaalsContact C-N 3.3Å; V348-K350 PolarHBondContact O-N 2.81Å
351	L	41.9	Very low	43.9	Very low	109 Å²	109	81.7 Å²	81.7	57%	0.571	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-27.1	175.4	-110.4	79.9	0	0	0	113.2	V177 V348 N349 L353	V177-L351 HydrophobicContact CG1-CD2 4.17Å; V177-L351 HydrophobicContact CG2-CD2 4.23Å; V348-L351 CarbonylContact O-C 3.53Å; V348-L351 WeakPolarHBondContact O-CA 3.44Å; V348-L351 WeakPolarHBondContact O-CB 3.38Å; V348-L351 PolarHBondContact O-N 2.98Å; N349-L351 VanDerWaalsContact C-N 3.25Å; N349-L351 PolarHBondContact O-N 2.92Å; L351-L353 VanDerWaalsContact C-N 3.3Å; L351-L353 PolarHBondContact O-N 3.23Å
352	T	39.8	Very low	42.4	Very low	16 Å²	16	88.1 Å²	88.1	10%	0.098	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	8.8	-178.6	62.9	0	0	0	0	113.8	V348 N349 T354 F393	V348-T352 HydrophobicContact CG1-CG2 3.96Å; V348-T352 VanDerWaalsContact O-CG2 3.24Å; V348-T352 WeakPolarHBondContact O-CG2 3.2Å; V348-T352 PolarHBondContact O-N 3.35Å; V348-T352 PolarHBondContact O-OG1 3.18Å; N349-T352 WeakPolarHBondContact CA-OG1 3.43Å; N349-T352 PolarHBondContact O-N 3.35Å; N349-T352 PolarHBondContact O-OG1 3.16Å; T352-T354 PolarHBondContact O-N 3.1Å; T352-F393 HydrophobicContact CG2-CD1 3.56Å; T352-F393 HydrophobicContact CG2-CE1 3.32Å; T352-F393 HydrophobicContact CG2-CZ 4.29Å
353	L	43	Very low	41.2	Very low	143 Å²	143	92.6 Å²	92.6	75%	0.749	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.4	-178.8	-69	165.5	0	0	0	112.8	N349 L351 T355	N349-L353 PolarHBondContact O-N 3.26Å; L351-L353 VanDerWaalsContact C-N 3.3Å; L351-L353 PolarHBondContact O-N 3.23Å; L353-T355 PolarHBondContact O-N 3.07Å
354	T	41.7	Very low	40.2	Very low	29 Å²	29	93.6 Å²	93.6	18%	0.178	53%	0.528	C	S	.	.			trans	-75.8	108.5	163	54.5	0	0	0	0	107.1	N349 T352 D356	N349-T354 VanDerWaalsContact CB-OG1 3.24Å; N349-T354 WeakPolarHBondContact CB-OG1 3.37Å; N349-T354 PolarHBondContact O-N 3.05Å; N349-T354 PolarHBondContact O-OG1 2.99Å; T352-T354 PolarHBondContact O-N 3.1Å; T354-D356 PolarHBondContact O-N 3.39Å
355	T	38.2	Very low	39.7	Very low	98 Å²	98	95.5 Å²	95.5	60%	0.601	54%	0.538	S	S	*	.			trans	-48	135.3	175.7	-49	0	0	0	0	110.7	L353 E357 S358	L353-T355 PolarHBondContact O-N 3.07Å; T355-E357 PolarHBondContact O-N 2.91Å; T355-S358 PolarHBondContact O-N 3.11Å
356	D	40.3	Very low	39	Very low	115 Å²	115	101 Å²	101	62%	0.615	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	-3	-177.8	-73.8	-44.6	0	0	0	116.3	T354	T354-D356 PolarHBondContact O-N 3.39Å
357	E	40.3	Very low	38.3	Very low	127 Å²	127	103.4 Å²	103.4	59%	0.593	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-25.6	179.9	-76.6	-171.7	122.7	0	0	114	T355	T355-E357 PolarHBondContact O-N 2.91Å
358	S	39.6	Very low	37.7	Very low	64 Å²	64	103.9 Å²	103.9	45%	0.448	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-80.7	-20.4	-177.3	-57.6	0	0	0	0	113.7	T355 L360	T355-S358 PolarHBondContact O-N 3.11Å; S358-L360 VanDerWaalsContact C-N 3.32Å
359	A	38.7	Very low	36.7	Very low	81 Å²	81	107.8 Å²	107.8	67%	0.669	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-80.1	-14.1	176.6	0	0	0	0	0	113
360	L	35.3	Very low	36	Very low	147 Å²	147	114.2 Å²	114.2	77%	0.77	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-92.6	1.6	-177.9	-71.1	171.3	0	0	0	114	S358	S358-L360 VanDerWaalsContact C-N 3.32Å
361	I	39.3	Very low	35.5	Very low	121 Å²	121	116.5 Å²	116.5	62%	0.621	64%	0.642	S	S	*	*	S	Bend	trans	-102.4	-11.2	-177.5	-56.6	178	0	0	0	111.9	D363	I361-D363 PolarHBondContact O-N 2.86Å
362	E	40	Very low	35.3	Very low	170 Å²	170	120.5 Å²	120.5	79%	0.794	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-4	-173.3	-134.5	173.2	175.5	0	0	114.8
363	D	30.9	Very low	35	Very low	168 Å²	168	122.8 Å²	122.8	90%	0.898	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	12.9	179.8	-135.8	14	0	0	0	113.7	I361	I361-D363 PolarHBondContact O-N 2.86Å
364	G	27.8	Very low	34.6	Very low	46 Å²	46	121.9 Å²	121.9	47%	0.474	69%	0.691	S	S	.	*	S	Bend	trans	-85.4	139.8	169.8	0	0	0	0	0	111	Q366	G364-Q366 PolarHBondContact O-N 3.02Å; G364-Q366 VanDerWaalsContact O-N 3.17Å
365	P	28.4	Very low	34.3	Very low	120 Å²	120	124 Å²	124	78%	0.779	72%	0.718	S	S	*	*			trans	-56.9	127	178.1	24.6	-32.2	0	0	0	109.2	T367	P365-T367 VanDerWaalsContact C-N 3.32Å; P365-T367 PolarHBondContact O-N 3.36Å
366	Q	30.6	Very low	34.5	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	73%	0.727	S	S	*	*			trans	-50.9	97.7	169.8	-81.8	179.2	-27.7	0	0	108.8	G364 D368	G364-Q366 PolarHBondContact O-N 3.02Å; G364-Q366 VanDerWaalsContact O-N 3.17Å; Q366-D368 VanDerWaalsContact C-N 3.32Å; Q366-D368 PolarHBondContact O-N 3.4Å; Q366-D368 VanDerWaalsContact O-N 3.08Å
367	T	27.3	Very low	34.8	Very low	125 Å²	125	127 Å²	127	77%	0.767	73%	0.725	S	S	*	*			trans	-74.5	97.1	162.8	47.1	0	0	0	0	106	P365 S369	P365-T367 VanDerWaalsContact C-N 3.32Å; P365-T367 PolarHBondContact O-N 3.36Å; T367-S369 PolarHBondContact O-N 3.14Å
368	D	29.1	Very low	35.5	Very low	120 Å²	120	129.7 Å²	129.7	64%	0.642	73%	0.73	S	S	*	*			trans	-54.2	89.2	162.1	-82.3	-31.8	0	0	0	108.7	Q366 F370	Q366-D368 VanDerWaalsContact C-N 3.32Å; Q366-D368 PolarHBondContact O-N 3.4Å; Q366-D368 VanDerWaalsContact O-N 3.08Å; D368-F370 HydrophobicContact CB-CD2 3.91Å; D368-F370 HydrophobicContact CB-CE2 3.62Å; D368-F370 HydrophobicContact CB-CZ 4.39Å; D368-F370 WeakPolarHBondContact O-CD2 3.47Å; D368-F370 PolarHBondContact O-N 2.84Å
369	S	28.4	Very low	36.3	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	72%	0.715	S	S	*	*			trans	-74.1	89	161.9	59.9	0	0	0	0	106.8	T367 E371	T367-S369 PolarHBondContact O-N 3.14Å; S369-E371 VanDerWaalsContact C-N 3.29Å; S369-E371 PolarHBondContact O-N 2.93Å
370	F	32.2	Very low	37.8	Very low	174 Å²	174	128 Å²	128	76%	0.763	71%	0.709	S	S	*	*			trans	-57.8	89.5	166.5	-74.6	-91.7	0	0	0	109.7	D368 E372	D368-F370 HydrophobicContact CB-CD2 3.91Å; D368-F370 HydrophobicContact CB-CE2 3.62Å; D368-F370 HydrophobicContact CB-CZ 4.39Å; D368-F370 WeakPolarHBondContact O-CD2 3.47Å; D368-F370 PolarHBondContact O-N 2.84Å; F370-E372 PolarHBondContact O-N 3.11Å
371	E	33.1	Very low	39.6	Very low	183 Å²	183	123.2 Å²	123.2	86%	0.855	69%	0.685	S	S	*	*			trans	-81.9	91.4	153.2	-79.5	-165.3	155.4	0	0	108	S369 G373	S369-E371 VanDerWaalsContact C-N 3.29Å; S369-E371 PolarHBondContact O-N 2.93Å; E371-G373 PolarHBondContact O-N 3.4Å; E371-G373 VanDerWaalsContact O-N 3.12Å
372	E	38	Very low	41.4	Very low	194 Å²	194	119.8 Å²	119.8	91%	0.907	67%	0.667	S	S	*	*			trans	-60.8	105.2	161.6	-85.9	-175.2	141	0	0	109.5	F370	F370-E372 PolarHBondContact O-N 3.11Å
373	G	33.7	Very low	43.2	Very low	64 Å²	64	111.7 Å²	111.7	66%	0.66	63%	0.63	S	S	*	*			trans	-161.8	79.1	178	0	0	0	0	0	112.9	E371	E371-G373 PolarHBondContact O-N 3.4Å; E371-G373 VanDerWaalsContact O-N 3.12Å
374	S	33	Very low	45.4	Very low	124 Å²	124	108.9 Å²	108.9	87%	0.867	61%	0.609	S	S	*	*			trans	31.1	106.6	155.5	60.9	0	0	0	0	120.5
375	G	36.6	Very low	47.5	Very low	73 Å²	73	113.6 Å²	113.6	75%	0.753	62%	0.624	S	S	*	*				87.1	105.6	128.8	0	0	0	0	0	119.8
376	H	41.4	Very low	49.9	Very low	168 Å²	168	109 Å²	109	78%	0.778	60%	0.598	S	S	*	*	S	Bend	trans	71.1	111.1	150.7	-109.8	71.6	0	0	0	118.8	R378	H376-R378 PolarHBondContact O-N 3.14Å
377	N	46.7	Very low	52.2	Low	107 Å²	107	101.1 Å²	101.1	57%	0.572	56%	0.562	S	S	*	*			trans	51.4	49.9	158.1	-60.5	-10.2	0	0	0	117.3
378	R	54.4	Low	54.6	Low	185 Å²	185	96.6 Å²	96.6	70%	0.698	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-93.7	122.1	167.2	-84.5	176.5	69.1	128	-5.6	110.6	H376	H376-R378 PolarHBondContact O-N 3.14Å
379	A	57.4	Low	57.1	Low	16 Å²	16	91.6 Å²	91.6	13%	0.132	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-62.6	143	169.3	0	0	0	0	0	110.7	L24 G32	L24-A379 HydrophobicContact CD2-CB 3.24Å; L24-A379 WeakPolarHBondContact CD2-O 3.5Å; G32-A379 WeakPolarHBondContact O-CA 3.32Å; G32-A379 WeakPolarHBondContact O-CB 3.47Å
380	V	69.3	Low	59.8	Low	93 Å²	93	88 Å²	88	56%	0.564	48%	0.482	S	S	*	.	B	Isolated β-bridge	trans	-91.6	130.1	-172.3	-179.5	0	0	0	0	109.5	G32 N34 N382	G32-V380 PolarHBondContact O-N 2.91Å; N34-V380 PolarHBondContact N-O 3.17Å; V380-N382 PolarHBondContact O-N 2.75Å
381	D	73.4	Confident	62.5	Low	47 Å²	47	79.8 Å²	79.8	25%	0.251	45%	0.446	S	S	.	.			trans	-79.9	96.1	172.4	-173.6	26	0	0	0	109.8	N34 S122 E383 K384	N34-D381 PolarHBondContact ND2-OD1 3.33Å; S122-D381 PolarHBondContact OG-OD2 3.45Å; D381-E383 VanDerWaalsContact C-N 3.32Å; D381-K384 HydrophobicContact CB-CG 4.42Å; D381-K384 VanDerWaalsContact OD2-CG 3.3Å; D381-K384 WeakPolarHBondContact OD2-CG 3.4Å
382	N	77.4	Confident	65.2	Low	48 Å²	48	72.1 Å²	72.1	26%	0.257	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	13.5	-176.6	70	-45	0	0	0	113.7	S35 V380	S35-N382 WeakPolarHBondContact CB-OD1 3.5Å; S35-N382 PolarHBondContact N-OD1 3.12Å; S35-N382 PolarHBondContact OG-ND2 3.2Å; S35-N382 PolarHBondContact OG-OD1 3.27Å; V380-N382 PolarHBondContact O-N 2.75Å
383	E	79.1	Confident	67.6	Low	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	14	-174.9	-66.2	-174.6	129.8	0	0	113.7	S122 D381 G386 T388 Y389 Y391	S122-E383 VanDerWaalsContact CB-O 3.29Å; S122-E383 WeakPolarHBondContact CB-O 3.4Å; S122-E383 PolarHBondContact N-O 3.48Å; S122-E383 PolarHBondContact OG-O 3.25Å; D381-E383 VanDerWaalsContact C-N 3.32Å; E383-G386 CarbonylContact C-O 3.54Å; E383-G386 VanDerWaalsContact CA-O 3.27Å; E383-G386 WeakPolarHBondContact CA-O 3.35Å; E383-T388 HydrophobicContact CG-CG2 3.96Å; E383-T388 PolarHBondContact OE1-N 3.49Å; E383-T388 PolarHBondContact OE1-OG1 2.87Å; E383-Y389 WeakPolarHBondContact OE1-CE1 3.19Å; E383-Y391 VanDerWaalsContact CD-OH 3.3Å; E383-Y391 PolarHBondContact OE2-OH 3.24Å
384	K	75.9	Confident	70.4	Confident	109 Å²	109	62.4 Å²	62.4	47%	0.474	35%	0.349	S	S	.	.	S	Bend	trans	-61.6	-48.2	-177.8	-71.1	-175.7	-178.5	176.9	0	112.7	S121 S122 D381	S121-K384 PolarHBondContact OG-O 3.39Å; S122-K384 WeakPolarHBondContact OG-CA 3.35Å; S122-K384 PolarHBondContact OG-N 3.18Å; D381-K384 HydrophobicContact CB-CG 4.42Å; D381-K384 VanDerWaalsContact OD2-CG 3.3Å; D381-K384 WeakPolarHBondContact OD2-CG 3.4Å
385	D	72.9	Confident	73.3	Confident	146 Å²	146	56.5 Å²	56.5	78%	0.781	31%	0.307	S	S	*	.	S	Bend	trans	-92.6	-12.8	-175.1	-56.1	-49.6	0	0	0	112.7
386	G	78.3	Confident	76	Confident	22 Å²	22	56.7 Å²	56.7	23%	0.227	29%	0.288	C	S	.	.	S	Bend	trans	-179.1	144.4	176.6	0	0	0	0	0	111.9	K120 E383	K120-G386 CarbonylContact O-C 3.56Å; K120-G386 WeakPolarHBondContact O-CA 3.13Å; E383-G386 CarbonylContact C-O 3.54Å; E383-G386 VanDerWaalsContact CA-O 3.27Å; E383-G386 WeakPolarHBondContact CA-O 3.35Å
387	V	79.4	Confident	78.5	Confident	17 Å²	17	49.9 Å²	49.9	10%	0.103	26%	0.256	C	S	.	.			trans	-68.8	136.2	174.7	-66.7	0	0	0	0	111.1	V119 K120 Y389 Y391	V119-V387 HydrophobicContact CG1-CG1 4.36Å; K120-V387 PolarHBondContact O-N 3.22Å; V387-Y389 VanDerWaalsContact C-N 3.28Å; V387-Y389 PolarHBondContact O-N 2.62Å; V387-Y391 HydrophobicContact CB-CE1 4.1Å; V387-Y391 HydrophobicContact CG1-CD1 4.48Å; V387-Y391 HydrophobicContact CG1-CE1 3.83Å; V387-Y391 HydrophobicContact CG1-CE2 3.88Å; V387-Y391 VanDerWaalsContact CG1-CZ 3.48Å
388	T	77.8	Confident	80.8	Confident	31 Å²	31	45.2 Å²	45.2	19%	0.19	23%	0.231	C	C	.	.	S	Bend	trans	-77	-18.4	-178.4	55.5	0	0	0	0	113	S35 S343 E383	S35-T388 WeakPolarHBondContact CB-OG1 3.31Å; S343-T388 WeakPolarHBondContact CB-O 3.26Å; S343-T388 WeakPolarHBondContact OG-CB 3.31Å; S343-T388 PolarHBondContact OG-O 3.43Å; E383-T388 HydrophobicContact CG-CG2 3.96Å; E383-T388 PolarHBondContact OE1-N 3.49Å; E383-T388 PolarHBondContact OE1-OG1 2.87Å
389	Y	80.6	Confident	82.9	Confident	15 Å²	15	37.4 Å²	37.4	6%	0.059	20%	0.202	C	C	.	.	S	Bend	trans	-149.4	157.3	175.2	63.6	-78.8	0	0	0	110.1	R39 H130 E383 V387 Y391 F394	R39-Y389 HydrophobicContact CG-CE1 4.01Å; R39-Y389 HydrophobicContact CG-CE2 4Å; R39-Y389 WeakPolarHBondContact CG-OH 3.12Å; H130-Y389 AromaticContact NE2-CZ 3.86Å; H130-Y389 PolarHBondContact NE2-OH 3.39Å; E383-Y389 WeakPolarHBondContact OE1-CE1 3.19Å; V387-Y389 VanDerWaalsContact C-N 3.28Å; V387-Y389 PolarHBondContact O-N 2.62Å; Y389-Y391 HydrophobicContact CD2-CD1 4.05Å; Y389-Y391 HydrophobicContact CE1-CD1 4.17Å; Y389-Y391 AromaticContact CE1-CE1 3.92Å; Y389-Y391 HydrophobicContact CE1-CE1 3.92Å; Y389-Y391 AromaticContact CE2-CD1 3.56Å; Y389-Y391 HydrophobicContact CE2-CD1 3.56Å; Y389-Y391 HydrophobicContact CE2-CE1 4.15Å; Y389-Y391 AromaticContact CZ-CD1 3.62Å; Y389-Y391 AromaticContact CZ-CE1 3.72Å; Y389-Y391 PolarHBondContact O-N 3.44Å; Y389-Y391 VanDerWaalsContact O-N 3.11Å; Y389-F394 HydrophobicContact CD2-CB 3.72Å; Y389-F394 HydrophobicContact CD2-CG 4.23Å; Y389-F394 HydrophobicContact CE2-CB 3.63Å; Y389-F394 HydrophobicContact CE2-CD1 4.07Å; Y389-F394 HydrophobicContact CE2-CD2 4.38Å; Y389-F394 AromaticContact CE2-CG 3.77Å; Y389-F394 HydrophobicContact CE2-CG 3.77Å
390	S	85.2	Confident	84.7	Confident	32 Å²	32	37 Å²	37	22%	0.224	20%	0.198	C	C	.	.			trans	-69.2	108.8	172.7	174.8	0	0	0	0	110.8	S392 F393 F394	S390-S392 VanDerWaalsContact C-N 3.27Å; S390-S392 PolarHBondContact O-N 3.31Å; S390-F393 PolarHBondContact O-N 3.27Å; S390-F393 PolarHBondContact OG-N 3.01Å; S390-F394 PolarHBondContact O-N 3.23Å
391	Y	88.6	Confident	86	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-57.1	-39.9	177.5	-65.3	-8	0	0	0	112.5	V119 A127 H130 E383 V387 Y389 F394 H395	V119-Y391 HydrophobicContact CB-CD2 4.08Å; V119-Y391 HydrophobicContact CG1-CD2 3.73Å; V119-Y391 HydrophobicContact CG1-CE2 3.71Å; A127-Y391 HydrophobicContact CB-CE2 4Å; H130-Y391 HydrophobicContact CB-CD2 4.15Å; H130-Y391 HydrophobicContact CB-CE2 4.27Å; H130-Y391 AromaticContact CD2-CD1 3.91Å; H130-Y391 AromaticContact CD2-CD2 3.7Å; H130-Y391 AromaticContact CD2-CE1 3.84Å; H130-Y391 AromaticContact CD2-CE2 3.66Å; H130-Y391 AromaticContact CD2-CG 3.84Å; H130-Y391 AromaticContact CD2-CZ 3.73Å; H130-Y391 AromaticContact CG-CD2 3.88Å; H130-Y391 AromaticContact NE2-CD1 3.7Å; H130-Y391 AromaticContact NE2-CE1 3.89Å; H130-Y391 AromaticContact NE2-CG 3.86Å; E383-Y391 VanDerWaalsContact CD-OH 3.3Å; E383-Y391 PolarHBondContact OE2-OH 3.24Å; V387-Y391 HydrophobicContact CB-CE1 4.1Å; V387-Y391 HydrophobicContact CG1-CD1 4.48Å; V387-Y391 HydrophobicContact CG1-CE1 3.83Å; V387-Y391 HydrophobicContact CG1-CE2 3.88Å; V387-Y391 VanDerWaalsContact CG1-CZ 3.48Å; Y389-Y391 HydrophobicContact CD2-CD1 4.05Å; Y389-Y391 HydrophobicContact CE1-CD1 4.17Å; Y389-Y391 AromaticContact CE1-CE1 3.92Å; Y389-Y391 HydrophobicContact CE1-CE1 3.92Å; Y389-Y391 AromaticContact CE2-CD1 3.56Å; Y389-Y391 HydrophobicContact CE2-CD1 3.56Å; Y389-Y391 HydrophobicContact CE2-CE1 4.15Å; Y389-Y391 AromaticContact CZ-CD1 3.62Å; Y389-Y391 AromaticContact CZ-CE1 3.72Å; Y389-Y391 PolarHBondContact O-N 3.44Å; Y389-Y391 VanDerWaalsContact O-N 3.11Å; Y391-F394 PolarHBondContact O-N 3.35Å; Y391-H395 PolarHBondContact O-CD2 2.84Å; Y391-H395 PolarHBondContact O-N 3.07Å; Y391-H395 VanDerWaalsContact O-N 3.11Å
392	S	89.8	Confident	87.1	Confident	21 Å²	21	30.3 Å²	30.3	15%	0.147	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-45.8	178.5	-176.4	0	0	0	0	111.5	S113 S390 H395 F396	S113-S392 WeakPolarHBondContact O-CB 3.3Å; S113-S392 PolarHBondContact O-OG 2.83Å; S113-S392 PolarHBondContact OG-O 3.36Å; S113-S392 PolarHBondContact OG-OG 3.45Å; S390-S392 VanDerWaalsContact C-N 3.27Å; S390-S392 PolarHBondContact O-N 3.31Å; S392-H395 PolarHBondContact O-N 3.48Å; S392-F396 WeakPolarHBondContact O-CB 3.27Å; S392-F396 PolarHBondContact O-N 3.13Å
393	F	89.3	Confident	88.1	Confident	49 Å²	49	28.1 Å²	28.1	22%	0.215	15%	0.148	C	C	.	.	H	α-helix	trans	-65.6	-41.3	178.2	-174.1	-102.8	0	0	0	111.6	T352 S390 H395 F396 M397	T352-F393 HydrophobicContact CG2-CD1 3.56Å; T352-F393 HydrophobicContact CG2-CE1 3.32Å; T352-F393 HydrophobicContact CG2-CZ 4.29Å; S390-F393 PolarHBondContact O-N 3.27Å; S390-F393 PolarHBondContact OG-N 3.01Å; F393-H395 PolarHBondContact O-N 3.46Å; F393-F396 WeakPolarHBondContact O-CB 3.26Å; F393-F396 PolarHBondContact O-N 3.47Å; F393-F396 VanDerWaalsContact O-N 3.14Å; F393-M397 HydrophobicContact CD1-CE 3.81Å; F393-M397 HydrophobicContact CD1-CG 4.05Å; F393-M397 HydrophobicContact CD1-SD 3.99Å; F393-M397 HydrophobicContact CE1-CE 3.8Å; F393-M397 HydrophobicContact CE1-CG 3.7Å; F393-M397 HydrophobicContact CE1-SD 3.39Å; F393-M397 WeakPolarHBondContact CE1-SD 3.42Å; F393-M397 HydrophobicContact CZ-CG 4.03Å; F393-M397 HydrophobicContact CZ-SD 4.08Å; F393-M397 WeakPolarHBondContact O-CG 3.21Å; F393-M397 PolarHBondContact O-N 3.22Å
394	F	91.1	Very high	88.9	Confident	5 Å²	5	28.5 Å²	28.5	2%	0.022	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-49.6	174.7	174	-104.3	0	0	0	112.5	R39 Y42 Y389 S390 Y391 F396 M397 L398	R39-F394 HydrophobicContact CB-CE2 4.01Å; R39-F394 HydrophobicContact CB-CZ 3.83Å; R39-F394 HydrophobicContact CG-CD2 4.16Å; R39-F394 HydrophobicContact CG-CE1 4.2Å; R39-F394 HydrophobicContact CG-CE2 3.75Å; R39-F394 HydrophobicContact CG-CZ 3.76Å; Y42-F394 HydrophobicContact CD2-CE1 4.01Å; Y42-F394 HydrophobicContact CG-CE1 4.16Å; Y389-F394 HydrophobicContact CD2-CB 3.72Å; Y389-F394 HydrophobicContact CD2-CG 4.23Å; Y389-F394 HydrophobicContact CE2-CB 3.63Å; Y389-F394 HydrophobicContact CE2-CD1 4.07Å; Y389-F394 HydrophobicContact CE2-CD2 4.38Å; Y389-F394 AromaticContact CE2-CG 3.77Å; Y389-F394 HydrophobicContact CE2-CG 3.77Å; S390-F394 PolarHBondContact O-N 3.23Å; Y391-F394 PolarHBondContact O-N 3.35Å; F394-F396 VanDerWaalsContact C-N 3.29Å; F394-F396 PolarHBondContact O-N 2.84Å; F394-M397 HydrophobicContact CD2-CE 4.3Å; F394-M397 WeakPolarHBondContact O-CB 3.4Å; F394-M397 PolarHBondContact O-N 3.14Å; F394-L398 HydrophobicContact CD1-CD1 4.25Å; F394-L398 HydrophobicContact CE1-CD1 3.59Å; F394-L398 HydrophobicContact CE1-CG 4.41Å; F394-L398 HydrophobicContact CE2-CD1 4.4Å; F394-L398 HydrophobicContact CZ-CD1 3.67Å; F394-L398 HydrophobicContact CZ-CD2 4.47Å; F394-L398 HydrophobicContact CZ-CG 4.25Å; F394-L398 PolarHBondContact O-N 3.31Å; F394-L398 VanDerWaalsContact O-N 3.1Å
395	H	94	Very high	89.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.6	-33.1	176.1	-75.3	-57.5	0	0	0	112.7	Y42 F109 F112 H130 Y391 S392 F393 L398 F399	Y42-H395 AromaticContact CD1-CE1 3.86Å; Y42-H395 AromaticContact CD2-CE1 3.88Å; Y42-H395 AromaticContact CE1-CE1 3.55Å; Y42-H395 AromaticContact CE2-CE1 3.59Å; Y42-H395 AromaticContact CE2-NE2 4Å; Y42-H395 AromaticContact CZ-CE1 3.4Å; Y42-H395 VanDerWaalsContact CZ-CE1 3.4Å; Y42-H395 AromaticContact CZ-NE2 3.94Å; F109-H395 AromaticContact CD1-ND1 3.88Å; F112-H395 HydrophobicContact CB-CB 4.32Å; H130-H395 AromaticContact CE1-CE1 3.94Å; H130-H395 AromaticContact CE1-NE2 3.21Å; H130-H395 PolarHBondContact CE1-NE2 3.39Å; H130-H395 AromaticContact ND1-CD2 3.92Å; H130-H395 AromaticContact ND1-CE1 3.86Å; H130-H395 AromaticContact ND1-NE2 2.95Å; H130-H395 PolarHBondContact ND1-NE2 3.38Å; Y391-H395 PolarHBondContact O-CD2 2.84Å; Y391-H395 PolarHBondContact O-N 3.07Å; Y391-H395 VanDerWaalsContact O-N 3.11Å; S392-H395 PolarHBondContact O-N 3.48Å; F393-H395 PolarHBondContact O-N 3.46Å; H395-L398 PolarHBondContact O-N 2.88Å; H395-F399 PolarHBondContact O-N 3.03Å
396	F	94.6	Very high	90.8	Very high	78 Å²	78	16.3 Å²	16.3	34%	0.342	9%	0.089	S	C	.	.	H	α-helix	trans	-64.6	-39.9	173.7	-171.3	-109	0	0	0	111.8	S392 F393 F394 L398 F399 L400	S392-F396 WeakPolarHBondContact O-CB 3.27Å; S392-F396 PolarHBondContact O-N 3.13Å; F393-F396 WeakPolarHBondContact O-CB 3.26Å; F393-F396 PolarHBondContact O-N 3.47Å; F393-F396 VanDerWaalsContact O-N 3.14Å; F394-F396 VanDerWaalsContact C-N 3.29Å; F394-F396 PolarHBondContact O-N 2.84Å; F396-L398 VanDerWaalsContact C-N 3.34Å; F396-L398 PolarHBondContact O-N 3.01Å; F396-F399 AromaticContact CD2-CD1 3.92Å; F396-F399 HydrophobicContact CD2-CD1 3.92Å; F396-F399 AromaticContact CE2-CD1 3.8Å; F396-F399 HydrophobicContact CE2-CD1 3.8Å; F396-F399 HydrophobicContact CE2-CE1 4Å; F396-F399 WeakPolarHBondContact O-CB 3.38Å; F396-F399 PolarHBondContact O-N 3.14Å; F396-L400 HydrophobicContact CD1-CD1 3.98Å; F396-L400 HydrophobicContact CD1-CG 4.37Å; F396-L400 HydrophobicContact CE1-CD1 3.63Å; F396-L400 HydrophobicContact CE1-CD2 4.41Å; F396-L400 HydrophobicContact CE1-CG 4.08Å; F396-L400 HydrophobicContact CZ-CD1 4.28Å; F396-L400 HydrophobicContact CZ-CD2 4.23Å; F396-L400 HydrophobicContact CZ-CG 4.32Å; F396-L400 WeakPolarHBondContact O-CG 3.48Å; F396-L400 PolarHBondContact O-N 3.45Å
397	M	93.8	Very high	91.5	Very high	24 Å²	24	15.3 Å²	15.3	12%	0.118	8%	0.079	C	C	.	.	H	α-helix	trans	-61.2	-42.3	172.7	-66.2	-165.4	-74.1	0	0	111.6	I174 F393 F394 F399 L400 A401	I174-M397 HydrophobicContact CD1-CG 4.05Å; I174-M397 HydrophobicContact CG2-SD 3.89Å; F393-M397 HydrophobicContact CD1-CE 3.81Å; F393-M397 HydrophobicContact CD1-CG 4.05Å; F393-M397 HydrophobicContact CD1-SD 3.99Å; F393-M397 HydrophobicContact CE1-CE 3.8Å; F393-M397 HydrophobicContact CE1-CG 3.7Å; F393-M397 HydrophobicContact CE1-SD 3.39Å; F393-M397 WeakPolarHBondContact CE1-SD 3.42Å; F393-M397 HydrophobicContact CZ-CG 4.03Å; F393-M397 HydrophobicContact CZ-SD 4.08Å; F393-M397 WeakPolarHBondContact O-CG 3.21Å; F393-M397 PolarHBondContact O-N 3.22Å; F394-M397 HydrophobicContact CD2-CE 4.3Å; F394-M397 WeakPolarHBondContact O-CB 3.4Å; F394-M397 PolarHBondContact O-N 3.14Å; M397-F399 VanDerWaalsContact C-N 3.34Å; M397-F399 PolarHBondContact O-N 3.33Å; M397-L400 PolarHBondContact O-N 3.16Å; M397-A401 WeakPolarHBondContact O-CB 3.42Å; M397-A401 PolarHBondContact O-N 3.03Å
398	L	95.1	Very high	92.1	Very high	9 Å²	9	14.8 Å²	14.8	5%	0.047	8%	0.076	C	C	.	.	H	α-helix	trans	-66.6	-33.8	176.2	-62.7	-179.3	0	0	0	112.7	L46 F109 F394 H395 F396 A401 S402	L46-L398 HydrophobicContact CD2-CD2 3.78Å; F109-L398 HydrophobicContact CB-CB 4.27Å; F109-L398 HydrophobicContact CD1-CB 3.64Å; F109-L398 HydrophobicContact CD1-CD1 3.79Å; F109-L398 HydrophobicContact CD1-CG 4.39Å; F109-L398 HydrophobicContact CD2-CB 4.12Å; F109-L398 HydrophobicContact CE1-CB 3.93Å; F109-L398 HydrophobicContact CE1-CD1 3.45Å; F109-L398 VanDerWaalsContact CE1-CD1 3.45Å; F109-L398 HydrophobicContact CE1-CG 4.34Å; F109-L398 HydrophobicContact CE2-CB 4.39Å; F109-L398 HydrophobicContact CG-CB 3.75Å; F109-L398 HydrophobicContact CZ-CB 4.3Å; F109-L398 HydrophobicContact CZ-CD1 4.12Å; F394-L398 HydrophobicContact CD1-CD1 4.25Å; F394-L398 HydrophobicContact CE1-CD1 3.59Å; F394-L398 HydrophobicContact CE1-CG 4.41Å; F394-L398 HydrophobicContact CE2-CD1 4.4Å; F394-L398 HydrophobicContact CZ-CD1 3.67Å; F394-L398 HydrophobicContact CZ-CD2 4.47Å; F394-L398 HydrophobicContact CZ-CG 4.25Å; F394-L398 PolarHBondContact O-N 3.31Å; F394-L398 VanDerWaalsContact O-N 3.1Å; H395-L398 PolarHBondContact O-N 2.88Å; F396-L398 VanDerWaalsContact C-N 3.34Å; F396-L398 PolarHBondContact O-N 3.01Å; L398-A401 WeakPolarHBondContact O-CB 3.44Å; L398-A401 PolarHBondContact O-N 3.04Å; L398-S402 PolarHBondContact O-N 3.31Å
399	F	97.3	Very high	92.6	Very high	21 Å²	21	13.7 Å²	13.7	9%	0.092	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-51.2	169.5	160.1	-107.7	0	0	0	111.2	A106 F109 L110 H395 F396 M397 A401 S402 L403	A106-F399 HydrophobicContact CB-CD2 3.77Å; A106-F399 HydrophobicContact CB-CE2 3.9Å; A106-F399 VanDerWaalsContact O-CD2 3.27Å; A106-F399 WeakPolarHBondContact O-CD2 3.4Å; F109-F399 HydrophobicContact CB-CB 3.99Å; L110-F399 HydrophobicContact CB-CD2 3.83Å; L110-F399 HydrophobicContact CB-CE2 4.17Å; L110-F399 HydrophobicContact CB-CG 4.2Å; L110-F399 HydrophobicContact CD1-CD1 4.36Å; L110-F399 HydrophobicContact CD1-CE1 4.4Å; L110-F399 HydrophobicContact CD1-CG 4.43Å; L110-F399 HydrophobicContact CD2-CE2 4.17Å; L110-F399 HydrophobicContact CD2-CZ 4.37Å; H395-F399 PolarHBondContact O-N 3.03Å; F396-F399 AromaticContact CD2-CD1 3.92Å; F396-F399 HydrophobicContact CD2-CD1 3.92Å; F396-F399 AromaticContact CE2-CD1 3.8Å; F396-F399 HydrophobicContact CE2-CD1 3.8Å; F396-F399 HydrophobicContact CE2-CE1 4Å; F396-F399 WeakPolarHBondContact O-CB 3.38Å; F396-F399 PolarHBondContact O-N 3.14Å; M397-F399 VanDerWaalsContact C-N 3.34Å; M397-F399 PolarHBondContact O-N 3.33Å; F399-A401 VanDerWaalsContact C-N 3.32Å; F399-A401 PolarHBondContact O-N 3.02Å; F399-S402 PolarHBondContact O-N 2.9Å; F399-S402 VanDerWaalsContact O-N 3.15Å; F399-S402 PolarHBondContact O-OG 3.5Å; F399-L403 HydrophobicContact CE1-CD1 3.99Å; F399-L403 HydrophobicContact CE2-CD1 3.9Å; F399-L403 HydrophobicContact CE2-CG 4.25Å; F399-L403 HydrophobicContact CZ-CD1 3.58Å; F399-L403 HydrophobicContact CZ-CG 4.41Å; F399-L403 PolarHBondContact O-N 3.47Å
400	L	97	Very high	92.9	Very high	7 Å²	7	13 Å²	13	4%	0.037	7%	0.066	C	C	.	.	H	α-helix	trans	-62	-39.9	177.4	-64.6	176.9	0	0	0	112.1	C170 F171 I174 F396 M397 S402 L403 Y404	C170-L400 HydrophobicContact CB-CD1 3.88Å; C170-L400 HydrophobicContact CB-CD2 4.1Å; F171-L400 HydrophobicContact CB-CB 4.03Å; F171-L400 HydrophobicContact CD2-CB 4.22Å; I174-L400 HydrophobicContact CD1-CD1 3.71Å; F396-L400 HydrophobicContact CD1-CD1 3.98Å; F396-L400 HydrophobicContact CD1-CG 4.37Å; F396-L400 HydrophobicContact CE1-CD1 3.63Å; F396-L400 HydrophobicContact CE1-CD2 4.41Å; F396-L400 HydrophobicContact CE1-CG 4.08Å; F396-L400 HydrophobicContact CZ-CD1 4.28Å; F396-L400 HydrophobicContact CZ-CD2 4.23Å; F396-L400 HydrophobicContact CZ-CG 4.32Å; F396-L400 WeakPolarHBondContact O-CG 3.48Å; F396-L400 PolarHBondContact O-N 3.45Å; M397-L400 PolarHBondContact O-N 3.16Å; L400-S402 VanDerWaalsContact C-N 3.33Å; L400-S402 PolarHBondContact O-N 3.23Å; L400-L403 WeakPolarHBondContact O-CB 3.41Å; L400-L403 PolarHBondContact O-N 3Å; L400-Y404 PolarHBondContact O-N 3.18Å
401	A	95.9	Very high	92.9	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.008	6%	0.057	C	C	.	.	H	α-helix	trans	-55.8	-44.3	172.6	0	0	0	0	0	112.5	L46 F171 F331 M397 L398 F399 L403 Y404 I405	L46-A401 HydrophobicContact CD2-CB 3.88Å; F171-A401 VanDerWaalsContact CD2-CA 3.49Å; F171-A401 HydrophobicContact CD2-CB 3.84Å; F171-A401 HydrophobicContact CE2-CB 3.47Å; F171-A401 VanDerWaalsContact CE2-CB 3.47Å; F171-A401 HydrophobicContact CZ-CB 3.96Å; F331-A401 HydrophobicContact CE2-CB 3.72Å; F331-A401 HydrophobicContact CZ-CB 4.44Å; M397-A401 WeakPolarHBondContact O-CB 3.42Å; M397-A401 PolarHBondContact O-N 3.03Å; L398-A401 WeakPolarHBondContact O-CB 3.44Å; L398-A401 PolarHBondContact O-N 3.04Å; F399-A401 VanDerWaalsContact C-N 3.32Å; F399-A401 PolarHBondContact O-N 3.02Å; A401-L403 VanDerWaalsContact C-N 3.32Å; A401-L403 PolarHBondContact O-N 3.24Å; A401-Y404 WeakPolarHBondContact O-CB 3.47Å; A401-Y404 PolarHBondContact O-N 3.4Å; A401-I405 WeakPolarHBondContact O-CG1 3.37Å; A401-I405 PolarHBondContact O-N 3.24Å
402	S	96.9	Very high	92.9	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.3	-34.7	178.3	71.4	0	0	0	0	112.7	A106 L398 F399 L400 M406	A106-S402 WeakPolarHBondContact CA-OG 3.39Å; A106-S402 WeakPolarHBondContact CB-OG 3.43Å; A106-S402 PolarHBondContact N-OG 3.14Å; L398-S402 PolarHBondContact O-N 3.31Å; F399-S402 PolarHBondContact O-N 2.9Å; F399-S402 VanDerWaalsContact O-N 3.15Å; F399-S402 PolarHBondContact O-OG 3.5Å; L400-S402 VanDerWaalsContact C-N 3.33Å; L400-S402 PolarHBondContact O-N 3.23Å; S402-M406 PolarHBondContact O-N 3.41Å; S402-M406 VanDerWaalsContact O-N 3.09Å
403	L	97.1	Very high	92.6	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.01	6%	0.057	C	C	.	.	H	α-helix	trans	-68.9	-41	172.5	-65.1	179.7	0	0	0	111.7	A106 W160 I163 F399 L400 A401 M406 M407	A106-L403 HydrophobicContact CB-CD2 4.1Å; W160-L403 HydrophobicContact CH2-CD2 4.44Å; W160-L403 HydrophobicContact CZ2-CD2 3.57Å; I163-L403 HydrophobicContact CG2-CD1 4.27Å; F399-L403 HydrophobicContact CE1-CD1 3.99Å; F399-L403 HydrophobicContact CE2-CD1 3.9Å; F399-L403 HydrophobicContact CE2-CG 4.25Å; F399-L403 HydrophobicContact CZ-CD1 3.58Å; F399-L403 HydrophobicContact CZ-CG 4.41Å; F399-L403 PolarHBondContact O-N 3.47Å; L400-L403 WeakPolarHBondContact O-CB 3.41Å; L400-L403 PolarHBondContact O-N 3Å; A401-L403 VanDerWaalsContact C-N 3.32Å; A401-L403 PolarHBondContact O-N 3.24Å; L403-M406 HydrophobicContact CD2-CE 4.2Å; L403-M406 WeakPolarHBondContact O-CB 3.36Å; L403-M406 PolarHBondContact O-N 2.98Å; L403-M407 WeakPolarHBondContact O-CG 3.31Å; L403-M407 PolarHBondContact O-N 3.31Å; L403-M407 VanDerWaalsContact O-N 3.14Å
404	Y	95.9	Very high	92.1	Very high	7 Å²	7	10.8 Å²	10.8	3%	0.027	5%	0.05	C	C	.	.	H	α-helix	trans	-60.1	-46.2	174.2	172.1	-94.8	0	0	0	112.6	A168 F171 I172 F331 L400 A401 M406 M407 T408	A168-Y404 HydrophobicContact CB-CD2 4.16Å; F171-Y404 AromaticContact CD1-CD1 3.79Å; F171-Y404 HydrophobicContact CD1-CD1 3.79Å; F171-Y404 AromaticContact CD1-CD2 3.86Å; F171-Y404 HydrophobicContact CD1-CD2 3.86Å; F171-Y404 AromaticContact CD1-CG 3.42Å; F171-Y404 HydrophobicContact CD1-CG 3.42Å; F171-Y404 VanDerWaalsContact CD1-CG 3.42Å; F171-Y404 AromaticContact CE1-CD1 3.87Å; F171-Y404 HydrophobicContact CE1-CD1 3.87Å; F171-Y404 HydrophobicContact CE1-CE1 4.4Å; F171-Y404 HydrophobicContact CE1-CG 4.01Å; F171-Y404 HydrophobicContact CG-CG 4.25Å; I172-Y404 HydrophobicContact CD1-CD2 4.37Å; I172-Y404 HydrophobicContact CD1-CE2 4.14Å; I172-Y404 HydrophobicContact CG1-CD2 3.95Å; I172-Y404 HydrophobicContact CG1-CE2 3.76Å; F331-Y404 HydrophobicContact CB-CD1 4.48Å; F331-Y404 HydrophobicContact CB-CE1 3.95Å; F331-Y404 AromaticContact CD2-CD1 3.86Å; F331-Y404 HydrophobicContact CD2-CD1 3.86Å; F331-Y404 HydrophobicContact CD2-CE1 4.18Å; F331-Y404 HydrophobicContact CG-CE1 4.43Å; L400-Y404 PolarHBondContact O-N 3.18Å; A401-Y404 WeakPolarHBondContact O-CB 3.47Å; A401-Y404 PolarHBondContact O-N 3.4Å; Y404-M406 VanDerWaalsContact C-N 3.31Å; Y404-M406 PolarHBondContact O-N 3.17Å; Y404-M407 PolarHBondContact O-N 2.88Å; Y404-T408 WeakPolarHBondContact CE1-OG1 3.47Å; Y404-T408 WeakPolarHBondContact O-CB 3.43Å; Y404-T408 PolarHBondContact O-N 3.32Å; Y404-T408 PolarHBondContact O-OG1 2.76Å
405	I	95	Very high	91.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-60.3	-44.1	177	-74.2	-58.1	0	0	0	111	V50 L328 F331 A401 M407 T408 L409	V50-I405 HydrophobicContact CG1-CD1 4.47Å; V50-I405 HydrophobicContact CG1-CG2 4.29Å; V50-I405 HydrophobicContact CG2-CB 4.49Å; V50-I405 HydrophobicContact CG2-CD1 4.35Å; V50-I405 HydrophobicContact CG2-CG1 3.95Å; V50-I405 HydrophobicContact CG2-CG2 3.97Å; L328-I405 HydrophobicContact CD2-CD1 3.54Å; F331-I405 HydrophobicContact CB-CD1 4.33Å; F331-I405 HydrophobicContact CD1-CD1 3.6Å; F331-I405 HydrophobicContact CD1-CG1 4.3Å; F331-I405 HydrophobicContact CD2-CD1 3.69Å; F331-I405 HydrophobicContact CD2-CG1 3.92Å; F331-I405 HydrophobicContact CE1-CD1 3.68Å; F331-I405 HydrophobicContact CE1-CG1 3.92Å; F331-I405 HydrophobicContact CE2-CD1 3.75Å; F331-I405 HydrophobicContact CE2-CG1 3.48Å; F331-I405 VanDerWaalsContact CE2-CG1 3.48Å; F331-I405 HydrophobicContact CG-CD1 3.59Å; F331-I405 HydrophobicContact CG-CG1 4.29Å; F331-I405 HydrophobicContact CZ-CD1 3.74Å; F331-I405 HydrophobicContact CZ-CG1 3.47Å; F331-I405 VanDerWaalsContact CZ-CG1 3.47Å; A401-I405 WeakPolarHBondContact O-CG1 3.37Å; A401-I405 PolarHBondContact O-N 3.24Å; I405-M407 VanDerWaalsContact C-N 3.32Å; I405-M407 PolarHBondContact O-N 3.2Å; I405-T408 PolarHBondContact O-N 3.04Å; I405-L409 HydrophobicContact CG2-CD1 3.65Å; I405-L409 HydrophobicContact CG2-CG 4.06Å; I405-L409 WeakPolarHBondContact O-CB 3.24Å; I405-L409 WeakPolarHBondContact O-CG 3.46Å; I405-L409 PolarHBondContact O-N 3.08Å
406	M	94	Very high	89.9	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-53.9	-51.7	176.9	-173.4	-179.4	67.9	0	0	111.3	Y99 C102 W160 S402 L403 Y404 T408 T410	Y99-M406 HydrophobicContact CD1-CE 4.33Å; Y99-M406 HydrophobicContact CD1-CG 4.21Å; Y99-M406 HydrophobicContact CD1-SD 3.59Å; Y99-M406 VanDerWaalsContact CD1-SD 3.59Å; Y99-M406 HydrophobicContact CE1-CE 3.96Å; Y99-M406 HydrophobicContact CE1-CG 4.28Å; Y99-M406 HydrophobicContact CE1-SD 3.81Å; Y99-M406 HydrophobicContact CG-CG 4.41Å; Y99-M406 HydrophobicContact CG-SD 4.24Å; C102-M406 HydrophobicContact CB-CB 3.55Å; C102-M406 HydrophobicContact CB-CG 3.8Å; C102-M406 HydrophobicContact CB-SD 4.16Å; W160-M406 VanDerWaalsContact CD1-CE 3.4Å; W160-M406 HydrophobicContact CG-CE 4.38Å; W160-M406 HydrophobicContact CG-SD 4.46Å; W160-M406 PolarHBondContact NE1-SD 3.21Å; S402-M406 PolarHBondContact O-N 3.41Å; S402-M406 VanDerWaalsContact O-N 3.09Å; L403-M406 HydrophobicContact CD2-CE 4.2Å; L403-M406 WeakPolarHBondContact O-CB 3.36Å; L403-M406 PolarHBondContact O-N 2.98Å; Y404-M406 VanDerWaalsContact C-N 3.31Å; Y404-M406 PolarHBondContact O-N 3.17Å; M406-T408 VanDerWaalsContact C-N 3.33Å; M406-T408 PolarHBondContact O-N 3.22Å; M406-T410 VanDerWaalsContact O-CG2 3.31Å; M406-T410 WeakPolarHBondContact O-CG2 3.25Å; M406-T410 PolarHBondContact O-N 3.48Å; M406-T410 PolarHBondContact O-OG1 3.35Å
407	M	92.8	Very high	88.2	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.1	-37.5	-179.8	-62.7	-54	-57.3	0	0	112.3	F161 G164 M165 A168 L403 Y404 I405 T410 N411 W412	F161-M407 HydrophobicContact CD2-CE 3.6Å; F161-M407 HydrophobicContact CD2-SD 4.32Å; F161-M407 HydrophobicContact CE2-CE 3.52Å; F161-M407 HydrophobicContact CZ-CE 4.42Å; G164-M407 VanDerWaalsContact C-CG 3.46Å; G164-M407 WeakPolarHBondContact O-CG 3.44Å; M165-M407 HydrophobicContact CG-CE 3.47Å; M165-M407 VanDerWaalsContact CG-CE 3.47Å; M165-M407 HydrophobicContact CG-SD 4.37Å; A168-M407 HydrophobicContact CB-CB 4.25Å; A168-M407 HydrophobicContact CB-CG 3.96Å; L403-M407 WeakPolarHBondContact O-CG 3.31Å; L403-M407 PolarHBondContact O-N 3.31Å; L403-M407 VanDerWaalsContact O-N 3.14Å; Y404-M407 PolarHBondContact O-N 2.88Å; I405-M407 VanDerWaalsContact C-N 3.32Å; I405-M407 PolarHBondContact O-N 3.2Å; M407-T410 PolarHBondContact O-OG1 3.24Å; M407-N411 PolarHBondContact O-N 2.95Å; M407-W412 HydrophobicContact CB-CD2 3.97Å; M407-W412 HydrophobicContact CB-CE3 4.35Å; M407-W412 HydrophobicContact CB-CG 4.41Å; M407-W412 HydrophobicContact CB-CH2 4.44Å; M407-W412 HydrophobicContact CB-CZ2 4.04Å; M407-W412 HydrophobicContact CE-CD2 4.28Å; M407-W412 HydrophobicContact CE-CE3 3.97Å; M407-W412 PolarHBondContact O-N 3.18Å
408	T	91.9	Very high	86.4	Confident	7 Å²	7	19.2 Å²	19.2	4%	0.043	10%	0.098	C	C	.	.	H	α-helix	trans	-70.3	-44.2	-178.8	-58.4	0	0	0	0	111.7	Y404 I405 M406 T410 N411	Y404-T408 WeakPolarHBondContact CE1-OG1 3.47Å; Y404-T408 WeakPolarHBondContact O-CB 3.43Å; Y404-T408 PolarHBondContact O-N 3.32Å; Y404-T408 PolarHBondContact O-OG1 2.76Å; I405-T408 PolarHBondContact O-N 3.04Å; M406-T408 VanDerWaalsContact C-N 3.33Å; M406-T408 PolarHBondContact O-N 3.22Å; T408-T410 VanDerWaalsContact C-N 3.26Å; T408-T410 PolarHBondContact O-N 2.8Å; T408-N411 PolarHBondContact O-N 3.38Å
409	L	89.3	Confident	84.6	Confident	8 Å²	8	18.8 Å²	18.8	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-70.1	-22.9	178.2	-68.6	-177.7	0	0	0	113	A53 L57 Y95 V98 L328 I405 N411	A53-L409 HydrophobicContact CB-CD1 3.63Å; L57-L409 WeakPolarHBondContact CD2-O 3.45Å; Y95-L409 WeakPolarHBondContact CE1-O 3.41Å; V98-L409 HydrophobicContact CG1-CB 3.85Å; V98-L409 HydrophobicContact CG1-CD1 4.18Å; L328-L409 HydrophobicContact CD1-CD2 3.94Å; L328-L409 HydrophobicContact CD2-CD2 4.12Å; L328-L409 HydrophobicContact CG-CD2 4.5Å; I405-L409 HydrophobicContact CG2-CD1 3.65Å; I405-L409 HydrophobicContact CG2-CG 4.06Å; I405-L409 WeakPolarHBondContact O-CB 3.24Å; I405-L409 WeakPolarHBondContact O-CG 3.46Å; I405-L409 PolarHBondContact O-N 3.08Å; L409-N411 VanDerWaalsContact C-N 3.32Å
410	T	86.9	Confident	82.7	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.006	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	15.1	174.7	63.6	0	0	0	0	112.7	Y95 V98 Y99 M406 M407 T408 W412 Y413	Y95-T410 HydrophobicContact CD1-CG2 4.07Å; Y95-T410 HydrophobicContact CG-CG2 4.16Å; V98-T410 HydrophobicContact CB-CG2 4.26Å; V98-T410 HydrophobicContact CG1-CG2 3.93Å; Y99-T410 HydrophobicContact CD2-CG2 3.86Å; Y99-T410 HydrophobicContact CE2-CG2 3.58Å; M406-T410 VanDerWaalsContact O-CG2 3.31Å; M406-T410 WeakPolarHBondContact O-CG2 3.25Å; M406-T410 PolarHBondContact O-N 3.48Å; M406-T410 PolarHBondContact O-OG1 3.35Å; M407-T410 PolarHBondContact O-OG1 3.24Å; T408-T410 VanDerWaalsContact C-N 3.26Å; T408-T410 PolarHBondContact O-N 2.8Å; T410-W412 PolarHBondContact O-N 2.96Å; T410-Y413 WeakPolarHBondContact O-CD2 3.17Å; T410-Y413 PolarHBondContact O-N 2.94Å; T410-Y413 VanDerWaalsContact O-N 3.11Å
411	N	85.1	Confident	80.9	Confident	6 Å²	6	24.8 Å²	24.8	3%	0.032	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	26.6	178.8	-66.2	-44	0	0	0	114.1	Y95 N289 T318 M407 T408 L409 Y413	Y95-N411 PolarHBondContact OH-ND2 3.49Å; N289-N411 PolarHBondContact ND2-O 3.48Å; T318-N411 PolarHBondContact O-ND2 3.24Å; M407-N411 PolarHBondContact O-N 2.95Å; T408-N411 PolarHBondContact O-N 3.38Å; L409-N411 VanDerWaalsContact C-N 3.32Å; N411-Y413 HydrophobicContact CB-CD2 3.66Å; N411-Y413 HydrophobicContact CB-CE2 3.51Å; N411-Y413 HydrophobicContact CB-CG 4.43Å; N411-Y413 PolarHBondContact O-N 3.47Å; N411-Y413 VanDerWaalsContact O-N 3.12Å
412	W	87.6	Confident	79.4	Confident	7 Å²	7	26.4 Å²	26.4	3%	0.027	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	21.6	-177.6	-64.8	70.3	0	0	0	114.6	M165 A168 I172 M407 T410 S428 V431	M165-W412 HydrophobicContact CG-CE3 4.3Å; M165-W412 HydrophobicContact CG-CZ3 4.2Å; A168-W412 HydrophobicContact CB-CH2 3.42Å; A168-W412 VanDerWaalsContact CB-CH2 3.42Å; A168-W412 HydrophobicContact CB-CZ2 3.8Å; A168-W412 HydrophobicContact CB-CZ3 4.27Å; I172-W412 HydrophobicContact CD1-CH2 4.11Å; I172-W412 HydrophobicContact CD1-CZ2 4.15Å; M407-W412 HydrophobicContact CB-CD2 3.97Å; M407-W412 HydrophobicContact CB-CE3 4.35Å; M407-W412 HydrophobicContact CB-CG 4.41Å; M407-W412 HydrophobicContact CB-CH2 4.44Å; M407-W412 HydrophobicContact CB-CZ2 4.04Å; M407-W412 HydrophobicContact CE-CD2 4.28Å; M407-W412 HydrophobicContact CE-CE3 3.97Å; M407-W412 PolarHBondContact O-N 3.18Å; T410-W412 PolarHBondContact O-N 2.96Å; W412-S428 PolarHBondContact O-OG 2.97Å; W412-S428 VanDerWaalsContact O-OG 3.11Å; W412-V431 HydrophobicContact CH2-CG1 3.83Å; W412-V431 HydrophobicContact CZ3-CB 4.37Å; W412-V431 HydrophobicContact CZ3-CG1 3.76Å
413	Y	83.2	Confident	78.1	Confident	35 Å²	35	28.9 Å²	28.9	14%	0.137	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-74.4	139.1	176.2	-68.2	-49	0	0	0	111.4	Y95 F161 V317 T410 N411 P415 M422 S424	Y95-Y413 AromaticContact CE2-CD2 3.95Å; Y95-Y413 HydrophobicContact CE2-CD2 3.95Å; F161-Y413 WeakPolarHBondContact CD2-O 2.97Å; F161-Y413 WeakPolarHBondContact CE2-O 3.32Å; V317-Y413 HydrophobicContact CG1-CE2 4.25Å; T410-Y413 WeakPolarHBondContact O-CD2 3.17Å; T410-Y413 PolarHBondContact O-N 2.94Å; T410-Y413 VanDerWaalsContact O-N 3.11Å; N411-Y413 HydrophobicContact CB-CD2 3.66Å; N411-Y413 HydrophobicContact CB-CE2 3.51Å; N411-Y413 HydrophobicContact CB-CG 4.43Å; N411-Y413 PolarHBondContact O-N 3.47Å; N411-Y413 VanDerWaalsContact O-N 3.12Å; Y413-P415 WeakPolarHBondContact O-CD 3.46Å; Y413-M422 HydrophobicContact CD2-CB 4.46Å; Y413-M422 HydrophobicContact CG-CB 4.26Å; Y413-S424 WeakPolarHBondContact CE1-OG 3.36Å
414	S	79.8	Confident	77.1	Confident	9 Å²	9	29.6 Å²	29.6	6%	0.063	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.1	175.5	-171.8	0	0	0	0	110.2	T423	S414-T423 PolarHBondContact N-O 3.45Å; S414-T423 PolarHBondContact O-N 2.91Å
415	P	72.9	Confident	76.4	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.013	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133.6	171.9	28.2	-31	0	0	0	110.7	A157 F161 Y413 Y419 M422	A157-P415 HydrophobicContact CB-CB 3.89Å; A157-P415 HydrophobicContact CB-CG 3.65Å; F161-P415 HydrophobicContact CB-CG 4.22Å; Y413-P415 WeakPolarHBondContact O-CD 3.46Å; P415-Y419 HydrophobicContact CB-CD1 3.83Å; P415-Y419 HydrophobicContact CB-CE1 3.92Å; P415-M422 HydrophobicContact CB-CE 3.68Å; P415-M422 HydrophobicContact CB-SD 4.09Å
416	D	66.4	Low	76.1	Confident	69 Å²	69	39.9 Å²	39.9	37%	0.369	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-68.4	159.7	162.5	-166.3	6.3	0	0	0	110.8	K418 Y419 T421	D416-K418 PolarHBondContact O-N 3.43Å; D416-Y419 WeakPolarHBondContact O-CA 3.48Å; D416-Y419 PolarHBondContact O-N 3.35Å; D416-T421 PolarHBondContact N-O 3.5Å
417	S	58.8	Low	75.8	Confident	72 Å²	72	42.8 Å²	42.8	50%	0.503	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-26.2	178.1	57.1	0	0	0	0	114.7
418	K	54.8	Low	75.6	Confident	140 Å²	140	42.8 Å²	42.8	61%	0.609	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.5	4.7	175.2	-61.8	-177	-177.5	176.6	0	113.5	D416 E420	D416-K418 PolarHBondContact O-N 3.43Å; K418-E420 HydrophobicContact CB-CG 3.84Å; K418-E420 WeakPolarHBondContact CD-OE1 3.33Å; K418-E420 PolarHBondContact O-N 3.47Å
419	Y	58.8	Low	75.6	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.212	C	C	.	.	S	Bend	trans	58.8	6.6	-172.1	-73.3	-92	0	0	0	114.6	L92 K96 E153 A157 P415 D416 T421 M422	L92-Y419 HydrophobicContact CD1-CD1 4.18Å; L92-Y419 WeakPolarHBondContact CD1-O 3.3Å; L92-Y419 WeakPolarHBondContact CD2-O 3.11Å; L92-Y419 WeakPolarHBondContact CG-O 3.36Å; K96-Y419 HydrophobicContact CD-CD1 4.4Å; K96-Y419 HydrophobicContact CD-CG 4.42Å; K96-Y419 VanDerWaalsContact CE-CB 3.43Å; K96-Y419 HydrophobicContact CG-CD1 3.8Å; K96-Y419 HydrophobicContact CG-CE1 3.69Å; K96-Y419 HydrophobicContact CG-CG 4.31Å; E153-Y419 HydrophobicContact CB-CE2 4.34Å; A157-Y419 WeakPolarHBondContact CA-OH 3.14Å; A157-Y419 HydrophobicContact CB-CD1 4.35Å; A157-Y419 HydrophobicContact CB-CD2 4.31Å; A157-Y419 HydrophobicContact CB-CE1 3.49Å; A157-Y419 VanDerWaalsContact CB-CE1 3.49Å; A157-Y419 HydrophobicContact CB-CE2 3.45Å; A157-Y419 VanDerWaalsContact CB-CE2 3.45Å; A157-Y419 WeakPolarHBondContact CB-OH 3.23Å; P415-Y419 HydrophobicContact CB-CD1 3.83Å; P415-Y419 HydrophobicContact CB-CE1 3.92Å; D416-Y419 WeakPolarHBondContact O-CA 3.48Å; D416-Y419 PolarHBondContact O-N 3.35Å; Y419-T421 PolarHBondContact O-N 3.48Å; Y419-M422 HydrophobicContact CD1-CE 3.86Å; Y419-M422 HydrophobicContact CE1-CE 4.42Å
420	E	56.2	Low	75.8	Confident	94 Å²	94	47.3 Å²	47.3	44%	0.439	23%	0.23	S	C	.	.			trans	-66.7	-23.1	-173.8	-71	170.9	-170.5	0	0	113.6	V87 K418	V87-E420 WeakPolarHBondContact CG1-O 3.47Å; V87-E420 HydrophobicContact CG2-CB 4.32Å; K418-E420 HydrophobicContact CB-CG 3.84Å; K418-E420 WeakPolarHBondContact CD-OE1 3.33Å; K418-E420 PolarHBondContact O-N 3.47Å
421	T	59.8	Low	76	Confident	60 Å²	60	48.4 Å²	48.4	37%	0.368	24%	0.237	S	C	.	.			trans	-135.7	144	176.8	61.7	0	0	0	0	111.4	D416 Y419	D416-T421 PolarHBondContact N-O 3.5Å; Y419-T421 PolarHBondContact O-N 3.48Å
422	M	65.2	Low	76.4	Confident	35 Å²	35	48.3 Å²	48.3	17%	0.172	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.7	173.5	-75.7	-72.7	175.2	0	0	107.1	L92 Y95 Y413 P415 Y419	L92-M422 HydrophobicContact CD1-CE 3.42Å; L92-M422 VanDerWaalsContact CD1-CE 3.42Å; L92-M422 HydrophobicContact CD1-CG 4.05Å; Y95-M422 HydrophobicContact CD2-CE 4.15Å; Y95-M422 HydrophobicContact CD2-CG 4.13Å; Y95-M422 HydrophobicContact CD2-SD 4.16Å; Y95-M422 HydrophobicContact CE2-CG 4.46Å; Y413-M422 HydrophobicContact CD2-CB 4.46Å; Y413-M422 HydrophobicContact CG-CB 4.26Å; P415-M422 HydrophobicContact CB-CE 3.68Å; P415-M422 HydrophobicContact CB-SD 4.09Å; Y419-M422 HydrophobicContact CD1-CE 3.86Å; Y419-M422 HydrophobicContact CE1-CE 4.42Å
423	T	68.7	Low	76.8	Confident	51 Å²	51	48 Å²	48	31%	0.313	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.6	-172.7	53.9	0	0	0	0	111.6	S414 R425	S414-T423 PolarHBondContact N-O 3.45Å; S414-T423 PolarHBondContact O-N 2.91Å; T423-R425 PolarHBondContact OG1-NE 2.94Å
424	S	76.8	Confident	77.4	Confident	18 Å²	18	47.9 Å²	47.9	13%	0.126	24%	0.239	C	C	.	.			trans	-64.5	139.8	165.4	-78.3	0	0	0	0	109.5	N289 Y413	N289-S424 WeakPolarHBondContact O-CB 3.5Å; Y413-S424 WeakPolarHBondContact CE1-OG 3.36Å
425	R	81.7	Confident	78	Confident	131 Å²	131	47.4 Å²	47.4	49%	0.494	24%	0.236	S	C	.	.			trans	-136.6	143.5	-178	-64.1	-68.7	-170.1	129.9	2.5	110.4	T423 P427 S428	T423-R425 PolarHBondContact OG1-NE 2.94Å; R425-P427 VanDerWaalsContact C-N 3.33Å; R425-S428 WeakPolarHBondContact O-CB 3.48Å; R425-S428 PolarHBondContact O-N 2.95Å
426	W	88.1	Confident	79.1	Confident	91 Å²	91	47.3 Å²	47.3	35%	0.345	24%	0.236	S	C	.	.	H	α-helix	trans	-48.5	-40.6	176.7	-78.6	111	0	0	0	115.5	E236 F240 E290 P291 S428 V429 W430	E236-W426 HydrophobicContact CB-CH2 3.73Å; E236-W426 HydrophobicContact CB-CZ3 4.29Å; E236-W426 HydrophobicContact CG-CH2 3.63Å; E236-W426 HydrophobicContact CG-CZ2 4.32Å; E236-W426 HydrophobicContact CG-CZ3 4.42Å; F240-W426 HydrophobicContact CE2-CZ3 4.14Å; F240-W426 HydrophobicContact CZ-CZ3 4.26Å; E290-W426 WeakPolarHBondContact OE1-CH2 3.27Å; E290-W426 WeakPolarHBondContact OE1-CZ2 3.35Å; E290-W426 WeakPolarHBondContact OE2-CH2 3.06Å; E290-W426 WeakPolarHBondContact OE2-CZ3 3.14Å; P291-W426 HydrophobicContact CG-CD2 4.06Å; P291-W426 HydrophobicContact CG-CG 4.05Å; P291-W426 HydrophobicContact CG-CZ2 4.2Å; P291-W426 VanDerWaalsContact CG-NE1 3.32Å; W426-S428 VanDerWaalsContact C-N 3.26Å; W426-S428 PolarHBondContact O-N 3.35Å; W426-V429 HydrophobicContact CE3-CB 4.31Å; W426-V429 HydrophobicContact CE3-CG1 4.47Å; W426-V429 HydrophobicContact CE3-CG2 4.45Å; W426-V429 HydrophobicContact CZ3-CG1 4.4Å; W426-V429 WeakPolarHBondContact O-CB 3.01Å; W426-V429 PolarHBondContact O-N 3.46Å; W426-V429 VanDerWaalsContact O-N 3.07Å; W426-W430 AromaticContact CE3-NE1 3.91Å; W426-W430 VanDerWaalsContact O-CD1 3.26Å; W426-W430 PolarHBondContact O-N 3.12Å
427	P	88.1	Confident	80.5	Confident	61 Å²	61	48 Å²	48	40%	0.396	23%	0.233	S	C	.	.	H	α-helix	trans	-55.3	-38.5	176.6	-29.3	38.2	0	0	0	114	M165 R425 V429 W430 V431	M165-P427 HydrophobicContact CE-CB 4.41Å; M165-P427 HydrophobicContact SD-CB 4.18Å; R425-P427 VanDerWaalsContact C-N 3.33Å; P427-V429 VanDerWaalsContact C-N 3.34Å; P427-V429 PolarHBondContact O-N 3.03Å; P427-W430 PolarHBondContact O-N 2.74Å; P427-V431 WeakPolarHBondContact O-CB 3.46Å; P427-V431 VanDerWaalsContact O-CG2 3.29Å; P427-V431 WeakPolarHBondContact O-CG2 3.29Å; P427-V431 PolarHBondContact O-N 3.05Å
428	S	87.3	Confident	82.2	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-39.5	177	-59.3	0	0	0	0	111.6	W412 R425 W426 K432	W412-S428 PolarHBondContact O-OG 2.97Å; W412-S428 VanDerWaalsContact O-OG 3.11Å; R425-S428 WeakPolarHBondContact O-CB 3.48Å; R425-S428 PolarHBondContact O-N 2.95Å; W426-S428 VanDerWaalsContact C-N 3.26Å; W426-S428 PolarHBondContact O-N 3.35Å; S428-K432 WeakPolarHBondContact O-CG 3.3Å; S428-K432 PolarHBondContact O-N 2.6Å
429	V	91.8	Very high	83.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-51	175.6	-174.6	0	0	0	0	110.2	F240 A286 N289 W426 P427 V431 K432 I433	F240-V429 HydrophobicContact CE2-CG1 3.85Å; F240-V429 HydrophobicContact CZ-CG1 4.5Å; A286-V429 HydrophobicContact CB-CG1 4.08Å; N289-V429 VanDerWaalsContact C-CG2 3.45Å; N289-V429 HydrophobicContact CB-CG2 4.22Å; N289-V429 WeakPolarHBondContact O-CG2 3.41Å; W426-V429 HydrophobicContact CE3-CB 4.31Å; W426-V429 HydrophobicContact CE3-CG1 4.47Å; W426-V429 HydrophobicContact CE3-CG2 4.45Å; W426-V429 HydrophobicContact CZ3-CG1 4.4Å; W426-V429 WeakPolarHBondContact O-CB 3.01Å; W426-V429 PolarHBondContact O-N 3.46Å; W426-V429 VanDerWaalsContact O-N 3.07Å; P427-V429 VanDerWaalsContact C-N 3.34Å; P427-V429 PolarHBondContact O-N 3.03Å; V429-V431 PolarHBondContact O-N 3.18Å; V429-K432 PolarHBondContact O-N 2.96Å; V429-K432 VanDerWaalsContact O-N 3.14Å; V429-I433 HydrophobicContact CG1-CG1 4.24Å; V429-I433 PolarHBondContact O-N 2.79Å
430	W	93.8	Very high	85.6	Confident	111 Å²	111	41 Å²	41	42%	0.42	20%	0.196	S	C	.	.	H	α-helix	trans	-63.7	-38.1	-177.9	-81.8	108.7	0	0	0	113.3	F240 W426 P427 K432 S434 W437	F240-W430 AromaticContact CE1-CH2 3.96Å; F240-W430 HydrophobicContact CE1-CH2 3.96Å; F240-W430 HydrophobicContact CE1-CZ2 4.28Å; F240-W430 HydrophobicContact CE1-CZ3 4.3Å; F240-W430 HydrophobicContact CZ-CH2 4.32Å; F240-W430 HydrophobicContact CZ-CZ2 4.19Å; W426-W430 AromaticContact CE3-NE1 3.91Å; W426-W430 VanDerWaalsContact O-CD1 3.26Å; W426-W430 PolarHBondContact O-N 3.12Å; P427-W430 PolarHBondContact O-N 2.74Å; W430-K432 VanDerWaalsContact C-N 3.32Å; W430-K432 PolarHBondContact O-N 2.81Å; W430-S434 WeakPolarHBondContact O-CB 3.42Å; W430-S434 PolarHBondContact O-N 3.27Å; W430-S434 PolarHBondContact O-OG 3Å; W430-W437 AromaticContact CZ3-CH2 3.82Å; W430-W437 HydrophobicContact CZ3-CH2 3.82Å; W430-W437 HydrophobicContact CZ3-CZ3 4.13Å
431	V	92.6	Very high	87.3	Confident	24 Å²	24	38.5 Å²	38.5	15%	0.145	20%	0.195	C	C	.	.	H	α-helix	trans	-56	-48.6	172.9	160.8	0	0	0	0	110.3	F169 W412 P427 V429 S434 S435	F169-V431 HydrophobicContact CB-CG1 3.82Å; F169-V431 HydrophobicContact CD2-CG1 3.97Å; F169-V431 HydrophobicContact CG-CG1 4.35Å; W412-V431 HydrophobicContact CH2-CG1 3.83Å; W412-V431 HydrophobicContact CZ3-CB 4.37Å; W412-V431 HydrophobicContact CZ3-CG1 3.76Å; P427-V431 WeakPolarHBondContact O-CB 3.46Å; P427-V431 VanDerWaalsContact O-CG2 3.29Å; P427-V431 WeakPolarHBondContact O-CG2 3.29Å; P427-V431 PolarHBondContact O-N 3.05Å; V429-V431 PolarHBondContact O-N 3.18Å; V431-S434 PolarHBondContact O-OG 2.9Å; V431-S434 VanDerWaalsContact O-OG 3.11Å; V431-S435 WeakPolarHBondContact O-CB 3.33Å; V431-S435 PolarHBondContact O-N 3.43Å; V431-S435 PolarHBondContact O-OG 2.9Å
432	K	93.5	Very high	88.8	Confident	3 Å²	3	38.7 Å²	38.7	1%	0.013	19%	0.194	C	C	.	.	H	α-helix	trans	-71.7	-42.9	-178	-66.4	175.4	179.9	-173.3	0	113	S285 A286 N289 S428 V429 W430 S435 S436	S285-K432 WeakPolarHBondContact O-CD 3.2Å; S285-K432 PolarHBondContact O-NZ 3.27Å; S285-K432 WeakPolarHBondContact OG-CE 3.35Å; S285-K432 PolarHBondContact OG-NZ 2.8Å; A286-K432 HydrophobicContact CB-CB 3.72Å; A286-K432 HydrophobicContact CB-CD 4.42Å; N289-K432 PolarHBondContact OD1-NZ 3.49Å; S428-K432 WeakPolarHBondContact O-CG 3.3Å; S428-K432 PolarHBondContact O-N 2.6Å; V429-K432 PolarHBondContact O-N 2.96Å; V429-K432 VanDerWaalsContact O-N 3.14Å; W430-K432 VanDerWaalsContact C-N 3.32Å; W430-K432 PolarHBondContact O-N 2.81Å; K432-S435 PolarHBondContact O-N 2.86Å; K432-S436 PolarHBondContact O-N 3.26Å
433	I	95.3	Very high	90	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-47.3	177.5	-69	-57.5	0	0	0	111.2	F240 T283 A286 V429 S435 S436 W437	F240-I433 HydrophobicContact CB-CD1 3.97Å; F240-I433 HydrophobicContact CD1-CG1 4.27Å; F240-I433 HydrophobicContact CD1-CG2 4.02Å; F240-I433 HydrophobicContact CD2-CD1 4.23Å; F240-I433 HydrophobicContact CD2-CG1 4.09Å; F240-I433 HydrophobicContact CE1-CG2 4.27Å; F240-I433 HydrophobicContact CE2-CG1 4.34Å; F240-I433 HydrophobicContact CG-CD1 4.01Å; F240-I433 HydrophobicContact CG-CG1 4.06Å; T283-I433 HydrophobicContact CG2-CD1 4.5Å; A286-I433 HydrophobicContact CB-CD1 3.48Å; A286-I433 VanDerWaalsContact CB-CD1 3.48Å; A286-I433 HydrophobicContact CB-CG1 3.58Å; V429-I433 HydrophobicContact CG1-CG1 4.24Å; V429-I433 PolarHBondContact O-N 2.79Å; I433-S435 VanDerWaalsContact C-N 3.33Å; I433-S435 PolarHBondContact O-N 3.24Å; I433-S436 WeakPolarHBondContact O-CA 3.35Å; I433-S436 WeakPolarHBondContact O-CB 3.29Å; I433-S436 PolarHBondContact O-N 3.49Å; I433-S436 PolarHBondContact O-OG 3.43Å; I433-W437 HydrophobicContact CG2-CD2 4.16Å; I433-W437 VanDerWaalsContact CG2-CE2 3.5Å; I433-W437 HydrophobicContact CG2-CH2 3.95Å; I433-W437 HydrophobicContact CG2-CZ2 3.39Å; I433-W437 PolarHBondContact O-N 3.26Å; I433-W437 VanDerWaalsContact O-N 3.12Å
434	S	94.8	Very high	91	Very high	33 Å²	33	36.2 Å²	36.2	23%	0.231	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-39.4	178	62.4	0	0	0	0	111.9	W430 V431 S436 W437 I438	W430-S434 WeakPolarHBondContact O-CB 3.42Å; W430-S434 PolarHBondContact O-N 3.27Å; W430-S434 PolarHBondContact O-OG 3Å; V431-S434 PolarHBondContact O-OG 2.9Å; V431-S434 VanDerWaalsContact O-OG 3.11Å; S434-S436 VanDerWaalsContact C-N 3.25Å; S434-S436 PolarHBondContact O-N 3.49Å; S434-W437 PolarHBondContact O-N 3.22Å; S434-I438 WeakPolarHBondContact O-CG1 3.24Å; S434-I438 PolarHBondContact O-N 3.47Å
435	S	93.6	Very high	91.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-37.1	170.6	-67.9	0	0	0	0	112.5	F169 L176 V431 K432 I433 I438 C439	F169-S435 VanDerWaalsContact CD2-OG 3.23Å; F169-S435 WeakPolarHBondContact CD2-OG 3.43Å; F169-S435 WeakPolarHBondContact CE2-OG 3.31Å; L176-S435 WeakPolarHBondContact CD1-O 3.38Å; V431-S435 WeakPolarHBondContact O-CB 3.33Å; V431-S435 PolarHBondContact O-N 3.43Å; V431-S435 PolarHBondContact O-OG 2.9Å; K432-S435 PolarHBondContact O-N 2.86Å; I433-S435 VanDerWaalsContact C-N 3.33Å; I433-S435 PolarHBondContact O-N 3.24Å; S435-I438 PolarHBondContact O-N 3.33Å; S435-C439 WeakPolarHBondContact O-CB 3.42Å; S435-C439 PolarHBondContact O-N 3.45Å
436	S	94.9	Very high	91.7	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.2	-37.3	177.1	83	0	0	0	0	112.7	N244 K432 I433 S434 C439 I440	N244-S436 PolarHBondContact ND2-OG 3.42Å; N244-S436 VanDerWaalsContact ND2-OG 3.07Å; N244-S436 PolarHBondContact OD1-OG 2.9Å; K432-S436 PolarHBondContact O-N 3.26Å; I433-S436 WeakPolarHBondContact O-CA 3.35Å; I433-S436 WeakPolarHBondContact O-CB 3.29Å; I433-S436 PolarHBondContact O-N 3.49Å; I433-S436 PolarHBondContact O-OG 3.43Å; S434-S436 VanDerWaalsContact C-N 3.25Å; S434-S436 PolarHBondContact O-N 3.49Å; S436-C439 WeakPolarHBondContact O-CB 3.28Å; S436-C439 PolarHBondContact O-N 3.18Å; S436-I440 WeakPolarHBondContact O-CG1 3.05Å; S436-I440 PolarHBondContact O-N 2.79Å
437	W	96	Very high	91.5	Very high	82 Å²	82	32.8 Å²	32.8	31%	0.311	17%	0.168	S	C	.	.	H	α-helix	trans	-70.7	-41.1	175.4	-59.8	-17.8	0	0	0	111.8	I243 N244 L247 W430 I433 S434 C439 I440 G441	I243-W437 HydrophobicContact CD1-CZ2 4.27Å; I243-W437 HydrophobicContact CG2-CZ2 4.26Å; N244-W437 PolarHBondContact OD1-NE1 3.07Å; L247-W437 HydrophobicContact CD1-CG 4.3Å; W430-W437 AromaticContact CZ3-CH2 3.82Å; W430-W437 HydrophobicContact CZ3-CH2 3.82Å; W430-W437 HydrophobicContact CZ3-CZ3 4.13Å; I433-W437 HydrophobicContact CG2-CD2 4.16Å; I433-W437 VanDerWaalsContact CG2-CE2 3.5Å; I433-W437 HydrophobicContact CG2-CH2 3.95Å; I433-W437 HydrophobicContact CG2-CZ2 3.39Å; I433-W437 PolarHBondContact O-N 3.26Å; I433-W437 VanDerWaalsContact O-N 3.12Å; S434-W437 PolarHBondContact O-N 3.22Å; W437-C439 VanDerWaalsContact C-N 3.32Å; W437-C439 PolarHBondContact O-N 3.03Å; W437-I440 PolarHBondContact O-N 3.05Å; W437-G441 PolarHBondContact O-N 2.86Å
438	I	94.2	Very high	91.4	Very high	62 Å²	62	31.4 Å²	31.4	32%	0.318	16%	0.158	S	C	.	.	H	α-helix	trans	-63.4	-40.5	175.4	-65.3	165.5	0	0	0	110.4	F169 L173 S434 S435 I440 G441 L442	F169-I438 HydrophobicContact CE2-CD1 4.22Å; F169-I438 HydrophobicContact CZ-CD1 3.85Å; L173-I438 HydrophobicContact CD2-CB 4.12Å; L173-I438 HydrophobicContact CD2-CD1 4.02Å; L173-I438 HydrophobicContact CD2-CG2 3.69Å; S434-I438 WeakPolarHBondContact O-CG1 3.24Å; S434-I438 PolarHBondContact O-N 3.47Å; S435-I438 PolarHBondContact O-N 3.33Å; I438-I440 PolarHBondContact O-N 3.45Å; I438-G441 PolarHBondContact O-N 3.41Å; I438-L442 HydrophobicContact CG2-CD1 3.81Å; I438-L442 HydrophobicContact CG2-CG 4.05Å; I438-L442 WeakPolarHBondContact O-CB 3.29Å; I438-L442 VanDerWaalsContact O-CG 3.28Å; I438-L442 WeakPolarHBondContact O-CG 2.88Å; I438-L442 PolarHBondContact O-N 3.37Å
439	C	91.6	Very high	91.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-52.9	-54.7	174.2	173.8	0	0	0	0	112	L176 S435 S436 W437 G441 L442 Y443	L176-C439 HydrophobicContact CD1-CB 3.64Å; L176-C439 HydrophobicContact CD2-CB 3.38Å; L176-C439 WeakPolarHBondContact CD2-SG 3.43Å; L176-C439 HydrophobicContact CG-CB 4.08Å; S435-C439 WeakPolarHBondContact O-CB 3.42Å; S435-C439 PolarHBondContact O-N 3.45Å; S436-C439 WeakPolarHBondContact O-CB 3.28Å; S436-C439 PolarHBondContact O-N 3.18Å; W437-C439 VanDerWaalsContact C-N 3.32Å; W437-C439 PolarHBondContact O-N 3.03Å; C439-G441 VanDerWaalsContact C-N 3.34Å; C439-L442 PolarHBondContact O-N 3.39Å; C439-Y443 PolarHBondContact O-N 2.88Å
440	I	93.4	Very high	90.8	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-40.9	-177.9	-60.4	164.2	0	0	0	109.9	L247 A251 T279 S436 W437 I438 L442 Y443 V444	L247-I440 HydrophobicContact CB-CD1 3.55Å; L247-I440 HydrophobicContact CB-CG2 4.09Å; L247-I440 HydrophobicContact CD1-CD1 4.1Å; L247-I440 HydrophobicContact CG-CD1 4.49Å; A251-I440 HydrophobicContact CB-CG2 4.03Å; T279-I440 HydrophobicContact CG2-CD1 3.68Å; T279-I440 HydrophobicContact CG2-CG1 4.4Å; S436-I440 WeakPolarHBondContact O-CG1 3.05Å; S436-I440 PolarHBondContact O-N 2.79Å; W437-I440 PolarHBondContact O-N 3.05Å; I438-I440 PolarHBondContact O-N 3.45Å; I440-L442 PolarHBondContact O-N 2.91Å; I440-Y443 PolarHBondContact O-N 2.89Å; I440-V444 HydrophobicContact CG2-CG2 4.15Å; I440-V444 WeakPolarHBondContact O-CB 3.43Å; I440-V444 VanDerWaalsContact O-CG2 3.3Å; I440-V444 WeakPolarHBondContact O-CG2 3.4Å; I440-V444 PolarHBondContact O-N 2.06Å
441	G	93.1	Very high	90.1	Very high	41 Å²	41	30.5 Å²	30.5	42%	0.423	16%	0.163	S	C	.	.	H	α-helix	trans	-59.5	-44.3	175.9	0	0	0	0	0	112.7	W437 I438 C439 W445	W437-G441 PolarHBondContact O-N 2.86Å; I438-G441 PolarHBondContact O-N 3.41Å; C439-G441 VanDerWaalsContact C-N 3.34Å; G441-W445 VanDerWaalsContact O-CB 3.23Å; G441-W445 WeakPolarHBondContact O-CB 2.91Å; G441-W445 PolarHBondContact O-N 3.33Å
442	L	90	Very high	89.5	Confident	65 Å²	65	33.8 Å²	33.8	34%	0.34	18%	0.184	S	C	.	.	H	α-helix	trans	-64.9	-43.4	175.8	-73.6	175.1	0	0	0	111.5	V177 I180 I438 C439 I440 W445 T446	V177-L442 HydrophobicContact CG2-CD1 4.22Å; I180-L442 HydrophobicContact CD1-CB 4.18Å; I438-L442 HydrophobicContact CG2-CD1 3.81Å; I438-L442 HydrophobicContact CG2-CG 4.05Å; I438-L442 WeakPolarHBondContact O-CB 3.29Å; I438-L442 VanDerWaalsContact O-CG 3.28Å; I438-L442 WeakPolarHBondContact O-CG 2.88Å; I438-L442 PolarHBondContact O-N 3.37Å; C439-L442 PolarHBondContact O-N 3.39Å; I440-L442 PolarHBondContact O-N 2.91Å; L442-W445 WeakPolarHBondContact O-CB 3.33Å; L442-W445 PolarHBondContact O-N 3.35Å; L442-T446 WeakPolarHBondContact O-CG2 3Å; L442-T446 PolarHBondContact O-N 2.71Å
443	Y	90.2	Very high	88.8	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-46.2	176.4	174.4	-111.6	0	0	0	112.4	I180 A251 Q271 S272 V275 C439 I440 W445 T446 L447	I180-Y443 HydrophobicContact CG2-CD2 4.39Å; A251-Y443 HydrophobicContact CB-CD1 4.12Å; A251-Y443 HydrophobicContact CB-CE1 4.23Å; Q271-Y443 HydrophobicContact CB-CE2 3.93Å; S272-Y443 WeakPolarHBondContact CA-OH 2.98Å; S272-Y443 WeakPolarHBondContact CB-OH 3.35Å; S272-Y443 PolarHBondContact N-OH 3.4Å; V275-Y443 HydrophobicContact CB-CD1 4.41Å; V275-Y443 HydrophobicContact CB-CG 4.39Å; V275-Y443 HydrophobicContact CG1-CD1 4.14Å; V275-Y443 HydrophobicContact CG1-CG 4.15Å; V275-Y443 HydrophobicContact CG2-CD1 4.35Å; V275-Y443 HydrophobicContact CG2-CD2 3.88Å; V275-Y443 HydrophobicContact CG2-CE2 4.36Å; V275-Y443 HydrophobicContact CG2-CG 3.87Å; C439-Y443 PolarHBondContact O-N 2.88Å; I440-Y443 PolarHBondContact O-N 2.89Å; Y443-W445 PolarHBondContact O-N 2.98Å; Y443-T446 PolarHBondContact O-N 2.73Å; Y443-T446 VanDerWaalsContact O-N 3.13Å; Y443-T446 PolarHBondContact O-OG1 2.77Å; Y443-L447 HydrophobicContact CD1-CD1 4.41Å; Y443-L447 HydrophobicContact CE1-CD1 3.74Å; Y443-L447 HydrophobicContact CE1-CG 4.49Å; Y443-L447 HydrophobicContact CE2-CD1 4.4Å; Y443-L447 HydrophobicContact CE2-CD2 4.39Å; Y443-L447 HydrophobicContact CE2-CG 4.34Å; Y443-L447 PolarHBondContact O-N 3.18Å
444	V	90.6	Very high	87.2	Confident	33 Å²	33	42.7 Å²	42.7	20%	0.2	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-38.6	174.9	169.4	0	0	0	0	110.3	A251 M254 I440 L447 V448	A251-V444 HydrophobicContact CB-CG2 3.87Å; M254-V444 HydrophobicContact CE-CG1 3.57Å; M254-V444 HydrophobicContact SD-CG1 3.77Å; M254-V444 HydrophobicContact SD-CG2 4.31Å; I440-V444 HydrophobicContact CG2-CG2 4.15Å; I440-V444 WeakPolarHBondContact O-CB 3.43Å; I440-V444 VanDerWaalsContact O-CG2 3.3Å; I440-V444 WeakPolarHBondContact O-CG2 3.4Å; I440-V444 PolarHBondContact O-N 2.06Å; V444-L447 PolarHBondContact O-N 3.41Å; V444-V448 HydrophobicContact CG1-CG2 4.16Å; V444-V448 WeakPolarHBondContact O-CB 3.33Å; V444-V448 VanDerWaalsContact O-CG2 3.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.18Å; V444-V448 PolarHBondContact O-N 3.2Å
445	W	88.9	Confident	85.5	Confident	137 Å²	137	49.3 Å²	49.3	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-38.4	174.9	-175	-103.2	0	0	0	112.7	G441 L442 Y443 L447 V448 A449 L453	G441-W445 VanDerWaalsContact O-CB 3.23Å; G441-W445 WeakPolarHBondContact O-CB 2.91Å; G441-W445 PolarHBondContact O-N 3.33Å; L442-W445 WeakPolarHBondContact O-CB 3.33Å; L442-W445 PolarHBondContact O-N 3.35Å; Y443-W445 PolarHBondContact O-N 2.98Å; W445-L447 PolarHBondContact O-N 3.33Å; W445-V448 PolarHBondContact O-N 3.29Å; W445-A449 HydrophobicContact CD2-CB 4.43Å; W445-A449 HydrophobicContact CZ2-CB 4.37Å; W445-A449 WeakPolarHBondContact O-CB 3.24Å; W445-A449 PolarHBondContact O-N 3.03Å; W445-L453 HydrophobicContact CZ2-CD1 4.26Å
446	T	84.6	Confident	83.5	Confident	29 Å²	29	55.4 Å²	55.4	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-32	175.6	62.1	0	0	0	0	112.4	I180 H184 Q264 L442 Y443 P450	I180-T446 HydrophobicContact CG2-CG2 4.4Å; H184-T446 PolarHBondContact NE2-OG1 3.19Å; Q264-T446 PolarHBondContact OE1-O 3.07Å; L442-T446 WeakPolarHBondContact O-CG2 3Å; L442-T446 PolarHBondContact O-N 2.71Å; Y443-T446 PolarHBondContact O-N 2.73Å; Y443-T446 VanDerWaalsContact O-N 3.13Å; Y443-T446 PolarHBondContact O-OG1 2.77Å; T446-P450 WeakPolarHBondContact O-CD 3.47Å
447	L	84.4	Confident	81.4	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-75.6	-36.9	175.1	-61.5	177.7	0	0	0	113.4	I260 S267 Y443 V444 W445	I260-L447 HydrophobicContact CG2-CB 4.15Å; I260-L447 HydrophobicContact CG2-CD2 4.32Å; S267-L447 WeakPolarHBondContact OG-CD2 2.93Å; Y443-L447 HydrophobicContact CD1-CD1 4.41Å; Y443-L447 HydrophobicContact CE1-CD1 3.74Å; Y443-L447 HydrophobicContact CE1-CG 4.49Å; Y443-L447 HydrophobicContact CE2-CD1 4.4Å; Y443-L447 HydrophobicContact CE2-CD2 4.39Å; Y443-L447 HydrophobicContact CE2-CG 4.34Å; Y443-L447 PolarHBondContact O-N 3.18Å; V444-L447 PolarHBondContact O-N 3.41Å; W445-L447 PolarHBondContact O-N 3.33Å
448	V	86	Confident	79.3	Confident	31 Å²	31	61.7 Å²	61.7	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-91.4	-28.3	-172.1	174.9	0	0	0	0	112.8	M254 V444 W445 P450 L451 V452	M254-V448 HydrophobicContact CE-CG2 3.29Å; V444-V448 HydrophobicContact CG1-CG2 4.16Å; V444-V448 WeakPolarHBondContact O-CB 3.33Å; V444-V448 VanDerWaalsContact O-CG2 3.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.18Å; V444-V448 PolarHBondContact O-N 3.2Å; W445-V448 PolarHBondContact O-N 3.29Å; V448-P450 VanDerWaalsContact C-CD 3.49Å; V448-L451 WeakPolarHBondContact O-CB 3.48Å; V448-L451 PolarHBondContact O-N 2.84Å; V448-V452 HydrophobicContact CG1-CG2 3.57Å; V448-V452 PolarHBondContact O-N 3.27Å
449	A	85.2	Confident	76.6	Confident	4 Å²	4	69.6 Å²	69.6	3%	0.033	37%	0.371	C	S	.	.	H	α-helix	trans	-55.2	-41.9	-175.9	0	0	0	0	0	113.8	W445 L451 V452 L453 F458	W445-A449 HydrophobicContact CD2-CB 4.43Å; W445-A449 HydrophobicContact CZ2-CB 4.37Å; W445-A449 WeakPolarHBondContact O-CB 3.24Å; W445-A449 PolarHBondContact O-N 3.03Å; A449-L451 VanDerWaalsContact C-N 3.26Å; A449-L451 PolarHBondContact O-N 3.07Å; A449-V452 PolarHBondContact O-N 3.34Å; A449-L453 WeakPolarHBondContact O-CB 3.37Å; A449-L453 PolarHBondContact O-N 3.38Å; A449-F458 HydrophobicContact CB-CE1 3.91Å; A449-F458 HydrophobicContact CB-CZ 3.95Å; A449-F458 WeakPolarHBondContact O-CZ 3.4Å
450	P	80	Confident	75.8	Confident	25 Å²	25	73.1 Å²	73.1	16%	0.162	39%	0.389	C	S	.	.	H	α-helix	trans	-61.3	-31.3	175.9	-24.1	35.6	0	0	0	114	T446 V448 F458	T446-P450 WeakPolarHBondContact O-CD 3.47Å; V448-P450 VanDerWaalsContact C-CD 3.49Å; P450-F458 HydrophobicContact CB-CD2 4.14Å; P450-F458 HydrophobicContact CB-CE2 4.49Å; P450-F458 HydrophobicContact CB-CG 4.39Å; P450-F458 HydrophobicContact CG-CD1 4.33Å; P450-F458 HydrophobicContact CG-CD2 4.38Å; P450-F458 HydrophobicContact CG-CG 4.19Å
451	L	78.7	Confident	74.9	Confident	63 Å²	63	76.6 Å²	76.6	33%	0.33	41%	0.408	S	S	.	.	H	α-helix	trans	-76	-37.6	178.9	-69.4	170.4	0	0	0	112.9	I260 S263 V448 A449	I260-L451 HydrophobicContact CB-CD1 4.47Å; I260-L451 HydrophobicContact CG1-CD1 3.49Å; I260-L451 VanDerWaalsContact CG1-CD1 3.49Å; S263-L451 WeakPolarHBondContact OG-CD2 3.37Å; V448-L451 WeakPolarHBondContact O-CB 3.48Å; V448-L451 PolarHBondContact O-N 2.84Å; A449-L451 VanDerWaalsContact C-N 3.26Å; A449-L451 PolarHBondContact O-N 3.07Å
452	V	81.2	Confident	73.9	Confident	94 Å²	94	78.6 Å²	78.6	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-87.3	-35.2	-174	178.5	0	0	0	0	111.5	V448 A449 V454	V448-V452 HydrophobicContact CG1-CG2 3.57Å; V448-V452 PolarHBondContact O-N 3.27Å; A449-V452 PolarHBondContact O-N 3.34Å; V452-V454 PolarHBondContact O-N 3.13Å
453	L	78.1	Confident	73	Confident	66 Å²	66	79.4 Å²	79.4	35%	0.346	41%	0.411	S	S	.	.			trans	-103.1	63.6	-175.1	-61.6	174.9	0	0	0	111	W445 A449 N455 R456 F458	W445-L453 HydrophobicContact CZ2-CD1 4.26Å; A449-L453 WeakPolarHBondContact O-CB 3.37Å; A449-L453 PolarHBondContact O-N 3.38Å; L453-N455 PolarHBondContact O-N 3.17Å; L453-R456 HydrophobicContact CB-CB 4.5Å; L453-R456 PolarHBondContact O-N 2.84Å; L453-R456 VanDerWaalsContact O-N 3.15Å; L453-F458 HydrophobicContact CB-CE2 3.85Å; L453-F458 HydrophobicContact CB-CZ 3.8Å; L453-F458 HydrophobicContact CD1-CZ 4.03Å; L453-F458 HydrophobicContact CG-CZ 4.49Å; L453-F458 WeakPolarHBondContact O-CE2 3.32Å
454	V	62.2	Low	71.9	Confident	123 Å²	123	84.3 Å²	84.3	75%	0.745	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-17.4	-178	-171.3	0	0	0	0	113.9	V452	V452-V454 PolarHBondContact O-N 3.13Å
455	N	57.8	Low	70.6	Confident	173 Å²	173	87.7 Å²	87.7	93%	0.925	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	15.6	-178.3	-65.5	-36.2	0	0	0	114.4	L453	L453-N455 PolarHBondContact O-N 3.17Å
456	R	52.3	Low	69.3	Low	127 Å²	127	84.2 Å²	84.2	48%	0.479	45%	0.448	S	S	.	.	S	Bend	trans	-126.4	127.8	178.3	-163.1	173.7	86.4	149.4	9.6	109.6	L453 F458	L453-R456 HydrophobicContact CB-CB 4.5Å; L453-R456 PolarHBondContact O-N 2.84Å; L453-R456 VanDerWaalsContact O-N 3.15Å; R456-F458 HydrophobicContact CB-CE2 3.98Å; R456-F458 HydrophobicContact CB-CZ 4.3Å; R456-F458 WeakPolarHBondContact O-CD2 3.34Å; R456-F458 VanDerWaalsContact O-CE2 3.31Å; R456-F458 WeakPolarHBondContact O-CE2 3.5Å; R456-F458 PolarHBondContact O-N 3.36Å
457	D	50.8	Low	68.2	Low	154 Å²	154	88.5 Å²	88.5	82%	0.824	47%	0.469	S	S	*	.			trans	-66.5	126.8	174.1	-59.5	-35.1	0	0	0	109.3
458	F	51.8	Low	66.8	Low	60 Å²	60	95.7 Å²	95.7	26%	0.263	51%	0.507	S	S	.	.			trans	-114.8	6.1	178.1	-71.5	-83.8	0	0	0	112.6	A449 P450 L453 R456	A449-F458 HydrophobicContact CB-CE1 3.91Å; A449-F458 HydrophobicContact CB-CZ 3.95Å; A449-F458 WeakPolarHBondContact O-CZ 3.4Å; P450-F458 HydrophobicContact CB-CD2 4.14Å; P450-F458 HydrophobicContact CB-CE2 4.49Å; P450-F458 HydrophobicContact CB-CG 4.39Å; P450-F458 HydrophobicContact CG-CD1 4.33Å; P450-F458 HydrophobicContact CG-CD2 4.38Å; P450-F458 HydrophobicContact CG-CG 4.19Å; L453-F458 HydrophobicContact CB-CE2 3.85Å; L453-F458 HydrophobicContact CB-CZ 3.8Å; L453-F458 HydrophobicContact CD1-CZ 4.03Å; L453-F458 HydrophobicContact CG-CZ 4.49Å; L453-F458 WeakPolarHBondContact O-CE2 3.32Å; R456-F458 HydrophobicContact CB-CE2 3.98Å; R456-F458 HydrophobicContact CB-CZ 4.3Å; R456-F458 WeakPolarHBondContact O-CD2 3.34Å; R456-F458 VanDerWaalsContact O-CE2 3.31Å; R456-F458 WeakPolarHBondContact O-CE2 3.5Å; R456-F458 PolarHBondContact O-N 3.36Å
459	D	37.7	Very low	65.1	Low	228 Å²	228	101.5 Å²	101.5	100%	1.219	54%	0.536	S	S	*	.			trans	-71.3	0	177.7	-72.2	-26.7	0	0	0	112.9

Retrieved 459 of 459 residues in 240.8 ms (Link to these results)

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