A0A087YKX5_POEFO Loading...

CCR4-NOT transcription complex subunit 10

Component of the CCR4-NOT complex which is one of the major cellular mRNA deadenylases and is linked to various cellular processes including bulk mRNA degradation, miRNA-mediated repression, translational repression during translational initiation and general transcription regulation.

AlphaFold DB , UniProt , Accession A0A087YKX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 732 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	27.2	Very low	238 Å²	238	161.2 Å²	161.2	100%	1.172	87%	0.865	S	S	*	*				0	96.5	0	-71.8	172.1	170.1	0	0	104.9
2	A	27.1	Very low	27.3	Very low	94 Å²	94	163.5 Å²	163.5	78%	0.777	87%	0.865	S	S	*	*				54.7	115.4	75.5	0	0	0	0	0	108.5
3	E	26.9	Very low	27	Very low	195 Å²	195	161.7 Å²	161.7	91%	0.911	86%	0.856	S	S	*	*			cis	-162.5	162.7	39.4	-101.7	164.1	164	0	0	112.4
4	N	25.9	Very low	27	Very low	155 Å²	155	154.9 Å²	154.9	83%	0.829	84%	0.844	S	S	*	*			trans	-65.8	159.1	173.3	-77.3	-28.8	0	0	0	114.8
5	S	26.6	Very low	27	Very low	112 Å²	112	152.1 Å²	152.1	78%	0.783	84%	0.84	S	S	*	*				170.5	120	106.9	-67.2	0	0	0	0	114.1
6	E	26.7	Very low	27.5	Very low	184 Å²	184	150.3 Å²	150.3	86%	0.86	84%	0.838	S	S	*	*			trans	31.3	131.6	142.6	-61.3	-179.9	162.9	0	0	122.8
7	L	26.7	Very low	28	Very low	155 Å²	155	148.1 Å²	148.1	81%	0.812	84%	0.835	S	S	*	*				-179.9	120.8	118.1	-95.8	149.2	0	0	0	114
8	N	25.1	Very low	29.1	Very low	145 Å²	145	146.9 Å²	146.9	78%	0.775	84%	0.838	S	S	*	*			trans	61.6	96.2	147.4	-68.6	-15.5	0	0	0	121.9	A10	N8-A10 PolarHBondContact O-N 3.49Å
9	E	25.6	Very low	30.6	Very low	204 Å²	204	142.3 Å²	142.3	95%	0.953	83%	0.826	S	S	*	*			trans	-73.3	102.2	147.6	-79.1	-176.8	153.2	0	0	110.1	K11	E9-K11 PolarHBondContact O-N 3.34Å
10	A	27.5	Very low	32.7	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	80%	0.804	S	S	*	*			trans	-81.5	112.7	166.2	0	0	0	0	0	109.6	N8 H12	N8-A10 PolarHBondContact O-N 3.49Å; A10-H12 PolarHBondContact O-N 3.07Å
11	K	26.9	Very low	35.1	Very low	196 Å²	196	136 Å²	136	85%	0.852	79%	0.787	S	S	*	*			trans	-51.7	108	164.8	-74.4	175.1	174.5	176.4	0	110	E9 N13	E9-K11 PolarHBondContact O-N 3.34Å; K11-N13 PolarHBondContact O-N 3.13Å
12	H	27.9	Very low	37.5	Very low	189 Å²	189	130.8 Å²	130.8	88%	0.875	76%	0.764	S	S	*	*			trans	-78.8	99.9	160	-132.8	-54.6	0	0	0	107.2	A10 G14	A10-H12 PolarHBondContact O-N 3.07Å; H12-G14 PolarHBondContact O-N 3.24Å; H12-G14 VanDerWaalsContact O-N 3.13Å
13	N	24.1	Very low	40.3	Very low	140 Å²	140	132.2 Å²	132.2	75%	0.749	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-54.9	116.3	168.9	-83.5	-21.9	0	0	0	108.4	K11 S15	K11-N13 PolarHBondContact O-N 3.13Å; N13-S15 PolarHBondContact O-N 3.47Å
14	G	26.3	Very low	43.1	Very low	66 Å²	66	123.9 Å²	123.9	68%	0.68	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-59.3	132	165.1	0	0	0	0	0	109.4	H12	H12-G14 PolarHBondContact O-N 3.24Å; H12-G14 VanDerWaalsContact O-N 3.13Å
15	S	27.5	Very low	46	Very low	113 Å²	113	121.4 Å²	121.4	79%	0.79	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-50.1	125.8	164.1	47.3	0	0	0	0	109.1	N13 S17	N13-S15 PolarHBondContact O-N 3.47Å; S15-S17 PolarHBondContact O-N 3.23Å
16	P	34.5	Very low	49	Very low	123 Å²	123	123.1 Å²	123.1	80%	0.799	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-66.2	129.8	175.9	27.6	-30.1	0	0	0	108	S18	P16-S18 PolarHBondContact O-N 3.33Å
17	S	37.1	Very low	52	Low	114 Å²	114	115.6 Å²	115.6	80%	0.797	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-49.9	124.9	167.1	55.1	0	0	0	0	109.3	S15 G19	S15-S17 PolarHBondContact O-N 3.23Å; S17-G19 VanDerWaalsContact C-N 3.29Å; S17-G19 PolarHBondContact O-N 2.82Å
18	S	46.4	Very low	55	Low	127 Å²	127	109.6 Å²	109.6	89%	0.888	63%	0.631	S	S	*	*			trans	-62	87.3	174.6	-177.3	0	0	0	0	110	P16	P16-S18 PolarHBondContact O-N 3.33Å
19	G	58.9	Low	58.2	Low	58 Å²	58	106.2 Å²	106.2	60%	0.598	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-93.2	126.2	171.2	0	0	0	0	0	108.9	S17 T21	S17-G19 VanDerWaalsContact C-N 3.29Å; S17-G19 PolarHBondContact O-N 2.82Å; G19-T21 PolarHBondContact O-N 2.67Å
20	M	71.3	Confident	61.3	Low	79 Å²	79	98.8 Å²	98.8	39%	0.389	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-49.5	126.3	173.1	-167.6	179.8	-159.8	0	0	110.3	E24 K25 A28	M20-E24 HydrophobicContact CE-CB 3.85Å; M20-E24 HydrophobicContact CG-CB 3.55Å; M20-E24 HydrophobicContact SD-CB 4.5Å; M20-K25 HydrophobicContact CB-CG 4.29Å; M20-K25 HydrophobicContact CG-CG 3.88Å; M20-K25 WeakPolarHBondContact O-CE 3.2Å; M20-K25 HydrophobicContact SD-CG 3.7Å; M20-A28 HydrophobicContact CE-CB 3.72Å
21	T	84.7	Confident	64.4	Low	73 Å²	73	94.4 Å²	94.4	45%	0.448	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-64.7	155.9	179.9	63.2	0	0	0	0	110.9	G19 Q23 E24 K25	G19-T21 PolarHBondContact O-N 2.67Å; T21-Q23 PolarHBondContact O-N 3.34Å; T21-E24 WeakPolarHBondContact CB-OE2 3.37Å; T21-E24 WeakPolarHBondContact CG2-OE2 3.34Å; T21-E24 PolarHBondContact N-OE2 2.97Å; T21-E24 PolarHBondContact O-N 2.75Å; T21-E24 VanDerWaalsContact O-N 3.14Å; T21-E24 WeakPolarHBondContact OG1-CB 3.44Å; T21-E24 VanDerWaalsContact OG1-CD 3.28Å; T21-E24 WeakPolarHBondContact OG1-CG 3.49Å; T21-E24 PolarHBondContact OG1-N 3.2Å; T21-E24 PolarHBondContact OG1-OE2 3.14Å; T21-K25 PolarHBondContact O-N 2.81Å
22	D	84.3	Confident	67.6	Low	130 Å²	130	91.8 Å²	91.8	70%	0.695	54%	0.536	S	S	*	.	H	α-helix	trans	-61.4	-33	178.9	-66.5	-29.6	0	0	0	111.8	K25 E26	D22-K25 PolarHBondContact O-N 3.27Å; D22-E26 WeakPolarHBondContact O-CB 3.15Å; D22-E26 PolarHBondContact O-N 3.46Å
23	Q	85.6	Confident	70.7	Confident	123 Å²	123	88.7 Å²	88.7	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-65	-45.7	173.9	-171.7	178.9	-3.7	0	0	112	T21 K25 E26 M27	T21-Q23 PolarHBondContact O-N 3.34Å; Q23-K25 VanDerWaalsContact C-N 3.34Å; Q23-K25 PolarHBondContact O-N 3.29Å; Q23-E26 PolarHBondContact O-N 3.34Å; Q23-M27 HydrophobicContact CG-CE 3.97Å; Q23-M27 WeakPolarHBondContact O-CE 3.32Å; Q23-M27 PolarHBondContact O-N 3.01Å
24	E	86.2	Confident	74	Confident	21 Å²	21	82.6 Å²	82.6	10%	0.098	49%	0.491	C	S	.	.	H	α-helix	trans	-61.7	-41.9	175.4	-74.3	167	135.2	0	0	111.5	M20 T21 M27 A28 L50	M20-E24 HydrophobicContact CE-CB 3.85Å; M20-E24 HydrophobicContact CG-CB 3.55Å; M20-E24 HydrophobicContact SD-CB 4.5Å; T21-E24 WeakPolarHBondContact CB-OE2 3.37Å; T21-E24 WeakPolarHBondContact CG2-OE2 3.34Å; T21-E24 PolarHBondContact N-OE2 2.97Å; T21-E24 PolarHBondContact O-N 2.75Å; T21-E24 VanDerWaalsContact O-N 3.14Å; T21-E24 WeakPolarHBondContact OG1-CB 3.44Å; T21-E24 VanDerWaalsContact OG1-CD 3.28Å; T21-E24 WeakPolarHBondContact OG1-CG 3.49Å; T21-E24 PolarHBondContact OG1-N 3.2Å; T21-E24 PolarHBondContact OG1-OE2 3.14Å; E24-M27 PolarHBondContact O-N 3.14Å; E24-A28 VanDerWaalsContact O-CB 3.31Å; E24-A28 WeakPolarHBondContact O-CB 3.4Å; E24-A28 PolarHBondContact O-N 3.25Å; E24-L50 HydrophobicContact CB-CD1 3.79Å; E24-L50 HydrophobicContact CG-CD1 3.84Å
25	K	87.3	Confident	77.2	Confident	102 Å²	102	81.7 Å²	81.7	44%	0.443	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-43.4	176.9	-73.4	177.1	-172.9	161.2	0	112.3	M20 T21 D22 Q23 A28 T29	M20-K25 HydrophobicContact CB-CG 4.29Å; M20-K25 HydrophobicContact CG-CG 3.88Å; M20-K25 WeakPolarHBondContact O-CE 3.2Å; M20-K25 HydrophobicContact SD-CG 3.7Å; T21-K25 PolarHBondContact O-N 2.81Å; D22-K25 PolarHBondContact O-N 3.27Å; Q23-K25 VanDerWaalsContact C-N 3.34Å; Q23-K25 PolarHBondContact O-N 3.29Å; K25-A28 PolarHBondContact O-N 3.38Å; K25-T29 WeakPolarHBondContact O-CB 3.4Å; K25-T29 PolarHBondContact O-N 3.32Å; K25-T29 PolarHBondContact O-OG1 2.93Å
26	E	89	Confident	80.3	Confident	148 Å²	148	81.7 Å²	81.7	69%	0.692	46%	0.459	S	S	*	.	H	α-helix	trans	-63.6	-44.6	178.2	-170.5	176.4	-173.7	0	0	111	D22 Q23 T29 S30	D22-E26 WeakPolarHBondContact O-CB 3.15Å; D22-E26 PolarHBondContact O-N 3.46Å; Q23-E26 PolarHBondContact O-N 3.34Å; E26-T29 PolarHBondContact O-N 3.24Å; E26-S30 WeakPolarHBondContact O-CB 3.2Å; E26-S30 PolarHBondContact O-N 3.16Å
27	M	89.3	Confident	83.1	Confident	26 Å²	26	79.1 Å²	79.1	13%	0.128	45%	0.448	C	S	.	.	H	α-helix	trans	-64.7	-42.2	175.5	-75	-175.1	-65.2	0	0	112.7	Q23 E24 T29 S30 A31 A49 L50 L53	Q23-M27 HydrophobicContact CG-CE 3.97Å; Q23-M27 WeakPolarHBondContact O-CE 3.32Å; Q23-M27 PolarHBondContact O-N 3.01Å; E24-M27 PolarHBondContact O-N 3.14Å; M27-T29 VanDerWaalsContact C-N 3.32Å; M27-T29 PolarHBondContact O-N 3.23Å; M27-S30 PolarHBondContact O-N 3.38Å; M27-A31 WeakPolarHBondContact O-CB 2.93Å; M27-A31 PolarHBondContact O-N 3.09Å; M27-A49 HydrophobicContact SD-CB 4.39Å; M27-L50 HydrophobicContact CB-CD1 4.24Å; M27-L50 HydrophobicContact CE-CD1 3.92Å; M27-L53 HydrophobicContact CE-CD1 3.08Å; M27-L53 HydrophobicContact SD-CD1 4.05Å
28	A	89.3	Confident	85.7	Confident	30 Å²	30	75.4 Å²	75.4	25%	0.248	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-40.8	176.2	0	0	0	0	0	111.6	M20 E24 K25 A31 Y32 L50	M20-A28 HydrophobicContact CE-CB 3.72Å; E24-A28 VanDerWaalsContact O-CB 3.31Å; E24-A28 WeakPolarHBondContact O-CB 3.4Å; E24-A28 PolarHBondContact O-N 3.25Å; K25-A28 PolarHBondContact O-N 3.38Å; A28-A31 PolarHBondContact O-N 3.4Å; A28-Y32 WeakPolarHBondContact O-CB 3.39Å; A28-Y32 PolarHBondContact O-N 3.06Å; A28-L50 HydrophobicContact CB-CD2 4.09Å
29	T	92.1	Very high	88	Confident	73 Å²	73	74.5 Å²	74.5	45%	0.448	41%	0.408	S	S	.	.	H	α-helix	trans	-65.5	-46	176.1	-53.2	0	0	0	0	110.8	K25 E26 M27 A31 Y32 E33	K25-T29 WeakPolarHBondContact O-CB 3.4Å; K25-T29 PolarHBondContact O-N 3.32Å; K25-T29 PolarHBondContact O-OG1 2.93Å; E26-T29 PolarHBondContact O-N 3.24Å; M27-T29 VanDerWaalsContact C-N 3.32Å; M27-T29 PolarHBondContact O-N 3.23Å; T29-A31 PolarHBondContact O-N 3.18Å; T29-Y32 PolarHBondContact O-N 3.4Å; T29-E33 WeakPolarHBondContact O-CG 3.23Å; T29-E33 PolarHBondContact O-N 3.18Å
30	S	91.9	Very high	89.7	Confident	49 Å²	49	75 Å²	75	34%	0.343	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-42.6	176.2	-173.5	0	0	0	0	112.3	E26 M27 Y32 E33 A34	E26-S30 WeakPolarHBondContact O-CB 3.2Å; E26-S30 PolarHBondContact O-N 3.16Å; M27-S30 PolarHBondContact O-N 3.38Å; S30-Y32 VanDerWaalsContact C-N 3.34Å; S30-Y32 PolarHBondContact O-N 3.46Å; S30-E33 PolarHBondContact O-N 3.43Å; S30-A34 WeakPolarHBondContact O-CB 3.5Å; S30-A34 PolarHBondContact O-N 2.69Å
31	A	92.9	Very high	90.7	Very high	3 Å²	3	75.8 Å²	75.8	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-60.9	-43.2	174.9	0	0	0	0	0	111.5	M27 A28 T29 F35 S43 Q46 L47	M27-A31 WeakPolarHBondContact O-CB 2.93Å; M27-A31 PolarHBondContact O-N 3.09Å; A28-A31 PolarHBondContact O-N 3.4Å; T29-A31 PolarHBondContact O-N 3.18Å; A31-F35 WeakPolarHBondContact O-CB 3.31Å; A31-F35 PolarHBondContact O-N 3.38Å; A31-S43 WeakPolarHBondContact O-CB 3.4Å; A31-S43 PolarHBondContact O-OG 3.29Å; A31-Q46 HydrophobicContact CB-CB 3.77Å; A31-L47 HydrophobicContact CB-CD2 4.04Å; A31-L47 HydrophobicContact CB-CG 4.12Å
32	Y	93.1	Very high	91.1	Very high	141 Å²	141	77.2 Å²	77.2	55%	0.553	40%	0.4	S	S	*	.	H	α-helix	trans	-66.7	-44	178.7	-178.4	-116	0	0	0	112.5	A28 T29 S30 F35 L36	A28-Y32 WeakPolarHBondContact O-CB 3.39Å; A28-Y32 PolarHBondContact O-N 3.06Å; T29-Y32 PolarHBondContact O-N 3.4Å; S30-Y32 VanDerWaalsContact C-N 3.34Å; S30-Y32 PolarHBondContact O-N 3.46Å; Y32-F35 WeakPolarHBondContact O-CB 3.46Å; Y32-F35 PolarHBondContact O-N 3.39Å; Y32-L36 HydrophobicContact CD1-CD1 4.06Å; Y32-L36 HydrophobicContact CE1-CD1 3.53Å; Y32-L36 HydrophobicContact CE1-CG 4.23Å; Y32-L36 HydrophobicContact CE2-CD1 4.33Å; Y32-L36 HydrophobicContact CE2-CD2 4.26Å; Y32-L36 HydrophobicContact CE2-CG 4.19Å; Y32-L36 WeakPolarHBondContact O-CG 3.38Å; Y32-L36 PolarHBondContact O-N 2.99Å
33	E	93.6	Very high	91.6	Very high	124 Å²	124	71.1 Å²	71.1	58%	0.579	37%	0.367	S	S	*	.	H	α-helix	trans	-62.7	-43.7	176.1	-72.4	179.3	174.4	0	0	112.1	T29 S30 F35 L36 A37	T29-E33 WeakPolarHBondContact O-CG 3.23Å; T29-E33 PolarHBondContact O-N 3.18Å; S30-E33 PolarHBondContact O-N 3.43Å; E33-F35 VanDerWaalsContact C-N 3.3Å; E33-F35 PolarHBondContact O-N 2.78Å; E33-L36 PolarHBondContact O-N 3.38Å; E33-A37 WeakPolarHBondContact O-CB 3.38Å; E33-A37 PolarHBondContact O-N 2.93Å
34	A	92.9	Very high	92	Very high	11 Å²	11	65.8 Å²	65.8	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-37.7	175.1	0	0	0	0	0	111.9	S30 A37 G38 K39 E42	S30-A34 WeakPolarHBondContact O-CB 3.5Å; S30-A34 PolarHBondContact O-N 2.69Å; A34-A37 PolarHBondContact O-N 2.87Å; A34-G38 PolarHBondContact O-N 3.06Å; A34-K39 HydrophobicContact CB-CB 4.48Å; A34-K39 PolarHBondContact O-N 3.36Å; A34-E42 HydrophobicContact CB-CB 4.3Å
35	F	93.6	Very high	92.3	Very high	47 Å²	47	71.7 Å²	71.7	21%	0.206	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-48.2	174	179.8	-91.1	0	0	0	111.7	A31 Y32 E33 A37 G38 Y40 L67 Y70	A31-F35 WeakPolarHBondContact O-CB 3.31Å; A31-F35 PolarHBondContact O-N 3.38Å; Y32-F35 WeakPolarHBondContact O-CB 3.46Å; Y32-F35 PolarHBondContact O-N 3.39Å; E33-F35 VanDerWaalsContact C-N 3.3Å; E33-F35 PolarHBondContact O-N 2.78Å; F35-A37 PolarHBondContact O-N 3.28Å; F35-G38 PolarHBondContact O-N 2.79Å; F35-Y40 AromaticContact CD2-CD1 3.92Å; F35-Y40 HydrophobicContact CD2-CD1 3.92Å; F35-Y40 AromaticContact CD2-CE1 3.93Å; F35-Y40 HydrophobicContact CD2-CE1 3.93Å; F35-Y40 HydrophobicContact CE2-CD1 4.13Å; F35-Y40 AromaticContact CE2-CE1 3.85Å; F35-Y40 HydrophobicContact CE2-CE1 3.85Å; F35-Y40 HydrophobicContact CZ-CE1 4.49Å; F35-L67 HydrophobicContact CD2-CB 4.45Å; F35-L67 HydrophobicContact CD2-CD1 4.17Å; F35-L67 HydrophobicContact CD2-CG 4.25Å; F35-L67 HydrophobicContact CE2-CB 4.49Å; F35-Y70 HydrophobicContact CE2-CD1 4.45Å; F35-Y70 HydrophobicContact CE2-CD2 4.09Å; F35-Y70 AromaticContact CE2-CG 3.92Å; F35-Y70 HydrophobicContact CE2-CG 3.92Å; F35-Y70 AromaticContact CZ-CD1 3.99Å; F35-Y70 HydrophobicContact CZ-CD1 3.99Å; F35-Y70 AromaticContact CZ-CD2 3.8Å; F35-Y70 HydrophobicContact CZ-CD2 3.8Å; F35-Y70 HydrophobicContact CZ-CE1 4.22Å; F35-Y70 HydrophobicContact CZ-CE2 4.05Å; F35-Y70 AromaticContact CZ-CG 3.77Å; F35-Y70 HydrophobicContact CZ-CG 3.77Å
36	L	92.5	Very high	92.5	Very high	113 Å²	113	70 Å²	70	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-61.5	-33.2	177	-70.5	-179.6	0	0	0	112.5	Y32 E33 G38	Y32-L36 HydrophobicContact CD1-CD1 4.06Å; Y32-L36 HydrophobicContact CE1-CD1 3.53Å; Y32-L36 HydrophobicContact CE1-CG 4.23Å; Y32-L36 HydrophobicContact CE2-CD1 4.33Å; Y32-L36 HydrophobicContact CE2-CD2 4.26Å; Y32-L36 HydrophobicContact CE2-CG 4.19Å; Y32-L36 WeakPolarHBondContact O-CG 3.38Å; Y32-L36 PolarHBondContact O-N 2.99Å; E33-L36 PolarHBondContact O-N 3.38Å; L36-G38 PolarHBondContact O-N 3.49Å
37	A	93	Very high	92.7	Very high	69 Å²	69	63.6 Å²	63.6	57%	0.57	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-1.9	174.8	0	0	0	0	0	114	E33 A34 F35 K39	E33-A37 WeakPolarHBondContact O-CB 3.38Å; E33-A37 PolarHBondContact O-N 2.93Å; A34-A37 PolarHBondContact O-N 2.87Å; F35-A37 PolarHBondContact O-N 3.28Å; A37-K39 VanDerWaalsContact C-N 3.27Å; A37-K39 HydrophobicContact CB-CG 4.2Å; A37-K39 PolarHBondContact O-N 3.42Å
38	G	91.6	Very high	92.8	Very high	37 Å²	37	66.2 Å²	66.2	38%	0.381	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	12.1	-177.3	0	0	0	0	0	114.4	A34 F35 L36 Y40	A34-G38 PolarHBondContact O-N 3.06Å; F35-G38 PolarHBondContact O-N 2.79Å; L36-G38 PolarHBondContact O-N 3.49Å; G38-Y40 VanDerWaalsContact C-N 3.34Å; G38-Y40 PolarHBondContact O-N 3.38Å
39	K	94.3	Very high	92.9	Very high	108 Å²	108	66.8 Å²	66.8	47%	0.47	35%	0.349	S	S	.	.			trans	-90	68.4	179.4	-58.2	-172.3	-173.9	178.5	0	110.7	A34 A37 D41 E42 S43	A34-K39 HydrophobicContact CB-CB 4.48Å; A34-K39 PolarHBondContact O-N 3.36Å; A37-K39 VanDerWaalsContact C-N 3.27Å; A37-K39 HydrophobicContact CB-CG 4.2Å; A37-K39 PolarHBondContact O-N 3.42Å; K39-D41 VanDerWaalsContact C-N 3.33Å; K39-D41 PolarHBondContact O-N 2.87Å; K39-E42 HydrophobicContact CB-CB 4.24Å; K39-E42 HydrophobicContact CB-CG 4.44Å; K39-E42 WeakPolarHBondContact CD-OE2 3.34Å; K39-E42 IonicContact NZ-OE1 3.83Å; K39-E42 IonicContact NZ-OE2 3.18Å; K39-E42 PolarHBondContact NZ-OE2 3.19Å; K39-E42 PolarHBondContact O-N 3.43Å; K39-S43 PolarHBondContact O-N 3.03Å; K39-S43 VanDerWaalsContact O-N 3.1Å
40	Y	94.5	Very high	92.8	Very high	67 Å²	67	63.6 Å²	63.6	26%	0.263	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-35.1	-171.1	-55.6	-59	0	0	0	114	F35 G38 S43 L44 Y70 R71	F35-Y40 AromaticContact CD2-CD1 3.92Å; F35-Y40 HydrophobicContact CD2-CD1 3.92Å; F35-Y40 AromaticContact CD2-CE1 3.93Å; F35-Y40 HydrophobicContact CD2-CE1 3.93Å; F35-Y40 HydrophobicContact CE2-CD1 4.13Å; F35-Y40 AromaticContact CE2-CE1 3.85Å; F35-Y40 HydrophobicContact CE2-CE1 3.85Å; F35-Y40 HydrophobicContact CZ-CE1 4.49Å; G38-Y40 VanDerWaalsContact C-N 3.34Å; G38-Y40 PolarHBondContact O-N 3.38Å; Y40-S43 PolarHBondContact O-N 2.97Å; Y40-L44 WeakPolarHBondContact O-CB 3.4Å; Y40-L44 PolarHBondContact O-N 2.73Å; Y40-Y70 HydrophobicContact CE1-CD1 4.44Å; Y40-Y70 HydrophobicContact CE1-CG 4.41Å; Y40-R71 HydrophobicContact CD2-CB 4.41Å; Y40-R71 HydrophobicContact CG-CB 4.25Å
41	D	93.6	Very high	92.7	Very high	97 Å²	97	62.9 Å²	62.9	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-32.9	179.3	-64.7	-47.6	0	0	0	113	K39 K45 R71	K39-D41 VanDerWaalsContact C-N 3.33Å; K39-D41 PolarHBondContact O-N 2.87Å; D41-K45 WeakPolarHBondContact O-CG 3.17Å; D41-K45 PolarHBondContact O-N 3.32Å; D41-R71 WeakPolarHBondContact OD1-CD 3.43Å; D41-R71 IonicContact OD1-NH1 2.84Å
42	E	92.9	Very high	92.5	Very high	102 Å²	102	68.9 Å²	68.9	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-69.2	-45.6	173.4	-69.8	178.2	-169.1	0	0	110.4	A34 K39 L44 K45 Q46	A34-E42 HydrophobicContact CB-CB 4.3Å; K39-E42 HydrophobicContact CB-CB 4.24Å; K39-E42 HydrophobicContact CB-CG 4.44Å; K39-E42 WeakPolarHBondContact CD-OE2 3.34Å; K39-E42 IonicContact NZ-OE1 3.83Å; K39-E42 IonicContact NZ-OE2 3.18Å; K39-E42 PolarHBondContact NZ-OE2 3.19Å; K39-E42 PolarHBondContact O-N 3.43Å; E42-L44 PolarHBondContact O-N 2.91Å; E42-K45 PolarHBondContact O-N 3.3Å; E42-Q46 WeakPolarHBondContact O-CG 3.39Å; E42-Q46 PolarHBondContact O-N 3.1Å
43	S	94.3	Very high	92.2	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-38.1	177.8	179.9	0	0	0	0	112.4	A31 K39 Y40 K45 Q46 L47 L67	A31-S43 WeakPolarHBondContact O-CB 3.4Å; A31-S43 PolarHBondContact O-OG 3.29Å; K39-S43 PolarHBondContact O-N 3.03Å; K39-S43 VanDerWaalsContact O-N 3.1Å; Y40-S43 PolarHBondContact O-N 2.97Å; S43-K45 PolarHBondContact O-N 3.1Å; S43-Q46 PolarHBondContact O-N 3.17Å; S43-L47 WeakPolarHBondContact O-CG 3.42Å; S43-L47 PolarHBondContact O-N 2.9Å; S43-L67 VanDerWaalsContact CB-CD1 3.45Å; S43-L67 WeakPolarHBondContact OG-CD1 3.38Å
44	L	93.4	Very high	91.7	Very high	12 Å²	12	62.9 Å²	62.9	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-60.3	-45.6	174.8	-176.7	63.8	0	0	0	112	Y40 E42 Q46 L47 E48 K64 L67	Y40-L44 WeakPolarHBondContact O-CB 3.4Å; Y40-L44 PolarHBondContact O-N 2.73Å; E42-L44 PolarHBondContact O-N 2.91Å; L44-Q46 VanDerWaalsContact C-N 3.29Å; L44-Q46 PolarHBondContact O-N 3.48Å; L44-L47 PolarHBondContact O-N 2.64Å; L44-E48 HydrophobicContact CD1-CG 4.38Å; L44-E48 HydrophobicContact CG-CG 4.46Å; L44-E48 WeakPolarHBondContact O-CG 3.41Å; L44-E48 PolarHBondContact O-N 3.04Å; L44-K64 HydrophobicContact CD1-CD 4.36Å; L44-K64 HydrophobicContact CD1-CG 3.91Å; L44-L67 HydrophobicContact CB-CD2 3.71Å; L44-L67 HydrophobicContact CD1-CD2 3.95Å; L44-L67 HydrophobicContact CG-CD2 4.31Å
45	K	93.5	Very high	91.2	Very high	144 Å²	144	68.7 Å²	68.7	63%	0.626	35%	0.352	S	S	*	.	H	α-helix	trans	-59.9	-41.1	178.3	-73.1	172.6	-177.1	177.9	0	111.8	D41 E42 S43 E48 A49	D41-K45 WeakPolarHBondContact O-CG 3.17Å; D41-K45 PolarHBondContact O-N 3.32Å; E42-K45 PolarHBondContact O-N 3.3Å; S43-K45 PolarHBondContact O-N 3.1Å; K45-E48 PolarHBondContact O-N 3.3Å; K45-A49 PolarHBondContact O-N 2.85Å
46	Q	92.2	Very high	90.5	Very high	68 Å²	68	74.8 Å²	74.8	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-67	-40.7	177.4	-63.3	-61.6	-13.8	0	0	111.7	A31 E42 S43 L44 A49 L50	A31-Q46 HydrophobicContact CB-CB 3.77Å; E42-Q46 WeakPolarHBondContact O-CG 3.39Å; E42-Q46 PolarHBondContact O-N 3.1Å; S43-Q46 PolarHBondContact O-N 3.17Å; L44-Q46 VanDerWaalsContact C-N 3.29Å; L44-Q46 PolarHBondContact O-N 3.48Å; Q46-A49 PolarHBondContact O-N 3.28Å; Q46-L50 WeakPolarHBondContact O-CB 3.41Å; Q46-L50 PolarHBondContact O-N 2.98Å
47	L	91.8	Very high	90	Very high	13 Å²	13	71.6 Å²	71.6	7%	0.068	37%	0.365	C	S	.	.	H	α-helix	trans	-66.6	-36.3	175.1	-71.5	178.8	0	0	0	112.8	A31 S43 L44 L50 Q51 I60 N63 L67	A31-L47 HydrophobicContact CB-CD2 4.04Å; A31-L47 HydrophobicContact CB-CG 4.12Å; S43-L47 WeakPolarHBondContact O-CG 3.42Å; S43-L47 PolarHBondContact O-N 2.9Å; L44-L47 PolarHBondContact O-N 2.64Å; L47-L50 HydrophobicContact CD2-CD2 4.49Å; L47-L50 PolarHBondContact O-N 3.42Å; L47-Q51 WeakPolarHBondContact O-CB 3.32Å; L47-Q51 PolarHBondContact O-N 3.07Å; L47-I60 HydrophobicContact CD2-CG2 4.48Å; L47-N63 HydrophobicContact CD1-CB 4.23Å; L47-N63 HydrophobicContact CD2-CB 4.44Å; L47-L67 HydrophobicContact CD1-CB 4.39Å; L47-L67 HydrophobicContact CD1-CD1 3.91Å
48	E	92.1	Very high	89.7	Confident	80 Å²	80	70.2 Å²	70.2	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-42.2	175.4	-73.7	-179.7	157.8	0	0	111.7	L44 K45 L50 Q51 E52 K64	L44-E48 HydrophobicContact CD1-CG 4.38Å; L44-E48 HydrophobicContact CG-CG 4.46Å; L44-E48 WeakPolarHBondContact O-CG 3.41Å; L44-E48 PolarHBondContact O-N 3.04Å; K45-E48 PolarHBondContact O-N 3.3Å; E48-L50 VanDerWaalsContact C-N 3.32Å; E48-L50 PolarHBondContact O-N 3.34Å; E48-Q51 PolarHBondContact O-N 3.5Å; E48-E52 PolarHBondContact O-N 3.05Å; E48-K64 IonicContact OE1-NZ 3.97Å; E48-K64 PolarHBondContact OE1-NZ 3.41Å
49	A	90.4	Very high	89.6	Confident	42 Å²	42	72.5 Å²	72.5	35%	0.347	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-39.6	172.6	0	0	0	0	0	112.1	M27 K45 Q46 E52 L53	M27-A49 HydrophobicContact SD-CB 4.39Å; K45-A49 PolarHBondContact O-N 2.85Å; Q46-A49 PolarHBondContact O-N 3.28Å; A49-E52 PolarHBondContact O-N 3.2Å; A49-L53 PolarHBondContact O-N 3.4Å
50	L	90.6	Very high	89.4	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-66.4	-40.1	177	-169.3	67.7	0	0	0	112.1	E24 M27 A28 Q46 L47 E48 E52 L53 N54 I60	E24-L50 HydrophobicContact CB-CD1 3.79Å; E24-L50 HydrophobicContact CG-CD1 3.84Å; M27-L50 HydrophobicContact CB-CD1 4.24Å; M27-L50 HydrophobicContact CE-CD1 3.92Å; A28-L50 HydrophobicContact CB-CD2 4.09Å; Q46-L50 WeakPolarHBondContact O-CB 3.41Å; Q46-L50 PolarHBondContact O-N 2.98Å; L47-L50 HydrophobicContact CD2-CD2 4.49Å; L47-L50 PolarHBondContact O-N 3.42Å; E48-L50 VanDerWaalsContact C-N 3.32Å; E48-L50 PolarHBondContact O-N 3.34Å; L50-E52 VanDerWaalsContact C-N 3.29Å; L50-E52 PolarHBondContact O-N 3.41Å; L50-L53 PolarHBondContact O-N 2.87Å; L50-N54 PolarHBondContact O-N 2.6Å; L50-I60 HydrophobicContact CD2-CD1 4.13Å; L50-I60 HydrophobicContact CD2-CG1 4.11Å; L50-I60 HydrophobicContact CG-CD1 3.88Å; L50-I60 HydrophobicContact CG-CG1 4.39Å
51	Q	90.3	Very high	89.2	Confident	34 Å²	34	66.8 Å²	66.8	16%	0.159	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-31.7	177.3	-170.3	75.1	63.5	0	0	112.2	L47 E48 L53 N54 K55 I60 S61	L47-Q51 WeakPolarHBondContact O-CB 3.32Å; L47-Q51 PolarHBondContact O-N 3.07Å; E48-Q51 PolarHBondContact O-N 3.5Å; Q51-L53 VanDerWaalsContact C-N 3.32Å; Q51-N54 PolarHBondContact NE2-O 3.45Å; Q51-N54 CarbonylContact O-C 3.33Å; Q51-N54 VanDerWaalsContact O-C 3.29Å; Q51-K55 PolarHBondContact NE2-O 2.9Å; Q51-K55 WeakPolarHBondContact O-CG 3.42Å; Q51-K55 PolarHBondContact O-N 3.21Å; Q51-I60 HydrophobicContact CB-CG2 3.89Å; Q51-I60 HydrophobicContact CG-CG2 4.48Å; Q51-S61 PolarHBondContact OE1-OG 3.42Å; Q51-S61 VanDerWaalsContact OE1-OG 3.05Å
52	E	88.8	Confident	89	Confident	128 Å²	128	62.5 Å²	62.5	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-69.8	-30.4	175	-73.6	-56.1	142.7	0	0	112.9	E48 A49 L50 K55	E48-E52 PolarHBondContact O-N 3.05Å; A49-E52 PolarHBondContact O-N 3.2Å; L50-E52 VanDerWaalsContact C-N 3.29Å; L50-E52 PolarHBondContact O-N 3.41Å; E52-K55 WeakPolarHBondContact O-CE 3.34Å; E52-K55 WeakPolarHBondContact OE2-CE 3.48Å; E52-K55 IonicContact OE2-NZ 2.85Å; E52-K55 PolarHBondContact OE2-NZ 3.46Å
53	L	85.9	Confident	89.1	Confident	94 Å²	94	61.8 Å²	61.8	49%	0.492	30%	0.304	S	S	.	.	H	α-helix	trans	-79.3	-35.5	177	-72	159.4	0	0	0	112.2	M27 A49 L50 Q51	M27-L53 HydrophobicContact CE-CD1 3.08Å; M27-L53 HydrophobicContact SD-CD1 4.05Å; A49-L53 PolarHBondContact O-N 3.4Å; L50-L53 PolarHBondContact O-N 2.87Å; Q51-L53 VanDerWaalsContact C-N 3.32Å
54	N	84.3	Confident	89	Confident	45 Å²	45	64.4 Å²	64.4	24%	0.241	32%	0.315	C	S	.	.			trans	-131.9	93.5	178.6	-169.9	-13.8	0	0	0	111.1	L50 Q51 D57 I60	L50-N54 PolarHBondContact O-N 2.6Å; Q51-N54 PolarHBondContact NE2-O 3.45Å; Q51-N54 CarbonylContact O-C 3.33Å; Q51-N54 VanDerWaalsContact O-C 3.29Å; N54-D57 PolarHBondContact OD1-N 3.19Å; N54-I60 HydrophobicContact CB-CD1 4.03Å
55	K	81.8	Confident	89	Confident	133 Å²	133	64.1 Å²	64.1	58%	0.578	31%	0.314	S	S	*	.	S	Bend	trans	-78.2	-22.4	-173.9	-67.2	-174.7	179.1	-165.1	0	113.9	Q51 E52	Q51-K55 PolarHBondContact NE2-O 2.9Å; Q51-K55 WeakPolarHBondContact O-CG 3.42Å; Q51-K55 PolarHBondContact O-N 3.21Å; E52-K55 WeakPolarHBondContact O-CE 3.34Å; E52-K55 WeakPolarHBondContact OE2-CE 3.48Å; E52-K55 IonicContact OE2-NZ 2.85Å; E52-K55 PolarHBondContact OE2-NZ 3.46Å
56	E	78.4	Confident	89	Confident	176 Å²	176	58.7 Å²	58.7	82%	0.822	29%	0.293	S	S	*	.	S	Bend	trans	-91.7	-15.8	-172.5	-58.8	-60.7	149.1	0	0	113	Y58	E56-Y58 PolarHBondContact O-N 3.37Å
57	D	83.3	Confident	89.1	Confident	46 Å²	46	55.6 Å²	55.6	25%	0.246	28%	0.279	C	S	.	.			trans	-78.9	103.8	-178.6	-171.5	-3.1	0	0	0	112.5	N54 K59 I60	N54-D57 PolarHBondContact OD1-N 3.19Å; D57-K59 PolarHBondContact O-N 3.36Å; D57-K59 WeakPolarHBondContact OD1-CB 3.36Å; D57-K59 WeakPolarHBondContact OD1-CG 3.46Å; D57-K59 PolarHBondContact OD1-N 3.41Å; D57-I60 HydrophobicContact CB-CD1 3.93Å; D57-I60 HydrophobicContact CB-CG1 4.14Å; D57-I60 PolarHBondContact O-N 2.84Å
58	Y	85.6	Confident	89.1	Confident	39 Å²	39	58.2 Å²	58.2	15%	0.153	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-22.4	176.9	81.8	-82.5	0	0	0	113.2	E56 I60 S61 L62 L91 E105 N106	E56-Y58 PolarHBondContact O-N 3.37Å; Y58-I60 VanDerWaalsContact C-N 3.27Å; Y58-I60 PolarHBondContact O-N 3.25Å; Y58-S61 WeakPolarHBondContact O-CB 3.39Å; Y58-S61 PolarHBondContact O-N 3.19Å; Y58-L62 WeakPolarHBondContact O-CB 3.37Å; Y58-L62 PolarHBondContact O-N 2.88Å; Y58-L91 HydrophobicContact CD1-CD2 4.42Å; Y58-L91 HydrophobicContact CD2-CD1 4.25Å; Y58-L91 HydrophobicContact CG-CD2 4.39Å; Y58-E105 PolarHBondContact OH-O 3.46Å; Y58-N106 VanDerWaalsContact CZ-OD1 3.28Å; Y58-N106 PolarHBondContact OH-OD1 3.45Å
59	K	88.7	Confident	89.2	Confident	86 Å²	86	54.9 Å²	54.9	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-32.3	-180	-62.9	170	-176.1	160.6	0	111.1	D57 L62 N63	D57-K59 PolarHBondContact O-N 3.36Å; D57-K59 WeakPolarHBondContact OD1-CB 3.36Å; D57-K59 WeakPolarHBondContact OD1-CG 3.46Å; D57-K59 PolarHBondContact OD1-N 3.41Å; K59-L62 PolarHBondContact O-N 2.94Å; K59-N63 WeakPolarHBondContact O-CB 3.35Å; K59-N63 PolarHBondContact O-N 2.88Å; K59-N63 PolarHBondContact O-ND2 3.42Å
60	I	90.4	Very high	89.3	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-46	174.3	-55.1	170.3	0	0	0	109.6	L47 L50 Q51 N54 D57 Y58 L62 N63 K64	L47-I60 HydrophobicContact CD2-CG2 4.48Å; L50-I60 HydrophobicContact CD2-CD1 4.13Å; L50-I60 HydrophobicContact CD2-CG1 4.11Å; L50-I60 HydrophobicContact CG-CD1 3.88Å; L50-I60 HydrophobicContact CG-CG1 4.39Å; Q51-I60 HydrophobicContact CB-CG2 3.89Å; Q51-I60 HydrophobicContact CG-CG2 4.48Å; N54-I60 HydrophobicContact CB-CD1 4.03Å; D57-I60 HydrophobicContact CB-CD1 3.93Å; D57-I60 HydrophobicContact CB-CG1 4.14Å; D57-I60 PolarHBondContact O-N 2.84Å; Y58-I60 VanDerWaalsContact C-N 3.27Å; Y58-I60 PolarHBondContact O-N 3.25Å; I60-L62 PolarHBondContact O-N 3.43Å; I60-N63 PolarHBondContact O-N 3.39Å; I60-K64 WeakPolarHBondContact O-CB 3.37Å; I60-K64 PolarHBondContact O-N 3.33Å
61	S	90.2	Very high	89.4	Confident	46 Å²	46	61.6 Å²	61.6	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-39.8	176.1	-72.1	0	0	0	0	112.6	Q51 Y58 K64 A65	Q51-S61 PolarHBondContact OE1-OG 3.42Å; Q51-S61 VanDerWaalsContact OE1-OG 3.05Å; Y58-S61 WeakPolarHBondContact O-CB 3.39Å; Y58-S61 PolarHBondContact O-N 3.19Å; S61-K64 PolarHBondContact O-N 3.09Å; S61-A65 PolarHBondContact O-N 3.23Å
62	L	91.2	Very high	89.4	Confident	6 Å²	6	62 Å²	62	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-48.3	173.9	179.4	60.9	0	0	0	111.5	Y58 K59 I60 K64 A65 V66 L84 M87 L108 L109	Y58-L62 WeakPolarHBondContact O-CB 3.37Å; Y58-L62 PolarHBondContact O-N 2.88Å; K59-L62 PolarHBondContact O-N 2.94Å; I60-L62 PolarHBondContact O-N 3.43Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 2.83Å; L62-A65 WeakPolarHBondContact O-CB 3.32Å; L62-A65 PolarHBondContact O-N 3.47Å; L62-V66 WeakPolarHBondContact O-CG2 3.48Å; L62-V66 PolarHBondContact O-N 3.35Å; L62-L84 HydrophobicContact CD1-CD2 3.48Å; L62-L84 VanDerWaalsContact CD1-CD2 3.48Å; L62-M87 HydrophobicContact CB-CE 4.4Å; L62-M87 HydrophobicContact CB-SD 4.44Å; L62-M87 HydrophobicContact CD1-CE 3.76Å; L62-L108 HydrophobicContact CD2-CB 4.25Å; L62-L109 HydrophobicContact CD1-CD1 4.07Å; L62-L109 HydrophobicContact CD2-CB 4.37Å
63	N	93	Very high	89.3	Confident	88 Å²	88	58 Å²	58	47%	0.471	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-38.2	177.8	-74.1	-18	0	0	0	111.7	L47 K59 I60 V66 L67	L47-N63 HydrophobicContact CD1-CB 4.23Å; L47-N63 HydrophobicContact CD2-CB 4.44Å; K59-N63 WeakPolarHBondContact O-CB 3.35Å; K59-N63 PolarHBondContact O-N 2.88Å; K59-N63 PolarHBondContact O-ND2 3.42Å; I60-N63 PolarHBondContact O-N 3.39Å; N63-V66 PolarHBondContact O-N 3.42Å; N63-L67 VanDerWaalsContact O-CB 3.28Å; N63-L67 WeakPolarHBondContact O-CB 3.4Å; N63-L67 PolarHBondContact O-N 3.24Å
64	K	92.8	Very high	89.5	Confident	56 Å²	56	56.4 Å²	56.4	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-47.4	172.9	-174.2	176.7	-174.2	167.4	0	111.3	L44 E48 I60 S61 L62 V66 L67 E68	L44-K64 HydrophobicContact CD1-CD 4.36Å; L44-K64 HydrophobicContact CD1-CG 3.91Å; E48-K64 IonicContact OE1-NZ 3.97Å; E48-K64 PolarHBondContact OE1-NZ 3.41Å; I60-K64 WeakPolarHBondContact O-CB 3.37Å; I60-K64 PolarHBondContact O-N 3.33Å; S61-K64 PolarHBondContact O-N 3.09Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 2.83Å; K64-V66 PolarHBondContact O-N 3.38Å; K64-L67 PolarHBondContact O-N 3.28Å; K64-E68 WeakPolarHBondContact CE-OE1 3.5Å; K64-E68 WeakPolarHBondContact O-CG 3.49Å; K64-E68 PolarHBondContact O-N 3.04Å
65	A	93	Very high	89.8	Confident	7 Å²	7	55.8 Å²	55.8	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-43	178.2	0	0	0	0	0	112.2	S61 L62 F69 L80 T83 M87	S61-A65 PolarHBondContact O-N 3.23Å; L62-A65 WeakPolarHBondContact O-CB 3.32Å; L62-A65 PolarHBondContact O-N 3.47Å; A65-F69 PolarHBondContact O-N 3.26Å; A65-F69 VanDerWaalsContact O-N 3.15Å; A65-L80 HydrophobicContact CB-CD1 4.06Å; A65-T83 HydrophobicContact CB-CG2 3.78Å; A65-M87 HydrophobicContact CB-CE 4.49Å
66	V	93.8	Very high	90.2	Very high	30 Å²	30	50.8 Å²	50.8	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-45.6	174.5	174.4	0	0	0	0	110.4	L62 N63 K64 E68 F69 Y70	L62-V66 WeakPolarHBondContact O-CG2 3.48Å; L62-V66 PolarHBondContact O-N 3.35Å; N63-V66 PolarHBondContact O-N 3.42Å; K64-V66 PolarHBondContact O-N 3.38Å; V66-E68 PolarHBondContact O-N 3.34Å; V66-F69 WeakPolarHBondContact O-CB 3.44Å; V66-F69 PolarHBondContact O-N 2.9Å; V66-F69 VanDerWaalsContact O-N 3.16Å; V66-Y70 HydrophobicContact CG1-CD2 3.84Å; V66-Y70 HydrophobicContact CG1-CE2 3.78Å; V66-Y70 WeakPolarHBondContact O-CD2 3.28Å; V66-Y70 PolarHBondContact O-N 2.88Å
67	L	94.4	Very high	90.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-45.5	178.8	-178.1	151.1	0	0	0	112.2	F35 S43 L44 L47 N63 K64 F69 Y70 R71	F35-L67 HydrophobicContact CD2-CB 4.45Å; F35-L67 HydrophobicContact CD2-CD1 4.17Å; F35-L67 HydrophobicContact CD2-CG 4.25Å; F35-L67 HydrophobicContact CE2-CB 4.49Å; S43-L67 VanDerWaalsContact CB-CD1 3.45Å; S43-L67 WeakPolarHBondContact OG-CD1 3.38Å; L44-L67 HydrophobicContact CB-CD2 3.71Å; L44-L67 HydrophobicContact CD1-CD2 3.95Å; L44-L67 HydrophobicContact CG-CD2 4.31Å; L47-L67 HydrophobicContact CD1-CB 4.39Å; L47-L67 HydrophobicContact CD1-CD1 3.91Å; N63-L67 VanDerWaalsContact O-CB 3.28Å; N63-L67 WeakPolarHBondContact O-CB 3.4Å; N63-L67 PolarHBondContact O-N 3.24Å; K64-L67 PolarHBondContact O-N 3.28Å; L67-F69 PolarHBondContact O-N 2.95Å; L67-Y70 PolarHBondContact O-N 2.96Å; L67-Y70 VanDerWaalsContact O-N 3.13Å; L67-R71 WeakPolarHBondContact O-CB 3.45Å; L67-R71 PolarHBondContact O-N 2.96Å
68	E	92.8	Very high	90.9	Very high	69 Å²	69	41.8 Å²	41.8	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-37.7	177.2	-75.3	178.5	176.5	0	0	111.6	K64 V66 R71 S72	K64-E68 WeakPolarHBondContact CE-OE1 3.5Å; K64-E68 WeakPolarHBondContact O-CG 3.49Å; K64-E68 PolarHBondContact O-N 3.04Å; V66-E68 PolarHBondContact O-N 3.34Å; E68-R71 PolarHBondContact O-N 2.98Å; E68-S72 PolarHBondContact O-N 2.87Å
69	F	93.6	Very high	91.2	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.039	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-46.7	172.9	171.7	-104	0	0	0	112	A65 V66 L67 S72 Q74 L80 M338	A65-F69 PolarHBondContact O-N 3.26Å; A65-F69 VanDerWaalsContact O-N 3.15Å; V66-F69 WeakPolarHBondContact O-CB 3.44Å; V66-F69 PolarHBondContact O-N 2.9Å; V66-F69 VanDerWaalsContact O-N 3.16Å; L67-F69 PolarHBondContact O-N 2.95Å; F69-S72 PolarHBondContact O-N 3.46Å; F69-S72 PolarHBondContact O-OG 3.38Å; F69-Q74 HydrophobicContact CD1-CB 4.41Å; F69-Q74 HydrophobicContact CD1-CG 4.2Å; F69-Q74 HydrophobicContact CE1-CB 3.66Å; F69-Q74 HydrophobicContact CE1-CG 3.65Å; F69-Q74 VanDerWaalsContact CE2-C 3.42Å; F69-Q74 HydrophobicContact CE2-CB 4.05Å; F69-Q74 VanDerWaalsContact CE2-O 3.25Å; F69-Q74 WeakPolarHBondContact CE2-O 3.26Å; F69-Q74 HydrophobicContact CZ-CB 3.45Å; F69-Q74 VanDerWaalsContact CZ-CB 3.45Å; F69-Q74 HydrophobicContact CZ-CG 4.01Å; F69-Q74 WeakPolarHBondContact CZ-O 3.44Å; F69-Q74 VanDerWaalsContact O-CA 3.3Å; F69-Q74 WeakPolarHBondContact O-CA 3.44Å; F69-Q74 PolarHBondContact O-N 3.16Å; F69-L80 HydrophobicContact CB-CB 4.47Å; F69-L80 HydrophobicContact CB-CD1 4.37Å; F69-L80 HydrophobicContact CB-CD2 4.05Å; F69-L80 HydrophobicContact CD1-CD2 4.09Å; F69-L80 HydrophobicContact CD2-CB 4.29Å; F69-L80 HydrophobicContact CD2-CD2 3.94Å; F69-L80 HydrophobicContact CE2-CD2 4.4Å; F69-L80 HydrophobicContact CG-CD2 3.76Å; F69-M338 HydrophobicContact CE1-CE 4.3Å; F69-M338 HydrophobicContact CE2-CB 4.22Å; F69-M338 HydrophobicContact CZ-CB 3.68Å; F69-M338 HydrophobicContact CZ-CE 4.05Å; F69-M338 HydrophobicContact CZ-CG 4.49Å; F69-M338 HydrophobicContact CZ-SD 4.11Å
70	Y	92.4	Very high	91.3	Very high	82 Å²	82	39.5 Å²	39.5	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-65.1	-39.3	175.6	-85.4	-100.3	0	0	0	112.6	F35 Y40 V66 L67 S72 G73 Q74	F35-Y70 HydrophobicContact CE2-CD1 4.45Å; F35-Y70 HydrophobicContact CE2-CD2 4.09Å; F35-Y70 AromaticContact CE2-CG 3.92Å; F35-Y70 HydrophobicContact CE2-CG 3.92Å; F35-Y70 AromaticContact CZ-CD1 3.99Å; F35-Y70 HydrophobicContact CZ-CD1 3.99Å; F35-Y70 AromaticContact CZ-CD2 3.8Å; F35-Y70 HydrophobicContact CZ-CD2 3.8Å; F35-Y70 HydrophobicContact CZ-CE1 4.22Å; F35-Y70 HydrophobicContact CZ-CE2 4.05Å; F35-Y70 AromaticContact CZ-CG 3.77Å; F35-Y70 HydrophobicContact CZ-CG 3.77Å; Y40-Y70 HydrophobicContact CE1-CD1 4.44Å; Y40-Y70 HydrophobicContact CE1-CG 4.41Å; V66-Y70 HydrophobicContact CG1-CD2 3.84Å; V66-Y70 HydrophobicContact CG1-CE2 3.78Å; V66-Y70 WeakPolarHBondContact O-CD2 3.28Å; V66-Y70 PolarHBondContact O-N 2.88Å; L67-Y70 PolarHBondContact O-N 2.96Å; L67-Y70 VanDerWaalsContact O-N 3.13Å; Y70-S72 PolarHBondContact O-N 3.14Å; Y70-G73 PolarHBondContact O-N 3.01Å; Y70-Q74 HydrophobicContact CD1-CG 4.34Å; Y70-Q74 VanDerWaalsContact CE1-NE2 3.27Å
71	R	92.6	Very high	91.4	Very high	109 Å²	109	41.6 Å²	41.6	41%	0.411	24%	0.236	S	C	.	.	H	α-helix	trans	-58.7	-34.5	174.5	-172.1	177.4	66	169.5	-6	112.2	Y40 D41 L67 E68 G73	Y40-R71 HydrophobicContact CD2-CB 4.41Å; Y40-R71 HydrophobicContact CG-CB 4.25Å; D41-R71 WeakPolarHBondContact OD1-CD 3.43Å; D41-R71 IonicContact OD1-NH1 2.84Å; L67-R71 WeakPolarHBondContact O-CB 3.45Å; L67-R71 PolarHBondContact O-N 2.96Å; E68-R71 PolarHBondContact O-N 2.98Å; R71-G73 PolarHBondContact O-N 3.27Å
72	S	90	Very high	91.5	Very high	41 Å²	41	46.3 Å²	46.3	29%	0.287	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	4.2	174.7	79.2	0	0	0	0	114.6	E68 F69 Y70 Q74 T75 A76	E68-S72 PolarHBondContact O-N 2.87Å; F69-S72 PolarHBondContact O-N 3.46Å; F69-S72 PolarHBondContact O-OG 3.38Å; Y70-S72 PolarHBondContact O-N 3.14Å; S72-Q74 VanDerWaalsContact C-N 3.28Å; S72-T75 PolarHBondContact O-OG1 3.02Å; S72-T75 PolarHBondContact OG-N 3.26Å; S72-A76 WeakPolarHBondContact OG-CB 3.42Å; S72-A76 PolarHBondContact OG-N 3.17Å; S72-A76 VanDerWaalsContact OG-N 3.16Å
73	G	87.7	Confident	91.6	Very high	46 Å²	46	48.5 Å²	48.5	47%	0.474	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	28.5	-169.4	0	0	0	0	0	112.6	Y70 R71 T75	Y70-G73 PolarHBondContact O-N 3.01Å; R71-G73 PolarHBondContact O-N 3.27Å; G73-T75 PolarHBondContact O-N 3.01Å
74	Q	90.1	Very high	91.5	Very high	59 Å²	59	44.3 Å²	44.3	28%	0.276	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	25.2	-178.3	-55.3	174	16.1	0	0	114.2	F69 Y70 S72 P337 M338	F69-Q74 HydrophobicContact CD1-CB 4.41Å; F69-Q74 HydrophobicContact CD1-CG 4.2Å; F69-Q74 HydrophobicContact CE1-CB 3.66Å; F69-Q74 HydrophobicContact CE1-CG 3.65Å; F69-Q74 VanDerWaalsContact CE2-C 3.42Å; F69-Q74 HydrophobicContact CE2-CB 4.05Å; F69-Q74 VanDerWaalsContact CE2-O 3.25Å; F69-Q74 WeakPolarHBondContact CE2-O 3.26Å; F69-Q74 HydrophobicContact CZ-CB 3.45Å; F69-Q74 VanDerWaalsContact CZ-CB 3.45Å; F69-Q74 HydrophobicContact CZ-CG 4.01Å; F69-Q74 WeakPolarHBondContact CZ-O 3.44Å; F69-Q74 VanDerWaalsContact O-CA 3.3Å; F69-Q74 WeakPolarHBondContact O-CA 3.44Å; F69-Q74 PolarHBondContact O-N 3.16Å; Y70-Q74 HydrophobicContact CD1-CG 4.34Å; Y70-Q74 VanDerWaalsContact CE1-NE2 3.27Å; S72-Q74 VanDerWaalsContact C-N 3.28Å; Q74-P337 CarbonylContact O-C 3.59Å; Q74-P337 WeakPolarHBondContact O-CA 3.47Å; Q74-M338 PolarHBondContact O-N 2.97Å
75	T	89.5	Confident	91.4	Very high	33 Å²	33	44 Å²	44	20%	0.202	25%	0.249	C	C	.	.			trans	-98	-14.6	-176.9	65	0	0	0	0	113.6	S72 G73 T77 G335 P337	S72-T75 PolarHBondContact O-OG1 3.02Å; S72-T75 PolarHBondContact OG-N 3.26Å; G73-T75 PolarHBondContact O-N 3.01Å; T75-T77 VanDerWaalsContact C-N 3.27Å; T75-T77 PolarHBondContact O-N 3.46Å; T75-G335 WeakPolarHBondContact CG2-O 3.48Å; T75-G335 PolarHBondContact O-N 3.32Å; T75-P337 HydrophobicContact CG2-CG 4.33Å
76	A	90.1	Very high	91.2	Very high	27 Å²	27	45.9 Å²	45.9	22%	0.223	27%	0.265	C	S	.	.			trans	-86.9	39	-177.3	0	0	0	0	0	114.2	S72 G78 S79 L80	S72-A76 WeakPolarHBondContact OG-CB 3.42Å; S72-A76 PolarHBondContact OG-N 3.17Å; S72-A76 VanDerWaalsContact OG-N 3.16Å; A76-G78 VanDerWaalsContact C-N 3.27Å; A76-G78 PolarHBondContact O-N 2.97Å; A76-S79 PolarHBondContact O-N 3.37Å; A76-S79 VanDerWaalsContact O-N 3.09Å; A76-L80 PolarHBondContact O-N 3.24Å; A76-L80 VanDerWaalsContact O-N 3.07Å
77	T	89.6	Confident	91	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-54.9	-39.9	-175.3	-52	0	0	0	0	113.1	T75 L80 K81 I116 M338 L341	T75-T77 VanDerWaalsContact C-N 3.27Å; T75-T77 PolarHBondContact O-N 3.46Å; T77-L80 PolarHBondContact O-N 3.24Å; T77-K81 WeakPolarHBondContact O-CB 3.33Å; T77-K81 PolarHBondContact O-N 3.38Å; T77-I116 HydrophobicContact CG2-CG2 4.43Å; T77-M338 HydrophobicContact CG2-CG 4.12Å; T77-M338 HydrophobicContact CG2-SD 4.23Å; T77-L341 HydrophobicContact CG2-CD1 4.09Å
78	G	88.3	Confident	90.6	Very high	32 Å²	32	49.5 Å²	49.5	33%	0.33	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-38.7	179.2	0	0	0	0	0	113.5	A76 Q82	A76-G78 VanDerWaalsContact C-N 3.27Å; A76-G78 PolarHBondContact O-N 2.97Å; G78-Q82 WeakPolarHBondContact O-CG 3.21Å; G78-Q82 PolarHBondContact O-N 3.27Å
79	S	90.4	Very high	90.2	Very high	63 Å²	63	51 Å²	51	44%	0.441	29%	0.286	S	S	.	.	H	α-helix	trans	-66.7	-47.7	176.3	-166.8	0	0	0	0	110.3	A76 K81 Q82 T83	A76-S79 PolarHBondContact O-N 3.37Å; A76-S79 VanDerWaalsContact O-N 3.09Å; S79-K81 VanDerWaalsContact C-N 3.31Å; S79-K81 PolarHBondContact O-N 3.21Å; S79-Q82 PolarHBondContact O-N 3.38Å; S79-Q82 VanDerWaalsContact O-N 3.13Å; S79-T83 PolarHBondContact O-N 3.1Å; S79-T83 PolarHBondContact O-OG1 3.15Å; S79-T83 VanDerWaalsContact O-OG1 3.13Å
80	L	92.3	Very high	89.6	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-56.5	-46.4	177.3	-177.9	63.9	0	0	0	111	A65 F69 A76 T77 Q82 T83 L84 I116	A65-L80 HydrophobicContact CB-CD1 4.06Å; F69-L80 HydrophobicContact CB-CB 4.47Å; F69-L80 HydrophobicContact CB-CD1 4.37Å; F69-L80 HydrophobicContact CB-CD2 4.05Å; F69-L80 HydrophobicContact CD1-CD2 4.09Å; F69-L80 HydrophobicContact CD2-CB 4.29Å; F69-L80 HydrophobicContact CD2-CD2 3.94Å; F69-L80 HydrophobicContact CE2-CD2 4.4Å; F69-L80 HydrophobicContact CG-CD2 3.76Å; A76-L80 PolarHBondContact O-N 3.24Å; A76-L80 VanDerWaalsContact O-N 3.07Å; T77-L80 PolarHBondContact O-N 3.24Å; L80-Q82 VanDerWaalsContact C-N 3.32Å; L80-Q82 PolarHBondContact O-N 3.39Å; L80-T83 PolarHBondContact O-N 3.23Å; L80-L84 HydrophobicContact CD1-CD1 4.48Å; L80-L84 HydrophobicContact CD1-CD2 4.08Å; L80-L84 HydrophobicContact CD1-CG 4.09Å; L80-L84 HydrophobicContact CG-CD1 4.34Å; L80-L84 HydrophobicContact CG-CG 4.24Å; L80-L84 VanDerWaalsContact O-CG 3.31Å; L80-L84 WeakPolarHBondContact O-CG 3.37Å; L80-L84 PolarHBondContact O-N 3.46Å; L80-I116 HydrophobicContact CB-CD1 4.46Å; L80-I116 HydrophobicContact CD2-CD1 3.92Å; L80-I116 HydrophobicContact CD2-CG1 4.49Å; L80-I116 HydrophobicContact CG-CD1 3.87Å
81	K	92.2	Very high	88.7	Confident	52 Å²	52	55 Å²	55	23%	0.226	31%	0.309	C	S	.	.	H	α-helix	trans	-56.1	-45	176.9	-176.3	175.1	-176.5	170.2	0	112.6	T77 S79 S85 I116 M120 Q122	T77-K81 WeakPolarHBondContact O-CB 3.33Å; T77-K81 PolarHBondContact O-N 3.38Å; S79-K81 VanDerWaalsContact C-N 3.31Å; S79-K81 PolarHBondContact O-N 3.21Å; K81-S85 WeakPolarHBondContact O-CB 3.39Å; K81-S85 PolarHBondContact O-N 3.29Å; K81-S85 PolarHBondContact O-OG 3.01Å; K81-I116 HydrophobicContact CB-CD1 4.34Å; K81-I116 HydrophobicContact CB-CG2 4.09Å; K81-I116 HydrophobicContact CD-CG2 4.12Å; K81-I116 HydrophobicContact CG-CG2 4.17Å; K81-M120 HydrophobicContact CD-CE 4.34Å; K81-M120 HydrophobicContact CD-SD 3.6Å; K81-M120 PolarHBondContact NZ-SD 2.89Å; K81-Q122 VanDerWaalsContact NZ-OE1 3.15Å
82	Q	92.3	Very high	87.7	Confident	145 Å²	145	56.1 Å²	56.1	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-64.3	-46.8	179.4	-72.8	176.1	-5.6	0	0	111.1	G78 S79 L80 S85 A86	G78-Q82 WeakPolarHBondContact O-CG 3.21Å; G78-Q82 PolarHBondContact O-N 3.27Å; S79-Q82 PolarHBondContact O-N 3.38Å; S79-Q82 VanDerWaalsContact O-N 3.13Å; L80-Q82 VanDerWaalsContact C-N 3.32Å; L80-Q82 PolarHBondContact O-N 3.39Å; Q82-S85 PolarHBondContact O-N 3Å; Q82-A86 PolarHBondContact O-N 3.36Å
83	T	92.1	Very high	86.3	Confident	52 Å²	52	59.7 Å²	59.7	32%	0.319	34%	0.339	S	S	.	.	H	α-helix	trans	-60.8	-47	177.6	-51.3	0	0	0	0	111.8	A65 S79 L80 S85 A86 M87	A65-T83 HydrophobicContact CB-CG2 3.78Å; S79-T83 PolarHBondContact O-N 3.1Å; S79-T83 PolarHBondContact O-OG1 3.15Å; S79-T83 VanDerWaalsContact O-OG1 3.13Å; L80-T83 PolarHBondContact O-N 3.23Å; T83-S85 VanDerWaalsContact C-N 3.29Å; T83-S85 PolarHBondContact O-N 3.41Å; T83-A86 PolarHBondContact O-N 3.37Å; T83-M87 HydrophobicContact CG2-CE 4.21Å; T83-M87 WeakPolarHBondContact O-CG 3.43Å; T83-M87 PolarHBondContact O-N 3.48Å
84	L	91.6	Very high	84.9	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-33.8	177.7	-61.8	-165.9	0	0	0	112.5	L62 L80 M87 R88 L109 N112 Q113 I116	L62-L84 HydrophobicContact CD1-CD2 3.48Å; L62-L84 VanDerWaalsContact CD1-CD2 3.48Å; L80-L84 HydrophobicContact CD1-CD1 4.48Å; L80-L84 HydrophobicContact CD1-CD2 4.08Å; L80-L84 HydrophobicContact CD1-CG 4.09Å; L80-L84 HydrophobicContact CG-CD1 4.34Å; L80-L84 HydrophobicContact CG-CG 4.24Å; L80-L84 VanDerWaalsContact O-CG 3.31Å; L80-L84 WeakPolarHBondContact O-CG 3.37Å; L80-L84 PolarHBondContact O-N 3.46Å; L84-M87 HydrophobicContact CD2-CE 3.29Å; L84-M87 HydrophobicContact CG-CE 4.43Å; L84-R88 PolarHBondContact O-N 3.3Å; L84-R88 VanDerWaalsContact O-N 3.15Å; L84-L109 HydrophobicContact CB-CD1 4.09Å; L84-L109 HydrophobicContact CD2-CD1 3.89Å; L84-L109 HydrophobicContact CG-CD1 4.42Å; L84-N112 HydrophobicContact CD1-CB 3.67Å; L84-Q113 HydrophobicContact CB-CG 4.04Å; L84-Q113 HydrophobicContact CD1-CG 4.15Å; L84-Q113 PolarHBondContact O-NE2 2.95Å; L84-I116 HydrophobicContact CD1-CD1 3.61Å; L84-I116 HydrophobicContact CG-CD1 4.4Å
85	S	90.4	Very high	83.1	Confident	49 Å²	49	61.4 Å²	61.4	34%	0.343	35%	0.352	S	S	.	.	H	α-helix	trans	-71.7	-40.2	177.8	-55.6	0	0	0	0	111.4	K81 Q82 T83 R88 N89	K81-S85 WeakPolarHBondContact O-CB 3.39Å; K81-S85 PolarHBondContact O-N 3.29Å; K81-S85 PolarHBondContact O-OG 3.01Å; Q82-S85 PolarHBondContact O-N 3Å; T83-S85 VanDerWaalsContact C-N 3.29Å; T83-S85 PolarHBondContact O-N 3.41Å; S85-R88 PolarHBondContact O-N 2.97Å; S85-N89 PolarHBondContact O-N 3.44Å; S85-N89 VanDerWaalsContact O-N 3.1Å
86	A	89.9	Confident	81	Confident	47 Å²	47	68.1 Å²	68.1	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-44.9	175.7	0	0	0	0	0	111.8	Q82 T83 R88 N89 Q90	Q82-A86 PolarHBondContact O-N 3.36Å; T83-A86 PolarHBondContact O-N 3.37Å; A86-R88 PolarHBondContact O-N 3.21Å; A86-N89 PolarHBondContact O-N 3.47Å; A86-Q90 WeakPolarHBondContact O-CG 3.48Å; A86-Q90 PolarHBondContact O-N 2.86Å
87	M	88.8	Confident	79	Confident	15 Å²	15	73.7 Å²	73.7	7%	0.074	41%	0.408	C	S	.	.	H	α-helix	trans	-61.1	-42.7	176.3	-71.5	-172.6	-62.9	0	0	112	L62 A65 T83 L84 N89 Q90 L91 L109	L62-M87 HydrophobicContact CB-CE 4.4Å; L62-M87 HydrophobicContact CB-SD 4.44Å; L62-M87 HydrophobicContact CD1-CE 3.76Å; A65-M87 HydrophobicContact CB-CE 4.49Å; T83-M87 HydrophobicContact CG2-CE 4.21Å; T83-M87 WeakPolarHBondContact O-CG 3.43Å; T83-M87 PolarHBondContact O-N 3.48Å; L84-M87 HydrophobicContact CD2-CE 3.29Å; L84-M87 HydrophobicContact CG-CE 4.43Å; M87-N89 VanDerWaalsContact C-N 3.33Å; M87-N89 PolarHBondContact O-N 3.17Å; M87-Q90 PolarHBondContact O-N 2.88Å; M87-L91 WeakPolarHBondContact O-CG 3.38Å; M87-L91 PolarHBondContact O-N 3.45Å; M87-L109 HydrophobicContact CB-CD1 4.5Å; M87-L109 HydrophobicContact CB-CD2 4.44Å; M87-L109 HydrophobicContact CE-CD1 4.02Å
88	R	85.4	Confident	76.8	Confident	92 Å²	92	79.1 Å²	79.1	35%	0.347	44%	0.441	S	S	.	.	H	α-helix	trans	-59.1	-44.3	175.5	173.6	177.4	175.3	156.5	-0.7	112	L84 S85 A86 Q90 L91 H92 L109 Y110	L84-R88 PolarHBondContact O-N 3.3Å; L84-R88 VanDerWaalsContact O-N 3.15Å; S85-R88 PolarHBondContact O-N 2.97Å; A86-R88 PolarHBondContact O-N 3.21Å; R88-Q90 VanDerWaalsContact C-N 3.34Å; R88-L91 PolarHBondContact O-N 3.22Å; R88-H92 WeakPolarHBondContact O-CB 3.44Å; R88-H92 PolarHBondContact O-N 2.98Å; R88-L109 HydrophobicContact CB-CD2 4.29Å; R88-Y110 HydrophobicContact CG-CE1 4.49Å
89	N	84.2	Confident	75.3	Confident	102 Å²	102	83.6 Å²	83.6	55%	0.545	46%	0.457	S	S	.	.	H	α-helix	trans	-65.6	-39.9	-179.8	-68	-11.4	0	0	0	111.4	S85 A86 M87 L91 H92 T93	S85-N89 PolarHBondContact O-N 3.44Å; S85-N89 VanDerWaalsContact O-N 3.1Å; A86-N89 PolarHBondContact O-N 3.47Å; M87-N89 VanDerWaalsContact C-N 3.33Å; M87-N89 PolarHBondContact O-N 3.17Å; N89-L91 PolarHBondContact O-N 2.98Å; N89-H92 PolarHBondContact O-N 3.41Å; N89-T93 PolarHBondContact O-N 3.43Å; N89-T93 PolarHBondContact O-OG1 3.23Å
90	Q	81.1	Confident	73.7	Confident	136 Å²	136	81.9 Å²	81.9	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-61.7	-43.3	176.9	-72.4	171.7	-11.2	0	0	112.2	A86 M87 R88 T93 A94	A86-Q90 WeakPolarHBondContact O-CG 3.48Å; A86-Q90 PolarHBondContact O-N 2.86Å; M87-Q90 PolarHBondContact O-N 2.88Å; R88-Q90 VanDerWaalsContact C-N 3.34Å; Q90-T93 PolarHBondContact O-N 3.39Å; Q90-A94 PolarHBondContact O-N 3.29Å
91	L	75.3	Confident	72.1	Confident	39 Å²	39	87.6 Å²	87.6	20%	0.204	48%	0.48	C	S	.	.	H	α-helix	trans	-65.7	-43.2	176.1	-68.6	163.5	0	0	0	111.6	Y58 M87 R88 N89 T93 A94 T95 N106 L109	Y58-L91 HydrophobicContact CD1-CD2 4.42Å; Y58-L91 HydrophobicContact CD2-CD1 4.25Å; Y58-L91 HydrophobicContact CG-CD2 4.39Å; M87-L91 WeakPolarHBondContact O-CG 3.38Å; M87-L91 PolarHBondContact O-N 3.45Å; R88-L91 PolarHBondContact O-N 3.22Å; N89-L91 PolarHBondContact O-N 2.98Å; L91-T93 PolarHBondContact O-N 3.04Å; L91-A94 PolarHBondContact O-N 3.08Å; L91-A94 VanDerWaalsContact O-N 3.09Å; L91-T95 PolarHBondContact O-N 3.35Å; L91-T95 PolarHBondContact O-OG1 3.2Å; L91-N106 WeakPolarHBondContact CD1-OD1 3.49Å; L91-L109 HydrophobicContact CD1-CD2 3.59Å
92	H	69.6	Low	71	Confident	132 Å²	132	87.4 Å²	87.4	61%	0.611	48%	0.481	S	S	*	.	H	α-helix	trans	-67.4	-20.7	179.3	-144.4	55.9	0	0	0	114	R88 N89	R88-H92 WeakPolarHBondContact O-CB 3.44Å; R88-H92 PolarHBondContact O-N 2.98Å; N89-H92 PolarHBondContact O-N 3.41Å
93	T	61.5	Low	69.9	Low	116 Å²	116	81.7 Å²	81.7	71%	0.712	46%	0.455	S	S	*	.	H	α-helix	trans	-87.5	-14.7	176.2	-35.7	0	0	0	0	111.8	N89 Q90 L91	N89-T93 PolarHBondContact O-N 3.43Å; N89-T93 PolarHBondContact O-OG1 3.23Å; Q90-T93 PolarHBondContact O-N 3.39Å; L91-T93 PolarHBondContact O-N 3.04Å
94	A	57.8	Low	69.1	Low	82 Å²	82	81.2 Å²	81.2	68%	0.678	45%	0.452	S	S	*	.	H	α-helix	trans	-92.8	-24.1	-177.6	0	0	0	0	0	113.3	Q90 L91	Q90-A94 PolarHBondContact O-N 3.29Å; L91-A94 PolarHBondContact O-N 3.08Å; L91-A94 VanDerWaalsContact O-N 3.09Å
95	T	53.5	Low	68.5	Low	58 Å²	58	86.3 Å²	86.3	36%	0.356	48%	0.476	S	S	.	.			trans	-128.2	83.1	-178.2	35.9	0	0	0	0	110.7	L91 D97 D102	L91-T95 PolarHBondContact O-N 3.35Å; L91-T95 PolarHBondContact O-OG1 3.2Å; T95-D97 VanDerWaalsContact C-N 3.31Å; T95-D102 WeakPolarHBondContact CB-OD2 3.42Å; T95-D102 PolarHBondContact OG1-OD2 3.32Å
96	E	44.9	Very low	68.3	Low	174 Å²	174	84.3 Å²	84.3	81%	0.813	46%	0.461	S	S	*	.			trans	-81.1	-2.7	171.6	-84.6	-164.1	154.4	0	0	114
97	D	47.2	Very low	68.3	Low	144 Å²	144	82.5 Å²	82.5	77%	0.77	45%	0.446	S	S	*	.	S	Bend	trans	-148.2	139.3	177.2	-80.5	-51.6	0	0	0	113	T95	T95-D97 VanDerWaalsContact C-N 3.31Å
98	V	45.2	Very low	68.5	Low	116 Å²	116	86 Å²	86	70%	0.703	47%	0.465	S	S	*	.			trans	102.4	112.3	158.9	-164	0	0	0	0	118.5
99	D	55.1	Low	68.8	Low	125 Å²	125	81.7 Å²	81.7	67%	0.668	45%	0.448	S	S	*	.			trans	49.4	143.6	154.9	-67.6	-26.2	0	0	0	120.6	L101 D102	D99-L101 PolarHBondContact O-N 2.96Å; D99-D102 PolarHBondContact O-N 3.45Å
100	G	57.9	Low	69.2	Low	28 Å²	28	77.9 Å²	77.9	29%	0.289	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	9	-178.4	0	0	0	0	0	117.7	D102 D103 V104	G100-D102 VanDerWaalsContact C-N 3.31Å; G100-D103 PolarHBondContact O-N 3.34Å; G100-V104 PolarHBondContact O-N 3.01Å
101	L	58.9	Low	69.8	Low	135 Å²	135	73.2 Å²	73.2	71%	0.707	40%	0.403	S	S	*	.	H	α-helix	trans	-58.4	-39.4	164.1	-90.4	133.9	0	0	0	112.4	D99 D103 V104 E105	D99-L101 PolarHBondContact O-N 2.96Å; L101-D103 PolarHBondContact O-N 3.5Å; L101-V104 PolarHBondContact O-N 3.45Å; L101-V104 VanDerWaalsContact O-N 3.14Å; L101-E105 PolarHBondContact O-N 2.89Å
102	D	67.6	Low	70.8	Confident	48 Å²	48	73.5 Å²	73.5	26%	0.257	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-30.7	177.1	-105.2	22.2	0	0	0	112.2	T95 D99 G100 N106	T95-D102 WeakPolarHBondContact CB-OD2 3.42Å; T95-D102 PolarHBondContact OG1-OD2 3.32Å; D99-D102 PolarHBondContact O-N 3.45Å; G100-D102 VanDerWaalsContact C-N 3.31Å; D102-N106 WeakPolarHBondContact O-CB 3.5Å; D102-N106 PolarHBondContact O-N 2.97Å; D102-N106 PolarHBondContact O-ND2 2.9Å
103	D	69.9	Low	71.9	Confident	25 Å²	25	67.6 Å²	67.6	13%	0.134	38%	0.378	C	S	.	.	H	α-helix	trans	-76.7	-30.1	178.7	-72.9	-39.7	0	0	0	113.3	G100 L101 S107 Y110 K132 F136	G100-D103 PolarHBondContact O-N 3.34Å; L101-D103 PolarHBondContact O-N 3.5Å; D103-S107 WeakPolarHBondContact O-CA 3.5Å; D103-S107 PolarHBondContact O-N 3.19Å; D103-Y110 WeakPolarHBondContact OD1-CE2 3.41Å; D103-K132 WeakPolarHBondContact OD1-CE 3.43Å; D103-K132 IonicContact OD1-NZ 2.6Å; D103-K132 PolarHBondContact OD1-NZ 3.26Å; D103-K132 WeakPolarHBondContact OD2-CE 3.34Å; D103-K132 IonicContact OD2-NZ 2.87Å; D103-K132 PolarHBondContact OD2-NZ 2.84Å; D103-F136 HydrophobicContact CB-CD2 4.29Å; D103-F136 HydrophobicContact CB-CE2 4.03Å
104	V	74.9	Confident	73.6	Confident	41 Å²	41	62.1 Å²	62.1	25%	0.248	34%	0.344	C	S	.	.	H	α-helix	trans	-73.9	-44.9	173.8	178.5	0	0	0	0	110	G100 L101 S107 F136 P139 F140	G100-V104 PolarHBondContact O-N 3.01Å; L101-V104 PolarHBondContact O-N 3.45Å; L101-V104 VanDerWaalsContact O-N 3.14Å; V104-S107 VanDerWaalsContact O-CB 3.23Å; V104-S107 WeakPolarHBondContact O-CB 3.39Å; V104-S107 PolarHBondContact O-N 3.02Å; V104-S107 PolarHBondContact O-OG 3.45Å; V104-F136 HydrophobicContact CG2-CB 3.74Å; V104-F136 HydrophobicContact CG2-CD1 4.05Å; V104-F136 HydrophobicContact CG2-CG 3.92Å; V104-P139 HydrophobicContact CG1-CB 4.02Å; V104-F140 HydrophobicContact CB-CE1 4.5Å; V104-F140 HydrophobicContact CG1-CD1 4.49Å; V104-F140 HydrophobicContact CG1-CE1 4Å
105	E	80.6	Confident	75.4	Confident	109 Å²	109	59.8 Å²	59.8	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-43.9	179.5	-175.6	159.9	-156.6	0	0	111.7	Y58 L101 S107	Y58-E105 PolarHBondContact OH-O 3.46Å; L101-E105 PolarHBondContact O-N 2.89Å; E105-S107 VanDerWaalsContact C-N 3.3Å; E105-S107 PolarHBondContact O-N 2.94Å
106	N	86	Confident	77.3	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.032	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	12	-179	-63.7	-59.6	0	0	0	114.7	Y58 L91 D102 L108 L109 Y110	Y58-N106 VanDerWaalsContact CZ-OD1 3.28Å; Y58-N106 PolarHBondContact OH-OD1 3.45Å; L91-N106 WeakPolarHBondContact CD1-OD1 3.49Å; D102-N106 WeakPolarHBondContact O-CB 3.5Å; D102-N106 PolarHBondContact O-N 2.97Å; D102-N106 PolarHBondContact O-ND2 2.9Å; N106-L108 VanDerWaalsContact C-N 3.33Å; N106-L108 PolarHBondContact O-N 2.78Å; N106-L109 WeakPolarHBondContact O-CB 3.41Å; N106-L109 PolarHBondContact O-N 3.16Å; N106-L109 VanDerWaalsContact O-N 3.09Å; N106-Y110 HydrophobicContact CB-CD2 4.26Å; N106-Y110 HydrophobicContact CB-CE2 3.8Å; N106-Y110 WeakPolarHBondContact O-CD2 3.45Å; N106-Y110 PolarHBondContact O-N 2.92Å
107	S	90.1	Very high	79.6	Confident	10 Å²	10	50.6 Å²	50.6	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-55.8	-39.7	-173.6	57.1	0	0	0	0	114.7	D103 V104 E105 Y110 Y111 F140	D103-S107 WeakPolarHBondContact O-CA 3.5Å; D103-S107 PolarHBondContact O-N 3.19Å; V104-S107 VanDerWaalsContact O-CB 3.23Å; V104-S107 WeakPolarHBondContact O-CB 3.39Å; V104-S107 PolarHBondContact O-N 3.02Å; V104-S107 PolarHBondContact O-OG 3.45Å; E105-S107 VanDerWaalsContact C-N 3.3Å; E105-S107 PolarHBondContact O-N 2.94Å; S107-Y110 PolarHBondContact O-N 2.93Å; S107-Y111 WeakPolarHBondContact O-CB 3.48Å; S107-Y111 PolarHBondContact O-N 3.22Å; S107-F140 VanDerWaalsContact CB-CE1 3.45Å; S107-F140 VanDerWaalsContact CB-CZ 3.44Å
108	L	91.6	Very high	81.9	Confident	89 Å²	89	45.7 Å²	45.7	47%	0.466	24%	0.244	S	C	.	.	H	α-helix	trans	-65.7	-38.6	177.7	-70.4	170.2	0	0	0	112.8	L62 N106 Y111 N112 F144	L62-L108 HydrophobicContact CD2-CB 4.25Å; N106-L108 VanDerWaalsContact C-N 3.33Å; N106-L108 PolarHBondContact O-N 2.78Å; L108-Y111 PolarHBondContact O-N 2.98Å; L108-N112 WeakPolarHBondContact O-CB 3.24Å; L108-N112 VanDerWaalsContact O-CG 3.32Å; L108-N112 PolarHBondContact O-N 3.33Å; L108-F144 HydrophobicContact CD2-CD2 3.9Å; L108-F144 HydrophobicContact CD2-CE2 3.66Å; L108-F144 HydrophobicContact CD2-CG 4.49Å; L108-F144 HydrophobicContact CD2-CZ 4.04Å
109	L	91.9	Very high	84.1	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-48.6	176.1	172.4	62.5	0	0	0	110.1	L62 L84 M87 R88 L91 N106 Y111 N112 Q113	L62-L109 HydrophobicContact CD1-CD1 4.07Å; L62-L109 HydrophobicContact CD2-CB 4.37Å; L84-L109 HydrophobicContact CB-CD1 4.09Å; L84-L109 HydrophobicContact CD2-CD1 3.89Å; L84-L109 HydrophobicContact CG-CD1 4.42Å; M87-L109 HydrophobicContact CB-CD1 4.5Å; M87-L109 HydrophobicContact CB-CD2 4.44Å; M87-L109 HydrophobicContact CE-CD1 4.02Å; R88-L109 HydrophobicContact CB-CD2 4.29Å; L91-L109 HydrophobicContact CD1-CD2 3.59Å; N106-L109 WeakPolarHBondContact O-CB 3.41Å; N106-L109 PolarHBondContact O-N 3.16Å; N106-L109 VanDerWaalsContact O-N 3.09Å; L109-Y111 PolarHBondContact O-N 3.29Å; L109-N112 PolarHBondContact O-N 3.46Å; L109-Q113 WeakPolarHBondContact O-CG 3.41Å; L109-Q113 PolarHBondContact O-N 3.19Å
110	Y	92.3	Very high	85.8	Confident	21 Å²	21	39.2 Å²	39.2	8%	0.082	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-42.8	177.2	-66.5	-42.1	0	0	0	112.2	R88 D103 N106 S107 N112 Q113 A114 I129 L133	R88-Y110 HydrophobicContact CG-CE1 4.49Å; D103-Y110 WeakPolarHBondContact OD1-CE2 3.41Å; N106-Y110 HydrophobicContact CB-CD2 4.26Å; N106-Y110 HydrophobicContact CB-CE2 3.8Å; N106-Y110 WeakPolarHBondContact O-CD2 3.45Å; N106-Y110 PolarHBondContact O-N 2.92Å; S107-Y110 PolarHBondContact O-N 2.93Å; Y110-N112 PolarHBondContact O-N 3.02Å; Y110-Q113 WeakPolarHBondContact O-CB 3.44Å; Y110-Q113 PolarHBondContact O-N 3.47Å; Y110-A114 PolarHBondContact O-N 2.99Å; Y110-I129 WeakPolarHBondContact O-CG2 3.34Å; Y110-L133 HydrophobicContact CD2-CD2 4.35Å
111	Y	95	Very high	87.3	Confident	39 Å²	39	42.4 Å²	42.4	15%	0.153	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-44.7	177.1	-179.5	-102.9	0	0	0	111.9	S107 L108 L109 Q113 A114 I115 L133 F144 S147 V148 L151	S107-Y111 WeakPolarHBondContact O-CB 3.48Å; S107-Y111 PolarHBondContact O-N 3.22Å; L108-Y111 PolarHBondContact O-N 2.98Å; L109-Y111 PolarHBondContact O-N 3.29Å; Y111-Q113 VanDerWaalsContact C-N 3.31Å; Y111-Q113 PolarHBondContact O-N 3.41Å; Y111-A114 WeakPolarHBondContact O-CB 3.42Å; Y111-A114 PolarHBondContact O-N 3.03Å; Y111-A114 VanDerWaalsContact O-N 3.13Å; Y111-I115 HydrophobicContact CD1-CG1 4.28Å; Y111-I115 HydrophobicContact CE1-CD1 4.25Å; Y111-I115 HydrophobicContact CE1-CG1 3.86Å; Y111-I115 HydrophobicContact CE2-CD1 4.38Å; Y111-I115 HydrophobicContact CE2-CG1 4.41Å; Y111-I115 WeakPolarHBondContact O-CG1 3.4Å; Y111-I115 PolarHBondContact O-N 3.02Å; Y111-L133 HydrophobicContact CD2-CD1 4.41Å; Y111-F144 AromaticContact CD1-CE2 3.86Å; Y111-F144 HydrophobicContact CD1-CE2 3.86Å; Y111-F144 HydrophobicContact CD2-CE2 4.17Å; Y111-F144 AromaticContact CG-CE2 3.62Å; Y111-F144 HydrophobicContact CG-CE2 3.62Å; Y111-F144 HydrophobicContact CG-CZ 4.18Å; Y111-S147 WeakPolarHBondContact OH-CB 3.45Å; Y111-V148 HydrophobicContact CD2-CG2 3.78Å; Y111-V148 HydrophobicContact CE2-CG2 4.14Å; Y111-L151 HydrophobicContact CD2-CD2 4.17Å; Y111-L151 HydrophobicContact CE2-CB 4.26Å; Y111-L151 HydrophobicContact CE2-CD2 3.75Å
112	N	94.9	Very high	88.9	Confident	44 Å²	44	38.9 Å²	38.9	24%	0.235	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-38	176.1	-72.5	-15.2	0	0	0	112.1	L84 L108 L109 Y110 I115 I116	L84-N112 HydrophobicContact CD1-CB 3.67Å; L108-N112 WeakPolarHBondContact O-CB 3.24Å; L108-N112 VanDerWaalsContact O-CG 3.32Å; L108-N112 PolarHBondContact O-N 3.33Å; L109-N112 PolarHBondContact O-N 3.46Å; Y110-N112 PolarHBondContact O-N 3.02Å; N112-I115 PolarHBondContact O-N 3.08Å; N112-I116 WeakPolarHBondContact O-CG1 3.41Å; N112-I116 PolarHBondContact O-N 3.06Å; N112-I116 VanDerWaalsContact O-N 3.16Å
113	Q	93.9	Very high	90.2	Very high	9 Å²	9	39 Å²	39	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-44.6	171.8	-71.3	-179.2	-13.7	0	0	111.8	L84 L109 Y110 Y111 I115 I116 H117 I129	L84-Q113 HydrophobicContact CB-CG 4.04Å; L84-Q113 HydrophobicContact CD1-CG 4.15Å; L84-Q113 PolarHBondContact O-NE2 2.95Å; L109-Q113 WeakPolarHBondContact O-CG 3.41Å; L109-Q113 PolarHBondContact O-N 3.19Å; Y110-Q113 WeakPolarHBondContact O-CB 3.44Å; Y110-Q113 PolarHBondContact O-N 3.47Å; Y111-Q113 VanDerWaalsContact C-N 3.31Å; Y111-Q113 PolarHBondContact O-N 3.41Å; Q113-I115 VanDerWaalsContact C-N 3.32Å; Q113-I115 PolarHBondContact O-N 3.18Å; Q113-I116 PolarHBondContact O-N 3.48Å; Q113-H117 PolarHBondContact O-CD2 3.03Å; Q113-H117 PolarHBondContact O-N 2.94Å; Q113-I129 HydrophobicContact CB-CD1 4.16Å
114	A	95.8	Very high	91.3	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-39.9	178.4	0	0	0	0	0	112.2	Y110 Y111 H117 Y118 I129 L151	Y110-A114 PolarHBondContact O-N 2.99Å; Y111-A114 WeakPolarHBondContact O-CB 3.42Å; Y111-A114 PolarHBondContact O-N 3.03Å; Y111-A114 VanDerWaalsContact O-N 3.13Å; A114-H117 PolarHBondContact O-N 3.4Å; A114-Y118 WeakPolarHBondContact O-CB 3.36Å; A114-Y118 PolarHBondContact O-N 3.44Å; A114-I129 HydrophobicContact CB-CB 4.11Å; A114-I129 HydrophobicContact CB-CG2 3.93Å; A114-L151 HydrophobicContact CB-CD2 3.86Å
115	I	95.3	Very high	92.2	Very high	34 Å²	34	44.3 Å²	44.3	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-43.5	175	-67.6	-70.2	0	0	0	111.6	Y111 N112 Q113 Y118 H119 L151 M338	Y111-I115 HydrophobicContact CD1-CG1 4.28Å; Y111-I115 HydrophobicContact CE1-CD1 4.25Å; Y111-I115 HydrophobicContact CE1-CG1 3.86Å; Y111-I115 HydrophobicContact CE2-CD1 4.38Å; Y111-I115 HydrophobicContact CE2-CG1 4.41Å; Y111-I115 WeakPolarHBondContact O-CG1 3.4Å; Y111-I115 PolarHBondContact O-N 3.02Å; N112-I115 PolarHBondContact O-N 3.08Å; Q113-I115 VanDerWaalsContact C-N 3.32Å; Q113-I115 PolarHBondContact O-N 3.18Å; I115-Y118 WeakPolarHBondContact O-CB 3.46Å; I115-Y118 PolarHBondContact O-N 2.98Å; I115-H119 PolarHBondContact O-CD2 3.35Å; I115-H119 VanDerWaalsContact O-CD2 3.31Å; I115-H119 PolarHBondContact O-N 3.17Å; I115-L151 HydrophobicContact CD1-CD1 3.86Å; I115-L151 HydrophobicContact CD1-CD2 3.76Å; I115-L151 HydrophobicContact CD1-CG 4.31Å; I115-L151 HydrophobicContact CG1-CD2 4.18Å; I115-M338 HydrophobicContact CG2-CE 3.77Å; I115-M338 HydrophobicContact CG2-SD 4.41Å
116	I	93.7	Very high	92.9	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-47.4	176	-67.1	173.5	0	0	0	110.3	T77 L80 K81 L84 N112 Q113 Y118 H119 M120 M338	T77-I116 HydrophobicContact CG2-CG2 4.43Å; L80-I116 HydrophobicContact CB-CD1 4.46Å; L80-I116 HydrophobicContact CD2-CD1 3.92Å; L80-I116 HydrophobicContact CD2-CG1 4.49Å; L80-I116 HydrophobicContact CG-CD1 3.87Å; K81-I116 HydrophobicContact CB-CD1 4.34Å; K81-I116 HydrophobicContact CB-CG2 4.09Å; K81-I116 HydrophobicContact CD-CG2 4.12Å; K81-I116 HydrophobicContact CG-CG2 4.17Å; L84-I116 HydrophobicContact CD1-CD1 3.61Å; L84-I116 HydrophobicContact CG-CD1 4.4Å; N112-I116 WeakPolarHBondContact O-CG1 3.41Å; N112-I116 PolarHBondContact O-N 3.06Å; N112-I116 VanDerWaalsContact O-N 3.16Å; Q113-I116 PolarHBondContact O-N 3.48Å; I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 PolarHBondContact O-N 3.44Å; I116-H119 PolarHBondContact O-N 2.9Å; I116-M120 HydrophobicContact CG2-CG 4.28Å; I116-M120 HydrophobicContact CG2-SD 3.85Å; I116-M120 WeakPolarHBondContact O-CB 3.49Å; I116-M120 VanDerWaalsContact O-CG 3.29Å; I116-M120 WeakPolarHBondContact O-CG 3.48Å; I116-M120 PolarHBondContact O-N 2.73Å; I116-M338 HydrophobicContact CG1-SD 4.32Å
117	H	94.3	Very high	93.4	Very high	35 Å²	35	39.5 Å²	39.5	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-41.2	177.2	-75.3	-61.9	0	0	0	112	Q113 A114 M120 R121 Q122 A126	Q113-H117 PolarHBondContact O-CD2 3.03Å; Q113-H117 PolarHBondContact O-N 2.94Å; A114-H117 PolarHBondContact O-N 3.4Å; H117-M120 CarbonylContact O-C 3.29Å; H117-M120 PolarHBondContact O-N 3.5Å; H117-R121 PolarHBondContact O-N 3.34Å; H117-Q122 HydrophobicContact CB-CB 4.08Å; H117-Q122 PolarHBondContact CE1-OE1 3.48Å; H117-Q122 PolarHBondContact ND1-OE1 3.29Å; H117-Q122 PolarHBondContact O-N 3.45Å; H117-A126 HydrophobicContact CB-CB 3.83Å
118	Y	94.8	Very high	93.6	Very high	41 Å²	41	42.8 Å²	42.8	16%	0.161	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-51.6	174.1	170.5	-94.2	0	0	0	112.2	A114 I115 I116 M120 R121 Y123 L151 D154 L155 L158 L342	A114-Y118 WeakPolarHBondContact O-CB 3.36Å; A114-Y118 PolarHBondContact O-N 3.44Å; I115-Y118 WeakPolarHBondContact O-CB 3.46Å; I115-Y118 PolarHBondContact O-N 2.98Å; I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 PolarHBondContact O-N 3.44Å; Y118-M120 VanDerWaalsContact C-N 3.28Å; Y118-M120 PolarHBondContact O-N 3.3Å; Y118-R121 PolarHBondContact O-N 3.16Å; Y118-R121 VanDerWaalsContact O-N 3.13Å; Y118-Y123 HydrophobicContact CD2-CE1 4.38Å; Y118-L151 HydrophobicContact CD2-CD1 4.01Å; Y118-L151 HydrophobicContact CG-CD1 3.99Å; Y118-D154 HydrophobicContact CE2-CB 4.14Å; Y118-L155 HydrophobicContact CD2-CD2 3.77Å; Y118-L155 HydrophobicContact CD2-CG 4.18Å; Y118-L158 HydrophobicContact CD2-CD1 4.28Å; Y118-L158 HydrophobicContact CE2-CD1 3.5Å; Y118-L342 HydrophobicContact CD1-CD1 4.39Å; Y118-L342 HydrophobicContact CE1-CD1 3.83Å
119	H	92	Very high	93.7	Very high	31 Å²	31	39.2 Å²	39.2	14%	0.144	20%	0.196	C	C	.	.	H	α-helix	trans	-69.8	-24.5	179.7	-77.3	-73.3	0	0	0	113.4	I115 I116 R121 M338 L341 L342	I115-H119 PolarHBondContact O-CD2 3.35Å; I115-H119 VanDerWaalsContact O-CD2 3.31Å; I115-H119 PolarHBondContact O-N 3.17Å; I116-H119 PolarHBondContact O-N 2.9Å; H119-R121 VanDerWaalsContact C-N 3.27Å; H119-R121 PolarHBondContact O-N 3.04Å; H119-M338 HydrophobicContact CB-CG 3.8Å; H119-M338 HydrophobicContact CB-SD 4.5Å; H119-M338 PolarHBondContact ND1-O 3.26Å; H119-L341 HydrophobicContact CB-CD1 4.33Å; H119-L342 WeakPolarHBondContact O-CD2 3.36Å
120	M	89.8	Confident	93.7	Very high	73 Å²	73	39.2 Å²	39.2	36%	0.36	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	5.1	173	-68	-171.3	75.2	0	0	114.1	K81 I116 H117 Y118 Q122	K81-M120 HydrophobicContact CD-CE 4.34Å; K81-M120 HydrophobicContact CD-SD 3.6Å; K81-M120 PolarHBondContact NZ-SD 2.89Å; I116-M120 HydrophobicContact CG2-CG 4.28Å; I116-M120 HydrophobicContact CG2-SD 3.85Å; I116-M120 WeakPolarHBondContact O-CB 3.49Å; I116-M120 VanDerWaalsContact O-CG 3.29Å; I116-M120 WeakPolarHBondContact O-CG 3.48Å; I116-M120 PolarHBondContact O-N 2.73Å; H117-M120 CarbonylContact O-C 3.29Å; H117-M120 PolarHBondContact O-N 3.5Å; Y118-M120 VanDerWaalsContact C-N 3.28Å; Y118-M120 PolarHBondContact O-N 3.3Å; M120-Q122 HydrophobicContact CB-CG 4.21Å; M120-Q122 PolarHBondContact O-N 3.4Å
121	R	90.1	Very high	93.8	Very high	96 Å²	96	41.2 Å²	41.2	36%	0.362	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	20.2	-175.8	-52.5	-177.6	178.4	-120.6	11.8	114.4	H117 Y118 H119 Y123 L342 N344 E348	H117-R121 PolarHBondContact O-N 3.34Å; Y118-R121 PolarHBondContact O-N 3.16Å; Y118-R121 VanDerWaalsContact O-N 3.13Å; H119-R121 VanDerWaalsContact C-N 3.27Å; H119-R121 PolarHBondContact O-N 3.04Å; R121-Y123 VanDerWaalsContact C-N 3.28Å; R121-Y123 HydrophobicContact CB-CE1 4.49Å; R121-Y123 HydrophobicContact CB-CE2 4.15Å; R121-Y123 PolarHBondContact O-N 3Å; R121-L342 HydrophobicContact CG-CD2 3.46Å; R121-L342 VanDerWaalsContact CG-CD2 3.46Å; R121-N344 PolarHBondContact NH2-O 3.02Å; R121-N344 VanDerWaalsContact NH2-O 3.17Å; R121-E348 IonicContact NH1-OE1 3.12Å; R121-E348 PolarHBondContact NH1-OE1 2.83Å; R121-E348 IonicContact NH2-OE1 2.67Å
122	Q	92.7	Very high	93.6	Very high	61 Å²	61	43.1 Å²	43.1	29%	0.285	22%	0.215	S	C	.	.			trans	-88.5	65.5	174.2	-63.6	-173.2	-50.4	0	0	109.3	K81 H117 M120 S124 E125 A126	K81-Q122 VanDerWaalsContact NZ-OE1 3.15Å; H117-Q122 HydrophobicContact CB-CB 4.08Å; H117-Q122 PolarHBondContact CE1-OE1 3.48Å; H117-Q122 PolarHBondContact ND1-OE1 3.29Å; H117-Q122 PolarHBondContact O-N 3.45Å; M120-Q122 HydrophobicContact CB-CG 4.21Å; M120-Q122 PolarHBondContact O-N 3.4Å; Q122-S124 PolarHBondContact O-N 3.47Å; Q122-E125 WeakPolarHBondContact CB-OE2 3.5Å; Q122-A126 PolarHBondContact O-N 3.22Å; Q122-A126 VanDerWaalsContact O-N 3.15Å
123	Y	93.9	Very high	93.4	Very high	49 Å²	49	41.2 Å²	41.2	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-69.3	-32.4	-168.5	-56.2	-50.9	0	0	0	113.3	Y118 R121 A126 I127 L155 L158	Y118-Y123 HydrophobicContact CD2-CE1 4.38Å; R121-Y123 VanDerWaalsContact C-N 3.28Å; R121-Y123 HydrophobicContact CB-CE1 4.49Å; R121-Y123 HydrophobicContact CB-CE2 4.15Å; R121-Y123 PolarHBondContact O-N 3Å; Y123-A126 PolarHBondContact O-N 3Å; Y123-I127 WeakPolarHBondContact O-CB 3.47Å; Y123-I127 WeakPolarHBondContact O-CG1 3.48Å; Y123-I127 PolarHBondContact O-N 2.95Å; Y123-L155 HydrophobicContact CD1-CD2 3.81Å; Y123-L155 HydrophobicContact CG-CD2 4.41Å; Y123-L158 HydrophobicContact CD1-CD1 4.27Å; Y123-L158 HydrophobicContact CE1-CD1 3.78Å
124	S	93.4	Very high	93.3	Very high	89 Å²	89	44 Å²	44	62%	0.622	22%	0.215	S	C	*	.	H	α-helix	trans	-65.4	-44.7	179.9	-57.9	0	0	0	0	111.5	Q122 I127 S128	Q122-S124 PolarHBondContact O-N 3.47Å; S124-I127 PolarHBondContact O-N 2.62Å; S124-S128 PolarHBondContact O-N 2.99Å
125	E	93.8	Very high	92.9	Very high	89 Å²	89	50.8 Å²	50.8	42%	0.416	25%	0.248	S	C	.	.	H	α-helix	trans	-66.4	-42.8	177.1	-63.7	82.7	170.1	0	0	111	Q122 I127 S128 I129	Q122-E125 WeakPolarHBondContact CB-OE2 3.5Å; E125-I127 VanDerWaalsContact C-N 3.34Å; E125-I127 PolarHBondContact O-N 2.96Å; E125-S128 PolarHBondContact O-N 3.35Å; E125-I129 WeakPolarHBondContact O-CG1 3.33Å; E125-I129 PolarHBondContact O-N 2.97Å; E125-I129 VanDerWaalsContact O-N 3.08Å
126	A	96.3	Very high	92.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-39.7	175.4	0	0	0	0	0	112.4	H117 Q122 Y123 G130 L155	H117-A126 HydrophobicContact CB-CB 3.83Å; Q122-A126 PolarHBondContact O-N 3.22Å; Q122-A126 VanDerWaalsContact O-N 3.15Å; Y123-A126 PolarHBondContact O-N 3Å; A126-G130 PolarHBondContact O-N 3.24Å; A126-L155 HydrophobicContact CB-CD1 3.77Å; A126-L155 HydrophobicContact CB-CD2 3.72Å; A126-L155 HydrophobicContact CB-CG 4.41Å
127	I	95.8	Very high	92	Very high	15 Å²	15	52.9 Å²	52.9	8%	0.077	26%	0.256	C	S	.	.	H	α-helix	trans	-64.8	-46.7	175	-73.2	167.1	0	0	0	110.4	Y123 S124 E125 I129 G130 E131 L155 Y156 T159	Y123-I127 WeakPolarHBondContact O-CB 3.47Å; Y123-I127 WeakPolarHBondContact O-CG1 3.48Å; Y123-I127 PolarHBondContact O-N 2.95Å; S124-I127 PolarHBondContact O-N 2.62Å; E125-I127 VanDerWaalsContact C-N 3.34Å; E125-I127 PolarHBondContact O-N 2.96Å; I127-I129 VanDerWaalsContact C-N 3.3Å; I127-I129 PolarHBondContact O-N 3.29Å; I127-G130 PolarHBondContact O-N 3.01Å; I127-G130 VanDerWaalsContact O-N 3.16Å; I127-E131 HydrophobicContact CG2-CG 4.04Å; I127-E131 WeakPolarHBondContact O-CB 3.37Å; I127-E131 PolarHBondContact O-N 2.71Å; I127-L155 HydrophobicContact CD1-CB 4.15Å; I127-L155 HydrophobicContact CG1-CB 3.61Å; I127-L155 HydrophobicContact CG1-CD1 4.05Å; I127-L155 HydrophobicContact CG1-CD2 4.28Å; I127-L155 HydrophobicContact CG1-CG 4.2Å; I127-Y156 HydrophobicContact CG2-CE1 4.25Å; I127-T159 HydrophobicContact CD1-CG2 3.71Å
128	S	94.6	Very high	91.5	Very high	78 Å²	78	60.3 Å²	60.3	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-57.2	-44.6	179.8	175.7	0	0	0	0	111.9	S124 E125 K132	S124-S128 PolarHBondContact O-N 2.99Å; E125-S128 PolarHBondContact O-N 3.35Å; S128-K132 PolarHBondContact O-N 3.15Å
129	I	92.6	Very high	91.1	Very high	15 Å²	15	62.6 Å²	62.6	8%	0.077	31%	0.311	C	S	.	.	H	α-helix	trans	-67.9	-44.4	176.3	-61.9	168.1	0	0	0	111	Y110 Q113 A114 E125 I127 K132 L133	Y110-I129 WeakPolarHBondContact O-CG2 3.34Å; Q113-I129 HydrophobicContact CB-CD1 4.16Å; A114-I129 HydrophobicContact CB-CB 4.11Å; A114-I129 HydrophobicContact CB-CG2 3.93Å; E125-I129 WeakPolarHBondContact O-CG1 3.33Å; E125-I129 PolarHBondContact O-N 2.97Å; E125-I129 VanDerWaalsContact O-N 3.08Å; I127-I129 VanDerWaalsContact C-N 3.3Å; I127-I129 PolarHBondContact O-N 3.29Å; I129-K132 WeakPolarHBondContact O-CB 3.38Å; I129-K132 PolarHBondContact O-N 3.13Å; I129-L133 HydrophobicContact CG2-CD1 4.35Å; I129-L133 WeakPolarHBondContact O-CG 3.48Å; I129-L133 PolarHBondContact O-N 3.42Å
130	G	93.3	Very high	90.8	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-44.8	179.5	0	0	0	0	0	113.1	A126 I127 K132 L133 Y134 L152	A126-G130 PolarHBondContact O-N 3.24Å; I127-G130 PolarHBondContact O-N 3.01Å; I127-G130 VanDerWaalsContact O-N 3.16Å; G130-K132 VanDerWaalsContact C-N 3.27Å; G130-K132 PolarHBondContact O-N 3Å; G130-L133 PolarHBondContact O-N 2.8Å; G130-Y134 WeakPolarHBondContact O-CB 3.16Å; G130-Y134 PolarHBondContact O-N 3.08Å; G130-L152 WeakPolarHBondContact O-CD1 3.43Å
131	E	94	Very high	90.7	Very high	62 Å²	62	65.2 Å²	65.2	29%	0.29	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-35.7	176.8	-78.6	-177.9	161	0	0	110.8	I127 Y134 Q135 L152 Y156 K164	I127-E131 HydrophobicContact CG2-CG 4.04Å; I127-E131 WeakPolarHBondContact O-CB 3.37Å; I127-E131 PolarHBondContact O-N 2.71Å; E131-Y134 PolarHBondContact O-N 3.01Å; E131-Q135 PolarHBondContact O-N 3.45Å; E131-L152 HydrophobicContact CG-CD2 4.3Å; E131-Y156 VanDerWaalsContact CG-OH 3.24Å; E131-Y156 WeakPolarHBondContact CG-OH 3.39Å; E131-Y156 PolarHBondContact OE1-OH 3.23Å; E131-K164 IonicContact OE1-NZ 3.95Å; E131-K164 PolarHBondContact OE1-NZ 2.9Å
132	K	91	Very high	90.4	Very high	79 Å²	79	63.2 Å²	63.2	34%	0.343	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-49.7	172.6	-164.2	-177.3	-164.2	-161.1	0	111.8	D103 S128 I129 G130 Y134 Q135	D103-K132 WeakPolarHBondContact OD1-CE 3.43Å; D103-K132 IonicContact OD1-NZ 2.6Å; D103-K132 PolarHBondContact OD1-NZ 3.26Å; D103-K132 WeakPolarHBondContact OD2-CE 3.34Å; D103-K132 IonicContact OD2-NZ 2.87Å; D103-K132 PolarHBondContact OD2-NZ 2.84Å; S128-K132 PolarHBondContact O-N 3.15Å; I129-K132 WeakPolarHBondContact O-CB 3.38Å; I129-K132 PolarHBondContact O-N 3.13Å; G130-K132 VanDerWaalsContact C-N 3.27Å; G130-K132 PolarHBondContact O-N 3Å; K132-Y134 VanDerWaalsContact C-N 3.28Å; K132-Y134 PolarHBondContact O-N 3.41Å; K132-Q135 PolarHBondContact O-N 3.15Å
133	L	91.1	Very high	90	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-34.9	177.5	-67.3	176.2	0	0	0	112.4	Y110 Y111 I129 G130 Q135 F136 F140 V148	Y110-L133 HydrophobicContact CD2-CD2 4.35Å; Y111-L133 HydrophobicContact CD2-CD1 4.41Å; I129-L133 HydrophobicContact CG2-CD1 4.35Å; I129-L133 WeakPolarHBondContact O-CG 3.48Å; I129-L133 PolarHBondContact O-N 3.42Å; G130-L133 PolarHBondContact O-N 2.8Å; L133-Q135 VanDerWaalsContact C-N 3.26Å; L133-Q135 PolarHBondContact O-N 2.88Å; L133-F136 PolarHBondContact O-N 3.44Å; L133-F140 HydrophobicContact CB-CE2 4.4Å; L133-F140 HydrophobicContact CD2-CZ 4.26Å; L133-F140 WeakPolarHBondContact O-CE2 3.31Å; L133-V148 HydrophobicContact CB-CG1 3.89Å; L133-V148 HydrophobicContact CB-CG2 4.48Å; L133-V148 HydrophobicContact CD1-CG2 4.32Å
134	Y	90.4	Very high	89.8	Confident	67 Å²	67	64.4 Å²	64.4	26%	0.263	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-28.6	179.2	177.4	-106.8	0	0	0	113.5	G130 E131 K132 F136 L137 L152 L168	G130-Y134 WeakPolarHBondContact O-CB 3.16Å; G130-Y134 PolarHBondContact O-N 3.08Å; E131-Y134 PolarHBondContact O-N 3.01Å; K132-Y134 VanDerWaalsContact C-N 3.28Å; K132-Y134 PolarHBondContact O-N 3.41Å; Y134-F136 PolarHBondContact O-N 3.22Å; Y134-L137 HydrophobicContact CD2-CD1 4.07Å; Y134-L137 PolarHBondContact O-N 2.86Å; Y134-L152 HydrophobicContact CD2-CD1 4.49Å; Y134-L152 HydrophobicContact CG-CD1 4.21Å; Y134-L168 HydrophobicContact CD2-CD1 3.69Å; Y134-L168 HydrophobicContact CE2-CD1 3.21Å
135	Q	89	Confident	89.7	Confident	144 Å²	144	60.3 Å²	60.3	67%	0.673	29%	0.294	S	S	*	.	H	α-helix	trans	-63.5	-27.1	176.7	-67.9	173.9	17.1	0	0	112.6	E131 K132 L133	E131-Q135 PolarHBondContact O-N 3.45Å; K132-Q135 PolarHBondContact O-N 3.15Å; L133-Q135 VanDerWaalsContact C-N 3.26Å; L133-Q135 PolarHBondContact O-N 2.88Å
136	F	85.4	Confident	89.5	Confident	57 Å²	57	56.6 Å²	56.6	25%	0.25	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	41.3	-177.6	-53.4	-78.2	0	0	0	111.9	D103 V104 L133 Y134 P139 F140	D103-F136 HydrophobicContact CB-CD2 4.29Å; D103-F136 HydrophobicContact CB-CE2 4.03Å; V104-F136 HydrophobicContact CG2-CB 3.74Å; V104-F136 HydrophobicContact CG2-CD1 4.05Å; V104-F136 HydrophobicContact CG2-CG 3.92Å; L133-F136 PolarHBondContact O-N 3.44Å; Y134-F136 PolarHBondContact O-N 3.22Å; F136-P139 WeakPolarHBondContact O-CD 3.32Å; F136-F140 HydrophobicContact CB-CZ 4.32Å; F136-F140 WeakPolarHBondContact O-CD2 3.38Å; F136-F140 VanDerWaalsContact O-CE2 3.28Å; F136-F140 WeakPolarHBondContact O-CE2 3.4Å; F136-F140 WeakPolarHBondContact O-CZ 3.43Å
137	L	84.2	Confident	89.3	Confident	25 Å²	25	58.9 Å²	58.9	13%	0.131	29%	0.292	C	S	.	.			trans	-71.4	-30.2	-175.1	-153.6	93.6	0	0	0	113.8	Y134 F140 A145 V148 I175	Y134-L137 HydrophobicContact CD2-CD1 4.07Å; Y134-L137 PolarHBondContact O-N 2.86Å; L137-F140 PolarHBondContact O-N 3.46Å; L137-A145 HydrophobicContact CD1-CB 4.1Å; L137-A145 HydrophobicContact CD2-CB 4.12Å; L137-A145 HydrophobicContact CG-CB 3.81Å; L137-V148 HydrophobicContact CD1-CG1 4.44Å; L137-I175 HydrophobicContact CD2-CD1 3.42Å; L137-I175 VanDerWaalsContact CD2-CD1 3.42Å
138	E	84.1	Confident	89.2	Confident	191 Å²	191	58.2 Å²	58.2	89%	0.893	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-40.2	-173	-177.9	175.8	-161.9	0	0	114.2	F140	E138-F140 PolarHBondContact O-N 3.3Å
139	P	84.9	Confident	89.1	Confident	88 Å²	88	54.5 Å²	54.5	57%	0.571	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.9	174.4	-22.9	34.7	0	0	0	115.4	V104 F136	V104-P139 HydrophobicContact CG1-CB 4.02Å; F136-P139 WeakPolarHBondContact O-CD 3.32Å
140	F	86.6	Confident	89.2	Confident	23 Å²	23	54.9 Å²	54.9	10%	0.101	26%	0.264	C	S	.	.	S	Bend	trans	-80.6	150.2	-173.7	-66.4	-22.2	0	0	0	113.4	V104 S107 L133 F136 L137 E138 F144 A145	V104-F140 HydrophobicContact CB-CE1 4.5Å; V104-F140 HydrophobicContact CG1-CD1 4.49Å; V104-F140 HydrophobicContact CG1-CE1 4Å; S107-F140 VanDerWaalsContact CB-CE1 3.45Å; S107-F140 VanDerWaalsContact CB-CZ 3.44Å; L133-F140 HydrophobicContact CB-CE2 4.4Å; L133-F140 HydrophobicContact CD2-CZ 4.26Å; L133-F140 WeakPolarHBondContact O-CE2 3.31Å; F136-F140 HydrophobicContact CB-CZ 4.32Å; F136-F140 WeakPolarHBondContact O-CD2 3.38Å; F136-F140 VanDerWaalsContact O-CE2 3.28Å; F136-F140 WeakPolarHBondContact O-CE2 3.4Å; F136-F140 WeakPolarHBondContact O-CZ 3.43Å; L137-F140 PolarHBondContact O-N 3.46Å; E138-F140 PolarHBondContact O-N 3.3Å; F140-F144 HydrophobicContact CB-CD1 3.91Å; F140-F144 HydrophobicContact CD1-CD1 4.09Å; F140-F144 HydrophobicContact CD1-CE1 4.08Å; F140-F144 AromaticContact CD2-CD1 3.87Å; F140-F144 HydrophobicContact CD2-CD1 3.87Å; F140-F144 AromaticContact CD2-CE1 3.84Å; F140-F144 HydrophobicContact CD2-CE1 3.84Å; F140-F144 HydrophobicContact CE1-CE1 4.16Å; F140-F144 HydrophobicContact CE2-CD1 4.43Å; F140-F144 AromaticContact CE2-CE1 3.93Å; F140-F144 HydrophobicContact CE2-CE1 3.93Å; F140-F144 AromaticContact CG-CD1 3.7Å; F140-F144 HydrophobicContact CG-CD1 3.7Å; F140-F144 AromaticContact CG-CE1 3.93Å; F140-F144 HydrophobicContact CG-CE1 3.93Å; F140-F144 HydrophobicContact CZ-CE1 4.11Å; F140-A145 HydrophobicContact CB-CB 4.22Å
141	E	87.1	Confident	89.3	Confident	136 Å²	136	55.4 Å²	55.4	64%	0.636	27%	0.266	S	S	*	.			trans	-58.4	140.2	167.7	-167.1	-162.9	152.8	0	0	110.2	K143 F144 A145	E141-K143 VanDerWaalsContact C-N 3.28Å; E141-K143 PolarHBondContact O-N 3.31Å; E141-K143 VanDerWaalsContact O-N 3.16Å; E141-F144 HydrophobicContact CB-CB 4.47Å; E141-F144 WeakPolarHBondContact O-CA 3.34Å; E141-F144 WeakPolarHBondContact O-CB 3.37Å; E141-F144 PolarHBondContact O-N 3.17Å; E141-A145 PolarHBondContact O-N 3.47Å
142	E	84.2	Confident	89.4	Confident	55 Å²	55	52.5 Å²	52.5	26%	0.257	25%	0.253	S	S	.	.	H	α-helix	trans	-52.9	-42.4	-174.1	-168.5	-179	168.9	0	0	113.1	F144 Q146 I175	E142-F144 VanDerWaalsContact C-N 3.34Å; E142-F144 PolarHBondContact O-N 3.46Å; E142-Q146 WeakPolarHBondContact O-CB 3.31Å; E142-Q146 VanDerWaalsContact O-CG 3.26Å; E142-Q146 WeakPolarHBondContact O-CG 3.41Å; E142-Q146 PolarHBondContact O-N 3.47Å; E142-Q146 PolarHBondContact OE1-NE2 3.06Å; E142-I175 HydrophobicContact CG-CG2 3.84Å
143	K	85.3	Confident	89.7	Confident	108 Å²	108	48.7 Å²	48.7	47%	0.47	24%	0.237	S	C	.	.	H	α-helix	trans	-64	-40.1	178.4	-63.5	-169.4	175.6	175.8	0	112	E141 S147 M202	E141-K143 VanDerWaalsContact C-N 3.28Å; E141-K143 PolarHBondContact O-N 3.31Å; E141-K143 VanDerWaalsContact O-N 3.16Å; K143-S147 WeakPolarHBondContact O-CB 3.41Å; K143-S147 PolarHBondContact O-N 2.9Å; K143-S147 VanDerWaalsContact O-N 3.08Å; K143-S147 PolarHBondContact O-OG 2.98Å; K143-M202 HydrophobicContact CB-CE 4.25Å; K143-M202 HydrophobicContact CD-CE 4.19Å; K143-M202 HydrophobicContact CD-SD 4.14Å; K143-M202 HydrophobicContact CG-CE 3.69Å; K143-M202 HydrophobicContact CG-SD 4.14Å
144	F	89.9	Confident	89.9	Confident	26 Å²	26	49.6 Å²	49.6	11%	0.114	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-45.4	179.8	-178.6	-120.1	0	0	0	111	L108 Y111 F140 E141 E142 Q146 S147 V148	L108-F144 HydrophobicContact CD2-CD2 3.9Å; L108-F144 HydrophobicContact CD2-CE2 3.66Å; L108-F144 HydrophobicContact CD2-CG 4.49Å; L108-F144 HydrophobicContact CD2-CZ 4.04Å; Y111-F144 AromaticContact CD1-CE2 3.86Å; Y111-F144 HydrophobicContact CD1-CE2 3.86Å; Y111-F144 HydrophobicContact CD2-CE2 4.17Å; Y111-F144 AromaticContact CG-CE2 3.62Å; Y111-F144 HydrophobicContact CG-CE2 3.62Å; Y111-F144 HydrophobicContact CG-CZ 4.18Å; F140-F144 HydrophobicContact CB-CD1 3.91Å; F140-F144 HydrophobicContact CD1-CD1 4.09Å; F140-F144 HydrophobicContact CD1-CE1 4.08Å; F140-F144 AromaticContact CD2-CD1 3.87Å; F140-F144 HydrophobicContact CD2-CD1 3.87Å; F140-F144 AromaticContact CD2-CE1 3.84Å; F140-F144 HydrophobicContact CD2-CE1 3.84Å; F140-F144 HydrophobicContact CE1-CE1 4.16Å; F140-F144 HydrophobicContact CE2-CD1 4.43Å; F140-F144 AromaticContact CE2-CE1 3.93Å; F140-F144 HydrophobicContact CE2-CE1 3.93Å; F140-F144 AromaticContact CG-CD1 3.7Å; F140-F144 HydrophobicContact CG-CD1 3.7Å; F140-F144 AromaticContact CG-CE1 3.93Å; F140-F144 HydrophobicContact CG-CE1 3.93Å; F140-F144 HydrophobicContact CZ-CE1 4.11Å; E141-F144 HydrophobicContact CB-CB 4.47Å; E141-F144 WeakPolarHBondContact O-CA 3.34Å; E141-F144 WeakPolarHBondContact O-CB 3.37Å; E141-F144 PolarHBondContact O-N 3.17Å; E142-F144 VanDerWaalsContact C-N 3.34Å; E142-F144 PolarHBondContact O-N 3.46Å; F144-Q146 VanDerWaalsContact C-N 3.31Å; F144-Q146 PolarHBondContact O-N 3.15Å; F144-S147 WeakPolarHBondContact O-CA 3.42Å; F144-S147 WeakPolarHBondContact O-CB 3.42Å; F144-S147 PolarHBondContact O-N 2.87Å; F144-V148 HydrophobicContact CE1-CG2 4.21Å; F144-V148 HydrophobicContact CE2-CG2 4.12Å; F144-V148 HydrophobicContact CZ-CG2 3.96Å; F144-V148 WeakPolarHBondContact O-CG2 3.33Å; F144-V148 PolarHBondContact O-N 3.13Å
145	A	89.9	Confident	90.2	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-55	-44.9	172.9	0	0	0	0	0	112.2	L137 F140 E141 S147 V148 C149	L137-A145 HydrophobicContact CD1-CB 4.1Å; L137-A145 HydrophobicContact CD2-CB 4.12Å; L137-A145 HydrophobicContact CG-CB 3.81Å; F140-A145 HydrophobicContact CB-CB 4.22Å; E141-A145 PolarHBondContact O-N 3.47Å; A145-S147 VanDerWaalsContact C-N 3.32Å; A145-S147 PolarHBondContact O-N 3.35Å; A145-V148 PolarHBondContact O-N 3.21Å; A145-C149 WeakPolarHBondContact O-CB 3.2Å; A145-C149 PolarHBondContact O-N 3.16Å; A145-C149 PolarHBondContact O-SG 3.38Å
146	Q	89.3	Confident	90.5	Very high	11 Å²	11	40.3 Å²	40.3	5%	0.051	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-40	175.1	-74.7	178	10.6	0	0	112	E142 F144 C149 F150 L172	E142-Q146 WeakPolarHBondContact O-CB 3.31Å; E142-Q146 VanDerWaalsContact O-CG 3.26Å; E142-Q146 WeakPolarHBondContact O-CG 3.41Å; E142-Q146 PolarHBondContact O-N 3.47Å; E142-Q146 PolarHBondContact OE1-NE2 3.06Å; F144-Q146 VanDerWaalsContact C-N 3.31Å; F144-Q146 PolarHBondContact O-N 3.15Å; Q146-C149 PolarHBondContact O-N 2.98Å; Q146-F150 HydrophobicContact CB-CE2 4.46Å; Q146-F150 WeakPolarHBondContact O-CD2 3.42Å; Q146-F150 PolarHBondContact O-N 2.67Å; Q146-L172 HydrophobicContact CB-CD2 4.21Å; Q146-L172 HydrophobicContact CG-CD2 3.98Å
147	S	91.8	Very high	90.9	Very high	47 Å²	47	37.7 Å²	37.7	33%	0.329	19%	0.189	S	C	.	.	H	α-helix	trans	-65.5	-45.4	-179.9	-58.6	0	0	0	0	111.8	Y111 K143 F144 A145 C149 F150 L151	Y111-S147 WeakPolarHBondContact OH-CB 3.45Å; K143-S147 WeakPolarHBondContact O-CB 3.41Å; K143-S147 PolarHBondContact O-N 2.9Å; K143-S147 VanDerWaalsContact O-N 3.08Å; K143-S147 PolarHBondContact O-OG 2.98Å; F144-S147 WeakPolarHBondContact O-CA 3.42Å; F144-S147 WeakPolarHBondContact O-CB 3.42Å; F144-S147 PolarHBondContact O-N 2.87Å; A145-S147 VanDerWaalsContact C-N 3.32Å; A145-S147 PolarHBondContact O-N 3.35Å; S147-C149 VanDerWaalsContact C-N 3.34Å; S147-C149 PolarHBondContact O-N 2.83Å; S147-F150 PolarHBondContact O-N 3.41Å; S147-L151 WeakPolarHBondContact O-CB 3.33Å; S147-L151 PolarHBondContact O-N 3.43Å
148	V	93.6	Very high	91.2	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-48	172	174.3	0	0	0	0	110.6	Y111 L133 L137 F144 A145 L151 L152	Y111-V148 HydrophobicContact CD2-CG2 3.78Å; Y111-V148 HydrophobicContact CE2-CG2 4.14Å; L133-V148 HydrophobicContact CB-CG1 3.89Å; L133-V148 HydrophobicContact CB-CG2 4.48Å; L133-V148 HydrophobicContact CD1-CG2 4.32Å; L137-V148 HydrophobicContact CD1-CG1 4.44Å; F144-V148 HydrophobicContact CE1-CG2 4.21Å; F144-V148 HydrophobicContact CE2-CG2 4.12Å; F144-V148 HydrophobicContact CZ-CG2 3.96Å; F144-V148 WeakPolarHBondContact O-CG2 3.33Å; F144-V148 PolarHBondContact O-N 3.13Å; A145-V148 PolarHBondContact O-N 3.21Å; V148-L151 PolarHBondContact O-N 2.94Å; V148-L152 PolarHBondContact O-N 3.4Å
149	C	94.2	Very high	91.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-44.3	-179	-68.3	0	0	0	0	112.3	A145 Q146 S147 L151 L152 V153 L168 L172	A145-C149 WeakPolarHBondContact O-CB 3.2Å; A145-C149 PolarHBondContact O-N 3.16Å; A145-C149 PolarHBondContact O-SG 3.38Å; Q146-C149 PolarHBondContact O-N 2.98Å; S147-C149 VanDerWaalsContact C-N 3.34Å; S147-C149 PolarHBondContact O-N 2.83Å; C149-L151 PolarHBondContact O-N 3.45Å; C149-L152 PolarHBondContact O-N 3.1Å; C149-V153 WeakPolarHBondContact O-CG2 3.28Å; C149-V153 PolarHBondContact O-N 2.95Å; C149-L168 HydrophobicContact CB-CD1 4.06Å; C149-L168 HydrophobicContact CB-CD2 4.33Å; C149-L168 HydrophobicContact CB-CG 4.11Å; C149-L168 WeakPolarHBondContact O-CD2 3.31Å; C149-L172 HydrophobicContact CB-CD1 3.73Å; C149-L172 HydrophobicContact CB-CD2 3.59Å; C149-L172 HydrophobicContact CB-CG 3.61Å
150	F	94.6	Very high	91.8	Very high	22 Å²	22	30.8 Å²	30.8	10%	0.096	15%	0.153	C	C	.	.	H	α-helix	trans	-65	-39.4	178.7	-79.6	-55.5	0	0	0	112.6	Q146 S147 V153 D154 L172 A206 K209 I210 Y213	Q146-F150 HydrophobicContact CB-CE2 4.46Å; Q146-F150 WeakPolarHBondContact O-CD2 3.42Å; Q146-F150 PolarHBondContact O-N 2.67Å; S147-F150 PolarHBondContact O-N 3.41Å; F150-V153 PolarHBondContact O-N 3Å; F150-D154 PolarHBondContact O-N 2.97Å; F150-L172 HydrophobicContact CD1-CD1 3.95Å; F150-L172 HydrophobicContact CE1-CD1 3.86Å; F150-L172 HydrophobicContact CG-CD1 4.4Å; F150-L172 HydrophobicContact CZ-CD1 4.23Å; F150-A206 HydrophobicContact CE2-CB 4.36Å; F150-A206 HydrophobicContact CZ-CB 4.26Å; F150-K209 HydrophobicContact CD1-CD 4.11Å; F150-K209 HydrophobicContact CE1-CB 4.21Å; F150-K209 HydrophobicContact CE1-CD 3.97Å; F150-K209 HydrophobicContact CE1-CG 4.28Å; F150-K209 HydrophobicContact CG-CD 4.47Å; F150-K209 HydrophobicContact CZ-CB 4.31Å; F150-K209 HydrophobicContact CZ-CD 4.23Å; F150-I210 HydrophobicContact CE1-CG1 3.97Å; F150-I210 HydrophobicContact CZ-CG1 4.01Å; F150-Y213 AromaticContact CD1-CD2 3.98Å; F150-Y213 HydrophobicContact CD1-CD2 3.98Å; F150-Y213 AromaticContact CD1-CE2 3.46Å; F150-Y213 HydrophobicContact CD1-CE2 3.46Å; F150-Y213 VanDerWaalsContact CD1-CE2 3.46Å; F150-Y213 HydrophobicContact CE1-CD2 4.01Å; F150-Y213 AromaticContact CE1-CE2 3.82Å; F150-Y213 HydrophobicContact CE1-CE2 3.82Å
151	L	95.7	Very high	92.1	Very high	12 Å²	12	32.4 Å²	32.4	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-47.3	174.1	177.6	60.6	0	0	0	111.1	Y111 A114 I115 Y118 S147 V148 C149 V153 D154 L155	Y111-L151 HydrophobicContact CD2-CD2 4.17Å; Y111-L151 HydrophobicContact CE2-CB 4.26Å; Y111-L151 HydrophobicContact CE2-CD2 3.75Å; A114-L151 HydrophobicContact CB-CD2 3.86Å; I115-L151 HydrophobicContact CD1-CD1 3.86Å; I115-L151 HydrophobicContact CD1-CD2 3.76Å; I115-L151 HydrophobicContact CD1-CG 4.31Å; I115-L151 HydrophobicContact CG1-CD2 4.18Å; Y118-L151 HydrophobicContact CD2-CD1 4.01Å; Y118-L151 HydrophobicContact CG-CD1 3.99Å; S147-L151 WeakPolarHBondContact O-CB 3.33Å; S147-L151 PolarHBondContact O-N 3.43Å; V148-L151 PolarHBondContact O-N 2.94Å; C149-L151 PolarHBondContact O-N 3.45Å; L151-V153 PolarHBondContact O-N 3.3Å; L151-D154 PolarHBondContact O-N 3.33Å; L151-L155 HydrophobicContact CD1-CD1 4.26Å; L151-L155 HydrophobicContact CD1-CG 4.46Å; L151-L155 HydrophobicContact CG-CD1 4Å; L151-L155 WeakPolarHBondContact O-CG 3.42Å; L151-L155 PolarHBondContact O-N 3.31Å
152	L	96.1	Very high	92.4	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-40	176.2	-87.6	178.3	0	0	0	112.8	G130 E131 Y134 V148 C149 D154 L155 Y156 L168	G130-L152 WeakPolarHBondContact O-CD1 3.43Å; E131-L152 HydrophobicContact CG-CD2 4.3Å; Y134-L152 HydrophobicContact CD2-CD1 4.49Å; Y134-L152 HydrophobicContact CG-CD1 4.21Å; V148-L152 PolarHBondContact O-N 3.4Å; C149-L152 PolarHBondContact O-N 3.1Å; L152-D154 PolarHBondContact O-N 3.43Å; L152-L155 HydrophobicContact CD2-CD1 4.49Å; L152-L155 PolarHBondContact O-N 3.24Å; L152-Y156 HydrophobicContact CB-CE2 4.24Å; L152-Y156 HydrophobicContact CD2-CE2 4.39Å; L152-Y156 WeakPolarHBondContact O-CB 3.03Å; L152-Y156 VanDerWaalsContact O-CD2 3.23Å; L152-Y156 WeakPolarHBondContact O-CD2 3.44Å; L152-Y156 VanDerWaalsContact O-CG 3.31Å; L152-Y156 PolarHBondContact O-N 3.4Å; L152-L168 HydrophobicContact CB-CD2 3.43Å; L152-L168 VanDerWaalsContact CB-CD2 3.43Å; L152-L168 HydrophobicContact CD1-CD2 4.06Å; L152-L168 HydrophobicContact CG-CD2 4.44Å
153	V	97.1	Very high	92.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60	-46	174.7	169.1	0	0	0	0	110.9	C149 F150 L151 L155 Y156 L157 A165 L168 L169 L172 Y213	C149-V153 WeakPolarHBondContact O-CG2 3.28Å; C149-V153 PolarHBondContact O-N 2.95Å; F150-V153 PolarHBondContact O-N 3Å; L151-V153 PolarHBondContact O-N 3.3Å; V153-L155 PolarHBondContact O-N 3.34Å; V153-Y156 PolarHBondContact O-N 2.95Å; V153-L157 HydrophobicContact CG1-CD1 3.96Å; V153-L157 HydrophobicContact CG1-CG 4.47Å; V153-L157 WeakPolarHBondContact O-CB 3.05Å; V153-L157 VanDerWaalsContact O-CG 3.31Å; V153-L157 WeakPolarHBondContact O-CG 3.33Å; V153-L157 PolarHBondContact O-N 3.47Å; V153-A165 HydrophobicContact CG1-CB 4.4Å; V153-L168 HydrophobicContact CG2-CB 4.11Å; V153-L168 HydrophobicContact CG2-CD2 3.85Å; V153-L168 HydrophobicContact CG2-CG 3.99Å; V153-L169 HydrophobicContact CG1-CD1 4.25Å; V153-L169 HydrophobicContact CG1-CD2 4.18Å; V153-L169 HydrophobicContact CG1-CG 4.26Å; V153-L169 HydrophobicContact CG2-CD2 4.02Å; V153-L169 HydrophobicContact CG2-CG 3.92Å; V153-L172 HydrophobicContact CG2-CD1 4.47Å; V153-Y213 HydrophobicContact CG1-CD1 3.55Å; V153-Y213 HydrophobicContact CG1-CD2 4Å; V153-Y213 HydrophobicContact CG1-CE1 3.94Å; V153-Y213 HydrophobicContact CG1-CE2 4.38Å; V153-Y213 HydrophobicContact CG1-CG 3.56Å
154	D	95.1	Very high	93.3	Very high	23 Å²	23	27.2 Å²	27.2	12%	0.123	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-46	175.8	-89.9	-48.6	0	0	0	111.5	Y118 F150 L151 L152 L157 L158 Y213 R216	Y118-D154 HydrophobicContact CE2-CB 4.14Å; F150-D154 PolarHBondContact O-N 2.97Å; L151-D154 PolarHBondContact O-N 3.33Å; L152-D154 PolarHBondContact O-N 3.43Å; D154-L157 PolarHBondContact O-N 2.82Å; D154-L158 WeakPolarHBondContact O-CB 3.23Å; D154-L158 VanDerWaalsContact O-CG 3.26Å; D154-L158 WeakPolarHBondContact O-CG 3.33Å; D154-L158 PolarHBondContact O-N 2.83Å; D154-Y213 WeakPolarHBondContact OD1-CE1 3.03Å; D154-Y213 PolarHBondContact OD1-OH 3.34Å; D154-Y213 PolarHBondContact OD2-OH 2.89Å; D154-R216 IonicContact OD1-NH1 3.47Å; D154-R216 PolarHBondContact OD1-NH1 3.14Å
155	L	95.8	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-44.1	178.6	-73.7	166.4	0	0	0	112.8	Y118 Y123 A126 I127 L151 L152 V153 L158 T159	Y118-L155 HydrophobicContact CD2-CD2 3.77Å; Y118-L155 HydrophobicContact CD2-CG 4.18Å; Y123-L155 HydrophobicContact CD1-CD2 3.81Å; Y123-L155 HydrophobicContact CG-CD2 4.41Å; A126-L155 HydrophobicContact CB-CD1 3.77Å; A126-L155 HydrophobicContact CB-CD2 3.72Å; A126-L155 HydrophobicContact CB-CG 4.41Å; I127-L155 HydrophobicContact CD1-CB 4.15Å; I127-L155 HydrophobicContact CG1-CB 3.61Å; I127-L155 HydrophobicContact CG1-CD1 4.05Å; I127-L155 HydrophobicContact CG1-CD2 4.28Å; I127-L155 HydrophobicContact CG1-CG 4.2Å; L151-L155 HydrophobicContact CD1-CD1 4.26Å; L151-L155 HydrophobicContact CD1-CG 4.46Å; L151-L155 HydrophobicContact CG-CD1 4Å; L151-L155 WeakPolarHBondContact O-CG 3.42Å; L151-L155 PolarHBondContact O-N 3.31Å; L152-L155 HydrophobicContact CD2-CD1 4.49Å; L152-L155 PolarHBondContact O-N 3.24Å; V153-L155 PolarHBondContact O-N 3.34Å; L155-L158 PolarHBondContact O-N 3.44Å; L155-T159 WeakPolarHBondContact O-CB 3.46Å; L155-T159 WeakPolarHBondContact O-CG2 3.34Å; L155-T159 PolarHBondContact O-N 3.5Å; L155-T159 PolarHBondContact O-OG1 3Å
156	Y	95.6	Very high	93.9	Very high	15 Å²	15	27.4 Å²	27.4	6%	0.059	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-41.6	175.8	-71.5	-36.5	0	0	0	111.7	I127 E131 L152 V153 T159 F160 Q161 K164 L168	I127-Y156 HydrophobicContact CG2-CE1 4.25Å; E131-Y156 VanDerWaalsContact CG-OH 3.24Å; E131-Y156 WeakPolarHBondContact CG-OH 3.39Å; E131-Y156 PolarHBondContact OE1-OH 3.23Å; L152-Y156 HydrophobicContact CB-CE2 4.24Å; L152-Y156 HydrophobicContact CD2-CE2 4.39Å; L152-Y156 WeakPolarHBondContact O-CB 3.03Å; L152-Y156 VanDerWaalsContact O-CD2 3.23Å; L152-Y156 WeakPolarHBondContact O-CD2 3.44Å; L152-Y156 VanDerWaalsContact O-CG 3.31Å; L152-Y156 PolarHBondContact O-N 3.4Å; V153-Y156 PolarHBondContact O-N 2.95Å; Y156-T159 CarbonylContact O-C 3.52Å; Y156-T159 PolarHBondContact O-N 3.28Å; Y156-T159 PolarHBondContact O-OG1 2.9Å; Y156-F160 PolarHBondContact O-N 3.48Å; Y156-Q161 HydrophobicContact CD1-CB 4.16Å; Y156-Q161 HydrophobicContact CG-CB 4.44Å; Y156-Q161 PolarHBondContact O-N 3.29Å; Y156-K164 HydrophobicContact CD1-CB 4.19Å; Y156-K164 HydrophobicContact CD1-CD 4.03Å; Y156-K164 HydrophobicContact CD2-CB 3.82Å; Y156-K164 HydrophobicContact CE1-CB 4.24Å; Y156-K164 HydrophobicContact CE1-CD 3.54Å; Y156-K164 HydrophobicContact CE2-CB 3.85Å; Y156-K164 HydrophobicContact CE2-CD 4.37Å; Y156-K164 HydrophobicContact CG-CB 4Å; Y156-L168 HydrophobicContact CD2-CD2 4.49Å; Y156-L168 HydrophobicContact CE2-CD2 4.17Å
157	L	94.1	Very high	94.1	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-69	-36.2	176.6	-68.5	174.7	0	0	0	112.4	V153 D154 T159 F160 A165 Y213 R216 A217 Q220	V153-L157 HydrophobicContact CG1-CD1 3.96Å; V153-L157 HydrophobicContact CG1-CG 4.47Å; V153-L157 WeakPolarHBondContact O-CB 3.05Å; V153-L157 VanDerWaalsContact O-CG 3.31Å; V153-L157 WeakPolarHBondContact O-CG 3.33Å; V153-L157 PolarHBondContact O-N 3.47Å; D154-L157 PolarHBondContact O-N 2.82Å; L157-T159 VanDerWaalsContact C-N 3.32Å; L157-F160 PolarHBondContact O-N 3.29Å; L157-A165 HydrophobicContact CD2-CB 3.99Å; L157-A165 HydrophobicContact CG-CB 4.06Å; L157-Y213 HydrophobicContact CD1-CD1 3.51Å; L157-Y213 HydrophobicContact CD1-CE1 4.23Å; L157-Y213 HydrophobicContact CD1-CG 4.39Å; L157-R216 HydrophobicContact CD1-CB 3.99Å; L157-A217 HydrophobicContact CD2-CB 3.9Å; L157-Q220 PolarHBondContact O-NE2 2.65Å
158	L	91.2	Very high	94.2	Very high	75 Å²	75	30.6 Å²	30.6	39%	0.393	15%	0.148	S	C	.	.	H	α-helix	trans	-66.9	-33.4	175	-75.3	171.5	0	0	0	112.5	Y118 Y123 D154 L155	Y118-L158 HydrophobicContact CD2-CD1 4.28Å; Y118-L158 HydrophobicContact CE2-CD1 3.5Å; Y123-L158 HydrophobicContact CD1-CD1 4.27Å; Y123-L158 HydrophobicContact CE1-CD1 3.78Å; D154-L158 WeakPolarHBondContact O-CB 3.23Å; D154-L158 VanDerWaalsContact O-CG 3.26Å; D154-L158 WeakPolarHBondContact O-CG 3.33Å; D154-L158 PolarHBondContact O-N 2.83Å; L155-L158 PolarHBondContact O-N 3.44Å
159	T	90.5	Very high	94.2	Very high	47 Å²	47	30.5 Å²	30.5	29%	0.288	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	9.9	177.3	59.6	0	0	0	0	113.7	I127 L155 Y156 L157 Q161	I127-T159 HydrophobicContact CD1-CG2 3.71Å; L155-T159 WeakPolarHBondContact O-CB 3.46Å; L155-T159 WeakPolarHBondContact O-CG2 3.34Å; L155-T159 PolarHBondContact O-N 3.5Å; L155-T159 PolarHBondContact O-OG1 3Å; Y156-T159 CarbonylContact O-C 3.52Å; Y156-T159 PolarHBondContact O-N 3.28Å; Y156-T159 PolarHBondContact O-OG1 2.9Å; L157-T159 VanDerWaalsContact C-N 3.32Å; T159-Q161 PolarHBondContact OG1-NE2 3.32Å
160	F	90.1	Very high	94	Very high	36 Å²	36	32.7 Å²	32.7	16%	0.158	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	43.7	174.6	-140.5	-95.8	0	0	0	114.5	Y156 L157 P162 Q220 F507 P515	Y156-F160 PolarHBondContact O-N 3.48Å; L157-F160 PolarHBondContact O-N 3.29Å; F160-P162 WeakPolarHBondContact O-CD 3.5Å; F160-Q220 HydrophobicContact CD2-CB 4.45Å; F160-Q220 HydrophobicContact CD2-CG 4.03Å; F160-Q220 HydrophobicContact CE1-CB 4.28Å; F160-Q220 HydrophobicContact CE2-CB 3.91Å; F160-Q220 HydrophobicContact CE2-CG 3.61Å; F160-Q220 HydrophobicContact CZ-CB 3.81Å; F160-Q220 HydrophobicContact CZ-CG 4.04Å; F160-F507 HydrophobicContact CD1-CD1 4.33Å; F160-F507 HydrophobicContact CD1-CE1 4.33Å; F160-F507 HydrophobicContact CE1-CD1 4.4Å; F160-F507 HydrophobicContact CE1-CE1 4.05Å; F160-F507 HydrophobicContact CE1-CZ 4.35Å; F160-P515 HydrophobicContact CB-CG 3.61Å; F160-P515 HydrophobicContact CD1-CB 4.33Å; F160-P515 HydrophobicContact CD1-CG 3.72Å; F160-P515 VanDerWaalsContact CD2-CD 3.49Å; F160-P515 HydrophobicContact CD2-CG 3.87Å; F160-P515 HydrophobicContact CE1-CG 4.32Å; F160-P515 HydrophobicContact CE2-CG 4.44Å; F160-P515 HydrophobicContact CG-CG 3.47Å; F160-P515 VanDerWaalsContact CG-CG 3.47Å
161	Q	92.3	Very high	93.7	Very high	57 Å²	57	33.1 Å²	33.1	27%	0.266	17%	0.17	S	C	.	.			trans	-111.3	62	173.8	-62.1	178.1	65.5	0	0	111	Y156 T159 E163 K164 A165	Y156-Q161 HydrophobicContact CD1-CB 4.16Å; Y156-Q161 HydrophobicContact CG-CB 4.44Å; Y156-Q161 PolarHBondContact O-N 3.29Å; T159-Q161 PolarHBondContact OG1-NE2 3.32Å; Q161-E163 VanDerWaalsContact C-N 3.3Å; Q161-E163 PolarHBondContact O-N 2.97Å; Q161-K164 HydrophobicContact CB-CB 4.47Å; Q161-K164 PolarHBondContact O-N 2.89Å; Q161-K164 VanDerWaalsContact OE1-NZ 3.16Å; Q161-A165 PolarHBondContact O-N 2.89Å
162	P	94.1	Very high	93.3	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-27.1	-170.6	28	-35.8	0	0	0	113.9	F160 A165 L166 A217 Q220 M221	F160-P162 WeakPolarHBondContact O-CD 3.5Å; P162-A165 PolarHBondContact O-N 3.49Å; P162-L166 WeakPolarHBondContact O-CB 3.42Å; P162-L166 WeakPolarHBondContact O-CG 3.19Å; P162-L166 PolarHBondContact O-N 2.95Å; P162-A217 HydrophobicContact CB-CB 3.98Å; P162-Q220 HydrophobicContact CB-CB 4.24Å; P162-Q220 HydrophobicContact CG-CB 4.23Å; P162-M221 HydrophobicContact CB-CG 3.71Å; P162-M221 HydrophobicContact CB-SD 4.18Å; P162-M221 HydrophobicContact CG-CG 3.42Å; P162-M221 VanDerWaalsContact CG-CG 3.42Å; P162-M221 HydrophobicContact CG-SD 4.27Å
163	E	93.8	Very high	92.8	Very high	100 Å²	100	34.9 Å²	34.9	47%	0.467	18%	0.179	S	C	.	.	H	α-helix	trans	-66.8	-45.7	178.3	-62	76.8	-168.1	0	0	111.3	Q161 A165 L166 H167 M221	Q161-E163 VanDerWaalsContact C-N 3.3Å; Q161-E163 PolarHBondContact O-N 2.97Å; E163-A165 VanDerWaalsContact C-N 3.32Å; E163-A165 PolarHBondContact O-N 3.5Å; E163-L166 PolarHBondContact O-N 3.19Å; E163-H167 PolarHBondContact O-N 3.29Å; E163-M221 HydrophobicContact CG-CE 3.98Å; E163-M221 WeakPolarHBondContact OE1-CE 3.46Å
164	K	94.6	Very high	92.1	Very high	90 Å²	90	41.6 Å²	41.6	39%	0.391	21%	0.208	S	C	.	.	H	α-helix	trans	-61.6	-42.2	173.8	-71.3	-166.9	179.8	180	0	111.1	E131 Y156 Q161 L166 H167 L168	E131-K164 IonicContact OE1-NZ 3.95Å; E131-K164 PolarHBondContact OE1-NZ 2.9Å; Y156-K164 HydrophobicContact CD1-CB 4.19Å; Y156-K164 HydrophobicContact CD1-CD 4.03Å; Y156-K164 HydrophobicContact CD2-CB 3.82Å; Y156-K164 HydrophobicContact CE1-CB 4.24Å; Y156-K164 HydrophobicContact CE1-CD 3.54Å; Y156-K164 HydrophobicContact CE2-CB 3.85Å; Y156-K164 HydrophobicContact CE2-CD 4.37Å; Y156-K164 HydrophobicContact CG-CB 4Å; Q161-K164 HydrophobicContact CB-CB 4.47Å; Q161-K164 PolarHBondContact O-N 2.89Å; Q161-K164 VanDerWaalsContact OE1-NZ 3.16Å; K164-L166 PolarHBondContact O-N 3.38Å; K164-H167 PolarHBondContact O-N 3.23Å; K164-L168 PolarHBondContact O-N 3.37Å
165	A	96.3	Very high	91.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-45.6	175.6	0	0	0	0	0	111.9	V153 L157 Q161 P162 E163 H167 L168 L169	V153-A165 HydrophobicContact CG1-CB 4.4Å; L157-A165 HydrophobicContact CD2-CB 3.99Å; L157-A165 HydrophobicContact CG-CB 4.06Å; Q161-A165 PolarHBondContact O-N 2.89Å; P162-A165 PolarHBondContact O-N 3.49Å; E163-A165 VanDerWaalsContact C-N 3.32Å; E163-A165 PolarHBondContact O-N 3.5Å; A165-H167 PolarHBondContact O-N 3.24Å; A165-L168 PolarHBondContact O-N 3.33Å; A165-L169 WeakPolarHBondContact O-CB 3.31Å; A165-L169 WeakPolarHBondContact O-CD1 3.14Å; A165-L169 WeakPolarHBondContact O-CG 3.48Å; A165-L169 PolarHBondContact O-N 3.41Å
166	L	95.4	Very high	90	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.173	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-39.2	177.5	-75.6	172.2	0	0	0	112.7	P162 E163 K164 L169 A170 K214 A217 Y218 M221	P162-L166 WeakPolarHBondContact O-CB 3.42Å; P162-L166 WeakPolarHBondContact O-CG 3.19Å; P162-L166 PolarHBondContact O-N 2.95Å; E163-L166 PolarHBondContact O-N 3.19Å; K164-L166 PolarHBondContact O-N 3.38Å; L166-L169 HydrophobicContact CD2-CD1 4.46Å; L166-L169 PolarHBondContact O-N 3.43Å; L166-A170 PolarHBondContact O-N 3.36Å; L166-K214 HydrophobicContact CD2-CB 4.33Å; L166-K214 HydrophobicContact CD2-CG 4.01Å; L166-A217 HydrophobicContact CD1-CB 4.21Å; L166-A217 HydrophobicContact CD2-CB 3.83Å; L166-A217 HydrophobicContact CG-CB 3.73Å; L166-Y218 HydrophobicContact CD1-CD1 4.13Å; L166-Y218 HydrophobicContact CD1-CE1 3.72Å; L166-Y218 HydrophobicContact CD2-CE1 4.12Å; L166-Y218 HydrophobicContact CD2-CE2 4.42Å; L166-M221 HydrophobicContact CD1-SD 3.61Å
167	H	94.1	Very high	88.6	Confident	122 Å²	122	46.3 Å²	46.3	57%	0.565	24%	0.238	S	C	*	.	H	α-helix	trans	-59.2	-48.6	174.1	-177.2	78.6	0	0	0	111	E163 K164 A165 L169 A170 V171	E163-H167 PolarHBondContact O-N 3.29Å; K164-H167 PolarHBondContact O-N 3.23Å; A165-H167 PolarHBondContact O-N 3.24Å; H167-L169 PolarHBondContact O-N 2.91Å; H167-A170 WeakPolarHBondContact O-CB 3.43Å; H167-A170 PolarHBondContact O-N 3.5Å; H167-A170 VanDerWaalsContact O-N 3.16Å; H167-V171 PolarHBondContact O-N 3.36Å; H167-V171 VanDerWaalsContact O-N 3.14Å
168	L	93.1	Very high	86.9	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-36.7	179.4	-170.3	55.8	0	0	0	112.7	Y134 C149 L152 V153 Y156 K164 A165 A170 V171 L172	Y134-L168 HydrophobicContact CD2-CD1 3.69Å; Y134-L168 HydrophobicContact CE2-CD1 3.21Å; C149-L168 HydrophobicContact CB-CD1 4.06Å; C149-L168 HydrophobicContact CB-CD2 4.33Å; C149-L168 HydrophobicContact CB-CG 4.11Å; C149-L168 WeakPolarHBondContact O-CD2 3.31Å; L152-L168 HydrophobicContact CB-CD2 3.43Å; L152-L168 VanDerWaalsContact CB-CD2 3.43Å; L152-L168 HydrophobicContact CD1-CD2 4.06Å; L152-L168 HydrophobicContact CG-CD2 4.44Å; V153-L168 HydrophobicContact CG2-CB 4.11Å; V153-L168 HydrophobicContact CG2-CD2 3.85Å; V153-L168 HydrophobicContact CG2-CG 3.99Å; Y156-L168 HydrophobicContact CD2-CD2 4.49Å; Y156-L168 HydrophobicContact CE2-CD2 4.17Å; K164-L168 PolarHBondContact O-N 3.37Å; A165-L168 PolarHBondContact O-N 3.33Å; L168-A170 VanDerWaalsContact C-N 3.3Å; L168-A170 PolarHBondContact O-N 2.88Å; L168-V171 WeakPolarHBondContact O-CB 3.48Å; L168-V171 PolarHBondContact O-N 3.16Å; L168-V171 VanDerWaalsContact O-N 3.17Å; L168-L172 PolarHBondContact O-N 3.48Å
169	L	93.6	Very high	85	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-33.9	173.8	-71.3	162.6	0	0	0	112.4	V153 A165 L166 H167 V171 L172 D173 I210 Y213 K214	V153-L169 HydrophobicContact CG1-CD1 4.25Å; V153-L169 HydrophobicContact CG1-CD2 4.18Å; V153-L169 HydrophobicContact CG1-CG 4.26Å; V153-L169 HydrophobicContact CG2-CD2 4.02Å; V153-L169 HydrophobicContact CG2-CG 3.92Å; A165-L169 WeakPolarHBondContact O-CB 3.31Å; A165-L169 WeakPolarHBondContact O-CD1 3.14Å; A165-L169 WeakPolarHBondContact O-CG 3.48Å; A165-L169 PolarHBondContact O-N 3.41Å; L166-L169 HydrophobicContact CD2-CD1 4.46Å; L166-L169 PolarHBondContact O-N 3.43Å; H167-L169 PolarHBondContact O-N 2.91Å; L169-V171 VanDerWaalsContact C-N 3.34Å; L169-L172 HydrophobicContact CD2-CD1 4.23Å; L169-L172 PolarHBondContact O-N 2.67Å; L169-D173 PolarHBondContact O-N 2.98Å; L169-I210 HydrophobicContact CB-CG2 4.47Å; L169-I210 HydrophobicContact CD2-CB 4.28Å; L169-I210 HydrophobicContact CD2-CG1 4.16Å; L169-I210 HydrophobicContact CD2-CG2 4.07Å; L169-Y213 HydrophobicContact CD2-CD2 4.17Å; L169-Y213 HydrophobicContact CD2-CG 4.33Å; L169-K214 HydrophobicContact CB-CG 4.42Å; L169-K214 HydrophobicContact CD1-CG 3.88Å
170	A	91.4	Very high	83	Confident	46 Å²	46	50.7 Å²	50.7	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-70.4	-31.4	173.7	0	0	0	0	0	112.4	L166 H167 L168 K174	L166-A170 PolarHBondContact O-N 3.36Å; H167-A170 WeakPolarHBondContact O-CB 3.43Å; H167-A170 PolarHBondContact O-N 3.5Å; H167-A170 VanDerWaalsContact O-N 3.16Å; L168-A170 VanDerWaalsContact C-N 3.3Å; L168-A170 PolarHBondContact O-N 2.88Å; A170-K174 WeakPolarHBondContact O-CG 3.42Å; A170-K174 PolarHBondContact O-N 3.35Å
171	V	87.7	Confident	80.7	Confident	31 Å²	31	55.8 Å²	55.8	19%	0.188	30%	0.295	C	S	.	.	H	α-helix	trans	-68.7	-45.8	171.5	175.1	0	0	0	0	110.5	H167 L168 L169 D173 K174 I175	H167-V171 PolarHBondContact O-N 3.36Å; H167-V171 VanDerWaalsContact O-N 3.14Å; L168-V171 WeakPolarHBondContact O-CB 3.48Å; L168-V171 PolarHBondContact O-N 3.16Å; L168-V171 VanDerWaalsContact O-N 3.17Å; L169-V171 VanDerWaalsContact C-N 3.34Å; V171-D173 VanDerWaalsContact C-N 3.32Å; V171-D173 PolarHBondContact O-N 3.43Å; V171-K174 WeakPolarHBondContact O-CB 3.44Å; V171-K174 PolarHBondContact O-N 2.92Å; V171-I175 HydrophobicContact CG1-CD1 3.85Å; V171-I175 HydrophobicContact CG1-CG1 4.41Å; V171-I175 WeakPolarHBondContact O-CG1 3.41Å; V171-I175 PolarHBondContact O-N 3.13Å
172	L	87.4	Confident	78.4	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-55.5	-44.1	174.3	-85.5	169.9	0	0	0	112.4	Q146 C149 F150 V153 L168 L169 K174 I175 S176 I210	Q146-L172 HydrophobicContact CB-CD2 4.21Å; Q146-L172 HydrophobicContact CG-CD2 3.98Å; C149-L172 HydrophobicContact CB-CD1 3.73Å; C149-L172 HydrophobicContact CB-CD2 3.59Å; C149-L172 HydrophobicContact CB-CG 3.61Å; F150-L172 HydrophobicContact CD1-CD1 3.95Å; F150-L172 HydrophobicContact CE1-CD1 3.86Å; F150-L172 HydrophobicContact CG-CD1 4.4Å; F150-L172 HydrophobicContact CZ-CD1 4.23Å; V153-L172 HydrophobicContact CG2-CD1 4.47Å; L168-L172 PolarHBondContact O-N 3.48Å; L169-L172 HydrophobicContact CD2-CD1 4.23Å; L169-L172 PolarHBondContact O-N 2.67Å; L172-K174 VanDerWaalsContact C-N 3.27Å; L172-K174 PolarHBondContact O-N 3.38Å; L172-I175 PolarHBondContact O-N 3.19Å; L172-S176 PolarHBondContact O-N 3.17Å; L172-S176 PolarHBondContact O-OG 3.15Å; L172-I210 HydrophobicContact CB-CD1 3.98Å; L172-I210 HydrophobicContact CB-CG1 4.42Å
173	D	85.2	Confident	75.8	Confident	48 Å²	48	69.1 Å²	69.1	26%	0.257	36%	0.359	S	S	.	.	H	α-helix	trans	-57.9	-38.5	174.9	-81.6	-34.6	0	0	0	112.3	L169 V171 V177 K214	L169-D173 PolarHBondContact O-N 2.98Å; V171-D173 VanDerWaalsContact C-N 3.32Å; V171-D173 PolarHBondContact O-N 3.43Å; D173-V177 WeakPolarHBondContact O-CG2 3.43Å; D173-V177 PolarHBondContact O-N 3.38Å; D173-K214 IonicContact OD1-NZ 2.62Å; D173-K214 IonicContact OD2-NZ 2.94Å; D173-K214 PolarHBondContact OD2-NZ 3.43Å
174	K	83.3	Confident	73.1	Confident	141 Å²	141	67.5 Å²	67.5	61%	0.613	37%	0.369	S	S	*	.	H	α-helix	trans	-70.3	-42.1	178.5	-69.2	174.7	-178.1	-179.4	0	111.9	A170 V171 L172 V177 Q178	A170-K174 WeakPolarHBondContact O-CG 3.42Å; A170-K174 PolarHBondContact O-N 3.35Å; V171-K174 WeakPolarHBondContact O-CB 3.44Å; V171-K174 PolarHBondContact O-N 2.92Å; L172-K174 VanDerWaalsContact C-N 3.27Å; L172-K174 PolarHBondContact O-N 3.38Å; K174-V177 PolarHBondContact O-N 2.99Å; K174-Q178 WeakPolarHBondContact O-CG 3.49Å; K174-Q178 PolarHBondContact O-N 3.43Å
175	I	75.9	Confident	70.4	Confident	32 Å²	32	73.5 Å²	73.5	16%	0.164	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-48.3	178.5	-65.7	168.3	0	0	0	109.7	L137 E142 V171 L172 V177 Q178 G179	L137-I175 HydrophobicContact CD2-CD1 3.42Å; L137-I175 VanDerWaalsContact CD2-CD1 3.42Å; E142-I175 HydrophobicContact CG-CG2 3.84Å; V171-I175 HydrophobicContact CG1-CD1 3.85Å; V171-I175 HydrophobicContact CG1-CG1 4.41Å; V171-I175 WeakPolarHBondContact O-CG1 3.41Å; V171-I175 PolarHBondContact O-N 3.13Å; L172-I175 PolarHBondContact O-N 3.19Å; I175-V177 PolarHBondContact O-N 3.34Å; I175-Q178 PolarHBondContact O-N 3.35Å; I175-G179 PolarHBondContact O-N 3.09Å
176	S	70.7	Confident	67.4	Low	10 Å²	10	78.2 Å²	78.2	7%	0.07	44%	0.435	C	S	.	.	H	α-helix	trans	-63.1	-25.7	178.7	-60.2	0	0	0	0	113.8	L172 M203	L172-S176 PolarHBondContact O-N 3.17Å; L172-S176 PolarHBondContact O-OG 3.15Å; S176-M203 WeakPolarHBondContact O-CE 3.22Å
177	V	65.7	Low	64.5	Low	96 Å²	96	86.1 Å²	86.1	58%	0.582	47%	0.471	S	S	*	.	H	α-helix	trans	-84.3	-36.2	176.8	173.3	0	0	0	0	112	D173 K174 I175 S180	D173-V177 WeakPolarHBondContact O-CG2 3.43Å; D173-V177 PolarHBondContact O-N 3.38Å; K174-V177 PolarHBondContact O-N 2.99Å; I175-V177 PolarHBondContact O-N 3.34Å; V177-S180 WeakPolarHBondContact O-CB 3.43Å; V177-S180 PolarHBondContact O-N 3.35Å
178	Q	59.1	Low	61.8	Low	129 Å²	129	85.8 Å²	85.8	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-70.7	-31.5	-179.6	-76.3	179.7	-9.2	0	0	113.4	K174 I175 S180 N181	K174-Q178 WeakPolarHBondContact O-CG 3.49Å; K174-Q178 PolarHBondContact O-N 3.43Å; I175-Q178 PolarHBondContact O-N 3.35Å; Q178-S180 PolarHBondContact O-N 3Å; Q178-S180 VanDerWaalsContact O-N 3.17Å; Q178-N181 PolarHBondContact O-N 3.5Å; Q178-N181 VanDerWaalsContact O-N 3.1Å
179	G	51.4	Low	58.9	Low	19 Å²	19	92.3 Å²	92.3	20%	0.196	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.9	172.5	0	0	0	0	0	113.8	I175	I175-G179 PolarHBondContact O-N 3.09Å
180	S	47.8	Very low	56.2	Low	68 Å²	68	100.5 Å²	100.5	48%	0.476	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-23	176.3	-60.9	0	0	0	0	113.9	V177 Q178	V177-S180 WeakPolarHBondContact O-CB 3.43Å; V177-S180 PolarHBondContact O-N 3.35Å; Q178-S180 PolarHBondContact O-N 3Å; Q178-S180 VanDerWaalsContact O-N 3.17Å
181	N	41.5	Very low	53.7	Low	144 Å²	144	103 Å²	103	77%	0.77	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-8.1	-170.6	-83.6	-4.3	0	0	0	115	Q178	Q178-N181 PolarHBondContact O-N 3.5Å; Q178-N181 VanDerWaalsContact O-N 3.1Å
182	K	45.1	Very low	51.5	Low	179 Å²	179	103.1 Å²	103.1	78%	0.778	58%	0.583	S	S	*	*			trans	-90.4	3.5	-177.5	-79.7	-172.1	176.4	179.3	0	115.5	G184	K182-G184 PolarHBondContact O-N 3.07Å
183	N	38.7	Very low	49.8	Very low	158 Å²	158	107.2 Å²	107.2	85%	0.845	61%	0.612	S	S	*	*			trans	-80.4	71.8	170.9	-87.1	-6.6	0	0	0	111.6
184	G	37.1	Very low	48.2	Very low	66 Å²	66	111 Å²	111	68%	0.68	63%	0.632	S	S	*	*			trans	-71.4	123.5	160.3	0	0	0	0	0	110.1	K182 A186	K182-G184 PolarHBondContact O-N 3.07Å; G184-A186 PolarHBondContact O-N 3.2Å
185	K	37.3	Very low	46.9	Very low	216 Å²	216	111.2 Å²	111.2	94%	0.939	64%	0.636	S	S	*	*			trans	7.9	96.9	164.7	-71.3	177.5	174.3	178	0	115.9
186	A	34.3	Very low	46.1	Very low	100 Å²	100	117 Å²	117	83%	0.826	66%	0.659	S	S	*	*			trans	-125.8	137.1	155.8	0	0	0	0	0	108.8	G184	G184-A186 PolarHBondContact O-N 3.2Å
187	E	34.5	Very low	46.1	Very low	198 Å²	198	121.2 Å²	121.2	93%	0.925	69%	0.685	S	S	*	*			trans	-66.9	153.4	-162.6	-67.2	176.7	146.6	0	0	114.3	N189	E187-N189 PolarHBondContact O-N 3.16Å
188	S	36.5	Very low	46.2	Very low	115 Å²	115	123.4 Å²	123.4	80%	0.804	69%	0.689	S	S	*	*			trans	-54	111.2	-178.4	169.3	0	0	0	0	113.3
189	N	33.5	Very low	46.7	Very low	142 Å²	142	121 Å²	121	76%	0.759	68%	0.676	S	S	*	*			trans	-126.8	132.9	152.4	-100.8	-17.4	0	0	0	110.5	E187 S191	E187-N189 PolarHBondContact O-N 3.16Å; N189-S191 PolarHBondContact O-N 3.34Å
190	N	37	Very low	47.8	Very low	171 Å²	171	123.6 Å²	123.6	91%	0.914	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	25.3	-161	-143.6	8.9	0	0	0	114.8
191	S	38.2	Very low	49.1	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-4.4	177	51.5	0	0	0	0	113.8	N189	N189-S191 PolarHBondContact O-N 3.34Å
192	G	42.3	Very low	50.8	Low	34 Å²	34	119.1 Å²	119.1	35%	0.351	67%	0.665	S	S	.	*			trans	-87.4	3.8	-170.3	0	0	0	0	0	117.9	K196	G192-K196 WeakPolarHBondContact O-CB 3.49Å; G192-K196 PolarHBondContact O-N 3.02Å
193	S	50.6	Low	52.1	Low	87 Å²	87	113 Å²	113	61%	0.608	64%	0.64	S	S	*	*	H	α-helix	trans	-73.8	-42.7	-177.5	63.9	0	0	0	0	112.8	V197	S193-V197 VanDerWaalsContact O-CG2 3.32Å; S193-V197 WeakPolarHBondContact O-CG2 3.48Å; S193-V197 PolarHBondContact O-N 2.94Å
194	N	51.9	Low	54.1	Low	128 Å²	128	111.9 Å²	111.9	68%	0.684	63%	0.63	S	S	*	*	H	α-helix	trans	-68.9	-42.8	179.3	-94.7	-1.9	0	0	0	112.7	K196 V197 E198	N194-K196 VanDerWaalsContact C-N 3.3Å; N194-K196 PolarHBondContact O-N 3.43Å; N194-V197 PolarHBondContact O-N 2.96Å; N194-E198 WeakPolarHBondContact O-CB 3.32Å; N194-E198 PolarHBondContact O-N 3.47Å
195	Q	55.9	Low	56.3	Low	145 Å²	145	111.7 Å²	111.7	68%	0.678	62%	0.621	S	S	*	*	H	α-helix	trans	-64.3	-34.6	178.8	-73.4	179.8	-5.6	0	0	112.5	F199	Q195-F199 WeakPolarHBondContact O-CB 3.42Å; Q195-F199 PolarHBondContact O-N 2.87Å
196	K	59.9	Low	58.6	Low	152 Å²	152	101.7 Å²	101.7	66%	0.661	58%	0.579	S	S	*	*	H	α-helix	trans	-71.2	-37.9	177.3	-165.7	174.8	-177.3	178.3	0	112.2	G192 N194 V200	G192-K196 WeakPolarHBondContact O-CB 3.49Å; G192-K196 PolarHBondContact O-N 3.02Å; N194-K196 VanDerWaalsContact C-N 3.3Å; N194-K196 PolarHBondContact O-N 3.43Å; K196-V200 VanDerWaalsContact O-CG2 3.31Å; K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 3.26Å; K196-V200 VanDerWaalsContact O-N 3.15Å
197	V	69.3	Low	61.1	Low	100 Å²	100	102.3 Å²	102.3	61%	0.606	56%	0.563	S	S	*	*	H	α-helix	trans	-67.8	-42.7	175.3	172.8	0	0	0	0	111	S193 N194 V200 A201	S193-V197 VanDerWaalsContact O-CG2 3.32Å; S193-V197 WeakPolarHBondContact O-CG2 3.48Å; S193-V197 PolarHBondContact O-N 2.94Å; N194-V197 PolarHBondContact O-N 2.96Å; V197-V200 PolarHBondContact O-N 3.06Å; V197-A201 WeakPolarHBondContact O-CB 3.38Å; V197-A201 PolarHBondContact O-N 3.33Å
198	E	68.6	Low	63.7	Low	142 Å²	142	93.6 Å²	93.6	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-39.3	177.8	-164.9	173.3	-168.6	0	0	112.2	N194 A201 M202	N194-E198 WeakPolarHBondContact O-CB 3.32Å; N194-E198 PolarHBondContact O-N 3.47Å; E198-A201 PolarHBondContact O-N 3.18Å; E198-M202 WeakPolarHBondContact O-CB 3.44Å; E198-M202 PolarHBondContact O-N 3.28Å
199	F	69.3	Low	66.3	Low	77 Å²	77	92 Å²	92	34%	0.338	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-43.6	174	-176.2	-97.4	0	0	0	112.7	Q195 M202 M203	Q195-F199 WeakPolarHBondContact O-CB 3.42Å; Q195-F199 PolarHBondContact O-N 2.87Å; F199-M202 PolarHBondContact O-N 3.23Å; F199-M203 HydrophobicContact CE1-SD 4.2Å; F199-M203 PolarHBondContact O-N 3.31Å
200	V	74.7	Confident	69.2	Low	74 Å²	74	85.3 Å²	85.3	45%	0.448	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-45	176.8	170.8	0	0	0	0	111.1	K196 V197 M202 M203 E204	K196-V200 VanDerWaalsContact O-CG2 3.31Å; K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 3.26Å; K196-V200 VanDerWaalsContact O-N 3.15Å; V197-V200 PolarHBondContact O-N 3.06Å; V200-M202 VanDerWaalsContact C-N 3.32Å; V200-M202 PolarHBondContact O-N 3.26Å; V200-M203 PolarHBondContact O-N 3.13Å; V200-E204 PolarHBondContact O-N 3.39Å
201	A	76	Confident	72	Confident	54 Å²	54	78.2 Å²	78.2	45%	0.446	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-40	176.9	0	0	0	0	0	112.1	V197 E198 E204 A205	V197-A201 WeakPolarHBondContact O-CB 3.38Å; V197-A201 PolarHBondContact O-N 3.33Å; E198-A201 PolarHBondContact O-N 3.18Å; A201-E204 PolarHBondContact O-N 3.25Å; A201-A205 WeakPolarHBondContact O-CB 3.29Å; A201-A205 PolarHBondContact O-N 2.79Å
202	M	75.8	Confident	74.7	Confident	64 Å²	64	75.4 Å²	75.4	32%	0.315	40%	0.404	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.5	-176.8	-170.6	166.6	0	0	111.7	K143 E198 F199 V200 A205 A206	K143-M202 HydrophobicContact CB-CE 4.25Å; K143-M202 HydrophobicContact CD-CE 4.19Å; K143-M202 HydrophobicContact CD-SD 4.14Å; K143-M202 HydrophobicContact CG-CE 3.69Å; K143-M202 HydrophobicContact CG-SD 4.14Å; E198-M202 WeakPolarHBondContact O-CB 3.44Å; E198-M202 PolarHBondContact O-N 3.28Å; F199-M202 PolarHBondContact O-N 3.23Å; V200-M202 VanDerWaalsContact C-N 3.32Å; V200-M202 PolarHBondContact O-N 3.26Å; M202-A205 PolarHBondContact O-N 2.94Å; M202-A206 WeakPolarHBondContact O-CB 3.47Å; M202-A206 PolarHBondContact O-N 3.43Å
203	M	73.8	Confident	77.2	Confident	52 Å²	52	74.2 Å²	74.2	26%	0.256	39%	0.389	S	S	.	.	H	α-helix	trans	-62.3	-42.8	177.8	-113.8	-166.9	73.9	0	0	112.3	S176 F199 V200 A206 K207	S176-M203 WeakPolarHBondContact O-CE 3.22Å; F199-M203 HydrophobicContact CE1-SD 4.2Å; F199-M203 PolarHBondContact O-N 3.31Å; V200-M203 PolarHBondContact O-N 3.13Å; M203-A206 PolarHBondContact O-N 3.35Å; M203-K207 WeakPolarHBondContact O-CB 3.25Å; M203-K207 PolarHBondContact O-N 2.96Å
204	E	80.3	Confident	79.4	Confident	134 Å²	134	71.4 Å²	71.4	63%	0.626	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-41	176.6	-73.2	-171.4	160.1	0	0	112.1	V200 A201 K207 S208	V200-E204 PolarHBondContact O-N 3.39Å; A201-E204 PolarHBondContact O-N 3.25Å; E204-K207 PolarHBondContact O-N 3.36Å; E204-S208 WeakPolarHBondContact O-CB 3.3Å; E204-S208 PolarHBondContact O-N 2.97Å
205	A	82.8	Confident	81.6	Confident	61 Å²	61	65.3 Å²	65.3	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-44.4	175.2	0	0	0	0	0	111.8	A201 M202 K207 S208 K209	A201-A205 WeakPolarHBondContact O-CB 3.29Å; A201-A205 PolarHBondContact O-N 2.79Å; M202-A205 PolarHBondContact O-N 2.94Å; A205-K207 PolarHBondContact O-N 3.19Å; A205-S208 WeakPolarHBondContact O-CB 3.46Å; A205-S208 PolarHBondContact O-N 3.41Å; A205-K209 WeakPolarHBondContact O-CB 3.16Å; A205-K209 PolarHBondContact O-N 2.78Å
206	A	84.8	Confident	83.5	Confident	7 Å²	7	62.5 Å²	62.5	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-45.3	175.6	0	0	0	0	0	111.4	F150 M202 M203 S208 K209 I210	F150-A206 HydrophobicContact CE2-CB 4.36Å; F150-A206 HydrophobicContact CZ-CB 4.26Å; M202-A206 WeakPolarHBondContact O-CB 3.47Å; M202-A206 PolarHBondContact O-N 3.43Å; M203-A206 PolarHBondContact O-N 3.35Å; A206-S208 PolarHBondContact O-N 2.89Å; A206-K209 WeakPolarHBondContact O-CB 3.39Å; A206-K209 PolarHBondContact O-N 2.79Å; A206-K209 VanDerWaalsContact O-N 3.16Å; A206-I210 VanDerWaalsContact O-CG1 3.31Å; A206-I210 WeakPolarHBondContact O-CG1 3.13Å; A206-I210 PolarHBondContact O-N 3.36Å
207	K	88.1	Confident	85.2	Confident	112 Å²	112	55.3 Å²	55.3	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-44.3	177	-172.4	176.9	-176.7	178.1	0	112.6	M203 E204 A205 K209 I210 H211	M203-K207 WeakPolarHBondContact O-CB 3.25Å; M203-K207 PolarHBondContact O-N 2.96Å; E204-K207 PolarHBondContact O-N 3.36Å; A205-K207 PolarHBondContact O-N 3.19Å; K207-K209 VanDerWaalsContact C-N 3.31Å; K207-K209 PolarHBondContact O-N 3.37Å; K207-I210 PolarHBondContact O-N 2.85Å; K207-H211 PolarHBondContact O-CD2 3.34Å; K207-H211 PolarHBondContact O-N 2.58Å; K207-H211 VanDerWaalsContact O-N 3.15Å
208	S	89.3	Confident	86.4	Confident	16 Å²	16	52.9 Å²	52.9	11%	0.112	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-44.6	173.5	177.2	0	0	0	0	111.6	E204 A205 A206 H211 Q212 A238	E204-S208 WeakPolarHBondContact O-CB 3.3Å; E204-S208 PolarHBondContact O-N 2.97Å; A205-S208 WeakPolarHBondContact O-CB 3.46Å; A205-S208 PolarHBondContact O-N 3.41Å; A206-S208 PolarHBondContact O-N 2.89Å; S208-H211 PolarHBondContact O-N 3.27Å; S208-Q212 WeakPolarHBondContact O-CG 3.33Å; S208-Q212 PolarHBondContact O-N 3.28Å; S208-Q212 PolarHBondContact OG-NE2 3.44Å; S208-A238 WeakPolarHBondContact OG-CB 3.24Å
209	K	91.5	Very high	87.6	Confident	82 Å²	82	47.5 Å²	47.5	36%	0.357	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-41.8	178.2	-152.7	-174.4	-177	-166.2	0	112.2	F150 A205 A206 K207 H211 Q212 Y213	F150-K209 HydrophobicContact CD1-CD 4.11Å; F150-K209 HydrophobicContact CE1-CB 4.21Å; F150-K209 HydrophobicContact CE1-CD 3.97Å; F150-K209 HydrophobicContact CE1-CG 4.28Å; F150-K209 HydrophobicContact CG-CD 4.47Å; F150-K209 HydrophobicContact CZ-CB 4.31Å; F150-K209 HydrophobicContact CZ-CD 4.23Å; A205-K209 WeakPolarHBondContact O-CB 3.16Å; A205-K209 PolarHBondContact O-N 2.78Å; A206-K209 WeakPolarHBondContact O-CB 3.39Å; A206-K209 PolarHBondContact O-N 2.79Å; A206-K209 VanDerWaalsContact O-N 3.16Å; K207-K209 VanDerWaalsContact C-N 3.31Å; K207-K209 PolarHBondContact O-N 3.37Å; K209-H211 PolarHBondContact O-N 2.95Å; K209-Q212 WeakPolarHBondContact O-CB 3.21Å; K209-Q212 PolarHBondContact O-N 2.79Å; K209-Y213 HydrophobicContact CD-CE2 3.76Å; K209-Y213 WeakPolarHBondContact CE-OH 3.46Å; K209-Y213 HydrophobicContact CG-CD2 4.06Å; K209-Y213 HydrophobicContact CG-CE2 3.55Å; K209-Y213 PolarHBondContact NZ-OH 2.92Å; K209-Y213 WeakPolarHBondContact O-CD2 3.5Å; K209-Y213 PolarHBondContact O-N 3Å
210	I	93.7	Very high	88.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-57	-47.8	175.8	-71.3	165.7	0	0	0	110.9	F150 L169 L172 A206 K207 Q212 Y213 K214	F150-I210 HydrophobicContact CE1-CG1 3.97Å; F150-I210 HydrophobicContact CZ-CG1 4.01Å; L169-I210 HydrophobicContact CB-CG2 4.47Å; L169-I210 HydrophobicContact CD2-CB 4.28Å; L169-I210 HydrophobicContact CD2-CG1 4.16Å; L169-I210 HydrophobicContact CD2-CG2 4.07Å; L172-I210 HydrophobicContact CB-CD1 3.98Å; L172-I210 HydrophobicContact CB-CG1 4.42Å; A206-I210 VanDerWaalsContact O-CG1 3.31Å; A206-I210 WeakPolarHBondContact O-CG1 3.13Å; A206-I210 PolarHBondContact O-N 3.36Å; K207-I210 PolarHBondContact O-N 2.85Å; I210-Q212 VanDerWaalsContact C-N 3.32Å; I210-Q212 PolarHBondContact O-N 3.31Å; I210-Y213 PolarHBondContact O-N 2.98Å; I210-K214 HydrophobicContact CG2-CD 4.15Å; I210-K214 WeakPolarHBondContact O-CG 3.26Å; I210-K214 PolarHBondContact O-N 3.49Å
211	H	94.8	Very high	89.4	Confident	22 Å²	22	45.3 Å²	45.3	10%	0.102	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-41.2	177.9	-69.1	-52.5	0	0	0	111.9	K207 S208 K209 Y213 K214 V215 E230 V234	K207-H211 PolarHBondContact O-CD2 3.34Å; K207-H211 PolarHBondContact O-N 2.58Å; K207-H211 VanDerWaalsContact O-N 3.15Å; S208-H211 PolarHBondContact O-N 3.27Å; K209-H211 PolarHBondContact O-N 2.95Å; H211-Y213 PolarHBondContact O-N 3.12Å; H211-K214 PolarHBondContact O-N 3.11Å; H211-V215 WeakPolarHBondContact O-CG2 3.25Å; H211-V215 PolarHBondContact O-N 3.32Å; H211-E230 IonicContact CE1-OE1 2.69Å; H211-E230 IonicContact CG-OE1 3.15Å; H211-E230 IonicContact ND1-OE1 2.87Å; H211-E230 PolarHBondContact ND1-OE1 3.04Å; H211-V234 HydrophobicContact CB-CG2 3.6Å
212	Q	94.9	Very high	90	Very high	40 Å²	40	48.9 Å²	48.9	19%	0.187	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-42.9	176.4	-67.8	175.7	44	0	0	112.1	S208 K209 I210 V215 R216 V234 P243 L247	S208-Q212 WeakPolarHBondContact O-CG 3.33Å; S208-Q212 PolarHBondContact O-N 3.28Å; S208-Q212 PolarHBondContact OG-NE2 3.44Å; K209-Q212 WeakPolarHBondContact O-CB 3.21Å; K209-Q212 PolarHBondContact O-N 2.79Å; I210-Q212 VanDerWaalsContact C-N 3.32Å; I210-Q212 PolarHBondContact O-N 3.31Å; Q212-V215 PolarHBondContact O-N 3.39Å; Q212-R216 WeakPolarHBondContact O-CG 3.42Å; Q212-R216 PolarHBondContact O-N 3.15Å; Q212-R216 VanDerWaalsContact O-N 3.09Å; Q212-V234 HydrophobicContact CG-CG1 4.07Å; Q212-V234 HydrophobicContact CG-CG2 4.25Å; Q212-P243 VanDerWaalsContact OE1-CB 3.31Å; Q212-L247 HydrophobicContact CB-CD1 3.85Å; Q212-L247 HydrophobicContact CG-CD1 3.93Å
213	Y	96.4	Very high	90.8	Very high	8 Å²	8	48.1 Å²	48.1	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-40.1	176.1	-74.7	-60	0	0	0	113.1	F150 V153 D154 L157 L169 K209 I210 H211 V215 R216 A217	F150-Y213 AromaticContact CD1-CD2 3.98Å; F150-Y213 HydrophobicContact CD1-CD2 3.98Å; F150-Y213 AromaticContact CD1-CE2 3.46Å; F150-Y213 HydrophobicContact CD1-CE2 3.46Å; F150-Y213 VanDerWaalsContact CD1-CE2 3.46Å; F150-Y213 HydrophobicContact CE1-CD2 4.01Å; F150-Y213 AromaticContact CE1-CE2 3.82Å; F150-Y213 HydrophobicContact CE1-CE2 3.82Å; V153-Y213 HydrophobicContact CG1-CD1 3.55Å; V153-Y213 HydrophobicContact CG1-CD2 4Å; V153-Y213 HydrophobicContact CG1-CE1 3.94Å; V153-Y213 HydrophobicContact CG1-CE2 4.38Å; V153-Y213 HydrophobicContact CG1-CG 3.56Å; D154-Y213 WeakPolarHBondContact OD1-CE1 3.03Å; D154-Y213 PolarHBondContact OD1-OH 3.34Å; D154-Y213 PolarHBondContact OD2-OH 2.89Å; L157-Y213 HydrophobicContact CD1-CD1 3.51Å; L157-Y213 HydrophobicContact CD1-CE1 4.23Å; L157-Y213 HydrophobicContact CD1-CG 4.39Å; L169-Y213 HydrophobicContact CD2-CD2 4.17Å; L169-Y213 HydrophobicContact CD2-CG 4.33Å; K209-Y213 HydrophobicContact CD-CE2 3.76Å; K209-Y213 WeakPolarHBondContact CE-OH 3.46Å; K209-Y213 HydrophobicContact CG-CD2 4.06Å; K209-Y213 HydrophobicContact CG-CE2 3.55Å; K209-Y213 PolarHBondContact NZ-OH 2.92Å; K209-Y213 WeakPolarHBondContact O-CD2 3.5Å; K209-Y213 PolarHBondContact O-N 3Å; I210-Y213 PolarHBondContact O-N 2.98Å; H211-Y213 PolarHBondContact O-N 3.12Å; Y213-V215 VanDerWaalsContact C-N 3.31Å; Y213-V215 PolarHBondContact O-N 2.9Å; Y213-R216 VanDerWaalsContact CE1-NH1 3.33Å; Y213-R216 WeakPolarHBondContact O-CB 3.45Å; Y213-R216 PolarHBondContact O-N 3.41Å; Y213-R216 VanDerWaalsContact O-N 3.14Å; Y213-A217 PolarHBondContact O-N 3.09Å
214	K	96.4	Very high	91.6	Very high	29 Å²	29	49 Å²	49	13%	0.126	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-42.6	174.5	-73.5	175.8	176.7	170.3	0	111.3	L166 L169 D173 I210 H211 R216 A217 Y218 E230	L166-K214 HydrophobicContact CD2-CB 4.33Å; L166-K214 HydrophobicContact CD2-CG 4.01Å; L169-K214 HydrophobicContact CB-CG 4.42Å; L169-K214 HydrophobicContact CD1-CG 3.88Å; D173-K214 IonicContact OD1-NZ 2.62Å; D173-K214 IonicContact OD2-NZ 2.94Å; D173-K214 PolarHBondContact OD2-NZ 3.43Å; I210-K214 HydrophobicContact CG2-CD 4.15Å; I210-K214 WeakPolarHBondContact O-CG 3.26Å; I210-K214 PolarHBondContact O-N 3.49Å; H211-K214 PolarHBondContact O-N 3.11Å; K214-R216 PolarHBondContact O-N 3.33Å; K214-A217 PolarHBondContact O-N 3.34Å; K214-Y218 HydrophobicContact CB-CD2 4.41Å; K214-Y218 HydrophobicContact CB-CE2 4.07Å; K214-Y218 WeakPolarHBondContact O-CD2 3.46Å; K214-Y218 PolarHBondContact O-N 3.48Å; K214-E230 HydrophobicContact CB-CG 3.59Å; K214-E230 WeakPolarHBondContact CD-OE1 3.37Å
215	V	96.7	Very high	92.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-46.8	173.6	175.6	0	0	0	0	111.2	H211 Q212 Y213 A217 Y218 I219 E230 I231 V234 L247	H211-V215 WeakPolarHBondContact O-CG2 3.25Å; H211-V215 PolarHBondContact O-N 3.32Å; Q212-V215 PolarHBondContact O-N 3.39Å; Y213-V215 VanDerWaalsContact C-N 3.31Å; Y213-V215 PolarHBondContact O-N 2.9Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.42Å; V215-Y218 PolarHBondContact O-N 3.19Å; V215-I219 HydrophobicContact CG1-CD1 3.82Å; V215-I219 HydrophobicContact CG1-CG1 4.39Å; V215-I219 WeakPolarHBondContact O-CB 3.48Å; V215-I219 WeakPolarHBondContact O-CG1 3.48Å; V215-I219 PolarHBondContact O-N 2.9Å; V215-E230 HydrophobicContact CG2-CB 3.79Å; V215-E230 HydrophobicContact CG2-CG 3.67Å; V215-I231 HydrophobicContact CG1-CD1 4.36Å; V215-I231 HydrophobicContact CG1-CG1 3.91Å; V215-I231 HydrophobicContact CG2-CG1 3.87Å; V215-V234 HydrophobicContact CG2-CG2 3.77Å; V215-L247 HydrophobicContact CB-CD1 4.35Å; V215-L247 HydrophobicContact CG1-CB 4.06Å; V215-L247 HydrophobicContact CG1-CD1 4.4Å; V215-L247 HydrophobicContact CG1-CD2 4.08Å; V215-L247 HydrophobicContact CG1-CG 4.41Å
216	R	95.9	Very high	92.8	Very high	86 Å²	86	47 Å²	47	33%	0.325	23%	0.225	S	C	.	.	H	α-helix	trans	-58	-45.1	177.1	-68.6	171.7	68.8	-171.4	-2.3	111.7	D154 L157 Q212 Y213 K214 I219 Q220 L247	D154-R216 IonicContact OD1-NH1 3.47Å; D154-R216 PolarHBondContact OD1-NH1 3.14Å; L157-R216 HydrophobicContact CD1-CB 3.99Å; Q212-R216 WeakPolarHBondContact O-CG 3.42Å; Q212-R216 PolarHBondContact O-N 3.15Å; Q212-R216 VanDerWaalsContact O-N 3.09Å; Y213-R216 VanDerWaalsContact CE1-NH1 3.33Å; Y213-R216 WeakPolarHBondContact O-CB 3.45Å; Y213-R216 PolarHBondContact O-N 3.41Å; Y213-R216 VanDerWaalsContact O-N 3.14Å; K214-R216 PolarHBondContact O-N 3.33Å; R216-I219 PolarHBondContact O-N 2.95Å; R216-Q220 WeakPolarHBondContact O-CG 3.41Å; R216-Q220 PolarHBondContact O-N 3.49Å; R216-Q220 VanDerWaalsContact O-N 3.15Å; R216-L247 HydrophobicContact CG-CD2 3.72Å
217	A	96	Very high	93.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-48.8	177.1	0	0	0	0	0	112	L157 P162 L166 Y213 K214 V215 I219 Q220 M221	L157-A217 HydrophobicContact CD2-CB 3.9Å; P162-A217 HydrophobicContact CB-CB 3.98Å; L166-A217 HydrophobicContact CD1-CB 4.21Å; L166-A217 HydrophobicContact CD2-CB 3.83Å; L166-A217 HydrophobicContact CG-CB 3.73Å; Y213-A217 PolarHBondContact O-N 3.09Å; K214-A217 PolarHBondContact O-N 3.34Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.42Å; A217-I219 VanDerWaalsContact C-N 3.29Å; A217-I219 PolarHBondContact O-N 3.35Å; A217-Q220 PolarHBondContact O-N 3Å; A217-Q220 VanDerWaalsContact O-N 3.11Å; A217-M221 WeakPolarHBondContact O-CG 3.45Å; A217-M221 PolarHBondContact O-N 3.24Å
218	Y	95.8	Very high	93.7	Very high	50 Å²	50	45.9 Å²	45.9	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-31.8	179.3	-67.3	-48.1	0	0	0	113.2	L166 K214 V215 K222 S223 A226 E230	L166-Y218 HydrophobicContact CD1-CD1 4.13Å; L166-Y218 HydrophobicContact CD1-CE1 3.72Å; L166-Y218 HydrophobicContact CD2-CE1 4.12Å; L166-Y218 HydrophobicContact CD2-CE2 4.42Å; K214-Y218 HydrophobicContact CB-CD2 4.41Å; K214-Y218 HydrophobicContact CB-CE2 4.07Å; K214-Y218 WeakPolarHBondContact O-CD2 3.46Å; K214-Y218 PolarHBondContact O-N 3.48Å; V215-Y218 PolarHBondContact O-N 3.19Å; Y218-K222 PolarHBondContact O-N 3.44Å; Y218-K222 VanDerWaalsContact O-N 3.12Å; Y218-S223 PolarHBondContact O-N 3.44Å; Y218-A226 HydrophobicContact CD1-CB 3.66Å; Y218-A226 HydrophobicContact CD2-CB 4.05Å; Y218-A226 HydrophobicContact CE1-CB 3.65Å; Y218-A226 HydrophobicContact CE2-CB 4.04Å; Y218-A226 HydrophobicContact CG-CB 3.88Å; Y218-E230 HydrophobicContact CD2-CB 4.14Å; Y218-E230 HydrophobicContact CD2-CG 4.39Å; Y218-E230 HydrophobicContact CE2-CB 4.2Å; Y218-E230 HydrophobicContact CE2-CG 4.26Å
219	I	93.6	Very high	93.9	Very high	28 Å²	28	53.5 Å²	53.5	14%	0.144	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-47.2	171.3	-75.2	171	0	0	0	110.7	V215 R216 A217 M221 K222 N250 L254	V215-I219 HydrophobicContact CG1-CD1 3.82Å; V215-I219 HydrophobicContact CG1-CG1 4.39Å; V215-I219 WeakPolarHBondContact O-CB 3.48Å; V215-I219 WeakPolarHBondContact O-CG1 3.48Å; V215-I219 PolarHBondContact O-N 2.9Å; R216-I219 PolarHBondContact O-N 2.95Å; A217-I219 VanDerWaalsContact C-N 3.29Å; A217-I219 PolarHBondContact O-N 3.35Å; I219-M221 VanDerWaalsContact C-N 3.33Å; I219-M221 PolarHBondContact O-N 3.46Å; I219-K222 PolarHBondContact O-N 3Å; I219-N250 HydrophobicContact CD1-CB 4.41Å; I219-L254 HydrophobicContact CB-CD1 4.47Å; I219-L254 HydrophobicContact CG1-CD1 4.32Å; I219-L254 HydrophobicContact CG2-CD1 3.66Å
220	Q	91.1	Very high	94.1	Very high	36 Å²	36	50.7 Å²	50.7	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-39.8	178.9	-70.9	-177.2	-13.2	0	0	112.4	L157 F160 P162 R216 A217 K222	L157-Q220 PolarHBondContact O-NE2 2.65Å; F160-Q220 HydrophobicContact CD2-CB 4.45Å; F160-Q220 HydrophobicContact CD2-CG 4.03Å; F160-Q220 HydrophobicContact CE1-CB 4.28Å; F160-Q220 HydrophobicContact CE2-CB 3.91Å; F160-Q220 HydrophobicContact CE2-CG 3.61Å; F160-Q220 HydrophobicContact CZ-CB 3.81Å; F160-Q220 HydrophobicContact CZ-CG 4.04Å; P162-Q220 HydrophobicContact CB-CB 4.24Å; P162-Q220 HydrophobicContact CG-CB 4.23Å; R216-Q220 WeakPolarHBondContact O-CG 3.41Å; R216-Q220 PolarHBondContact O-N 3.49Å; R216-Q220 VanDerWaalsContact O-N 3.15Å; A217-Q220 PolarHBondContact O-N 3Å; A217-Q220 VanDerWaalsContact O-N 3.11Å; Q220-K222 PolarHBondContact O-N 3.44Å
221	M	89.8	Confident	94.2	Very high	69 Å²	69	51.2 Å²	51.2	34%	0.34	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.5	175.1	-63.5	179.4	76.4	0	0	113.5	P162 E163 L166 A217 I219 S223	P162-M221 HydrophobicContact CB-CG 3.71Å; P162-M221 HydrophobicContact CB-SD 4.18Å; P162-M221 HydrophobicContact CG-CG 3.42Å; P162-M221 VanDerWaalsContact CG-CG 3.42Å; P162-M221 HydrophobicContact CG-SD 4.27Å; E163-M221 HydrophobicContact CG-CE 3.98Å; E163-M221 WeakPolarHBondContact OE1-CE 3.46Å; L166-M221 HydrophobicContact CD1-SD 3.61Å; A217-M221 WeakPolarHBondContact O-CG 3.45Å; A217-M221 PolarHBondContact O-N 3.24Å; I219-M221 VanDerWaalsContact C-N 3.33Å; I219-M221 PolarHBondContact O-N 3.46Å; M221-S223 PolarHBondContact O-N 3.37Å
222	K	89.1	Confident	94.2	Very high	130 Å²	130	56.4 Å²	56.4	57%	0.565	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	31.3	-171.6	-51.9	-176.2	-176.4	177	0	113.3	Y218 I219 Q220 S224	Y218-K222 PolarHBondContact O-N 3.44Å; Y218-K222 VanDerWaalsContact O-N 3.12Å; I219-K222 PolarHBondContact O-N 3Å; Q220-K222 PolarHBondContact O-N 3.44Å; K222-S224 PolarHBondContact O-N 3.4Å
223	S	92.9	Very high	94.2	Very high	47 Å²	47	56.3 Å²	56.3	33%	0.329	26%	0.262	S	S	.	.			trans	-88.5	82.8	180	-173.4	0	0	0	0	112	Y218 M221 K225 A226 C227	Y218-S223 PolarHBondContact O-N 3.44Å; M221-S223 PolarHBondContact O-N 3.37Å; S223-K225 PolarHBondContact O-N 3.07Å; S223-A226 PolarHBondContact O-N 3.18Å; S223-A226 WeakPolarHBondContact OG-CB 3.3Å; S223-C227 VanDerWaalsContact O-CB 3.25Å; S223-C227 WeakPolarHBondContact O-CB 3.32Å; S223-C227 PolarHBondContact O-N 3.04Å
224	S	90.9	Very high	94.1	Very high	70 Å²	70	56 Å²	56	49%	0.49	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-39.8	-172.7	-65.5	0	0	0	0	114.5	K222 K228	K222-S224 PolarHBondContact O-N 3.4Å; S224-K228 WeakPolarHBondContact O-CB 3.47Å; S224-K228 PolarHBondContact O-N 2.99Å
225	K	93.5	Very high	93.9	Very high	145 Å²	145	56.3 Å²	56.3	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-67.8	-45	-178.2	-68.8	178.7	-177	168.3	0	111.8	S223 R229	S223-K225 PolarHBondContact O-N 3.07Å; K225-R229 PolarHBondContact O-N 3.26Å
226	A	93.8	Very high	93.7	Very high	10 Å²	10	63 Å²	63	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-45.9	176.9	0	0	0	0	0	110.9	Y218 S223 K228 R229 E230	Y218-A226 HydrophobicContact CD1-CB 3.66Å; Y218-A226 HydrophobicContact CD2-CB 4.05Å; Y218-A226 HydrophobicContact CE1-CB 3.65Å; Y218-A226 HydrophobicContact CE2-CB 4.04Å; Y218-A226 HydrophobicContact CG-CB 3.88Å; S223-A226 PolarHBondContact O-N 3.18Å; S223-A226 WeakPolarHBondContact OG-CB 3.3Å; A226-K228 PolarHBondContact O-N 2.9Å; A226-R229 PolarHBondContact O-N 3.03Å; A226-E230 PolarHBondContact O-N 3.18Å
227	C	95.5	Very high	93.4	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-57.3	-43.6	177.4	-169.7	0	0	0	0	112.9	S223 R229 E230 I231 F251	S223-C227 VanDerWaalsContact O-CB 3.25Å; S223-C227 WeakPolarHBondContact O-CB 3.32Å; S223-C227 PolarHBondContact O-N 3.04Å; C227-R229 VanDerWaalsContact C-N 3.33Å; C227-R229 PolarHBondContact O-N 3.31Å; C227-E230 PolarHBondContact O-N 3.43Å; C227-I231 WeakPolarHBondContact O-CG1 3.37Å; C227-I231 PolarHBondContact O-N 3.35Å; C227-F251 HydrophobicContact CB-CD2 4.01Å; C227-F251 HydrophobicContact CB-CE2 3.91Å; C227-F251 WeakPolarHBondContact SG-CD2 3.48Å
228	K	95.3	Very high	93	Very high	92 Å²	92	62.9 Å²	62.9	40%	0.4	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-40.5	178.4	-173.5	-179.9	177.6	-175.5	0	112.5	S224 A226 F251	S224-K228 WeakPolarHBondContact O-CB 3.47Å; S224-K228 PolarHBondContact O-N 2.99Å; A226-K228 PolarHBondContact O-N 2.9Å; K228-F251 HydrophobicContact CB-CE1 4.26Å; K228-F251 HydrophobicContact CB-CZ 3.77Å; K228-F251 HydrophobicContact CG-CE1 4.41Å; K228-F251 HydrophobicContact CG-CZ 4.32Å
229	R	95.3	Very high	92.6	Very high	176 Å²	176	62 Å²	62	66%	0.664	32%	0.317	S	S	*	.	H	α-helix	trans	-66.2	-46.8	176.5	-70.6	-172	-66.9	166.1	0.2	110.3	K225 A226 C227 I231 K232 S233	K225-R229 PolarHBondContact O-N 3.26Å; A226-R229 PolarHBondContact O-N 3.03Å; C227-R229 VanDerWaalsContact C-N 3.33Å; C227-R229 PolarHBondContact O-N 3.31Å; R229-I231 PolarHBondContact O-N 3.42Å; R229-K232 WeakPolarHBondContact O-CB 3.29Å; R229-K232 PolarHBondContact O-N 3.39Å; R229-K232 VanDerWaalsContact O-N 3.1Å; R229-S233 PolarHBondContact O-N 3.1Å
230	E	95.7	Very high	92.4	Very high	23 Å²	23	66.5 Å²	66.5	11%	0.107	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-35.6	-176.4	-158.9	64.7	-155.4	0	0	113.1	H211 K214 V215 Y218 A226 C227 K232 S233 V234	H211-E230 IonicContact CE1-OE1 2.69Å; H211-E230 IonicContact CG-OE1 3.15Å; H211-E230 IonicContact ND1-OE1 2.87Å; H211-E230 PolarHBondContact ND1-OE1 3.04Å; K214-E230 HydrophobicContact CB-CG 3.59Å; K214-E230 WeakPolarHBondContact CD-OE1 3.37Å; V215-E230 HydrophobicContact CG2-CB 3.79Å; V215-E230 HydrophobicContact CG2-CG 3.67Å; Y218-E230 HydrophobicContact CD2-CB 4.14Å; Y218-E230 HydrophobicContact CD2-CG 4.39Å; Y218-E230 HydrophobicContact CE2-CB 4.2Å; Y218-E230 HydrophobicContact CE2-CG 4.26Å; A226-E230 PolarHBondContact O-N 3.18Å; C227-E230 PolarHBondContact O-N 3.43Å; E230-K232 PolarHBondContact O-N 3.13Å; E230-S233 WeakPolarHBondContact O-CA 3.33Å; E230-S233 VanDerWaalsContact O-CB 3.3Å; E230-S233 WeakPolarHBondContact O-CB 3.38Å; E230-S233 PolarHBondContact O-N 3.43Å; E230-V234 PolarHBondContact O-N 2.97Å
231	I	95.6	Very high	92.3	Very high	13 Å²	13	66.7 Å²	66.7	7%	0.067	35%	0.347	C	S	.	.	H	α-helix	trans	-59.1	-36.9	173.1	-75.7	167.7	0	0	0	111.4	V215 C227 R229 S233 V234 M235 K248 F251	V215-I231 HydrophobicContact CG1-CD1 4.36Å; V215-I231 HydrophobicContact CG1-CG1 3.91Å; V215-I231 HydrophobicContact CG2-CG1 3.87Å; C227-I231 WeakPolarHBondContact O-CG1 3.37Å; C227-I231 PolarHBondContact O-N 3.35Å; R229-I231 PolarHBondContact O-N 3.42Å; I231-S233 VanDerWaalsContact C-N 3.31Å; I231-S233 PolarHBondContact O-N 3.42Å; I231-V234 PolarHBondContact O-N 3.14Å; I231-M235 HydrophobicContact CG2-CG 4.34Å; I231-M235 VanDerWaalsContact O-CG 3.26Å; I231-M235 WeakPolarHBondContact O-CG 3.34Å; I231-M235 PolarHBondContact O-N 3.37Å; I231-K248 HydrophobicContact CG2-CB 4.25Å; I231-K248 HydrophobicContact CG2-CD 4.21Å; I231-K248 HydrophobicContact CG2-CG 3.95Å; I231-F251 HydrophobicContact CD1-CB 3.3Å; I231-F251 HydrophobicContact CD1-CD1 3.53Å; I231-F251 HydrophobicContact CD1-CD2 3.93Å; I231-F251 HydrophobicContact CD1-CE1 4.31Å; I231-F251 HydrophobicContact CD1-CG 3.29Å
232	K	94.8	Very high	92.3	Very high	131 Å²	131	64.5 Å²	64.5	57%	0.57	34%	0.339	S	S	*	.	H	α-helix	trans	-62.6	-42.1	175.3	-64	179.4	-178.8	-176.7	0	110.7	R229 E230 M235 N236	R229-K232 WeakPolarHBondContact O-CB 3.29Å; R229-K232 PolarHBondContact O-N 3.39Å; R229-K232 VanDerWaalsContact O-N 3.1Å; E230-K232 PolarHBondContact O-N 3.13Å; K232-M235 PolarHBondContact O-N 2.98Å; K232-N236 PolarHBondContact O-N 3.17Å; K232-N236 PolarHBondContact O-OD1 2.84Å
233	S	94.5	Very high	92.4	Very high	37 Å²	37	61 Å²	61	26%	0.259	33%	0.33	S	S	.	.	H	α-helix	trans	-59.7	-46.9	175.3	-51.1	0	0	0	0	111.5	R229 E230 I231 M235 N236 T237	R229-S233 PolarHBondContact O-N 3.1Å; E230-S233 WeakPolarHBondContact O-CA 3.33Å; E230-S233 VanDerWaalsContact O-CB 3.3Å; E230-S233 WeakPolarHBondContact O-CB 3.38Å; E230-S233 PolarHBondContact O-N 3.43Å; I231-S233 VanDerWaalsContact C-N 3.31Å; I231-S233 PolarHBondContact O-N 3.42Å; S233-M235 PolarHBondContact O-N 3.37Å; S233-N236 PolarHBondContact O-N 3.43Å; S233-N236 VanDerWaalsContact O-N 3.13Å; S233-T237 PolarHBondContact O-N 3.33Å; S233-T237 PolarHBondContact O-OG1 3.42Å
234	V	93.9	Very high	92.4	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	31%	0.314	C	S	.	.	H	α-helix	trans	-58.1	-45.5	175.6	173.9	0	0	0	0	111.8	H211 Q212 V215 E230 I231 N236 T237 A238 S244	H211-V234 HydrophobicContact CB-CG2 3.6Å; Q212-V234 HydrophobicContact CG-CG1 4.07Å; Q212-V234 HydrophobicContact CG-CG2 4.25Å; V215-V234 HydrophobicContact CG2-CG2 3.77Å; E230-V234 PolarHBondContact O-N 2.97Å; I231-V234 PolarHBondContact O-N 3.14Å; V234-N236 VanDerWaalsContact C-N 3.27Å; V234-N236 PolarHBondContact O-N 3.16Å; V234-T237 PolarHBondContact O-N 2.97Å; V234-T237 PolarHBondContact O-OG1 3.48Å; V234-A238 WeakPolarHBondContact O-CB 3.4Å; V234-A238 PolarHBondContact O-N 3.3Å; V234-S244 WeakPolarHBondContact CG1-OG 3.37Å
235	M	92.9	Very high	92.6	Very high	34 Å²	34	55.6 Å²	55.6	17%	0.167	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-32.9	178.6	-64.1	-58.8	-53.4	0	0	112.2	I231 K232 S233 G239 N240 K248	I231-M235 HydrophobicContact CG2-CG 4.34Å; I231-M235 VanDerWaalsContact O-CG 3.26Å; I231-M235 WeakPolarHBondContact O-CG 3.34Å; I231-M235 PolarHBondContact O-N 3.37Å; K232-M235 PolarHBondContact O-N 2.98Å; S233-M235 PolarHBondContact O-N 3.37Å; M235-G239 WeakPolarHBondContact CE-O 3.43Å; M235-G239 WeakPolarHBondContact O-CA 3.29Å; M235-G239 PolarHBondContact O-N 2.73Å; M235-G239 VanDerWaalsContact O-N 3.09Å; M235-N240 WeakPolarHBondContact CE-OD1 3.44Å; M235-K248 HydrophobicContact CG-CD 4.34Å; M235-K248 HydrophobicContact SD-CD 3.82Å
236	N	92.5	Very high	92.7	Very high	141 Å²	141	50 Å²	50	75%	0.754	27%	0.268	S	S	*	.	H	α-helix	trans	-73.5	-37	178.2	-69.2	-9.5	0	0	0	112.3	K232 S233 V234	K232-N236 PolarHBondContact O-N 3.17Å; K232-N236 PolarHBondContact O-OD1 2.84Å; S233-N236 PolarHBondContact O-N 3.43Å; S233-N236 VanDerWaalsContact O-N 3.13Å; V234-N236 VanDerWaalsContact C-N 3.27Å; V234-N236 PolarHBondContact O-N 3.16Å
237	T	90.2	Very high	92.7	Very high	59 Å²	59	50.6 Å²	50.6	36%	0.362	27%	0.269	S	S	.	.	H	α-helix	trans	-88.9	-35.1	-177.4	56.9	0	0	0	0	113.6	S233 V234	S233-T237 PolarHBondContact O-N 3.33Å; S233-T237 PolarHBondContact O-OG1 3.42Å; V234-T237 PolarHBondContact O-N 2.97Å; V234-T237 PolarHBondContact O-OG1 3.48Å
238	A	86.2	Confident	92.8	Very high	24 Å²	24	53.2 Å²	53.2	20%	0.198	28%	0.28	C	S	.	.	H	α-helix	trans	-114.3	0.8	-172.9	0	0	0	0	0	113.7	S208 V234 S241 S244	S208-A238 WeakPolarHBondContact OG-CB 3.24Å; V234-A238 WeakPolarHBondContact O-CB 3.4Å; V234-A238 PolarHBondContact O-N 3.3Å; A238-S241 WeakPolarHBondContact O-CB 3.11Å; A238-S241 PolarHBondContact O-N 3.25Å; A238-S241 PolarHBondContact O-OG 2.6Å; A238-S244 VanDerWaalsContact CB-OG 3.29Å; A238-S244 WeakPolarHBondContact CB-OG 3.49Å
239	G	87.9	Confident	92.8	Very high	31 Å²	31	49 Å²	49	32%	0.32	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	-143.4	-179.3	0	0	0	0	0	113.2	M235 S241 S244	M235-G239 WeakPolarHBondContact CE-O 3.43Å; M235-G239 WeakPolarHBondContact O-CA 3.29Å; M235-G239 PolarHBondContact O-N 2.73Å; M235-G239 VanDerWaalsContact O-N 3.09Å; G239-S241 PolarHBondContact O-N 2.64Å; G239-S244 WeakPolarHBondContact O-CB 3.42Å; G239-S244 PolarHBondContact O-OG 3.19Å; G239-S244 VanDerWaalsContact O-OG 3.09Å
240	N	89.7	Confident	92.9	Very high	123 Å²	123	43.6 Å²	43.6	66%	0.658	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	34.9	177.3	-68.9	-27.4	0	0	0	113	M235 L245	M235-N240 WeakPolarHBondContact CE-OD1 3.44Å; N240-L245 HydrophobicContact CB-CD1 4.35Å; N240-L245 WeakPolarHBondContact O-CD1 3.43Å
241	S	89.4	Confident	92.9	Very high	41 Å²	41	43 Å²	43	29%	0.287	24%	0.244	S	C	.	.			trans	-59.9	157.1	172.8	76.1	0	0	0	0	111.8	A238 G239 S244 L245	A238-S241 WeakPolarHBondContact O-CB 3.11Å; A238-S241 PolarHBondContact O-N 3.25Å; A238-S241 PolarHBondContact O-OG 2.6Å; G239-S241 PolarHBondContact O-N 2.64Å; S241-S244 WeakPolarHBondContact O-CB 3.45Å; S241-S244 PolarHBondContact O-N 2.95Å; S241-S244 PolarHBondContact OG-N 3.44Å; S241-S244 PolarHBondContact OG-OG 2.95Å; S241-L245 PolarHBondContact O-N 3.29Å
242	A	89.6	Confident	92.9	Very high	22 Å²	22	42.9 Å²	42.9	18%	0.182	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-47.3	177.2	0	0	0	0	0	112.6	S244 L245 F246	A242-S244 PolarHBondContact O-N 3.32Å; A242-L245 PolarHBondContact O-N 2.84Å; A242-F246 WeakPolarHBondContact O-CB 3.43Å; A242-F246 WeakPolarHBondContact O-CD2 3.44Å; A242-F246 PolarHBondContact O-N 3.43Å
243	P	90.8	Very high	93	Very high	56 Å²	56	39.7 Å²	39.7	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-56.7	-43.9	174.4	-26.6	35.4	0	0	0	113.6	Q212 L245 F246 L247	Q212-P243 VanDerWaalsContact OE1-CB 3.31Å; P243-L245 PolarHBondContact O-N 3.47Å; P243-F246 PolarHBondContact O-N 3.13Å; P243-L247 WeakPolarHBondContact O-CB 3.2Å; P243-L247 VanDerWaalsContact O-CG 3.29Å; P243-L247 WeakPolarHBondContact O-CG 3.45Å; P243-L247 PolarHBondContact O-N 3.38Å
244	S	92.6	Very high	93	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	24%	0.241	C	C	.	.	H	α-helix	trans	-58.5	-47.8	177.8	-58.9	0	0	0	0	112.2	V234 A238 G239 S241 A242 K248	V234-S244 WeakPolarHBondContact CG1-OG 3.37Å; A238-S244 VanDerWaalsContact CB-OG 3.29Å; A238-S244 WeakPolarHBondContact CB-OG 3.49Å; G239-S244 WeakPolarHBondContact O-CB 3.42Å; G239-S244 PolarHBondContact O-OG 3.19Å; G239-S244 VanDerWaalsContact O-OG 3.09Å; S241-S244 WeakPolarHBondContact O-CB 3.45Å; S241-S244 PolarHBondContact O-N 2.95Å; S241-S244 PolarHBondContact OG-N 3.44Å; S241-S244 PolarHBondContact OG-OG 2.95Å; A242-S244 PolarHBondContact O-N 3.32Å; S244-K248 VanDerWaalsContact O-CB 3.3Å; S244-K248 WeakPolarHBondContact O-CB 3.41Å; S244-K248 PolarHBondContact O-N 2.94Å
245	L	94.8	Very high	92.9	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-69.4	-37.9	-177.9	-69.7	173.2	0	0	0	112	N240 S241 A242 P243 S249 L264	N240-L245 HydrophobicContact CB-CD1 4.35Å; N240-L245 WeakPolarHBondContact O-CD1 3.43Å; S241-L245 PolarHBondContact O-N 3.29Å; A242-L245 PolarHBondContact O-N 2.84Å; P243-L245 PolarHBondContact O-N 3.47Å; L245-S249 VanDerWaalsContact O-CB 3.22Å; L245-S249 WeakPolarHBondContact O-CB 3.29Å; L245-S249 PolarHBondContact O-N 3.19Å; L245-L264 HydrophobicContact CD2-CD2 4.12Å
246	F	95.1	Very high	93	Very high	27 Å²	27	48.5 Å²	48.5	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-46.1	175.8	-87.9	-119.3	0	0	0	111.7	A242 P243 S249 N250 L265 V283 M286 F287	A242-F246 WeakPolarHBondContact O-CB 3.43Å; A242-F246 WeakPolarHBondContact O-CD2 3.44Å; A242-F246 PolarHBondContact O-N 3.43Å; P243-F246 PolarHBondContact O-N 3.13Å; F246-S249 PolarHBondContact O-N 3.18Å; F246-N250 WeakPolarHBondContact O-CB 3.35Å; F246-N250 PolarHBondContact O-N 3.35Å; F246-L265 HydrophobicContact CD1-CD2 4.12Å; F246-L265 HydrophobicContact CD2-CD2 3.98Å; F246-L265 HydrophobicContact CE1-CD2 4.18Å; F246-L265 HydrophobicContact CE2-CD2 4.07Å; F246-L265 HydrophobicContact CG-CD2 4.03Å; F246-L265 HydrophobicContact CZ-CD2 4.17Å; F246-V283 HydrophobicContact CE2-CG1 4.16Å; F246-V283 HydrophobicContact CZ-CG1 3.84Å; F246-M286 HydrophobicContact CE1-CB 3.83Å; F246-F287 HydrophobicContact CZ-CB 4.03Å
247	L	95.6	Very high	93.2	Very high	23 Å²	23	44.8 Å²	44.8	12%	0.12	25%	0.25	C	S	.	.	H	α-helix	trans	-62.2	-44.9	176.7	-72	172.8	0	0	0	111.7	Q212 V215 R216 P243 S249 N250 F251	Q212-L247 HydrophobicContact CB-CD1 3.85Å; Q212-L247 HydrophobicContact CG-CD1 3.93Å; V215-L247 HydrophobicContact CB-CD1 4.35Å; V215-L247 HydrophobicContact CG1-CB 4.06Å; V215-L247 HydrophobicContact CG1-CD1 4.4Å; V215-L247 HydrophobicContact CG1-CD2 4.08Å; V215-L247 HydrophobicContact CG1-CG 4.41Å; R216-L247 HydrophobicContact CG-CD2 3.72Å; P243-L247 WeakPolarHBondContact O-CB 3.2Å; P243-L247 VanDerWaalsContact O-CG 3.29Å; P243-L247 WeakPolarHBondContact O-CG 3.45Å; P243-L247 PolarHBondContact O-N 3.38Å; L247-S249 PolarHBondContact O-N 3.25Å; L247-N250 PolarHBondContact O-N 2.99Å; L247-F251 PolarHBondContact O-N 3.09Å
248	K	95.9	Very high	93.5	Very high	56 Å²	56	45.5 Å²	45.5	24%	0.243	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-38.6	177	-169.3	174.6	-179.9	178.7	0	112.1	I231 M235 S244 F251 E252 L264	I231-K248 HydrophobicContact CG2-CB 4.25Å; I231-K248 HydrophobicContact CG2-CD 4.21Å; I231-K248 HydrophobicContact CG2-CG 3.95Å; M235-K248 HydrophobicContact CG-CD 4.34Å; M235-K248 HydrophobicContact SD-CD 3.82Å; S244-K248 VanDerWaalsContact O-CB 3.3Å; S244-K248 WeakPolarHBondContact O-CB 3.41Å; S244-K248 PolarHBondContact O-N 2.94Å; K248-F251 PolarHBondContact O-N 3.22Å; K248-E252 WeakPolarHBondContact O-CG 3.29Å; K248-E252 PolarHBondContact O-N 2.91Å; K248-E252 VanDerWaalsContact O-N 3.07Å; K248-L264 HydrophobicContact CB-CD1 4.35Å; K248-L264 HydrophobicContact CD-CD1 4.3Å; K248-L264 HydrophobicContact CD-CD2 4.08Å; K248-L264 HydrophobicContact CG-CD1 3.85Å; K248-L264 HydrophobicContact CG-CD2 4.49Å
249	S	96.8	Very high	94	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.028	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-45.3	174.9	-179.3	0	0	0	0	111.9	L245 F246 L247 F251 E252 Y253 A261 L265	L245-S249 VanDerWaalsContact O-CB 3.22Å; L245-S249 WeakPolarHBondContact O-CB 3.29Å; L245-S249 PolarHBondContact O-N 3.19Å; F246-S249 PolarHBondContact O-N 3.18Å; L247-S249 PolarHBondContact O-N 3.25Å; S249-F251 VanDerWaalsContact C-N 3.32Å; S249-F251 PolarHBondContact O-N 3.37Å; S249-E252 PolarHBondContact O-N 2.96Å; S249-Y253 WeakPolarHBondContact O-CB 3.37Å; S249-Y253 PolarHBondContact O-N 3.3Å; S249-A261 WeakPolarHBondContact OG-CA 3.37Å; S249-A261 WeakPolarHBondContact OG-CB 3.25Å; S249-A261 PolarHBondContact OG-O 3.46Å; S249-L265 VanDerWaalsContact OG-CG 3.31Å; S249-L265 WeakPolarHBondContact OG-CG 3.33Å
250	N	96	Very high	94.4	Very high	62 Å²	62	57.5 Å²	57.5	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-58.3	-44.9	176.2	-172.4	-8.1	0	0	0	111.1	I219 F246 L247 E252 Y253 L254	I219-N250 HydrophobicContact CD1-CB 4.41Å; F246-N250 WeakPolarHBondContact O-CB 3.35Å; F246-N250 PolarHBondContact O-N 3.35Å; L247-N250 PolarHBondContact O-N 2.99Å; N250-E252 PolarHBondContact O-N 3.01Å; N250-Y253 WeakPolarHBondContact O-CB 3.43Å; N250-Y253 PolarHBondContact O-N 3.22Å; N250-L254 WeakPolarHBondContact O-CG 3.34Å; N250-L254 PolarHBondContact O-N 3.37Å
251	F	96.2	Very high	94.7	Very high	12 Å²	12	51.7 Å²	51.7	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-43.7	175.3	176.9	-106.3	0	0	0	113.4	C227 K228 I231 L247 K248 S249 Y253 L254 R255	C227-F251 HydrophobicContact CB-CD2 4.01Å; C227-F251 HydrophobicContact CB-CE2 3.91Å; C227-F251 WeakPolarHBondContact SG-CD2 3.48Å; K228-F251 HydrophobicContact CB-CE1 4.26Å; K228-F251 HydrophobicContact CB-CZ 3.77Å; K228-F251 HydrophobicContact CG-CE1 4.41Å; K228-F251 HydrophobicContact CG-CZ 4.32Å; I231-F251 HydrophobicContact CD1-CB 3.3Å; I231-F251 HydrophobicContact CD1-CD1 3.53Å; I231-F251 HydrophobicContact CD1-CD2 3.93Å; I231-F251 HydrophobicContact CD1-CE1 4.31Å; I231-F251 HydrophobicContact CD1-CG 3.29Å; L247-F251 PolarHBondContact O-N 3.09Å; K248-F251 PolarHBondContact O-N 3.22Å; S249-F251 VanDerWaalsContact C-N 3.32Å; S249-F251 PolarHBondContact O-N 3.37Å; F251-Y253 VanDerWaalsContact C-N 3.35Å; F251-L254 PolarHBondContact O-N 3.03Å; F251-R255 HydrophobicContact CZ-CG 4.38Å; F251-R255 WeakPolarHBondContact O-CG 3.12Å; F251-R255 PolarHBondContact O-N 3.03Å
252	E	96.2	Very high	95.1	Very high	9 Å²	9	51.1 Å²	51.1	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-68.2	-34.5	176.1	-66.1	-65.6	175.5	0	0	112.2	K248 S249 N250 R255 G256 N257 K260 A261 L264	K248-E252 WeakPolarHBondContact O-CG 3.29Å; K248-E252 PolarHBondContact O-N 2.91Å; K248-E252 VanDerWaalsContact O-N 3.07Å; S249-E252 PolarHBondContact O-N 2.96Å; N250-E252 PolarHBondContact O-N 3.01Å; E252-R255 PolarHBondContact O-N 2.74Å; E252-G256 PolarHBondContact O-N 3.19Å; E252-N257 HydrophobicContact CB-CB 4.16Å; E252-N257 WeakPolarHBondContact O-CA 3.36Å; E252-N257 WeakPolarHBondContact O-CB 3.48Å; E252-N257 PolarHBondContact O-N 3.4Å; E252-N257 WeakPolarHBondContact OE2-CB 3.22Å; E252-N257 PolarHBondContact OE2-ND2 3.3Å; E252-K260 HydrophobicContact CG-CD 3.96Å; E252-K260 HydrophobicContact CG-CG 4.23Å; E252-K260 VanDerWaalsContact OE1-CE 3.31Å; E252-K260 WeakPolarHBondContact OE1-CE 3.26Å; E252-K260 IonicContact OE1-NZ 3.38Å; E252-K260 PolarHBondContact OE1-NZ 3.33Å; E252-K260 IonicContact OE2-NZ 3.47Å; E252-A261 HydrophobicContact CB-CB 4.28Å; E252-L264 HydrophobicContact CG-CD1 3.94Å
253	Y	95.9	Very high	95.4	Very high	65 Å²	65	57.6 Å²	57.6	26%	0.255	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-47.6	172.3	162.7	-101.2	0	0	0	111.5	S249 N250 F251 R255 G256 Y258 I294 A297	S249-Y253 WeakPolarHBondContact O-CB 3.37Å; S249-Y253 PolarHBondContact O-N 3.3Å; N250-Y253 WeakPolarHBondContact O-CB 3.43Å; N250-Y253 PolarHBondContact O-N 3.22Å; F251-Y253 VanDerWaalsContact C-N 3.35Å; Y253-R255 PolarHBondContact O-N 3.37Å; Y253-G256 PolarHBondContact O-N 3.33Å; Y253-Y258 AromaticContact CD2-CD1 3.98Å; Y253-Y258 HydrophobicContact CD2-CD1 3.98Å; Y253-Y258 AromaticContact CD2-CE1 3.97Å; Y253-Y258 HydrophobicContact CD2-CE1 3.97Å; Y253-Y258 HydrophobicContact CE2-CE1 4.2Å; Y253-I294 HydrophobicContact CD2-CB 4.36Å; Y253-I294 HydrophobicContact CD2-CG1 3.69Å; Y253-I294 HydrophobicContact CE2-CG1 4.34Å; Y253-I294 HydrophobicContact CG-CG1 4.36Å; Y253-A297 HydrophobicContact CE2-CB 3.65Å
254	L	93.8	Very high	95.7	Very high	100 Å²	100	56 Å²	56	52%	0.524	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-23.6	178.3	-67.6	172.7	0	0	0	113.3	I219 N250 F251 G256	I219-L254 HydrophobicContact CB-CD1 4.47Å; I219-L254 HydrophobicContact CG1-CD1 4.32Å; I219-L254 HydrophobicContact CG2-CD1 3.66Å; N250-L254 WeakPolarHBondContact O-CG 3.34Å; N250-L254 PolarHBondContact O-N 3.37Å; F251-L254 PolarHBondContact O-N 3.03Å; L254-G256 VanDerWaalsContact C-N 3.32Å
255	R	93.4	Very high	95.8	Very high	128 Å²	128	56 Å²	56	48%	0.483	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.2	173.6	-70	-170.6	68.8	-153.1	-0.7	114.1	F251 E252 Y253 N257	F251-R255 HydrophobicContact CZ-CG 4.38Å; F251-R255 WeakPolarHBondContact O-CG 3.12Å; F251-R255 PolarHBondContact O-N 3.03Å; E252-R255 PolarHBondContact O-N 2.74Å; Y253-R255 PolarHBondContact O-N 3.37Å; R255-N257 VanDerWaalsContact C-N 3.27Å; R255-N257 PolarHBondContact O-N 3.45Å
256	G	93.9	Very high	95.8	Very high	31 Å²	31	60.5 Å²	60.5	32%	0.32	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	4.5	-175	0	0	0	0	0	114.5	E252 Y253 L254 Y258	E252-G256 PolarHBondContact O-N 3.19Å; Y253-G256 PolarHBondContact O-N 3.33Å; L254-G256 VanDerWaalsContact C-N 3.32Å; G256-Y258 WeakPolarHBondContact O-CD2 3.31Å; G256-Y258 PolarHBondContact O-N 2.97Å
257	N	96.4	Very high	95.7	Very high	63 Å²	63	62.5 Å²	62.5	34%	0.337	30%	0.297	S	S	.	.			trans	-82.5	57.1	-179	-67.4	-25.4	0	0	0	111.7	E252 R255 R259 K260 A261	E252-N257 HydrophobicContact CB-CB 4.16Å; E252-N257 WeakPolarHBondContact O-CA 3.36Å; E252-N257 WeakPolarHBondContact O-CB 3.48Å; E252-N257 PolarHBondContact O-N 3.4Å; E252-N257 WeakPolarHBondContact OE2-CB 3.22Å; E252-N257 PolarHBondContact OE2-ND2 3.3Å; R255-N257 VanDerWaalsContact C-N 3.27Å; R255-N257 PolarHBondContact O-N 3.45Å; N257-R259 PolarHBondContact O-N 2.88Å; N257-K260 HydrophobicContact CB-CB 4.28Å; N257-K260 WeakPolarHBondContact O-CB 3.4Å; N257-K260 PolarHBondContact O-N 3.09Å; N257-A261 PolarHBondContact O-N 3.46Å
258	Y	97.1	Very high	95.3	Very high	73 Å²	73	61.9 Å²	61.9	29%	0.286	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-42	-168.4	-53.8	-50.9	0	0	0	114.1	Y253 G256 K260 A261 V262 I294 A297 M298	Y253-Y258 AromaticContact CD2-CD1 3.98Å; Y253-Y258 HydrophobicContact CD2-CD1 3.98Å; Y253-Y258 AromaticContact CD2-CE1 3.97Å; Y253-Y258 HydrophobicContact CD2-CE1 3.97Å; Y253-Y258 HydrophobicContact CE2-CE1 4.2Å; G256-Y258 WeakPolarHBondContact O-CD2 3.31Å; G256-Y258 PolarHBondContact O-N 2.97Å; Y258-K260 VanDerWaalsContact C-N 3.27Å; Y258-K260 PolarHBondContact O-N 2.88Å; Y258-A261 WeakPolarHBondContact O-CB 3.46Å; Y258-A261 PolarHBondContact O-N 3.05Å; Y258-V262 WeakPolarHBondContact O-CG2 3.47Å; Y258-V262 PolarHBondContact O-N 3.36Å; Y258-I294 HydrophobicContact CD1-CG2 4.26Å; Y258-I294 HydrophobicContact CG-CG2 4.37Å; Y258-A297 HydrophobicContact CD1-CB 4.28Å; Y258-A297 HydrophobicContact CE1-CB 3.55Å; Y258-M298 HydrophobicContact CD2-CG 3.66Å; Y258-M298 HydrophobicContact CE2-CG 4.43Å; Y258-M298 HydrophobicContact CG-CG 3.77Å
259	R	96.1	Very high	94.7	Very high	209 Å²	209	63.3 Å²	63.3	79%	0.789	31%	0.305	S	S	*	.	H	α-helix	trans	-61.9	-37.1	178.6	-64.8	-176.7	-167.9	161.7	4.5	111.7	N257 K263	N257-R259 PolarHBondContact O-N 2.88Å; R259-K263 WeakPolarHBondContact O-CG 3.48Å; R259-K263 PolarHBondContact O-N 3.17Å
260	K	96.6	Very high	93.9	Very high	99 Å²	99	65.4 Å²	65.4	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-72.2	-41.2	178.2	-170.2	177.1	177.2	-168.6	0	111	E252 N257 Y258 V262 K263 L264	E252-K260 HydrophobicContact CG-CD 3.96Å; E252-K260 HydrophobicContact CG-CG 4.23Å; E252-K260 VanDerWaalsContact OE1-CE 3.31Å; E252-K260 WeakPolarHBondContact OE1-CE 3.26Å; E252-K260 IonicContact OE1-NZ 3.38Å; E252-K260 PolarHBondContact OE1-NZ 3.33Å; E252-K260 IonicContact OE2-NZ 3.47Å; N257-K260 HydrophobicContact CB-CB 4.28Å; N257-K260 WeakPolarHBondContact O-CB 3.4Å; N257-K260 PolarHBondContact O-N 3.09Å; Y258-K260 VanDerWaalsContact C-N 3.27Å; Y258-K260 PolarHBondContact O-N 2.88Å; K260-V262 VanDerWaalsContact C-N 3.33Å; K260-V262 PolarHBondContact O-N 2.99Å; K260-K263 PolarHBondContact O-N 2.96Å; K260-L264 HydrophobicContact CG-CD1 4.29Å; K260-L264 WeakPolarHBondContact O-CG 3.42Å; K260-L264 PolarHBondContact O-N 3.09Å
261	A	97.4	Very high	93	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-56.6	-45.1	174.1	0	0	0	0	0	112.1	S249 E252 N257 Y258 L264 L265 I294	S249-A261 WeakPolarHBondContact OG-CA 3.37Å; S249-A261 WeakPolarHBondContact OG-CB 3.25Å; S249-A261 PolarHBondContact OG-O 3.46Å; E252-A261 HydrophobicContact CB-CB 4.28Å; N257-A261 PolarHBondContact O-N 3.46Å; Y258-A261 WeakPolarHBondContact O-CB 3.46Å; Y258-A261 PolarHBondContact O-N 3.05Å; A261-L264 PolarHBondContact O-N 2.7Å; A261-L265 PolarHBondContact O-N 3.29Å; A261-L265 VanDerWaalsContact O-N 3.1Å; A261-I294 HydrophobicContact CB-CD1 3.85Å; A261-I294 HydrophobicContact CB-CG1 4.41Å
262	V	97	Very high	92	Very high	30 Å²	30	73.5 Å²	73.5	18%	0.182	37%	0.366	C	S	.	.	H	α-helix	trans	-62.5	-46.4	175.8	174.4	0	0	0	0	111.9	Y258 K260 L264 L265 N266 L291 I294	Y258-V262 WeakPolarHBondContact O-CG2 3.47Å; Y258-V262 PolarHBondContact O-N 3.36Å; K260-V262 VanDerWaalsContact C-N 3.33Å; K260-V262 PolarHBondContact O-N 2.99Å; V262-L264 VanDerWaalsContact C-N 3.3Å; V262-L264 PolarHBondContact O-N 3.4Å; V262-L265 PolarHBondContact O-N 3.36Å; V262-N266 PolarHBondContact O-N 2.87Å; V262-L291 HydrophobicContact CB-CD2 4.41Å; V262-L291 HydrophobicContact CG1-CD2 4.08Å; V262-L291 HydrophobicContact CG2-CD2 3.98Å; V262-I294 HydrophobicContact CG2-CD1 4.14Å; V262-I294 HydrophobicContact CG2-CG2 3.85Å
263	K	96.8	Very high	91.3	Very high	158 Å²	158	75.6 Å²	75.6	69%	0.687	38%	0.376	S	S	*	.	H	α-helix	trans	-57.8	-43.2	178.1	-75.3	180	-179.6	-175.6	0	111.9	R259 K260 N266 S267	R259-K263 WeakPolarHBondContact O-CG 3.48Å; R259-K263 PolarHBondContact O-N 3.17Å; K260-K263 PolarHBondContact O-N 2.96Å; K263-N266 PolarHBondContact O-N 3.15Å; K263-S267 PolarHBondContact O-N 2.77Å; K263-S267 VanDerWaalsContact O-N 3.09Å; K263-S267 PolarHBondContact O-OG 3.47Å
264	L	95.8	Very high	90.6	Very high	21 Å²	21	76.4 Å²	76.4	11%	0.11	39%	0.389	C	S	.	.	H	α-helix	trans	-64.4	-42.3	178.6	-71.6	166.6	0	0	0	112.3	L245 K248 E252 K260 A261 V262 S267	L245-L264 HydrophobicContact CD2-CD2 4.12Å; K248-L264 HydrophobicContact CB-CD1 4.35Å; K248-L264 HydrophobicContact CD-CD1 4.3Å; K248-L264 HydrophobicContact CD-CD2 4.08Å; K248-L264 HydrophobicContact CG-CD1 3.85Å; K248-L264 HydrophobicContact CG-CD2 4.49Å; E252-L264 HydrophobicContact CG-CD1 3.94Å; K260-L264 HydrophobicContact CG-CD1 4.29Å; K260-L264 WeakPolarHBondContact O-CG 3.42Å; K260-L264 PolarHBondContact O-N 3.09Å; A261-L264 PolarHBondContact O-N 2.7Å; V262-L264 VanDerWaalsContact C-N 3.3Å; V262-L264 PolarHBondContact O-N 3.4Å; L264-S267 WeakPolarHBondContact CA-OG 3.43Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 PolarHBondContact O-OG 3.19Å
265	L	94.6	Very high	90.1	Very high	1 Å²	1	72.6 Å²	72.6	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-63.7	-44.6	175.7	-71	171.6	0	0	0	111.4	F246 S249 A261 V262 S267 S268 F287 N290 L291 I294	F246-L265 HydrophobicContact CD1-CD2 4.12Å; F246-L265 HydrophobicContact CD2-CD2 3.98Å; F246-L265 HydrophobicContact CE1-CD2 4.18Å; F246-L265 HydrophobicContact CE2-CD2 4.07Å; F246-L265 HydrophobicContact CG-CD2 4.03Å; F246-L265 HydrophobicContact CZ-CD2 4.17Å; S249-L265 VanDerWaalsContact OG-CG 3.31Å; S249-L265 WeakPolarHBondContact OG-CG 3.33Å; A261-L265 PolarHBondContact O-N 3.29Å; A261-L265 VanDerWaalsContact O-N 3.1Å; V262-L265 PolarHBondContact O-N 3.36Å; L265-S267 PolarHBondContact O-N 3.47Å; L265-S268 WeakPolarHBondContact O-CB 3.43Å; L265-S268 PolarHBondContact O-N 3.06Å; L265-S268 PolarHBondContact O-OG 3.11Å; L265-F287 HydrophobicContact CB-CD2 4Å; L265-F287 HydrophobicContact CB-CE2 3.83Å; L265-N290 HydrophobicContact CD1-CB 3.89Å; L265-L291 HydrophobicContact CD1-CD2 4.1Å; L265-L291 HydrophobicContact CD1-CG 4.42Å; L265-I294 HydrophobicContact CD1-CD1 3.65Å
266	N	94.4	Very high	89.6	Confident	99 Å²	99	67.3 Å²	67.3	53%	0.529	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-22.2	179.4	-71.7	-17.6	0	0	0	113.3	V262 K263 S268 F287	V262-N266 PolarHBondContact O-N 2.87Å; K263-N266 PolarHBondContact O-N 3.15Å; N266-S268 VanDerWaalsContact C-N 3.28Å; N266-F287 VanDerWaalsContact OD1-CZ 3.31Å; N266-F287 WeakPolarHBondContact OD1-CZ 3.17Å
267	S	93.1	Very high	89.1	Confident	69 Å²	69	69.7 Å²	69.7	48%	0.483	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.4	173.9	60.1	0	0	0	0	114.4	K263 L264 L265	K263-S267 PolarHBondContact O-N 2.77Å; K263-S267 VanDerWaalsContact O-N 3.09Å; K263-S267 PolarHBondContact O-OG 3.47Å; L264-S267 WeakPolarHBondContact CA-OG 3.43Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 PolarHBondContact O-OG 3.19Å; L265-S267 PolarHBondContact O-N 3.47Å
268	S	88.4	Confident	88.4	Confident	10 Å²	10	76.4 Å²	76.4	7%	0.07	38%	0.382	C	S	.	.	S	Bend	trans	-77.2	127	179.3	68.1	0	0	0	0	111.5	L265 N266 M270	L265-S268 WeakPolarHBondContact O-CB 3.43Å; L265-S268 PolarHBondContact O-N 3.06Å; L265-S268 PolarHBondContact O-OG 3.11Å; N266-S268 VanDerWaalsContact C-N 3.28Å; S268-M270 PolarHBondContact O-N 3.12Å; S268-M270 VanDerWaalsContact O-N 3.11Å
269	N	82.7	Confident	87.7	Confident	86 Å²	86	75.4 Å²	75.4	46%	0.46	38%	0.383	S	S	.	.			trans	-79.4	92.8	175.3	-170.7	2.6	0	0	0	110.1	A271 E272	N269-A271 PolarHBondContact OD1-N 3.33Å; N269-E272 PolarHBondContact ND2-OE1 2.71Å; N269-E272 PolarHBondContact ND2-OE2 2.93Å
270	M	80.4	Confident	87.1	Confident	48 Å²	48	66 Å²	66	24%	0.236	35%	0.351	C	S	.	.			trans	-82.6	-14.3	-178.1	-57.7	-179.2	-66.4	0	0	113.5	S268 E272 V283 F287	S268-M270 PolarHBondContact O-N 3.12Å; S268-M270 VanDerWaalsContact O-N 3.11Å; M270-E272 VanDerWaalsContact C-N 3.34Å; M270-V283 HydrophobicContact CB-CG1 4.44Å; M270-V283 HydrophobicContact CG-CG1 3.97Å; M270-V283 HydrophobicContact SD-CG1 4.4Å; M270-F287 HydrophobicContact CE-CD1 4.07Å; M270-F287 HydrophobicContact CE-CD2 4.18Å; M270-F287 HydrophobicContact CE-CE1 4.25Å; M270-F287 HydrophobicContact CE-CE2 4.36Å; M270-F287 HydrophobicContact CE-CG 4.03Å; M270-F287 HydrophobicContact CE-CZ 4.38Å; M270-F287 HydrophobicContact SD-CB 3.53Å; M270-F287 VanDerWaalsContact SD-CB 3.53Å; M270-F287 HydrophobicContact SD-CD1 4.09Å; M270-F287 HydrophobicContact SD-CD2 3.73Å; M270-F287 HydrophobicContact SD-CE2 4.45Å; M270-F287 HydrophobicContact SD-CG 3.52Å; M270-F287 VanDerWaalsContact SD-CG 3.52Å
271	A	77	Confident	86.6	Confident	90 Å²	90	66 Å²	66	74%	0.744	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-27.2	-174.1	0	0	0	0	0	113	N269 H273	N269-A271 PolarHBondContact OD1-N 3.33Å; A271-H273 VanDerWaalsContact C-N 3.29Å; A271-H273 PolarHBondContact O-N 3Å
272	E	74.9	Confident	86.2	Confident	154 Å²	154	66.8 Å²	66.8	72%	0.72	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.1	-179.2	-70.5	173.1	-172	0	0	113.4	N269 M270	N269-E272 PolarHBondContact ND2-OE1 2.71Å; N269-E272 PolarHBondContact ND2-OE2 2.93Å; M270-E272 VanDerWaalsContact C-N 3.34Å
273	H	81.1	Confident	85.8	Confident	53 Å²	53	66 Å²	66	25%	0.245	35%	0.353	C	S	.	.			trans	-70.2	133	-177.4	-167.3	-98.1	0	0	0	111.4	A271 G275 T279 E281 V283	A271-H273 VanDerWaalsContact C-N 3.29Å; A271-H273 PolarHBondContact O-N 3Å; H273-G275 PolarHBondContact ND1-N 3.48Å; H273-G275 PolarHBondContact O-N 2.92Å; H273-T279 PolarHBondContact CE1-OG1 2.96Å; H273-E281 PolarHBondContact CE1-O 3.39Å; H273-E281 IonicContact NE2-OE2 3.4Å; H273-V283 HydrophobicContact CB-CG2 4.41Å; H273-V283 VanDerWaalsContact CD2-CG2 3.46Å; H273-V283 WeakPolarHBondContact CD2-CG2 3.33Å; H273-V283 WeakPolarHBondContact NE2-CG2 3.29Å
274	P	81.4	Confident	85.5	Confident	83 Å²	83	64.2 Å²	64.2	54%	0.539	34%	0.342	S	S	.	.			trans	-64.2	-2	-175.6	-20.3	30.8	0	0	0	116	R278 T279	P274-R278 HydrophobicContact CB-CB 4.32Å; P274-T279 HydrophobicContact CB-CG2 3.91Å; P274-T279 HydrophobicContact CG-CG2 4.08Å
275	G	83.6	Confident	85.4	Confident	19 Å²	19	63.5 Å²	63.5	20%	0.196	34%	0.338	C	S	.	.			trans	85	165.6	175.4	0	0	0	0	0	114.7	H273 I277 R278 T279	H273-G275 PolarHBondContact ND1-N 3.48Å; H273-G275 PolarHBondContact O-N 2.92Å; G275-I277 VanDerWaalsContact C-N 3.33Å; G275-I277 PolarHBondContact O-N 3.28Å; G275-R278 PolarHBondContact O-N 3.35Å; G275-T279 PolarHBondContact O-N 2.94Å; G275-T279 VanDerWaalsContact O-N 3.14Å; G275-T279 PolarHBondContact O-OG1 2.59Å
276	P	83.4	Confident	85.3	Confident	18 Å²	18	66.8 Å²	66.8	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-68.5	-28.8	-173.6	25.1	-32.7	0	0	0	113.3	R278 G280 C282 T318	P276-R278 VanDerWaalsContact C-N 3.27Å; P276-R278 PolarHBondContact O-N 3.45Å; P276-G280 WeakPolarHBondContact O-CA 3.48Å; P276-G280 PolarHBondContact O-N 2.87Å; P276-C282 HydrophobicContact CB-CB 4.42Å; P276-T318 HydrophobicContact CB-CG2 3.63Å; P276-T318 HydrophobicContact CG-CG2 3.42Å; P276-T318 VanDerWaalsContact CG-CG2 3.42Å
277	I	82.3	Confident	85.4	Confident	80 Å²	80	62.5 Å²	62.5	41%	0.41	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-33.6	178.5	-61.8	173.3	0	0	0	111.7	G275 L322 P337 C339	G275-I277 VanDerWaalsContact C-N 3.33Å; G275-I277 PolarHBondContact O-N 3.28Å; I277-L322 HydrophobicContact CG1-CD2 3.76Å; I277-P337 HydrophobicContact CG2-CG 4.31Å; I277-C339 PolarHBondContact O-SG 3.38Å; I277-C339 VanDerWaalsContact O-SG 3.35Å
278	R	82.5	Confident	85.6	Confident	205 Å²	205	61.2 Å²	61.2	77%	0.774	32%	0.316	S	S	*	.	H	α-helix	trans	-94	-35.5	-178.1	-67.9	-171.4	175.6	-161.6	-0.3	113.2	P274 G275 P276	P274-R278 HydrophobicContact CB-CB 4.32Å; G275-R278 PolarHBondContact O-N 3.35Å; P276-R278 VanDerWaalsContact C-N 3.27Å; P276-R278 PolarHBondContact O-N 3.45Å
279	T	83	Confident	86	Confident	52 Å²	52	62.1 Å²	62.1	32%	0.319	32%	0.32	S	S	.	.	H	α-helix	trans	-109.2	-17.2	-169.8	60.7	0	0	0	0	113.6	H273 P274 G275 E281	H273-T279 PolarHBondContact CE1-OG1 2.96Å; P274-T279 HydrophobicContact CB-CG2 3.91Å; P274-T279 HydrophobicContact CG-CG2 4.08Å; G275-T279 PolarHBondContact O-N 2.94Å; G275-T279 VanDerWaalsContact O-N 3.14Å; G275-T279 PolarHBondContact O-OG1 2.59Å; T279-E281 PolarHBondContact O-N 2.88Å; T279-E281 PolarHBondContact OG1-N 3.27Å; T279-E281 VanDerWaalsContact OG1-N 3.1Å
280	G	83.8	Confident	86.7	Confident	12 Å²	12	60.4 Å²	60.4	12%	0.124	31%	0.311	C	S	.	.	S	Bend	trans	76.2	-7.6	-166.2	0	0	0	0	0	114.6	P276 C339 S343	P276-G280 WeakPolarHBondContact O-CA 3.48Å; P276-G280 PolarHBondContact O-N 2.87Å; G280-C339 WeakPolarHBondContact CA-O 3.37Å; G280-S343 VanDerWaalsContact C-OG 3.27Å; G280-S343 WeakPolarHBondContact CA-OG 3.28Å; G280-S343 PolarHBondContact O-OG 3.45Å
281	E	84.6	Confident	87.5	Confident	99 Å²	99	58.3 Å²	58.3	46%	0.463	30%	0.301	S	S	.	.			trans	-104.1	125.9	-172.1	-65.3	-172.8	174.1	0	0	112.4	H273 T279 M286	H273-E281 PolarHBondContact CE1-O 3.39Å; H273-E281 IonicContact NE2-OE2 3.4Å; T279-E281 PolarHBondContact O-N 2.88Å; T279-E281 PolarHBondContact OG1-N 3.27Å; T279-E281 VanDerWaalsContact OG1-N 3.1Å; E281-M286 HydrophobicContact CB-CE 3.83Å; E281-M286 HydrophobicContact CG-CE 4.29Å
282	C	88.6	Confident	88.4	Confident	16 Å²	16	54 Å²	54	11%	0.108	27%	0.265	C	S	.	.			trans	-102.4	84.5	171.2	-171.3	0	0	0	0	110.5	P276 R284 C285 M286 T318	P276-C282 HydrophobicContact CB-CB 4.42Å; C282-R284 VanDerWaalsContact C-N 3.26Å; C282-R284 PolarHBondContact O-N 3.17Å; C282-C285 HydrophobicContact CB-CB 3.88Å; C282-C285 WeakPolarHBondContact O-CB 3.31Å; C282-C285 PolarHBondContact O-N 3.45Å; C282-C285 VanDerWaalsContact O-N 3.17Å; C282-C285 WeakPolarHBondContact SG-CB 3.43Å; C282-M286 PolarHBondContact O-N 2.7Å; C282-T318 PolarHBondContact SG-OG1 2.8Å; C282-T318 VanDerWaalsContact SG-OG1 3.37Å
283	V	90.1	Very high	89.5	Confident	12 Å²	12	48 Å²	48	7%	0.073	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-36.1	-178.1	179.8	0	0	0	0	112.5	F246 M270 H273 M286 F287	F246-V283 HydrophobicContact CE2-CG1 4.16Å; F246-V283 HydrophobicContact CZ-CG1 3.84Å; M270-V283 HydrophobicContact CB-CG1 4.44Å; M270-V283 HydrophobicContact CG-CG1 3.97Å; M270-V283 HydrophobicContact SD-CG1 4.4Å; H273-V283 HydrophobicContact CB-CG2 4.41Å; H273-V283 VanDerWaalsContact CD2-CG2 3.46Å; H273-V283 WeakPolarHBondContact CD2-CG2 3.33Å; H273-V283 WeakPolarHBondContact NE2-CG2 3.29Å; V283-M286 HydrophobicContact CG2-CE 4.25Å; V283-M286 PolarHBondContact O-N 2.97Å; V283-F287 WeakPolarHBondContact O-CB 3.17Å; V283-F287 PolarHBondContact O-N 3.38Å
284	R	90.8	Very high	90.3	Very high	122 Å²	122	45.7 Å²	45.7	46%	0.46	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-43.3	177.2	-64.7	177.6	67.7	107.7	1.9	112.2	C282 F287 W288 E314	C282-R284 VanDerWaalsContact C-N 3.26Å; C282-R284 PolarHBondContact O-N 3.17Å; R284-F287 WeakPolarHBondContact O-CB 3.4Å; R284-F287 PolarHBondContact O-N 3.45Å; R284-W288 PolarHBondContact O-N 3.06Å; R284-W288 VanDerWaalsContact O-N 3.15Å; R284-E314 HydrophobicContact CB-CG 4.46Å; R284-E314 WeakPolarHBondContact CD-OE2 3.4Å; R284-E314 IonicContact CZ-OE1 3.53Å; R284-E314 IonicContact CZ-OE2 2.94Å; R284-E314 IonicContact NE-OE1 2.67Å; R284-E314 PolarHBondContact NE-OE1 3.16Å; R284-E314 VanDerWaalsContact NE-OE1 3.12Å; R284-E314 IonicContact NE-OE2 2.69Å; R284-E314 PolarHBondContact NE-OE2 3.43Å; R284-E314 IonicContact NH2-OE1 3.13Å; R284-E314 PolarHBondContact NH2-OE1 3Å
285	C	92.9	Very high	91	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.034	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-47.7	173.8	175.6	0	0	0	0	110.9	C282 F287 W288 N289 E314	C282-C285 HydrophobicContact CB-CB 3.88Å; C282-C285 WeakPolarHBondContact O-CB 3.31Å; C282-C285 PolarHBondContact O-N 3.45Å; C282-C285 VanDerWaalsContact O-N 3.17Å; C282-C285 WeakPolarHBondContact SG-CB 3.43Å; C285-F287 VanDerWaalsContact C-N 3.34Å; C285-F287 PolarHBondContact O-N 2.88Å; C285-W288 PolarHBondContact O-N 3.48Å; C285-N289 WeakPolarHBondContact O-CB 3.37Å; C285-N289 PolarHBondContact O-N 3.05Å; C285-E314 HydrophobicContact CB-CB 4.46Å
286	M	93.1	Very high	91.6	Very high	70 Å²	70	44.6 Å²	44.6	35%	0.345	21%	0.211	S	C	.	.	H	α-helix	trans	-59.4	-42.6	176.9	-66	-171.7	-107.4	0	0	112.4	F246 E281 C282 V283 N289 N290	F246-M286 HydrophobicContact CE1-CB 3.83Å; E281-M286 HydrophobicContact CB-CE 3.83Å; E281-M286 HydrophobicContact CG-CE 4.29Å; C282-M286 PolarHBondContact O-N 2.7Å; V283-M286 HydrophobicContact CG2-CE 4.25Å; V283-M286 PolarHBondContact O-N 2.97Å; M286-N289 PolarHBondContact O-N 3.12Å; M286-N290 WeakPolarHBondContact O-CB 3.36Å; M286-N290 PolarHBondContact O-N 3.31Å; M286-N290 PolarHBondContact O-ND2 3.48Å; M286-N290 PolarHBondContact O-OD1 2.84Å
287	F	95.4	Very high	92.1	Very high	10 Å²	10	44.9 Å²	44.9	4%	0.044	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-53	177.7	171.4	-96.9	0	0	0	112.1	F246 L265 N266 M270 V283 R284 C285 N290 L291	F246-F287 HydrophobicContact CZ-CB 4.03Å; L265-F287 HydrophobicContact CB-CD2 4Å; L265-F287 HydrophobicContact CB-CE2 3.83Å; N266-F287 VanDerWaalsContact OD1-CZ 3.31Å; N266-F287 WeakPolarHBondContact OD1-CZ 3.17Å; M270-F287 HydrophobicContact CE-CD1 4.07Å; M270-F287 HydrophobicContact CE-CD2 4.18Å; M270-F287 HydrophobicContact CE-CE1 4.25Å; M270-F287 HydrophobicContact CE-CE2 4.36Å; M270-F287 HydrophobicContact CE-CG 4.03Å; M270-F287 HydrophobicContact CE-CZ 4.38Å; M270-F287 HydrophobicContact SD-CB 3.53Å; M270-F287 VanDerWaalsContact SD-CB 3.53Å; M270-F287 HydrophobicContact SD-CD1 4.09Å; M270-F287 HydrophobicContact SD-CD2 3.73Å; M270-F287 HydrophobicContact SD-CE2 4.45Å; M270-F287 HydrophobicContact SD-CG 3.52Å; M270-F287 VanDerWaalsContact SD-CG 3.52Å; V283-F287 WeakPolarHBondContact O-CB 3.17Å; V283-F287 PolarHBondContact O-N 3.38Å; R284-F287 WeakPolarHBondContact O-CB 3.4Å; R284-F287 PolarHBondContact O-N 3.45Å; C285-F287 VanDerWaalsContact C-N 3.34Å; C285-F287 PolarHBondContact O-N 2.88Å; F287-N290 PolarHBondContact O-N 3.43Å; F287-L291 HydrophobicContact CD1-CD1 4.17Å; F287-L291 HydrophobicContact CE1-CD1 3.51Å; F287-L291 HydrophobicContact CE2-CD1 4.18Å; F287-L291 HydrophobicContact CZ-CD1 3.52Å; F287-L291 HydrophobicContact CZ-CG 4.38Å; F287-L291 PolarHBondContact O-N 2.71Å
288	W	97.1	Very high	92.7	Very high	42 Å²	42	43.7 Å²	43.7	16%	0.159	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-39.3	-179.7	-68.8	123.2	0	0	0	112.3	R284 C285 N290 L291 G292 Y307 K310 A311	R284-W288 PolarHBondContact O-N 3.06Å; R284-W288 VanDerWaalsContact O-N 3.15Å; C285-W288 PolarHBondContact O-N 3.48Å; W288-N290 VanDerWaalsContact C-N 3.35Å; W288-N290 PolarHBondContact O-N 3.1Å; W288-L291 HydrophobicContact CE3-CD1 3.85Å; W288-L291 HydrophobicContact CZ3-CD1 3.9Å; W288-L291 PolarHBondContact O-N 3.41Å; W288-G292 PolarHBondContact O-N 3.38Å; W288-Y307 AromaticContact CE3-CD1 3.34Å; W288-Y307 HydrophobicContact CE3-CD1 3.34Å; W288-Y307 AromaticContact CE3-CE1 3.79Å; W288-Y307 HydrophobicContact CE3-CE1 3.79Å; W288-Y307 HydrophobicContact CE3-CG 4.38Å; W288-Y307 AromaticContact CZ3-CD1 3.49Å; W288-Y307 HydrophobicContact CZ3-CD1 3.49Å; W288-Y307 VanDerWaalsContact CZ3-CD1 3.49Å; W288-Y307 AromaticContact CZ3-CE1 3.4Å; W288-Y307 HydrophobicContact CZ3-CE1 3.4Å; W288-Y307 VanDerWaalsContact CZ3-CE1 3.4Å; W288-K310 HydrophobicContact CB-CB 4.25Å; W288-K310 HydrophobicContact CD2-CB 3.88Å; W288-K310 HydrophobicContact CD2-CD 3.94Å; W288-K310 HydrophobicContact CE3-CB 4.42Å; W288-K310 HydrophobicContact CE3-CD 3.97Å; W288-K310 HydrophobicContact CG-CB 3.82Å; W288-K310 HydrophobicContact CH2-CD 3.87Å; W288-K310 HydrophobicContact CZ2-CD 3.81Å; W288-K310 HydrophobicContact CZ3-CD 3.96Å; W288-A311 HydrophobicContact CB-CB 3.75Å
289	N	96.9	Very high	93.1	Very high	29 Å²	29	35.7 Å²	35.7	16%	0.155	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-45	174.8	177.2	73.3	0	0	0	111.7	C285 M286 L291 G292 C293 F308 A311 L349 N352	C285-N289 WeakPolarHBondContact O-CB 3.37Å; C285-N289 PolarHBondContact O-N 3.05Å; M286-N289 PolarHBondContact O-N 3.12Å; N289-L291 PolarHBondContact O-N 2.69Å; N289-G292 WeakPolarHBondContact O-CA 3.25Å; N289-G292 PolarHBondContact O-N 2.91Å; N289-G292 VanDerWaalsContact O-N 3.15Å; N289-C293 PolarHBondContact O-N 3.34Å; N289-C293 PolarHBondContact O-SG 2.92Å; N289-F308 WeakPolarHBondContact O-CE1 3.42Å; N289-F308 WeakPolarHBondContact OD1-CE1 3.31Å; N289-A311 HydrophobicContact CB-CB 4.21Å; N289-L349 HydrophobicContact CB-CD2 3.77Å; N289-L349 WeakPolarHBondContact OD1-CD2 3.43Å; N289-N352 PolarHBondContact OD1-ND2 3.31Å
290	N	97.1	Very high	93.7	Very high	50 Å²	50	38.4 Å²	38.4	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-65.8	-39.3	179.9	-69.9	-6.7	0	0	0	111.7	L265 M286 F287 W288 G292 C293 I294	L265-N290 HydrophobicContact CD1-CB 3.89Å; M286-N290 WeakPolarHBondContact O-CB 3.36Å; M286-N290 PolarHBondContact O-N 3.31Å; M286-N290 PolarHBondContact O-ND2 3.48Å; M286-N290 PolarHBondContact O-OD1 2.84Å; F287-N290 PolarHBondContact O-N 3.43Å; W288-N290 VanDerWaalsContact C-N 3.35Å; W288-N290 PolarHBondContact O-N 3.1Å; N290-G292 VanDerWaalsContact C-N 3.33Å; N290-G292 PolarHBondContact O-N 3.14Å; N290-C293 PolarHBondContact O-N 3.4Å; N290-I294 VanDerWaalsContact O-CG1 3.31Å; N290-I294 WeakPolarHBondContact O-CG1 3.46Å; N290-I294 PolarHBondContact O-N 3.08Å
291	L	97.3	Very high	94.2	Very high	4 Å²	4	40 Å²	40	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-41.4	171.2	-73.2	179.9	0	0	0	112	V262 L265 F287 W288 N289 C293 I294 H295 Y307	V262-L291 HydrophobicContact CB-CD2 4.41Å; V262-L291 HydrophobicContact CG1-CD2 4.08Å; V262-L291 HydrophobicContact CG2-CD2 3.98Å; L265-L291 HydrophobicContact CD1-CD2 4.1Å; L265-L291 HydrophobicContact CD1-CG 4.42Å; F287-L291 HydrophobicContact CD1-CD1 4.17Å; F287-L291 HydrophobicContact CE1-CD1 3.51Å; F287-L291 HydrophobicContact CE2-CD1 4.18Å; F287-L291 HydrophobicContact CZ-CD1 3.52Å; F287-L291 HydrophobicContact CZ-CG 4.38Å; F287-L291 PolarHBondContact O-N 2.71Å; W288-L291 HydrophobicContact CE3-CD1 3.85Å; W288-L291 HydrophobicContact CZ3-CD1 3.9Å; W288-L291 PolarHBondContact O-N 3.41Å; N289-L291 PolarHBondContact O-N 2.69Å; L291-C293 VanDerWaalsContact C-N 3.34Å; L291-C293 PolarHBondContact O-N 3.36Å; L291-I294 HydrophobicContact CD2-CD1 4.48Å; L291-I294 PolarHBondContact O-N 3.25Å; L291-H295 PolarHBondContact O-CD2 3.21Å; L291-H295 PolarHBondContact O-N 3.4Å; L291-Y307 HydrophobicContact CB-CD1 4.32Å; L291-Y307 HydrophobicContact CB-CD2 4.07Å; L291-Y307 HydrophobicContact CB-CE2 4.46Å; L291-Y307 HydrophobicContact CB-CG 3.97Å; L291-Y307 HydrophobicContact CD1-CD1 4.28Å; L291-Y307 HydrophobicContact CD1-CE1 4.11Å
292	G	97.4	Very high	94.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-55	-48.6	172.7	0	0	0	0	0	112.2	W288 N289 N290 H295 F296	W288-G292 PolarHBondContact O-N 3.38Å; N289-G292 WeakPolarHBondContact O-CA 3.25Å; N289-G292 PolarHBondContact O-N 2.91Å; N289-G292 VanDerWaalsContact O-N 3.15Å; N290-G292 VanDerWaalsContact C-N 3.33Å; N290-G292 PolarHBondContact O-N 3.14Å; G292-H295 PolarHBondContact O-N 2.95Å; G292-F296 PolarHBondContact O-N 3.36Å
293	C	97	Very high	95	Very high	28 Å²	28	42.2 Å²	42.2	19%	0.189	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-40.6	178.1	-62.8	0	0	0	0	112.9	N289 N290 L291 F296 A297	N289-C293 PolarHBondContact O-N 3.34Å; N289-C293 PolarHBondContact O-SG 2.92Å; N290-C293 PolarHBondContact O-N 3.4Å; L291-C293 VanDerWaalsContact C-N 3.34Å; L291-C293 PolarHBondContact O-N 3.36Å; C293-F296 WeakPolarHBondContact O-CB 3.5Å; C293-F296 PolarHBondContact O-N 2.86Å; C293-A297 PolarHBondContact O-N 3.07Å; C293-A297 VanDerWaalsContact O-N 3.14Å
294	I	97.7	Very high	95.3	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-45.6	175.6	-66.9	162.1	0	0	0	110.2	Y253 Y258 A261 V262 L265 N290 L291 F296 A297 M298	Y253-I294 HydrophobicContact CD2-CB 4.36Å; Y253-I294 HydrophobicContact CD2-CG1 3.69Å; Y253-I294 HydrophobicContact CE2-CG1 4.34Å; Y253-I294 HydrophobicContact CG-CG1 4.36Å; Y258-I294 HydrophobicContact CD1-CG2 4.26Å; Y258-I294 HydrophobicContact CG-CG2 4.37Å; A261-I294 HydrophobicContact CB-CD1 3.85Å; A261-I294 HydrophobicContact CB-CG1 4.41Å; V262-I294 HydrophobicContact CG2-CD1 4.14Å; V262-I294 HydrophobicContact CG2-CG2 3.85Å; L265-I294 HydrophobicContact CD1-CD1 3.65Å; N290-I294 VanDerWaalsContact O-CG1 3.31Å; N290-I294 WeakPolarHBondContact O-CG1 3.46Å; N290-I294 PolarHBondContact O-N 3.08Å; L291-I294 HydrophobicContact CD2-CD1 4.48Å; L291-I294 PolarHBondContact O-N 3.25Å; I294-F296 VanDerWaalsContact C-N 3.33Å; I294-F296 PolarHBondContact O-N 3.25Å; I294-A297 PolarHBondContact O-N 3.41Å; I294-M298 HydrophobicContact CG2-CG 4.49Å; I294-M298 HydrophobicContact CG2-SD 4.1Å; I294-M298 WeakPolarHBondContact O-CG 3.21Å; I294-M298 PolarHBondContact O-N 3.24Å
295	H	96.6	Very high	95.6	Very high	15 Å²	15	36.2 Å²	36.2	7%	0.069	19%	0.192	C	C	.	.	H	α-helix	trans	-69.8	-28.6	179.9	-78.2	-62.8	0	0	0	113.8	L291 G292 M298 G299 K300 L303 Y307	L291-H295 PolarHBondContact O-CD2 3.21Å; L291-H295 PolarHBondContact O-N 3.4Å; G292-H295 PolarHBondContact O-N 2.95Å; H295-M298 PolarHBondContact O-N 3.42Å; H295-G299 PolarHBondContact O-N 3.46Å; H295-K300 HydrophobicContact CB-CB 4.44Å; H295-K300 PolarHBondContact O-N 3.37Å; H295-L303 WeakPolarHBondContact CE1-CD2 3.39Å; H295-L303 WeakPolarHBondContact ND1-CD2 3.46Å; H295-Y307 AromaticContact CD2-CD2 3.4Å; H295-Y307 VanDerWaalsContact CD2-CD2 3.4Å; H295-Y307 WeakPolarHBondContact CD2-CD2 3.37Å; H295-Y307 AromaticContact CD2-CE2 3.18Å; H295-Y307 WeakPolarHBondContact CD2-CE2 3.22Å; H295-Y307 AromaticContact NE2-CE2 3.37Å; H295-Y307 WeakPolarHBondContact NE2-CE2 3.3Å
296	F	95.3	Very high	95.9	Very high	63 Å²	63	40.7 Å²	40.7	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-58.2	-51.9	166.1	-176.7	-112.2	0	0	0	111.5	G292 C293 I294 M298 G299 H301 V355 Q356 H359	G292-F296 PolarHBondContact O-N 3.36Å; C293-F296 WeakPolarHBondContact O-CB 3.5Å; C293-F296 PolarHBondContact O-N 2.86Å; I294-F296 VanDerWaalsContact C-N 3.33Å; I294-F296 PolarHBondContact O-N 3.25Å; F296-M298 PolarHBondContact O-N 3.18Å; F296-G299 PolarHBondContact O-N 3.03Å; F296-H301 AromaticContact CD2-CE1 3.89Å; F296-H301 AromaticContact CD2-ND1 3.67Å; F296-H301 AromaticContact CE2-CE1 3.95Å; F296-V355 HydrophobicContact CE2-CG1 4.29Å; F296-V355 HydrophobicContact CZ-CG1 4.09Å; F296-Q356 VanDerWaalsContact CG-OE1 3.28Å; F296-H359 HydrophobicContact CE2-CB 4.05Å; F296-H359 AromaticContact CE2-CD2 3.55Å; F296-H359 AromaticContact CE2-CG 3.72Å; F296-H359 AromaticContact CZ-CD2 3.72Å; F296-H359 AromaticContact CZ-NE2 3.77Å
297	A	94.8	Very high	96.1	Very high	25 Å²	25	39.5 Å²	39.5	21%	0.207	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-27.2	-179.4	0	0	0	0	0	113.1	Y253 Y258 C293 I294 G299	Y253-A297 HydrophobicContact CE2-CB 3.65Å; Y258-A297 HydrophobicContact CD1-CB 4.28Å; Y258-A297 HydrophobicContact CE1-CB 3.55Å; C293-A297 PolarHBondContact O-N 3.07Å; C293-A297 VanDerWaalsContact O-N 3.14Å; I294-A297 PolarHBondContact O-N 3.41Å; A297-G299 VanDerWaalsContact C-N 3.26Å; A297-G299 PolarHBondContact O-N 3.2Å
298	M	94.3	Very high	96.2	Very high	54 Å²	54	39.2 Å²	39.2	27%	0.266	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-0.7	171.9	-64.5	176.4	78.1	0	0	114.4	Y258 I294 H295 F296 K300	Y258-M298 HydrophobicContact CD2-CG 3.66Å; Y258-M298 HydrophobicContact CE2-CG 4.43Å; Y258-M298 HydrophobicContact CG-CG 3.77Å; I294-M298 HydrophobicContact CG2-CG 4.49Å; I294-M298 HydrophobicContact CG2-SD 4.1Å; I294-M298 WeakPolarHBondContact O-CG 3.21Å; I294-M298 PolarHBondContact O-N 3.24Å; H295-M298 PolarHBondContact O-N 3.42Å; F296-M298 PolarHBondContact O-N 3.18Å; M298-K300 HydrophobicContact CB-CD 4.44Å; M298-K300 HydrophobicContact CB-CG 4.2Å; M298-K300 HydrophobicContact CE-CD 4.3Å; M298-K300 PolarHBondContact O-N 2.91Å
299	G	91.5	Very high	96.2	Very high	38 Å²	38	42.8 Å²	42.8	39%	0.392	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	9.8	-174.4	0	0	0	0	0	114.4	H295 F296 A297 H301	H295-G299 PolarHBondContact O-N 3.46Å; F296-G299 PolarHBondContact O-N 3.03Å; A297-G299 VanDerWaalsContact C-N 3.26Å; A297-G299 PolarHBondContact O-N 3.2Å; G299-H301 VanDerWaalsContact C-N 3.28Å; G299-H301 PolarHBondContact O-N 3.5Å; G299-H301 VanDerWaalsContact O-N 3.07Å
300	K	95.1	Very high	96.2	Very high	108 Å²	108	44.2 Å²	44.2	47%	0.47	22%	0.223	S	C	.	.			trans	-88.5	66.4	-178.8	-65.3	-175.5	179.8	-176.1	0	110.1	H295 M298 N302 L303 G304	H295-K300 HydrophobicContact CB-CB 4.44Å; H295-K300 PolarHBondContact O-N 3.37Å; M298-K300 HydrophobicContact CB-CD 4.44Å; M298-K300 HydrophobicContact CB-CG 4.2Å; M298-K300 HydrophobicContact CE-CD 4.3Å; M298-K300 PolarHBondContact O-N 2.91Å; K300-N302 PolarHBondContact O-N 2.98Å; K300-L303 HydrophobicContact CB-CB 4.22Å; K300-L303 HydrophobicContact CD-CD2 4.41Å; K300-L303 PolarHBondContact O-N 3.04Å; K300-L303 VanDerWaalsContact O-N 3.12Å; K300-G304 PolarHBondContact O-N 3.26Å
301	H	95.2	Very high	96.2	Very high	46 Å²	46	41.9 Å²	41.9	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-48.2	-166	-61.3	-56	0	0	0	113.9	F296 G299 L303 G304 I305 Q356 H359 A360	F296-H301 AromaticContact CD2-CE1 3.89Å; F296-H301 AromaticContact CD2-ND1 3.67Å; F296-H301 AromaticContact CE2-CE1 3.95Å; G299-H301 VanDerWaalsContact C-N 3.28Å; G299-H301 PolarHBondContact O-N 3.5Å; G299-H301 VanDerWaalsContact O-N 3.07Å; H301-L303 VanDerWaalsContact C-N 3.31Å; H301-L303 PolarHBondContact O-N 3.32Å; H301-G304 PolarHBondContact O-N 2.84Å; H301-I305 WeakPolarHBondContact O-CG1 3.45Å; H301-I305 PolarHBondContact O-N 2.71Å; H301-Q356 WeakPolarHBondContact O-CG 3.31Å; H301-Q356 PolarHBondContact O-NE2 3.02Å; H301-H359 PolarHBondContact CD2-O 2.69Å; H301-A360 HydrophobicContact CB-CB 3.92Å
302	N	94.3	Very high	96.2	Very high	99 Å²	99	42.7 Å²	42.7	53%	0.529	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-36.8	178.3	-67.5	-53	0	0	0	113.6	K300 I305 F306 R362	K300-N302 PolarHBondContact O-N 2.98Å; N302-I305 PolarHBondContact O-N 3.42Å; N302-F306 PolarHBondContact O-N 2.95Å; N302-R362 PolarHBondContact OD1-NH2 3.27Å
303	L	95.8	Very high	96.1	Very high	62 Å²	62	48.7 Å²	48.7	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-72.6	-37.7	178.5	-175.7	57.4	0	0	0	111.3	H295 K300 H301 I305 F306 Y307	H295-L303 WeakPolarHBondContact CE1-CD2 3.39Å; H295-L303 WeakPolarHBondContact ND1-CD2 3.46Å; K300-L303 HydrophobicContact CB-CB 4.22Å; K300-L303 HydrophobicContact CD-CD2 4.41Å; K300-L303 PolarHBondContact O-N 3.04Å; K300-L303 VanDerWaalsContact O-N 3.12Å; H301-L303 VanDerWaalsContact C-N 3.31Å; H301-L303 PolarHBondContact O-N 3.32Å; L303-I305 VanDerWaalsContact C-N 3.33Å; L303-I305 PolarHBondContact O-N 2.97Å; L303-F306 HydrophobicContact CD1-CD1 4.32Å; L303-F306 WeakPolarHBondContact O-CB 3.47Å; L303-F306 PolarHBondContact O-N 2.97Å; L303-Y307 HydrophobicContact CD1-CD2 4.24Å; L303-Y307 HydrophobicContact CD1-CE2 3.61Å; L303-Y307 HydrophobicContact CD2-CE2 4.21Å; L303-Y307 HydrophobicContact CG-CD2 4.11Å; L303-Y307 HydrophobicContact CG-CE2 3.61Å; L303-Y307 WeakPolarHBondContact O-CD2 3.39Å; L303-Y307 PolarHBondContact O-N 3.31Å
304	G	96.9	Very high	95.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-38.5	171.5	0	0	0	0	0	112.7	K300 H301 F306 Y307 F308	K300-G304 PolarHBondContact O-N 3.26Å; H301-G304 PolarHBondContact O-N 2.84Å; G304-F306 VanDerWaalsContact C-N 3.31Å; G304-F306 PolarHBondContact O-N 3.26Å; G304-Y307 PolarHBondContact O-N 3.23Å; G304-F308 WeakPolarHBondContact O-CD2 3.41Å; G304-F308 PolarHBondContact O-N 2.79Å
305	I	97.1	Very high	95.7	Very high	9 Å²	9	49 Å²	49	5%	0.046	24%	0.241	C	C	.	.	H	α-helix	trans	-58.1	-45.3	173.9	-64.5	166.4	0	0	0	110.4	H301 N302 L303 Y307 F308 K309 Q356 L357 A360	H301-I305 WeakPolarHBondContact O-CG1 3.45Å; H301-I305 PolarHBondContact O-N 2.71Å; N302-I305 PolarHBondContact O-N 3.42Å; L303-I305 VanDerWaalsContact C-N 3.33Å; L303-I305 PolarHBondContact O-N 2.97Å; I305-Y307 VanDerWaalsContact C-N 3.32Å; I305-Y307 PolarHBondContact O-N 3.32Å; I305-F308 PolarHBondContact O-N 2.99Å; I305-K309 HydrophobicContact CG2-CD 4.27Å; I305-K309 HydrophobicContact CG2-CG 4.39Å; I305-K309 WeakPolarHBondContact O-CG 3.44Å; I305-K309 PolarHBondContact O-N 3.43Å; I305-Q356 HydrophobicContact CB-CG 4.43Å; I305-Q356 HydrophobicContact CD1-CG 4.42Å; I305-Q356 HydrophobicContact CG1-CB 4.12Å; I305-Q356 HydrophobicContact CG1-CG 3.45Å; I305-Q356 VanDerWaalsContact CG1-CG 3.45Å; I305-L357 HydrophobicContact CD1-CD2 3.58Å; I305-L357 HydrophobicContact CD1-CG 4.15Å; I305-L357 HydrophobicContact CG1-CD2 4.14Å; I305-L357 HydrophobicContact CG1-CG 4.29Å; I305-L357 HydrophobicContact CG2-CD2 4.27Å; I305-A360 HydrophobicContact CD1-CB 3.71Å
306	F	97.7	Very high	95.5	Very high	99 Å²	99	51.6 Å²	51.6	43%	0.434	26%	0.256	S	S	.	.	H	α-helix	trans	-57.1	-44.9	177.9	170.1	-98	0	0	0	112.1	N302 L303 G304 K309 K310	N302-F306 PolarHBondContact O-N 2.95Å; L303-F306 HydrophobicContact CD1-CD1 4.32Å; L303-F306 WeakPolarHBondContact O-CB 3.47Å; L303-F306 PolarHBondContact O-N 2.97Å; G304-F306 VanDerWaalsContact C-N 3.31Å; G304-F306 PolarHBondContact O-N 3.26Å; F306-K309 PolarHBondContact O-N 3.32Å; F306-K310 HydrophobicContact CE1-CD 3.89Å; F306-K310 HydrophobicContact CZ-CD 3.98Å; F306-K310 PolarHBondContact O-N 3.01Å; F306-K310 VanDerWaalsContact O-N 3.12Å
307	Y	98.3	Very high	95.3	Very high	45 Å²	45	53.7 Å²	53.7	18%	0.176	27%	0.266	C	S	.	.	H	α-helix	trans	-71.4	-38.1	178.9	-68.2	-54.5	0	0	0	113.3	W288 L291 H295 L303 G304 I305 K309 K310 A311	W288-Y307 AromaticContact CE3-CD1 3.34Å; W288-Y307 HydrophobicContact CE3-CD1 3.34Å; W288-Y307 AromaticContact CE3-CE1 3.79Å; W288-Y307 HydrophobicContact CE3-CE1 3.79Å; W288-Y307 HydrophobicContact CE3-CG 4.38Å; W288-Y307 AromaticContact CZ3-CD1 3.49Å; W288-Y307 HydrophobicContact CZ3-CD1 3.49Å; W288-Y307 VanDerWaalsContact CZ3-CD1 3.49Å; W288-Y307 AromaticContact CZ3-CE1 3.4Å; W288-Y307 HydrophobicContact CZ3-CE1 3.4Å; W288-Y307 VanDerWaalsContact CZ3-CE1 3.4Å; L291-Y307 HydrophobicContact CB-CD1 4.32Å; L291-Y307 HydrophobicContact CB-CD2 4.07Å; L291-Y307 HydrophobicContact CB-CE2 4.46Å; L291-Y307 HydrophobicContact CB-CG 3.97Å; L291-Y307 HydrophobicContact CD1-CD1 4.28Å; L291-Y307 HydrophobicContact CD1-CE1 4.11Å; H295-Y307 AromaticContact CD2-CD2 3.4Å; H295-Y307 VanDerWaalsContact CD2-CD2 3.4Å; H295-Y307 WeakPolarHBondContact CD2-CD2 3.37Å; H295-Y307 AromaticContact CD2-CE2 3.18Å; H295-Y307 WeakPolarHBondContact CD2-CE2 3.22Å; H295-Y307 AromaticContact NE2-CE2 3.37Å; H295-Y307 WeakPolarHBondContact NE2-CE2 3.3Å; L303-Y307 HydrophobicContact CD1-CD2 4.24Å; L303-Y307 HydrophobicContact CD1-CE2 3.61Å; L303-Y307 HydrophobicContact CD2-CE2 4.21Å; L303-Y307 HydrophobicContact CG-CD2 4.11Å; L303-Y307 HydrophobicContact CG-CE2 3.61Å; L303-Y307 WeakPolarHBondContact O-CD2 3.39Å; L303-Y307 PolarHBondContact O-N 3.31Å; G304-Y307 PolarHBondContact O-N 3.23Å; I305-Y307 VanDerWaalsContact C-N 3.32Å; I305-Y307 PolarHBondContact O-N 3.32Å; Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.43Å; Y307-K310 WeakPolarHBondContact O-CB 3.48Å; Y307-K310 PolarHBondContact O-N 2.85Å; Y307-A311 PolarHBondContact O-N 3.32Å
308	F	97.9	Very high	94.9	Very high	3 Å²	3	52.8 Å²	52.8	1%	0.013	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-37.6	173	-70.1	-50.7	0	0	0	112.4	N289 G304 I305 K310 A311 L312 N352 C353 Q356	N289-F308 WeakPolarHBondContact O-CE1 3.42Å; N289-F308 WeakPolarHBondContact OD1-CE1 3.31Å; G304-F308 WeakPolarHBondContact O-CD2 3.41Å; G304-F308 PolarHBondContact O-N 2.79Å; I305-F308 PolarHBondContact O-N 2.99Å; F308-K310 VanDerWaalsContact C-N 3.34Å; F308-K310 PolarHBondContact O-N 3.05Å; F308-A311 WeakPolarHBondContact O-CB 3.49Å; F308-A311 PolarHBondContact O-N 3.23Å; F308-L312 PolarHBondContact O-N 3.22Å; F308-N352 HydrophobicContact CD1-CB 4.03Å; F308-N352 HydrophobicContact CE1-CB 3.61Å; F308-N352 HydrophobicContact CE2-CB 4.24Å; F308-N352 HydrophobicContact CZ-CB 3.73Å; F308-C353 HydrophobicContact CB-CB 4.05Å; F308-Q356 HydrophobicContact CD2-CB 4.01Å; F308-Q356 HydrophobicContact CD2-CG 4.14Å; F308-Q356 HydrophobicContact CE2-CB 4Å; F308-Q356 HydrophobicContact CE2-CG 4.15Å
309	K	96.8	Very high	94.6	Very high	117 Å²	117	51.4 Å²	51.4	51%	0.509	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-40.3	172.5	-75.4	-173.2	174.8	-165.4	0	112.3	I305 F306 Y307 L312 Q313	I305-K309 HydrophobicContact CG2-CD 4.27Å; I305-K309 HydrophobicContact CG2-CG 4.39Å; I305-K309 WeakPolarHBondContact O-CG 3.44Å; I305-K309 PolarHBondContact O-N 3.43Å; F306-K309 PolarHBondContact O-N 3.32Å; Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.43Å; K309-L312 PolarHBondContact O-N 2.93Å; K309-Q313 WeakPolarHBondContact O-CG 3.5Å; K309-Q313 PolarHBondContact O-N 3.17Å
310	K	97.3	Very high	94.3	Very high	60 Å²	60	52.9 Å²	52.9	26%	0.261	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-40.1	172.7	-76.9	-171.5	163.9	-173.7	0	112.6	W288 F306 Y307 F308 L312 Q313 E314	W288-K310 HydrophobicContact CB-CB 4.25Å; W288-K310 HydrophobicContact CD2-CB 3.88Å; W288-K310 HydrophobicContact CD2-CD 3.94Å; W288-K310 HydrophobicContact CE3-CB 4.42Å; W288-K310 HydrophobicContact CE3-CD 3.97Å; W288-K310 HydrophobicContact CG-CB 3.82Å; W288-K310 HydrophobicContact CH2-CD 3.87Å; W288-K310 HydrophobicContact CZ2-CD 3.81Å; W288-K310 HydrophobicContact CZ3-CD 3.96Å; F306-K310 HydrophobicContact CE1-CD 3.89Å; F306-K310 HydrophobicContact CZ-CD 3.98Å; F306-K310 PolarHBondContact O-N 3.01Å; F306-K310 VanDerWaalsContact O-N 3.12Å; Y307-K310 WeakPolarHBondContact O-CB 3.48Å; Y307-K310 PolarHBondContact O-N 2.85Å; F308-K310 VanDerWaalsContact C-N 3.34Å; F308-K310 PolarHBondContact O-N 3.05Å; K310-L312 VanDerWaalsContact C-N 3.34Å; K310-L312 PolarHBondContact O-N 3.35Å; K310-Q313 PolarHBondContact O-N 3.28Å; K310-E314 WeakPolarHBondContact O-CG 3.39Å; K310-E314 PolarHBondContact O-N 2.96Å
311	A	97.3	Very high	93.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-43.1	175.6	0	0	0	0	0	111.7	W288 N289 Y307 F308 E314 N315 L349	W288-A311 HydrophobicContact CB-CB 3.75Å; N289-A311 HydrophobicContact CB-CB 4.21Å; Y307-A311 PolarHBondContact O-N 3.32Å; F308-A311 WeakPolarHBondContact O-CB 3.49Å; F308-A311 PolarHBondContact O-N 3.23Å; A311-E314 PolarHBondContact O-N 3.35Å; A311-N315 WeakPolarHBondContact O-CB 3.45Å; A311-N315 PolarHBondContact O-N 3.32Å; A311-L349 HydrophobicContact CB-CD1 4.29Å; A311-L349 HydrophobicContact CB-CD2 3.78Å
312	L	96.4	Very high	92.7	Very high	21 Å²	21	51.4 Å²	51.4	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-45.1	174.5	-75.3	165	0	0	0	111.9	F308 K309 K310 E314 N315 D316 L349 L350	F308-L312 PolarHBondContact O-N 3.22Å; K309-L312 PolarHBondContact O-N 2.93Å; K310-L312 VanDerWaalsContact C-N 3.34Å; K310-L312 PolarHBondContact O-N 3.35Å; L312-E314 VanDerWaalsContact C-N 3.34Å; L312-E314 PolarHBondContact O-N 2.86Å; L312-N315 WeakPolarHBondContact O-CB 3.33Å; L312-N315 PolarHBondContact O-N 3.43Å; L312-D316 WeakPolarHBondContact O-CB 3.29Å; L312-D316 VanDerWaalsContact O-CG 3.22Å; L312-D316 PolarHBondContact O-N 3.38Å; L312-L349 HydrophobicContact CD2-CB 3.55Å; L312-L349 HydrophobicContact CD2-CD1 4Å; L312-L349 HydrophobicContact CD2-CG 4.46Å; L312-L349 HydrophobicContact CG-CB 3.98Å; L312-L349 HydrophobicContact CG-CD1 4.34Å; L312-L350 HydrophobicContact CD1-CD2 4.08Å; L312-L350 HydrophobicContact CD2-CD2 4.19Å; L312-L350 HydrophobicContact CD2-CG 4.11Å
313	Q	95.3	Very high	91.2	Very high	127 Å²	127	49.5 Å²	49.5	59%	0.593	26%	0.261	S	S	*	.	H	α-helix	trans	-59.1	-42.9	176.8	-72.9	170.1	-9	0	0	112.7	K309 K310 D316 H317	K309-Q313 WeakPolarHBondContact O-CG 3.5Å; K309-Q313 PolarHBondContact O-N 3.17Å; K310-Q313 PolarHBondContact O-N 3.28Å; Q313-D316 PolarHBondContact O-N 3.45Å; Q313-H317 WeakPolarHBondContact O-CB 3.33Å; Q313-H317 PolarHBondContact O-N 2.98Å
314	E	93.8	Very high	89	Confident	37 Å²	37	52 Å²	52	17%	0.173	28%	0.275	C	S	.	.	H	α-helix	trans	-70	-34.5	177.8	-65	-88.6	-178.3	0	0	111.7	R284 C285 K310 A311 L312 T318	R284-E314 HydrophobicContact CB-CG 4.46Å; R284-E314 WeakPolarHBondContact CD-OE2 3.4Å; R284-E314 IonicContact CZ-OE1 3.53Å; R284-E314 IonicContact CZ-OE2 2.94Å; R284-E314 IonicContact NE-OE1 2.67Å; R284-E314 PolarHBondContact NE-OE1 3.16Å; R284-E314 VanDerWaalsContact NE-OE1 3.12Å; R284-E314 IonicContact NE-OE2 2.69Å; R284-E314 PolarHBondContact NE-OE2 3.43Å; R284-E314 IonicContact NH2-OE1 3.13Å; R284-E314 PolarHBondContact NH2-OE1 3Å; C285-E314 HydrophobicContact CB-CB 4.46Å; K310-E314 WeakPolarHBondContact O-CG 3.39Å; K310-E314 PolarHBondContact O-N 2.96Å; A311-E314 PolarHBondContact O-N 3.35Å; L312-E314 VanDerWaalsContact C-N 3.34Å; L312-E314 PolarHBondContact O-N 2.86Å; E314-T318 WeakPolarHBondContact O-CB 3.42Å; E314-T318 PolarHBondContact O-N 3.25Å; E314-T318 PolarHBondContact O-OG1 2.92Å
315	N	93	Very high	86.3	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-48.1	172.1	-178.2	87.3	0	0	0	111.7	A311 L312 H317 T318 C319 N344 K345 L349	A311-N315 WeakPolarHBondContact O-CB 3.45Å; A311-N315 PolarHBondContact O-N 3.32Å; L312-N315 WeakPolarHBondContact O-CB 3.33Å; L312-N315 PolarHBondContact O-N 3.43Å; N315-H317 VanDerWaalsContact C-N 3.33Å; N315-H317 PolarHBondContact O-N 3.17Å; N315-T318 WeakPolarHBondContact O-CB 3.48Å; N315-T318 PolarHBondContact O-N 3.02Å; N315-C319 PolarHBondContact O-N 3.27Å; N315-C319 PolarHBondContact O-SG 3.09Å; N315-N344 PolarHBondContact ND2-OD1 3.32Å; N315-K345 PolarHBondContact OD1-N 3.06Å; N315-L349 HydrophobicContact CB-CD1 3.77Å
316	D	92.1	Very high	83.4	Confident	69 Å²	69	58.3 Å²	58.3	37%	0.369	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-40	179.5	-66.5	-16.5	0	0	0	110.7	L312 Q313 T318 C319 A320 R346	L312-D316 WeakPolarHBondContact O-CB 3.29Å; L312-D316 VanDerWaalsContact O-CG 3.22Å; L312-D316 PolarHBondContact O-N 3.38Å; Q313-D316 PolarHBondContact O-N 3.45Å; D316-T318 PolarHBondContact O-N 3.44Å; D316-C319 PolarHBondContact O-N 2.94Å; D316-A320 WeakPolarHBondContact O-CB 3.45Å; D316-A320 PolarHBondContact O-N 3.05Å; D316-R346 IonicContact OD1-NH1 3.45Å; D316-R346 PolarHBondContact OD1-NH1 3.49Å; D316-R346 IonicContact OD2-NH1 3.27Å
317	H	89.9	Confident	80.4	Confident	108 Å²	108	60.5 Å²	60.5	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-42.1	173	-172	59.2	0	0	0	112.2	Q313 N315 A320 Q321	Q313-H317 WeakPolarHBondContact O-CB 3.33Å; Q313-H317 PolarHBondContact O-N 2.98Å; N315-H317 VanDerWaalsContact C-N 3.33Å; N315-H317 PolarHBondContact O-N 3.17Å; H317-A320 PolarHBondContact O-N 3.26Å; H317-Q321 PolarHBondContact CD2-NE2 2.99Å; H317-Q321 VanDerWaalsContact CD2-NE2 3.29Å; H317-Q321 PolarHBondContact NE2-NE2 3.21Å; H317-Q321 WeakPolarHBondContact O-CG 3.49Å; H317-Q321 PolarHBondContact O-N 3.11Å; H317-Q321 VanDerWaalsContact O-N 3.09Å
318	T	88.2	Confident	77.6	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.037	39%	0.392	C	S	.	.	H	α-helix	trans	-62.6	-44.2	175.3	-59.5	0	0	0	0	111.3	P276 C282 E314 N315 D316 Q321 L322	P276-T318 HydrophobicContact CB-CG2 3.63Å; P276-T318 HydrophobicContact CG-CG2 3.42Å; P276-T318 VanDerWaalsContact CG-CG2 3.42Å; C282-T318 PolarHBondContact SG-OG1 2.8Å; C282-T318 VanDerWaalsContact SG-OG1 3.37Å; E314-T318 WeakPolarHBondContact O-CB 3.42Å; E314-T318 PolarHBondContact O-N 3.25Å; E314-T318 PolarHBondContact O-OG1 2.92Å; N315-T318 WeakPolarHBondContact O-CB 3.48Å; N315-T318 PolarHBondContact O-N 3.02Å; D316-T318 PolarHBondContact O-N 3.44Å; T318-Q321 PolarHBondContact O-N 2.97Å; T318-L322 HydrophobicContact CG2-CD1 3.94Å; T318-L322 VanDerWaalsContact O-CG 3.32Å; T318-L322 WeakPolarHBondContact O-CG 3.35Å; T318-L322 PolarHBondContact O-N 3.26Å; T318-L322 VanDerWaalsContact O-N 3.13Å
319	C	86.1	Confident	74.6	Confident	25 Å²	25	74 Å²	74	17%	0.169	43%	0.428	C	S	.	.	H	α-helix	trans	-64.8	-40.9	178.2	-63.4	0	0	0	0	111.6	N315 D316 Q321 L322 G323	N315-C319 PolarHBondContact O-N 3.27Å; N315-C319 PolarHBondContact O-SG 3.09Å; D316-C319 PolarHBondContact O-N 2.94Å; C319-Q321 VanDerWaalsContact C-N 3.3Å; C319-Q321 PolarHBondContact O-N 3.43Å; C319-L322 PolarHBondContact O-N 3.32Å; C319-L322 VanDerWaalsContact O-N 3.13Å; C319-G323 PolarHBondContact O-N 3Å
320	A	85.7	Confident	71.8	Confident	68 Å²	68	75.2 Å²	75.2	56%	0.562	45%	0.449	S	S	*	.	H	α-helix	trans	-61.2	-37.7	175.7	0	0	0	0	0	112.5	D316 H317 L322 G323	D316-A320 WeakPolarHBondContact O-CB 3.45Å; D316-A320 PolarHBondContact O-N 3.05Å; H317-A320 PolarHBondContact O-N 3.26Å; A320-L322 VanDerWaalsContact C-N 3.34Å; A320-G323 PolarHBondContact O-N 2.98Å
321	Q	82.1	Confident	69.2	Low	101 Å²	101	81.5 Å²	81.5	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-69.5	-29.3	175	-70.7	177.1	5.1	0	0	113.5	H317 T318 C319 G323	H317-Q321 PolarHBondContact CD2-NE2 2.99Å; H317-Q321 VanDerWaalsContact CD2-NE2 3.29Å; H317-Q321 PolarHBondContact NE2-NE2 3.21Å; H317-Q321 WeakPolarHBondContact O-CG 3.49Å; H317-Q321 PolarHBondContact O-N 3.11Å; H317-Q321 VanDerWaalsContact O-N 3.09Å; T318-Q321 PolarHBondContact O-N 2.97Å; C319-Q321 VanDerWaalsContact C-N 3.3Å; C319-Q321 PolarHBondContact O-N 3.43Å; Q321-G323 PolarHBondContact O-N 3.28Å
322	L	75.6	Confident	66.8	Low	23 Å²	23	92.1 Å²	92.1	12%	0.12	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-3.1	179.2	-69.1	167.9	0	0	0	113.1	I277 T318 C319 A320 V336 A340	I277-L322 HydrophobicContact CG1-CD2 3.76Å; T318-L322 HydrophobicContact CG2-CD1 3.94Å; T318-L322 VanDerWaalsContact O-CG 3.32Å; T318-L322 WeakPolarHBondContact O-CG 3.35Å; T318-L322 PolarHBondContact O-N 3.26Å; T318-L322 VanDerWaalsContact O-N 3.13Å; C319-L322 PolarHBondContact O-N 3.32Å; C319-L322 VanDerWaalsContact O-N 3.13Å; A320-L322 VanDerWaalsContact C-N 3.34Å; L322-V336 HydrophobicContact CB-CG1 4.48Å; L322-V336 HydrophobicContact CD2-CG1 4.3Å; L322-A340 HydrophobicContact CD1-CB 4.05Å; L322-A340 HydrophobicContact CD2-CB 3.61Å
323	G	62.2	Low	64.8	Low	58 Å²	58	93.7 Å²	93.7	60%	0.598	53%	0.529	S	S	*	.			trans	83.7	87.7	178.6	0	0	0	0	0	112	C319 A320 Q321	C319-G323 PolarHBondContact O-N 3Å; A320-G323 PolarHBondContact O-N 2.98Å; Q321-G323 PolarHBondContact O-N 3.28Å
324	D	49.7	Very low	63.1	Low	116 Å²	116	92.3 Å²	92.3	62%	0.62	53%	0.533	S	S	*	.			trans	-120.8	93.5	159.1	-159.1	9.7	0	0	0	107.6	G326	D324-G326 PolarHBondContact O-N 2.86Å; D324-G326 VanDerWaalsContact O-N 3.12Å
325	G	39.1	Very low	62.1	Low	76 Å²	76	92.6 Å²	92.6	78%	0.784	55%	0.546	S	S	*	.			trans	-66	105.6	163	0	0	0	0	0	106.8	N327	G325-N327 PolarHBondContact O-N 3.19Å
326	G	38.1	Very low	61.7	Low	65 Å²	65	94 Å²	94	67%	0.67	55%	0.554	S	S	*	*	S	Bend	trans	-44.1	120.1	-164.3	0	0	0	0	0	115.6	D324	D324-G326 PolarHBondContact O-N 2.86Å; D324-G326 VanDerWaalsContact O-N 3.12Å
327	N	34.1	Very low	61.5	Low	145 Å²	145	91.8 Å²	91.8	78%	0.775	54%	0.544	S	S	*	.				-176.8	143.1	129.9	-109.9	-23.5	0	0	0	109.8	G325 Q329	G325-N327 PolarHBondContact O-N 3.19Å; N327-Q329 PolarHBondContact O-N 3.13Å
328	N	38.9	Very low	61.5	Low	168 Å²	168	87.7 Å²	87.7	90%	0.898	53%	0.525	S	S	*	.	S	Bend	trans	-61.8	42.3	-175.3	-109.4	-10.7	0	0	0	116.4
329	Q	34.9	Very low	61.5	Low	164 Å²	164	88.5 Å²	88.5	77%	0.766	53%	0.531	S	S	*	.	S	Bend	trans	-137.9	119.4	174.8	-70.7	-170.6	15.8	0	0	112.7	N327 K331	N327-Q329 PolarHBondContact O-N 3.13Å; Q329-K331 PolarHBondContact O-N 3.41Å
330	C	38.9	Very low	61.6	Low	141 Å²	141	87.5 Å²	87.5	95%	0.953	52%	0.524	S	S	*	.			trans	-14.6	93.4	159.5	-157	0	0	0	0	114
331	K	42	Very low	61.7	Low	193 Å²	193	86.3 Å²	86.3	84%	0.839	51%	0.508	S	S	*	.			trans	-128.3	131.5	163.1	-72.9	-176.4	-179.2	176.5	0	107.5	Q329	Q329-K331 PolarHBondContact O-N 3.41Å
332	R	47.3	Very low	61.9	Low	222 Å²	222	82.4 Å²	82.4	84%	0.838	49%	0.491	S	S	*	.			trans	-23.6	148.3	-170.7	-61.4	176.3	-137.6	-179.1	4.3	115.4	S334	R332-S334 PolarHBondContact O-N 2.97Å
333	P	53.4	Low	62.4	Low	55 Å²	55	81.5 Å²	81.5	36%	0.357	49%	0.486	S	S	.	.	S	Bend	trans	-65.4	22.7	176	29.9	-36.7	0	0	0	114.8	G335 L341	P333-G335 PolarHBondContact O-N 3.19Å; P333-L341 HydrophobicContact CB-CD2 3.92Å
334	S	60.3	Low	63.6	Low	97 Å²	97	81.9 Å²	81.9	68%	0.678	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	118.9	179.2	-170.9	0	0	0	0	109.2	R332	R332-S334 PolarHBondContact O-N 2.97Å
335	G	72.9	Confident	65.5	Low	44 Å²	44	80 Å²	80	45%	0.454	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.2	-13.7	176	0	0	0	0	0	115	T75 P333	T75-G335 WeakPolarHBondContact CG2-O 3.48Å; T75-G335 PolarHBondContact O-N 3.32Å; P333-G335 PolarHBondContact O-N 3.19Å
336	V	84.4	Confident	68.2	Low	30 Å²	30	79.6 Å²	79.6	18%	0.182	44%	0.435	C	S	.	.	S	Bend	trans	-102.2	129.1	175.3	-177.1	0	0	0	0	109.3	L322 M338 A340 L341	L322-V336 HydrophobicContact CB-CG1 4.48Å; L322-V336 HydrophobicContact CD2-CG1 4.3Å; V336-M338 PolarHBondContact O-N 3.22Å; V336-A340 HydrophobicContact CG1-CB 4.02Å; V336-L341 HydrophobicContact CB-CD2 4.15Å; V336-L341 HydrophobicContact CG1-CD2 4.14Å
337	P	88.1	Confident	70.9	Confident	22 Å²	22	79.7 Å²	79.7	14%	0.143	42%	0.416	C	S	.	.			trans	-55	136.3	173.6	-26.5	35.4	0	0	0	111.6	Q74 T75 I277 C339 A340 L341	Q74-P337 CarbonylContact O-C 3.59Å; Q74-P337 WeakPolarHBondContact O-CA 3.47Å; T75-P337 HydrophobicContact CG2-CG 4.33Å; I277-P337 HydrophobicContact CG2-CG 4.31Å; P337-C339 PolarHBondContact O-N 3.37Å; P337-C339 VanDerWaalsContact O-N 3.15Å; P337-A340 WeakPolarHBondContact O-CA 3.37Å; P337-A340 WeakPolarHBondContact O-CB 3.27Å; P337-A340 PolarHBondContact O-N 3.4Å; P337-L341 PolarHBondContact O-N 3.47Å
338	M	90.1	Very high	73.7	Confident	22 Å²	22	74.6 Å²	74.6	11%	0.108	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-53.6	-40	-174.9	-175.9	179.4	66.1	0	0	113.3	F69 Q74 T77 I115 I116 H119 V336 A340 L341	F69-M338 HydrophobicContact CE1-CE 4.3Å; F69-M338 HydrophobicContact CE2-CB 4.22Å; F69-M338 HydrophobicContact CZ-CB 3.68Å; F69-M338 HydrophobicContact CZ-CE 4.05Å; F69-M338 HydrophobicContact CZ-CG 4.49Å; F69-M338 HydrophobicContact CZ-SD 4.11Å; Q74-M338 PolarHBondContact O-N 2.97Å; T77-M338 HydrophobicContact CG2-CG 4.12Å; T77-M338 HydrophobicContact CG2-SD 4.23Å; I115-M338 HydrophobicContact CG2-CE 3.77Å; I115-M338 HydrophobicContact CG2-SD 4.41Å; I116-M338 HydrophobicContact CG1-SD 4.32Å; H119-M338 HydrophobicContact CB-CG 3.8Å; H119-M338 HydrophobicContact CB-SD 4.5Å; H119-M338 PolarHBondContact ND1-O 3.26Å; V336-M338 PolarHBondContact O-N 3.22Å; M338-A340 PolarHBondContact O-N 3.38Å; M338-L341 HydrophobicContact CB-CD1 4.41Å; M338-L341 HydrophobicContact CG-CD1 4.08Å; M338-L341 WeakPolarHBondContact O-CB 3.39Å; M338-L341 WeakPolarHBondContact O-CG 3.49Å; M338-L341 PolarHBondContact O-N 3.4Å
339	C	87.1	Confident	76.5	Confident	24 Å²	24	66.8 Å²	66.8	16%	0.162	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-60	-32	177.7	61.7	0	0	0	0	112.6	I277 G280 P337	I277-C339 PolarHBondContact O-SG 3.38Å; I277-C339 VanDerWaalsContact O-SG 3.35Å; G280-C339 WeakPolarHBondContact CA-O 3.37Å; P337-C339 PolarHBondContact O-N 3.37Å; P337-C339 VanDerWaalsContact O-N 3.15Å
340	A	88.5	Confident	79.5	Confident	3 Å²	3	59.4 Å²	59.4	3%	0.025	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-84.9	-5.4	-178.9	0	0	0	0	0	114.5	L322 V336 P337 M338 L342 S343	L322-A340 HydrophobicContact CD1-CB 4.05Å; L322-A340 HydrophobicContact CD2-CB 3.61Å; V336-A340 HydrophobicContact CG1-CB 4.02Å; P337-A340 WeakPolarHBondContact O-CA 3.37Å; P337-A340 WeakPolarHBondContact O-CB 3.27Å; P337-A340 PolarHBondContact O-N 3.4Å; M338-A340 PolarHBondContact O-N 3.38Å; A340-L342 PolarHBondContact O-N 2.85Å; A340-L342 VanDerWaalsContact O-N 3.12Å; A340-S343 WeakPolarHBondContact CA-OG 3.3Å; A340-S343 VanDerWaalsContact O-CB 3.25Å; A340-S343 WeakPolarHBondContact O-CB 3.46Å; A340-S343 PolarHBondContact O-N 2.92Å; A340-S343 PolarHBondContact O-OG 3.45Å
341	L	87.4	Confident	82.3	Confident	43 Å²	43	53.7 Å²	53.7	23%	0.225	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.3	178	-67.4	174.9	0	0	0	113.1	T77 H119 P333 V336 P337 M338	T77-L341 HydrophobicContact CG2-CD1 4.09Å; H119-L341 HydrophobicContact CB-CD1 4.33Å; P333-L341 HydrophobicContact CB-CD2 3.92Å; V336-L341 HydrophobicContact CB-CD2 4.15Å; V336-L341 HydrophobicContact CG1-CD2 4.14Å; P337-L341 PolarHBondContact O-N 3.47Å; M338-L341 HydrophobicContact CB-CD1 4.41Å; M338-L341 HydrophobicContact CG-CD1 4.08Å; M338-L341 WeakPolarHBondContact O-CB 3.39Å; M338-L341 WeakPolarHBondContact O-CG 3.49Å; M338-L341 PolarHBondContact O-N 3.4Å
342	L	86.4	Confident	84.9	Confident	20 Å²	20	46.6 Å²	46.6	11%	0.105	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-93.3	-1.8	178	-61.1	-179.8	0	0	0	113.5	Y118 H119 R121 A340 K345	Y118-L342 HydrophobicContact CD1-CD1 4.39Å; Y118-L342 HydrophobicContact CE1-CD1 3.83Å; H119-L342 WeakPolarHBondContact O-CD2 3.36Å; R121-L342 HydrophobicContact CG-CD2 3.46Å; R121-L342 VanDerWaalsContact CG-CD2 3.46Å; A340-L342 PolarHBondContact O-N 2.85Å; A340-L342 VanDerWaalsContact O-N 3.12Å; L342-K345 WeakPolarHBondContact O-CE 3.46Å; L342-K345 PolarHBondContact O-NZ 2.66Å
343	S	85.9	Confident	87.3	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.021	20%	0.202	C	C	.	.			trans	-71.6	-28.7	-173.5	-60.4	0	0	0	0	113.8	G280 A340 K345	G280-S343 VanDerWaalsContact C-OG 3.27Å; G280-S343 WeakPolarHBondContact CA-OG 3.28Å; G280-S343 PolarHBondContact O-OG 3.45Å; A340-S343 WeakPolarHBondContact CA-OG 3.3Å; A340-S343 VanDerWaalsContact O-CB 3.25Å; A340-S343 WeakPolarHBondContact O-CB 3.46Å; A340-S343 PolarHBondContact O-N 2.92Å; A340-S343 PolarHBondContact O-OG 3.45Å; S343-K345 PolarHBondContact O-N 3.28Å
344	N	88	Confident	89.4	Confident	67 Å²	67	33.6 Å²	33.6	36%	0.358	19%	0.185	S	C	.	.			trans	-73.3	115.6	177.1	-171.8	-4.4	0	0	0	110.4	R121 N315 R346	R121-N344 PolarHBondContact NH2-O 3.02Å; R121-N344 VanDerWaalsContact NH2-O 3.17Å; N315-N344 PolarHBondContact ND2-OD1 3.32Å; N344-R346 WeakPolarHBondContact OD1-CB 3.44Å; N344-R346 PolarHBondContact OD1-N 3.42Å
345	K	90.9	Very high	91.1	Very high	75 Å²	75	29.9 Å²	29.9	33%	0.326	16%	0.159	S	C	.	.			trans	-115.4	18.2	178.6	-57.2	-54.6	-172.9	-163.9	0	112.7	N315 L342 S343 Y347 E348 L349	N315-K345 PolarHBondContact OD1-N 3.06Å; L342-K345 WeakPolarHBondContact O-CE 3.46Å; L342-K345 PolarHBondContact O-NZ 2.66Å; S343-K345 PolarHBondContact O-N 3.28Å; K345-Y347 VanDerWaalsContact C-N 3.34Å; K345-Y347 PolarHBondContact O-N 3.4Å; K345-E348 VanDerWaalsContact C-OE2 3.27Å; K345-E348 WeakPolarHBondContact CA-OE2 3.21Å; K345-E348 PolarHBondContact O-N 2.99Å; K345-L349 HydrophobicContact CB-CD1 4.43Å; K345-L349 HydrophobicContact CB-CG 4.35Å; K345-L349 VanDerWaalsContact O-CG 3.27Å; K345-L349 WeakPolarHBondContact O-CG 3.33Å; K345-L349 PolarHBondContact O-N 3.17Å
346	R	93.8	Very high	92.2	Very high	69 Å²	69	27.9 Å²	27.9	26%	0.26	14%	0.137	S	C	.	.	H	α-helix	trans	-49.9	-51.3	-172.3	179.3	178	178.2	82.4	5.1	112.5	D316 N344 L349 L350 E372	D316-R346 IonicContact OD1-NH1 3.45Å; D316-R346 PolarHBondContact OD1-NH1 3.49Å; D316-R346 IonicContact OD2-NH1 3.27Å; N344-R346 WeakPolarHBondContact OD1-CB 3.44Å; N344-R346 PolarHBondContact OD1-N 3.42Å; R346-L349 PolarHBondContact O-N 2.77Å; R346-L350 HydrophobicContact CG-CD1 3.77Å; R346-L350 HydrophobicContact CG-CG 4.32Å; R346-L350 WeakPolarHBondContact O-CB 3.39Å; R346-L350 VanDerWaalsContact O-CG 3.31Å; R346-L350 WeakPolarHBondContact O-CG 3.35Å; R346-L350 PolarHBondContact O-N 3.39Å; R346-E372 IonicContact CZ-OE2 3.3Å; R346-E372 IonicContact NE-OE2 3.69Å; R346-E372 PolarHBondContact NE-OE2 3.22Å; R346-E372 VanDerWaalsContact NE-OE2 3.15Å; R346-E372 IonicContact NH2-OE1 3.17Å; R346-E372 PolarHBondContact NH2-OE1 3.48Å; R346-E372 IonicContact NH2-OE2 2.93Å; R346-E372 PolarHBondContact NH2-OE2 3.22Å
347	Y	94.9	Very high	92.8	Very high	67 Å²	67	26.9 Å²	26.9	26%	0.263	13%	0.131	S	C	.	.	H	α-helix	trans	-70	-35.6	-174.9	-59	-74.4	0	0	0	112.6	K345 L349 Y351 E372 V376	K345-Y347 VanDerWaalsContact C-N 3.34Å; K345-Y347 PolarHBondContact O-N 3.4Å; Y347-L349 VanDerWaalsContact C-N 3.35Å; Y347-Y351 WeakPolarHBondContact O-CB 3.27Å; Y347-Y351 PolarHBondContact O-N 3.11Å; Y347-E372 VanDerWaalsContact CD1-O 3.32Å; Y347-E372 WeakPolarHBondContact CD1-O 3.48Å; Y347-E372 WeakPolarHBondContact CE1-O 3.34Å; Y347-V376 HydrophobicContact CD1-CG2 3.88Å; Y347-V376 HydrophobicContact CD2-CB 4.39Å; Y347-V376 HydrophobicContact CD2-CG2 3.61Å; Y347-V376 HydrophobicContact CE1-CG2 3.88Å; Y347-V376 HydrophobicContact CE2-CG2 3.61Å; Y347-V376 HydrophobicContact CG-CB 4.26Å; Y347-V376 HydrophobicContact CG-CG2 3.73Å
348	E	94.8	Very high	93.1	Very high	37 Å²	37	26.9 Å²	26.9	17%	0.173	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-42.1	171.8	-63	92.6	143.3	0	0	111.5	R121 K345 N352 Y377 P512	R121-E348 IonicContact NH1-OE1 3.12Å; R121-E348 PolarHBondContact NH1-OE1 2.83Å; R121-E348 IonicContact NH2-OE1 2.67Å; K345-E348 VanDerWaalsContact C-OE2 3.27Å; K345-E348 WeakPolarHBondContact CA-OE2 3.21Å; K345-E348 PolarHBondContact O-N 2.99Å; E348-N352 PolarHBondContact O-N 3.38Å; E348-Y377 HydrophobicContact CG-CE2 4.49Å; E348-Y377 WeakPolarHBondContact CG-OH 3.41Å; E348-Y377 PolarHBondContact OE1-OH 3.3Å; E348-Y377 PolarHBondContact OE2-OH 2.98Å; E348-P512 HydrophobicContact CB-CB 4.4Å; E348-P512 HydrophobicContact CG-CB 3.94Å
349	L	96.8	Very high	93.2	Very high	5 Å²	5	30 Å²	30	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-70.2	-40.3	178.4	-64.8	172.9	0	0	0	112.4	N289 A311 L312 N315 K345 R346 Y347 Y351 N352 C353	N289-L349 HydrophobicContact CB-CD2 3.77Å; N289-L349 WeakPolarHBondContact OD1-CD2 3.43Å; A311-L349 HydrophobicContact CB-CD1 4.29Å; A311-L349 HydrophobicContact CB-CD2 3.78Å; L312-L349 HydrophobicContact CD2-CB 3.55Å; L312-L349 HydrophobicContact CD2-CD1 4Å; L312-L349 HydrophobicContact CD2-CG 4.46Å; L312-L349 HydrophobicContact CG-CB 3.98Å; L312-L349 HydrophobicContact CG-CD1 4.34Å; N315-L349 HydrophobicContact CB-CD1 3.77Å; K345-L349 HydrophobicContact CB-CD1 4.43Å; K345-L349 HydrophobicContact CB-CG 4.35Å; K345-L349 VanDerWaalsContact O-CG 3.27Å; K345-L349 WeakPolarHBondContact O-CG 3.33Å; K345-L349 PolarHBondContact O-N 3.17Å; R346-L349 PolarHBondContact O-N 2.77Å; Y347-L349 VanDerWaalsContact C-N 3.35Å; L349-Y351 VanDerWaalsContact C-N 3.35Å; L349-N352 PolarHBondContact O-N 3.26Å; L349-C353 VanDerWaalsContact O-CB 3.3Å; L349-C353 WeakPolarHBondContact O-CB 3.32Å; L349-C353 PolarHBondContact O-N 2.88Å
350	L	97.3	Very high	93.4	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-39.6	175.7	-74.2	171.2	0	0	0	111.5	L312 R346 C353 G354 C369 E372	L312-L350 HydrophobicContact CD1-CD2 4.08Å; L312-L350 HydrophobicContact CD2-CD2 4.19Å; L312-L350 HydrophobicContact CD2-CG 4.11Å; R346-L350 HydrophobicContact CG-CD1 3.77Å; R346-L350 HydrophobicContact CG-CG 4.32Å; R346-L350 WeakPolarHBondContact O-CB 3.39Å; R346-L350 VanDerWaalsContact O-CG 3.31Å; R346-L350 WeakPolarHBondContact O-CG 3.35Å; R346-L350 PolarHBondContact O-N 3.39Å; L350-C353 PolarHBondContact O-N 3.1Å; L350-G354 PolarHBondContact O-N 3.25Å; L350-C369 HydrophobicContact CD2-CB 4.3Å; L350-E372 HydrophobicContact CD1-CB 3.65Å; L350-E372 HydrophobicContact CD1-CG 4.27Å; L350-E372 WeakPolarHBondContact CD1-OE2 3.38Å
351	Y	97.4	Very high	93.5	Very high	22 Å²	22	33.6 Å²	33.6	9%	0.086	18%	0.175	C	C	.	.	H	α-helix	trans	-56.4	-52.3	171.7	175.6	-92	0	0	0	111.3	Y347 L349 C353 G354 V355 L370 L383 P512	Y347-Y351 WeakPolarHBondContact O-CB 3.27Å; Y347-Y351 PolarHBondContact O-N 3.11Å; L349-Y351 VanDerWaalsContact C-N 3.35Å; Y351-C353 PolarHBondContact O-N 3.45Å; Y351-G354 PolarHBondContact O-N 2.69Å; Y351-V355 HydrophobicContact CE1-CG2 4.15Å; Y351-V355 HydrophobicContact CE2-CG2 4.38Å; Y351-V355 WeakPolarHBondContact O-CG2 3.37Å; Y351-V355 PolarHBondContact O-N 3.06Å; Y351-L370 HydrophobicContact CD2-CD2 4.22Å; Y351-L383 HydrophobicContact CD2-CD1 3.86Å; Y351-L383 HydrophobicContact CD2-CD2 4.4Å; Y351-L383 HydrophobicContact CE2-CB 4.22Å; Y351-L383 HydrophobicContact CE2-CD1 4.03Å; Y351-P512 HydrophobicContact CD1-CG 3.73Å; Y351-P512 HydrophobicContact CD2-CG 4.02Å; Y351-P512 HydrophobicContact CE1-CG 4.34Å; Y351-P512 HydrophobicContact CG-CG 3.56Å
352	N	97.1	Very high	93.8	Very high	43 Å²	43	37.6 Å²	37.6	23%	0.23	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-44	179.1	-75	-13.6	0	0	0	112.3	N289 F308 E348 L349 Q356	N289-N352 PolarHBondContact OD1-ND2 3.31Å; F308-N352 HydrophobicContact CD1-CB 4.03Å; F308-N352 HydrophobicContact CE1-CB 3.61Å; F308-N352 HydrophobicContact CE2-CB 4.24Å; F308-N352 HydrophobicContact CZ-CB 3.73Å; E348-N352 PolarHBondContact O-N 3.38Å; L349-N352 PolarHBondContact O-N 3.26Å; N352-Q356 WeakPolarHBondContact O-CB 3.17Å; N352-Q356 PolarHBondContact O-N 2.69Å
353	C	97.7	Very high	94.2	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-43.4	177	-169.3	0	0	0	0	111.8	F308 L349 L350 Y351 Q356 L357	F308-C353 HydrophobicContact CB-CB 4.05Å; L349-C353 VanDerWaalsContact O-CB 3.3Å; L349-C353 WeakPolarHBondContact O-CB 3.32Å; L349-C353 PolarHBondContact O-N 2.88Å; L350-C353 PolarHBondContact O-N 3.1Å; Y351-C353 PolarHBondContact O-N 3.45Å; C353-Q356 VanDerWaalsContact O-CB 3.31Å; C353-Q356 WeakPolarHBondContact O-CB 3.48Å; C353-Q356 PolarHBondContact O-N 2.91Å; C353-L357 WeakPolarHBondContact O-CB 3.49Å; C353-L357 VanDerWaalsContact O-CG 3.28Å; C353-L357 WeakPolarHBondContact O-CG 3.44Å; C353-L357 PolarHBondContact O-N 3.26Å
354	G	97.2	Very high	94.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-46.5	178.6	0	0	0	0	0	112.3	L350 Y351 Q356 L357 L358 A366	L350-G354 PolarHBondContact O-N 3.25Å; Y351-G354 PolarHBondContact O-N 2.69Å; G354-Q356 VanDerWaalsContact C-N 3.32Å; G354-Q356 PolarHBondContact O-N 3.05Å; G354-L357 PolarHBondContact O-N 3.25Å; G354-L358 PolarHBondContact O-N 3.22Å; G354-A366 VanDerWaalsContact O-CB 3.28Å; G354-A366 WeakPolarHBondContact O-CB 3.48Å
355	V	96.3	Very high	95	Very high	19 Å²	19	41 Å²	41	12%	0.115	21%	0.211	C	C	.	.	H	α-helix	trans	-59.2	-45	173.3	174.3	0	0	0	0	110.6	F296 Y351 L357 L358 H359 L370 R386	F296-V355 HydrophobicContact CE2-CG1 4.29Å; F296-V355 HydrophobicContact CZ-CG1 4.09Å; Y351-V355 HydrophobicContact CE1-CG2 4.15Å; Y351-V355 HydrophobicContact CE2-CG2 4.38Å; Y351-V355 WeakPolarHBondContact O-CG2 3.37Å; Y351-V355 PolarHBondContact O-N 3.06Å; V355-L357 PolarHBondContact O-N 3.01Å; V355-L358 PolarHBondContact O-N 3.01Å; V355-H359 PolarHBondContact O-CD2 2.9Å; V355-H359 VanDerWaalsContact O-CD2 3.29Å; V355-H359 PolarHBondContact O-N 2.74Å; V355-H359 VanDerWaalsContact O-N 3.17Å; V355-L370 HydrophobicContact CG2-CD2 4.45Å; V355-R386 HydrophobicContact CG2-CG 4.39Å
356	Q	96.1	Very high	95.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-44.6	176.8	-166	79.4	9.7	0	0	112.8	F296 H301 I305 F308 N352 C353 G354 H359 A360	F296-Q356 VanDerWaalsContact CG-OE1 3.28Å; H301-Q356 WeakPolarHBondContact O-CG 3.31Å; H301-Q356 PolarHBondContact O-NE2 3.02Å; I305-Q356 HydrophobicContact CB-CG 4.43Å; I305-Q356 HydrophobicContact CD1-CG 4.42Å; I305-Q356 HydrophobicContact CG1-CB 4.12Å; I305-Q356 HydrophobicContact CG1-CG 3.45Å; I305-Q356 VanDerWaalsContact CG1-CG 3.45Å; F308-Q356 HydrophobicContact CD2-CB 4.01Å; F308-Q356 HydrophobicContact CD2-CG 4.14Å; F308-Q356 HydrophobicContact CE2-CB 4Å; F308-Q356 HydrophobicContact CE2-CG 4.15Å; N352-Q356 WeakPolarHBondContact O-CB 3.17Å; N352-Q356 PolarHBondContact O-N 2.69Å; C353-Q356 VanDerWaalsContact O-CB 3.31Å; C353-Q356 WeakPolarHBondContact O-CB 3.48Å; C353-Q356 PolarHBondContact O-N 2.91Å; G354-Q356 VanDerWaalsContact C-N 3.32Å; G354-Q356 PolarHBondContact O-N 3.05Å; Q356-H359 PolarHBondContact O-N 3.24Å; Q356-A360 PolarHBondContact O-N 3.28Å
357	L	96.6	Very high	95.4	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-39.7	-179.9	-77.6	162.4	0	0	0	111.8	I305 C353 G354 V355 A360 A361 R362 A365 A366	I305-L357 HydrophobicContact CD1-CD2 3.58Å; I305-L357 HydrophobicContact CD1-CG 4.15Å; I305-L357 HydrophobicContact CG1-CD2 4.14Å; I305-L357 HydrophobicContact CG1-CG 4.29Å; I305-L357 HydrophobicContact CG2-CD2 4.27Å; C353-L357 WeakPolarHBondContact O-CB 3.49Å; C353-L357 VanDerWaalsContact O-CG 3.28Å; C353-L357 WeakPolarHBondContact O-CG 3.44Å; C353-L357 PolarHBondContact O-N 3.26Å; G354-L357 PolarHBondContact O-N 3.25Å; V355-L357 PolarHBondContact O-N 3.01Å; L357-A360 CarbonylContact O-C 3.49Å; L357-A360 WeakPolarHBondContact O-CA 3.4Å; L357-A360 WeakPolarHBondContact O-CB 3.44Å; L357-A360 PolarHBondContact O-N 3.43Å; L357-A360 VanDerWaalsContact O-N 3.1Å; L357-A361 PolarHBondContact O-N 2.87Å; L357-R362 HydrophobicContact CD2-CB 4.22Å; L357-R362 PolarHBondContact O-N 3.47Å; L357-A365 HydrophobicContact CD1-CB 4.12Å; L357-A365 HydrophobicContact CD2-CB 4.16Å; L357-A366 HydrophobicContact CB-CB 3.71Å
358	L	94.4	Very high	95.5	Very high	21 Å²	21	38 Å²	38	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-46.5	176.1	-177.9	57.7	0	0	0	110.9	G354 V355 A360 A361 A366 E389	G354-L358 PolarHBondContact O-N 3.22Å; V355-L358 PolarHBondContact O-N 3.01Å; L358-A360 PolarHBondContact O-N 3.44Å; L358-A361 PolarHBondContact O-N 3.37Å; L358-A366 HydrophobicContact CB-CB 3.94Å; L358-E389 HydrophobicContact CD2-CB 3.91Å; L358-E389 WeakPolarHBondContact CD2-OE2 3.41Å
359	H	92.3	Very high	95.6	Very high	87 Å²	87	37.2 Å²	37.2	40%	0.403	20%	0.202	S	C	.	.	H	α-helix	trans	-67.7	-20.7	174.9	-80.3	-89.7	0	0	0	113.9	F296 H301 V355 Q356 A361	F296-H359 HydrophobicContact CE2-CB 4.05Å; F296-H359 AromaticContact CE2-CD2 3.55Å; F296-H359 AromaticContact CE2-CG 3.72Å; F296-H359 AromaticContact CZ-CD2 3.72Å; F296-H359 AromaticContact CZ-NE2 3.77Å; H301-H359 PolarHBondContact CD2-O 2.69Å; V355-H359 PolarHBondContact O-CD2 2.9Å; V355-H359 VanDerWaalsContact O-CD2 3.29Å; V355-H359 PolarHBondContact O-N 2.74Å; V355-H359 VanDerWaalsContact O-N 3.17Å; Q356-H359 PolarHBondContact O-N 3.24Å; H359-A361 PolarHBondContact O-N 3.04Å
360	A	92.2	Very high	95.6	Very high	23 Å²	23	37 Å²	37	19%	0.19	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	9.9	171.5	0	0	0	0	0	113.5	H301 I305 Q356 L357 L358 R362	H301-A360 HydrophobicContact CB-CB 3.92Å; I305-A360 HydrophobicContact CD1-CB 3.71Å; Q356-A360 PolarHBondContact O-N 3.28Å; L357-A360 CarbonylContact O-C 3.49Å; L357-A360 WeakPolarHBondContact O-CA 3.4Å; L357-A360 WeakPolarHBondContact O-CB 3.44Å; L357-A360 PolarHBondContact O-N 3.43Å; L357-A360 VanDerWaalsContact O-N 3.1Å; L358-A360 PolarHBondContact O-N 3.44Å; A360-R362 VanDerWaalsContact C-N 3.3Å; A360-R362 HydrophobicContact CB-CG 4.45Å; A360-R362 PolarHBondContact O-N 3.42Å
361	A	90.4	Very high	95.6	Very high	80 Å²	80	38.1 Å²	38.1	66%	0.661	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	38.2	-175.3	0	0	0	0	0	113.4	L357 L358 H359 P363	L357-A361 PolarHBondContact O-N 2.87Å; L358-A361 PolarHBondContact O-N 3.37Å; H359-A361 PolarHBondContact O-N 3.04Å; A361-P363 VanDerWaalsContact O-CD 3.3Å; A361-P363 WeakPolarHBondContact O-CD 3.43Å
362	R	94	Very high	95.5	Very high	127 Å²	127	40.2 Å²	40.2	48%	0.479	22%	0.216	S	C	.	.			trans	-117	68.3	174.7	-57.6	-173.6	-166.2	-162.5	4.7	110.6	N302 L357 A360 L364 A365 A366	N302-R362 PolarHBondContact OD1-NH2 3.27Å; L357-R362 HydrophobicContact CD2-CB 4.22Å; L357-R362 PolarHBondContact O-N 3.47Å; A360-R362 VanDerWaalsContact C-N 3.3Å; A360-R362 HydrophobicContact CB-CG 4.45Å; A360-R362 PolarHBondContact O-N 3.42Å; R362-L364 PolarHBondContact O-N 3.05Å; R362-A365 HydrophobicContact CB-CB 4.49Å; R362-A365 PolarHBondContact O-N 3.14Å; R362-A366 WeakPolarHBondContact O-CB 3.37Å; R362-A366 PolarHBondContact O-N 3.41Å; R362-A366 VanDerWaalsContact O-N 3.08Å
363	P	94.8	Very high	95.4	Very high	20 Å²	20	38.1 Å²	38.1	13%	0.13	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-36.3	-168.1	24.5	-34.5	0	0	0	114.1	A361 A366 F367 C390 A394	A361-P363 VanDerWaalsContact O-CD 3.3Å; A361-P363 WeakPolarHBondContact O-CD 3.43Å; P363-A366 WeakPolarHBondContact O-CB 3.47Å; P363-A366 PolarHBondContact O-N 3.38Å; P363-F367 WeakPolarHBondContact O-CB 3.34Å; P363-F367 PolarHBondContact O-N 3.23Å; P363-C390 WeakPolarHBondContact CB-O 3.24Å; P363-A394 HydrophobicContact CB-CB 4.27Å; P363-A394 HydrophobicContact CG-CB 4.21Å
364	L	94.6	Very high	95.3	Very high	108 Å²	108	38.4 Å²	38.4	57%	0.565	21%	0.207	S	C	*	.	H	α-helix	trans	-68.3	-45.2	-179.3	-62.2	178.9	0	0	0	112.4	R362 A366 F367 E368 A394 A448	R362-L364 PolarHBondContact O-N 3.05Å; L364-A366 VanDerWaalsContact C-N 3.29Å; L364-A366 PolarHBondContact O-N 2.98Å; L364-F367 WeakPolarHBondContact O-CB 3.36Å; L364-F367 PolarHBondContact O-N 3.02Å; L364-E368 PolarHBondContact O-N 3.43Å; L364-E368 VanDerWaalsContact O-N 3.11Å; L364-A394 HydrophobicContact CD2-CB 3.79Å; L364-A394 HydrophobicContact CG-CB 4.48Å; L364-A448 HydrophobicContact CD2-CB 3.86Å
365	A	95.4	Very high	95.1	Very high	35 Å²	35	44.9 Å²	44.9	29%	0.289	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-34.5	175.3	0	0	0	0	0	111.9	L357 R362 C369	L357-A365 HydrophobicContact CD1-CB 4.12Å; L357-A365 HydrophobicContact CD2-CB 4.16Å; R362-A365 HydrophobicContact CB-CB 4.49Å; R362-A365 PolarHBondContact O-N 3.14Å; A365-C369 PolarHBondContact O-N 3.3Å; A365-C369 PolarHBondContact O-SG 3.4Å
366	A	97.4	Very high	95	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-44.6	172.7	0	0	0	0	0	111.3	G354 L357 L358 R362 P363 L364 E368 C369 L370	G354-A366 VanDerWaalsContact O-CB 3.28Å; G354-A366 WeakPolarHBondContact O-CB 3.48Å; L357-A366 HydrophobicContact CB-CB 3.71Å; L358-A366 HydrophobicContact CB-CB 3.94Å; R362-A366 WeakPolarHBondContact O-CB 3.37Å; R362-A366 PolarHBondContact O-N 3.41Å; R362-A366 VanDerWaalsContact O-N 3.08Å; P363-A366 WeakPolarHBondContact O-CB 3.47Å; P363-A366 PolarHBondContact O-N 3.38Å; L364-A366 VanDerWaalsContact C-N 3.29Å; L364-A366 PolarHBondContact O-N 2.98Å; A366-E368 PolarHBondContact O-N 3.46Å; A366-C369 PolarHBondContact O-N 3.16Å; A366-L370 WeakPolarHBondContact O-CB 3.43Å; A366-L370 VanDerWaalsContact O-CG 3.24Å; A366-L370 WeakPolarHBondContact O-CG 3.44Å; A366-L370 PolarHBondContact O-N 2.92Å
367	F	97	Very high	94.9	Very high	14 Å²	14	48 Å²	48	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-56.1	-49.3	177.7	-174.9	-97.1	0	0	0	111.6	P363 L364 C369 L370 M371 L387 C390 P446 A448 F452	P363-F367 WeakPolarHBondContact O-CB 3.34Å; P363-F367 PolarHBondContact O-N 3.23Å; L364-F367 WeakPolarHBondContact O-CB 3.36Å; L364-F367 PolarHBondContact O-N 3.02Å; F367-C369 PolarHBondContact O-N 2.97Å; F367-L370 PolarHBondContact O-N 3.23Å; F367-M371 HydrophobicContact CD1-CG 3.85Å; F367-M371 HydrophobicContact CD2-CG 4.35Å; F367-M371 HydrophobicContact CE1-CG 3.58Å; F367-M371 HydrophobicContact CE1-SD 4.3Å; F367-M371 HydrophobicContact CE2-CG 4.11Å; F367-M371 HydrophobicContact CE2-SD 4.15Å; F367-M371 HydrophobicContact CG-CG 4.24Å; F367-M371 HydrophobicContact CZ-CG 3.72Å; F367-M371 HydrophobicContact CZ-SD 3.86Å; F367-M371 VanDerWaalsContact O-CB 3.3Å; F367-M371 WeakPolarHBondContact O-CB 3.41Å; F367-M371 WeakPolarHBondContact O-CG 3.27Å; F367-M371 PolarHBondContact O-N 3.2Å; F367-L387 HydrophobicContact CD2-CD2 3.92Å; F367-L387 HydrophobicContact CE2-CD2 4.11Å; F367-C390 HydrophobicContact CB-CB 4.01Å; F367-C390 HydrophobicContact CD2-CB 4.09Å; F367-P446 HydrophobicContact CE1-CB 4.29Å; F367-P446 HydrophobicContact CZ-CB 4.16Å; F367-A448 HydrophobicContact CB-CB 4.49Å; F367-A448 HydrophobicContact CD1-CB 4.21Å; F367-A448 HydrophobicContact CD2-CB 3.96Å; F367-A448 HydrophobicContact CE1-CB 4.41Å; F367-A448 HydrophobicContact CE2-CB 4.18Å; F367-A448 HydrophobicContact CG-CB 3.97Å; F367-A448 HydrophobicContact CZ-CB 4.4Å; F367-F452 AromaticContact CE2-CD1 3.59Å; F367-F452 HydrophobicContact CE2-CD1 3.59Å; F367-F452 AromaticContact CE2-CE1 3.49Å; F367-F452 HydrophobicContact CE2-CE1 3.49Å; F367-F452 VanDerWaalsContact CE2-CE1 3.49Å; F367-F452 AromaticContact CZ-CD1 3.73Å; F367-F452 HydrophobicContact CZ-CD1 3.73Å; F367-F452 AromaticContact CZ-CE1 3.57Å; F367-F452 HydrophobicContact CZ-CE1 3.57Å; F367-F452 HydrophobicContact CZ-CZ 4.32Å
368	E	95.9	Very high	94.8	Very high	134 Å²	134	53.1 Å²	53.1	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-55.4	-49.2	177	-69.1	174.4	173.8	0	0	112.3	L364 A366 L370 M371 E372	L364-E368 PolarHBondContact O-N 3.43Å; L364-E368 VanDerWaalsContact O-N 3.11Å; A366-E368 PolarHBondContact O-N 3.46Å; E368-L370 PolarHBondContact O-N 3.12Å; E368-M371 PolarHBondContact O-N 2.95Å; E368-E372 PolarHBondContact O-N 2.92Å
369	C	97	Very high	94.7	Very high	20 Å²	20	54.8 Å²	54.8	14%	0.135	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-42.9	179.2	-69.7	0	0	0	0	112.5	L350 A365 A366 F367 E372 A373	L350-C369 HydrophobicContact CD2-CB 4.3Å; A365-C369 PolarHBondContact O-N 3.3Å; A365-C369 PolarHBondContact O-SG 3.4Å; A366-C369 PolarHBondContact O-N 3.16Å; F367-C369 PolarHBondContact O-N 2.97Å; C369-E372 PolarHBondContact O-N 3.42Å; C369-A373 PolarHBondContact O-N 2.66Å
370	L	97.5	Very high	94.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-74.3	-29.3	-177.5	-65.5	173.9	0	0	0	112.2	Y351 V355 A366 F367 E368 A373 V374 L383 R386 L387	Y351-L370 HydrophobicContact CD2-CD2 4.22Å; V355-L370 HydrophobicContact CG2-CD2 4.45Å; A366-L370 WeakPolarHBondContact O-CB 3.43Å; A366-L370 VanDerWaalsContact O-CG 3.24Å; A366-L370 WeakPolarHBondContact O-CG 3.44Å; A366-L370 PolarHBondContact O-N 2.92Å; F367-L370 PolarHBondContact O-N 3.23Å; E368-L370 PolarHBondContact O-N 3.12Å; L370-A373 PolarHBondContact O-N 3.44Å; L370-V374 PolarHBondContact O-N 3.12Å; L370-L383 HydrophobicContact CB-CD1 3.98Å; L370-L383 HydrophobicContact CD2-CD1 3.64Å; L370-L383 HydrophobicContact CG-CD1 4.29Å; L370-R386 HydrophobicContact CD1-CB 3.74Å; L370-L387 HydrophobicContact CB-CD2 3.56Å; L370-L387 HydrophobicContact CB-CG 4.12Å
371	M	95.9	Very high	95	Very high	32 Å²	32	49.7 Å²	49.7	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-34	173.8	-78.2	-58.2	-53.6	0	0	112.4	F367 E368 V374 L387 P446 F452	F367-M371 HydrophobicContact CD1-CG 3.85Å; F367-M371 HydrophobicContact CD2-CG 4.35Å; F367-M371 HydrophobicContact CE1-CG 3.58Å; F367-M371 HydrophobicContact CE1-SD 4.3Å; F367-M371 HydrophobicContact CE2-CG 4.11Å; F367-M371 HydrophobicContact CE2-SD 4.15Å; F367-M371 HydrophobicContact CG-CG 4.24Å; F367-M371 HydrophobicContact CZ-CG 3.72Å; F367-M371 HydrophobicContact CZ-SD 3.86Å; F367-M371 VanDerWaalsContact O-CB 3.3Å; F367-M371 WeakPolarHBondContact O-CB 3.41Å; F367-M371 WeakPolarHBondContact O-CG 3.27Å; F367-M371 PolarHBondContact O-N 3.2Å; E368-M371 PolarHBondContact O-N 2.95Å; M371-V374 HydrophobicContact CE-CG1 4.39Å; M371-V374 WeakPolarHBondContact O-CG1 3.44Å; M371-V374 HydrophobicContact SD-CG1 4.35Å; M371-L387 HydrophobicContact CG-CD2 3.87Å; M371-L387 HydrophobicContact SD-CD1 4.03Å; M371-L387 HydrophobicContact SD-CD2 3.71Å; M371-P446 HydrophobicContact CE-CB 3.51Å; M371-P446 HydrophobicContact CE-CG 3.49Å; M371-P446 VanDerWaalsContact CE-CG 3.49Å; M371-P446 HydrophobicContact SD-CB 4.23Å; M371-F452 HydrophobicContact CE-CZ 4.03Å; M371-F452 HydrophobicContact SD-CE1 3.78Å; M371-F452 HydrophobicContact SD-CZ 3.66Å
372	E	95.3	Very high	95.3	Very high	65 Å²	65	48.1 Å²	48.1	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-67.2	-43.5	168.6	-76.3	-170.4	-126	0	0	111.1	R346 Y347 L350 E368 C369 V374 Q375	R346-E372 IonicContact CZ-OE2 3.3Å; R346-E372 IonicContact NE-OE2 3.69Å; R346-E372 PolarHBondContact NE-OE2 3.22Å; R346-E372 VanDerWaalsContact NE-OE2 3.15Å; R346-E372 IonicContact NH2-OE1 3.17Å; R346-E372 PolarHBondContact NH2-OE1 3.48Å; R346-E372 IonicContact NH2-OE2 2.93Å; R346-E372 PolarHBondContact NH2-OE2 3.22Å; Y347-E372 VanDerWaalsContact CD1-O 3.32Å; Y347-E372 WeakPolarHBondContact CD1-O 3.48Å; Y347-E372 WeakPolarHBondContact CE1-O 3.34Å; L350-E372 HydrophobicContact CD1-CB 3.65Å; L350-E372 HydrophobicContact CD1-CG 4.27Å; L350-E372 WeakPolarHBondContact CD1-OE2 3.38Å; E368-E372 PolarHBondContact O-N 2.92Å; C369-E372 PolarHBondContact O-N 3.42Å; E372-V374 PolarHBondContact O-N 2.81Å; E372-Q375 PolarHBondContact O-N 3.4Å
373	A	96.1	Very high	95.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-36.2	-178.2	0	0	0	0	0	113.3	C369 L370 Q375 V376 Y377 L383	C369-A373 PolarHBondContact O-N 2.66Å; L370-A373 PolarHBondContact O-N 3.44Å; A373-Q375 PolarHBondContact O-N 3.39Å; A373-V376 PolarHBondContact O-N 3.03Å; A373-Y377 WeakPolarHBondContact O-CD2 3.21Å; A373-Y377 PolarHBondContact O-N 3.19Å; A373-L383 HydrophobicContact CB-CD2 4.23Å
374	V	95.3	Very high	95.6	Very high	10 Å²	10	42.7 Å²	42.7	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-21.8	-176.8	77.9	0	0	0	0	112.8	L370 M371 E372 V376 H378 L383 W384 L387	L370-V374 PolarHBondContact O-N 3.12Å; M371-V374 HydrophobicContact CE-CG1 4.39Å; M371-V374 WeakPolarHBondContact O-CG1 3.44Å; M371-V374 HydrophobicContact SD-CG1 4.35Å; E372-V374 PolarHBondContact O-N 2.81Å; V374-V376 PolarHBondContact O-N 3.44Å; V374-H378 WeakPolarHBondContact O-CA 3.33Å; V374-H378 VanDerWaalsContact O-CB 3.29Å; V374-H378 WeakPolarHBondContact O-CB 3.26Å; V374-H378 PolarHBondContact O-N 2.89Å; V374-L383 HydrophobicContact CB-CD2 3.83Å; V374-L383 HydrophobicContact CB-CG 4.14Å; V374-L383 HydrophobicContact CG2-CD2 4.06Å; V374-L383 HydrophobicContact CG2-CG 4.18Å; V374-W384 HydrophobicContact CG2-CD2 4.09Å; V374-W384 HydrophobicContact CG2-CE3 4.26Å; V374-W384 HydrophobicContact CG2-CH2 3.72Å; V374-W384 HydrophobicContact CG2-CZ2 3.5Å; V374-W384 HydrophobicContact CG2-CZ3 4.09Å; V374-L387 HydrophobicContact CB-CD1 4.01Å; V374-L387 HydrophobicContact CG1-CD1 4Å; V374-L387 HydrophobicContact CG2-CD1 4.09Å
375	Q	93.3	Very high	95.7	Very high	135 Å²	135	37.7 Å²	37.7	63%	0.631	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.9	174.5	-64.4	176.9	14.2	0	0	112.3	E372 A373	E372-Q375 PolarHBondContact O-N 3.4Å; A373-Q375 PolarHBondContact O-N 3.39Å
376	V	93.1	Very high	95.8	Very high	66 Å²	66	39 Å²	39	40%	0.4	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-37.6	179	-179.6	0	0	0	0	111.7	Y347 A373 V374	Y347-V376 HydrophobicContact CD1-CG2 3.88Å; Y347-V376 HydrophobicContact CD2-CB 4.39Å; Y347-V376 HydrophobicContact CD2-CG2 3.61Å; Y347-V376 HydrophobicContact CE1-CG2 3.88Å; Y347-V376 HydrophobicContact CE2-CG2 3.61Å; Y347-V376 HydrophobicContact CG-CB 4.26Å; Y347-V376 HydrophobicContact CG-CG2 3.73Å; A373-V376 PolarHBondContact O-N 3.03Å; V374-V376 PolarHBondContact O-N 3.44Å
377	Y	94.1	Very high	95.8	Very high	22 Å²	22	39 Å²	39	9%	0.086	19%	0.188	C	C	.	.			trans	-107.5	38	-174.4	-58.5	-67	0	0	0	113	E348 A373 S379 N380 P512	E348-Y377 HydrophobicContact CG-CE2 4.49Å; E348-Y377 WeakPolarHBondContact CG-OH 3.41Å; E348-Y377 PolarHBondContact OE1-OH 3.3Å; E348-Y377 PolarHBondContact OE2-OH 2.98Å; A373-Y377 WeakPolarHBondContact O-CD2 3.21Å; A373-Y377 PolarHBondContact O-N 3.19Å; Y377-S379 PolarHBondContact O-N 3.44Å; Y377-S379 VanDerWaalsContact O-N 3.11Å; Y377-N380 WeakPolarHBondContact O-CB 3.43Å; Y377-N380 PolarHBondContact O-N 3.29Å; Y377-P512 HydrophobicContact CD2-CB 4.43Å; Y377-P512 HydrophobicContact CD2-CG 3.98Å; Y377-P512 HydrophobicContact CE1-CB 4.24Å; Y377-P512 HydrophobicContact CE2-CB 4.03Å; Y377-P512 HydrophobicContact CE2-CG 3.98Å; Y377-P512 HydrophobicContact CG-CG 4.35Å
378	H	94.4	Very high	95.9	Very high	117 Å²	117	38.3 Å²	38.3	54%	0.542	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.8	-177.9	59.6	79.2	0	0	0	114	V374 N380 W384 L463	V374-H378 WeakPolarHBondContact O-CA 3.33Å; V374-H378 VanDerWaalsContact O-CB 3.29Å; V374-H378 WeakPolarHBondContact O-CB 3.26Å; V374-H378 PolarHBondContact O-N 2.89Å; H378-N380 VanDerWaalsContact C-N 3.29Å; H378-W384 HydrophobicContact CB-CZ2 4.33Å; H378-W384 PolarHBondContact O-NE1 3.41Å; H378-L463 WeakPolarHBondContact O-CD1 3.42Å
379	S	93.1	Very high	95.9	Very high	55 Å²	55	34 Å²	34	39%	0.385	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.7	175.6	56.2	0	0	0	0	113.8	Y377 P381	Y377-S379 PolarHBondContact O-N 3.44Å; Y377-S379 VanDerWaalsContact O-N 3.11Å; S379-P381 VanDerWaalsContact O-CD 3.25Å; S379-P381 WeakPolarHBondContact O-CD 3.49Å
380	N	94.9	Very high	95.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.			trans	-90.7	108.6	-178.3	-175.4	-14	0	0	0	112.1	Y377 H378 R382 L383 W384 A510 T511	Y377-N380 WeakPolarHBondContact O-CB 3.43Å; Y377-N380 PolarHBondContact O-N 3.29Å; H378-N380 VanDerWaalsContact C-N 3.29Å; N380-R382 VanDerWaalsContact C-N 3.27Å; N380-R382 PolarHBondContact O-N 3.13Å; N380-R382 WeakPolarHBondContact OD1-CB 3.44Å; N380-R382 PolarHBondContact OD1-N 3.12Å; N380-L383 HydrophobicContact CB-CB 4.03Å; N380-L383 WeakPolarHBondContact O-CB 3.46Å; N380-L383 PolarHBondContact O-N 3.46Å; N380-L383 PolarHBondContact OD1-N 2.91Å; N380-W384 VanDerWaalsContact O-CD1 3.29Å; N380-W384 PolarHBondContact O-N 3.3Å; N380-A510 PolarHBondContact ND2-O 3.34Å; N380-T511 VanDerWaalsContact CB-O 3.29Å; N380-T511 WeakPolarHBondContact CB-O 3.34Å; N380-T511 PolarHBondContact ND2-O 3.28Å
381	P	95.9	Very high	95.8	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-65.6	-27.4	-179.8	26.5	-35.2	0	0	0	113.2	S379 L383 L385 L463 L464 L516 L524	S379-P381 VanDerWaalsContact O-CD 3.25Å; S379-P381 WeakPolarHBondContact O-CD 3.49Å; P381-L383 VanDerWaalsContact C-N 3.34Å; P381-L385 PolarHBondContact O-N 3.39Å; P381-L385 VanDerWaalsContact O-N 3.13Å; P381-L463 HydrophobicContact CB-CB 4.04Å; P381-L463 HydrophobicContact CG-CB 4.5Å; P381-L464 HydrophobicContact CB-CD2 3.76Å; P381-L464 HydrophobicContact CB-CG 4.34Å; P381-L464 HydrophobicContact CG-CD2 3.69Å; P381-L516 HydrophobicContact CG-CD1 3.73Å; P381-L524 HydrophobicContact CB-CD2 4.09Å; P381-L524 HydrophobicContact CG-CD2 3.99Å
382	R	95.6	Very high	95.6	Very high	48 Å²	48	32.8 Å²	32.8	18%	0.181	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-39.3	176	-64.1	-173.3	-176.2	117.1	-8	111	N380 L385 R386 S513 S514 L516 E520 L524	N380-R382 VanDerWaalsContact C-N 3.27Å; N380-R382 PolarHBondContact O-N 3.13Å; N380-R382 WeakPolarHBondContact OD1-CB 3.44Å; N380-R382 PolarHBondContact OD1-N 3.12Å; R382-L385 PolarHBondContact O-N 3.13Å; R382-R386 VanDerWaalsContact O-CG 3.3Å; R382-R386 WeakPolarHBondContact O-CG 3.32Å; R382-R386 PolarHBondContact O-N 3.24Å; R382-S513 PolarHBondContact NH1-OG 3.44Å; R382-S514 PolarHBondContact NH1-O 3.24Å; R382-L516 VanDerWaalsContact CZ-CG 3.48Å; R382-E520 IonicContact NH2-OE2 3.5Å; R382-E520 PolarHBondContact NH2-OE2 3.5Å; R382-L524 HydrophobicContact CG-CD1 4.39Å; R382-L524 HydrophobicContact CG-CD2 3.73Å
383	L	97.1	Very high	95.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-44.4	-179.9	178.4	48.9	0	0	0	111.2	Y351 L370 A373 V374 N380 P381 L385 R386 L387	Y351-L383 HydrophobicContact CD2-CD1 3.86Å; Y351-L383 HydrophobicContact CD2-CD2 4.4Å; Y351-L383 HydrophobicContact CE2-CB 4.22Å; Y351-L383 HydrophobicContact CE2-CD1 4.03Å; L370-L383 HydrophobicContact CB-CD1 3.98Å; L370-L383 HydrophobicContact CD2-CD1 3.64Å; L370-L383 HydrophobicContact CG-CD1 4.29Å; A373-L383 HydrophobicContact CB-CD2 4.23Å; V374-L383 HydrophobicContact CB-CD2 3.83Å; V374-L383 HydrophobicContact CB-CG 4.14Å; V374-L383 HydrophobicContact CG2-CD2 4.06Å; V374-L383 HydrophobicContact CG2-CG 4.18Å; N380-L383 HydrophobicContact CB-CB 4.03Å; N380-L383 WeakPolarHBondContact O-CB 3.46Å; N380-L383 PolarHBondContact O-N 3.46Å; N380-L383 PolarHBondContact OD1-N 2.91Å; P381-L383 VanDerWaalsContact C-N 3.34Å; L383-L385 VanDerWaalsContact C-N 3.34Å; L383-L385 PolarHBondContact O-N 3.27Å; L383-R386 PolarHBondContact O-N 3.46Å; L383-R386 VanDerWaalsContact O-N 3.12Å; L383-L387 PolarHBondContact O-N 3.15Å
384	W	97.7	Very high	95.2	Very high	33 Å²	33	33.9 Å²	33.9	13%	0.125	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-42	173.8	-71.6	112.6	0	0	0	112.9	V374 H378 N380 R386 L387 A388 C456 N459 A460 L463	V374-W384 HydrophobicContact CG2-CD2 4.09Å; V374-W384 HydrophobicContact CG2-CE3 4.26Å; V374-W384 HydrophobicContact CG2-CH2 3.72Å; V374-W384 HydrophobicContact CG2-CZ2 3.5Å; V374-W384 HydrophobicContact CG2-CZ3 4.09Å; H378-W384 HydrophobicContact CB-CZ2 4.33Å; H378-W384 PolarHBondContact O-NE1 3.41Å; N380-W384 VanDerWaalsContact O-CD1 3.29Å; N380-W384 PolarHBondContact O-N 3.3Å; W384-R386 VanDerWaalsContact C-N 3.34Å; W384-R386 PolarHBondContact O-N 3.15Å; W384-L387 HydrophobicContact CE3-CD1 3.96Å; W384-L387 HydrophobicContact CZ3-CD1 4.15Å; W384-L387 PolarHBondContact O-N 3.5Å; W384-A388 PolarHBondContact O-N 3.49Å; W384-C456 WeakPolarHBondContact CB-O 3.43Å; W384-C456 HydrophobicContact CE3-CB 4.09Å; W384-C456 WeakPolarHBondContact O-CB 3.43Å; W384-N459 HydrophobicContact CD2-CB 3.77Å; W384-N459 HydrophobicContact CE3-CB 4.15Å; W384-N459 HydrophobicContact CG-CB 4Å; W384-N459 WeakPolarHBondContact CH2-ND2 3.11Å; W384-N459 HydrophobicContact CZ2-CB 4.4Å; W384-N459 WeakPolarHBondContact CZ3-ND2 3.11Å; W384-A460 HydrophobicContact CB-CB 3.68Å; W384-L463 VanDerWaalsContact CD1-CD1 3.43Å
385	L	97.6	Very high	94.7	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-42.4	173	178.7	63.3	0	0	0	111.7	P381 R382 L383 L387 A388 E389 L457 L524 I528 C531	P381-L385 PolarHBondContact O-N 3.39Å; P381-L385 VanDerWaalsContact O-N 3.13Å; R382-L385 PolarHBondContact O-N 3.13Å; L383-L385 VanDerWaalsContact C-N 3.34Å; L383-L385 PolarHBondContact O-N 3.27Å; L385-L387 VanDerWaalsContact C-N 3.32Å; L385-L387 PolarHBondContact O-N 2.67Å; L385-A388 WeakPolarHBondContact O-CB 3.31Å; L385-A388 PolarHBondContact O-N 2.98Å; L385-E389 HydrophobicContact CD1-CG 4.43Å; L385-E389 HydrophobicContact CG-CG 4.43Å; L385-E389 WeakPolarHBondContact O-CG 3.18Å; L385-E389 PolarHBondContact O-N 3.03Å; L385-L457 HydrophobicContact CD1-CD2 3.81Å; L385-L524 HydrophobicContact CB-CD1 4.4Å; L385-L524 HydrophobicContact CD2-CD1 3.42Å; L385-L524 VanDerWaalsContact CD2-CD1 3.42Å; L385-I528 HydrophobicContact CB-CG1 4.36Å; L385-I528 HydrophobicContact CD1-CG1 4.05Å; L385-I528 HydrophobicContact CD2-CG1 4.33Å; L385-I528 HydrophobicContact CG-CG1 4.48Å; L385-C531 HydrophobicContact CD1-CB 4.48Å
386	R	97.8	Very high	93.8	Very high	62 Å²	62	37.4 Å²	37.4	23%	0.234	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-37.4	177.8	-63.3	-68.5	144	-160.2	-16.9	112.1	V355 L370 R382 L383 W384 E389 C390	V355-R386 HydrophobicContact CG2-CG 4.39Å; L370-R386 HydrophobicContact CD1-CB 3.74Å; R382-R386 VanDerWaalsContact O-CG 3.3Å; R382-R386 WeakPolarHBondContact O-CG 3.32Å; R382-R386 PolarHBondContact O-N 3.24Å; L383-R386 PolarHBondContact O-N 3.46Å; L383-R386 VanDerWaalsContact O-N 3.12Å; W384-R386 VanDerWaalsContact C-N 3.34Å; W384-R386 PolarHBondContact O-N 3.15Å; R386-E389 WeakPolarHBondContact CD-OE2 3.37Å; R386-E389 IonicContact CZ-OE1 3.8Å; R386-E389 IonicContact CZ-OE2 2.68Å; R386-E389 IonicContact NE-OE2 3.43Å; R386-E389 PolarHBondContact NE-OE2 2.79Å; R386-E389 IonicContact NH1-OE1 3.38Å; R386-E389 PolarHBondContact NH1-OE1 3Å; R386-E389 IonicContact NH1-OE2 2.81Å; R386-E389 PolarHBondContact NH1-OE2 3.39Å; R386-E389 IonicContact NH2-OE1 3.42Å; R386-E389 PolarHBondContact NH2-OE1 2.87Å; R386-E389 IonicContact NH2-OE2 3.15Å; R386-E389 PolarHBondContact O-N 3.42Å; R386-C390 PolarHBondContact O-N 2.87Å; R386-C390 PolarHBondContact O-SG 3.26Å
387	L	97.8	Very high	92	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-44	173.2	-75.9	170.1	0	0	0	111.7	F367 L370 M371 V374 L383 W384 L385 E389 C390 C391 C456	F367-L387 HydrophobicContact CD2-CD2 3.92Å; F367-L387 HydrophobicContact CE2-CD2 4.11Å; L370-L387 HydrophobicContact CB-CD2 3.56Å; L370-L387 HydrophobicContact CB-CG 4.12Å; M371-L387 HydrophobicContact CG-CD2 3.87Å; M371-L387 HydrophobicContact SD-CD1 4.03Å; M371-L387 HydrophobicContact SD-CD2 3.71Å; V374-L387 HydrophobicContact CB-CD1 4.01Å; V374-L387 HydrophobicContact CG1-CD1 4Å; V374-L387 HydrophobicContact CG2-CD1 4.09Å; L383-L387 PolarHBondContact O-N 3.15Å; W384-L387 HydrophobicContact CE3-CD1 3.96Å; W384-L387 HydrophobicContact CZ3-CD1 4.15Å; W384-L387 PolarHBondContact O-N 3.5Å; L385-L387 VanDerWaalsContact C-N 3.32Å; L385-L387 PolarHBondContact O-N 2.67Å; L387-E389 PolarHBondContact O-N 3.29Å; L387-C390 WeakPolarHBondContact O-CB 3.46Å; L387-C390 PolarHBondContact O-N 3.18Å; L387-C391 PolarHBondContact O-N 3.19Å; L387-C391 VanDerWaalsContact O-N 3.11Å; L387-C391 PolarHBondContact O-SG 3.18Å; L387-C456 HydrophobicContact CB-CB 4.41Å
388	A	97.7	Very high	89.5	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-42.5	174.8	0	0	0	0	0	112.1	W384 L385 C390 C391 I392 A453 C456 L457	W384-A388 PolarHBondContact O-N 3.49Å; L385-A388 WeakPolarHBondContact O-CB 3.31Å; L385-A388 PolarHBondContact O-N 2.98Å; A388-C390 VanDerWaalsContact C-N 3.3Å; A388-C390 PolarHBondContact O-N 3.45Å; A388-C391 WeakPolarHBondContact O-CB 3.44Å; A388-C391 PolarHBondContact O-N 3.42Å; A388-C391 VanDerWaalsContact O-N 3.15Å; A388-I392 WeakPolarHBondContact O-CG1 3.48Å; A388-I392 PolarHBondContact O-N 3.03Å; A388-A453 HydrophobicContact CB-CB 4.42Å; A388-C456 HydrophobicContact CB-CB 3.94Å; A388-L457 HydrophobicContact CB-CD1 4.16Å; A388-L457 HydrophobicContact CB-CD2 3.67Å; A388-L457 HydrophobicContact CB-CG 3.57Å
389	E	96.4	Very high	87	Confident	45 Å²	45	36.3 Å²	36.3	21%	0.21	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-37.4	174.8	-72.4	173.5	172.7	0	0	112.1	L358 L385 R386 L387 S393	L358-E389 HydrophobicContact CD2-CB 3.91Å; L358-E389 WeakPolarHBondContact CD2-OE2 3.41Å; L385-E389 HydrophobicContact CD1-CG 4.43Å; L385-E389 HydrophobicContact CG-CG 4.43Å; L385-E389 WeakPolarHBondContact O-CG 3.18Å; L385-E389 PolarHBondContact O-N 3.03Å; R386-E389 WeakPolarHBondContact CD-OE2 3.37Å; R386-E389 IonicContact CZ-OE1 3.8Å; R386-E389 IonicContact CZ-OE2 2.68Å; R386-E389 IonicContact NE-OE2 3.43Å; R386-E389 PolarHBondContact NE-OE2 2.79Å; R386-E389 IonicContact NH1-OE1 3.38Å; R386-E389 PolarHBondContact NH1-OE1 3Å; R386-E389 IonicContact NH1-OE2 2.81Å; R386-E389 PolarHBondContact NH1-OE2 3.39Å; R386-E389 IonicContact NH2-OE1 3.42Å; R386-E389 PolarHBondContact NH2-OE1 2.87Å; R386-E389 IonicContact NH2-OE2 3.15Å; R386-E389 PolarHBondContact O-N 3.42Å; L387-E389 PolarHBondContact O-N 3.29Å; E389-S393 WeakPolarHBondContact O-CB 3.45Å; E389-S393 PolarHBondContact O-N 3.45Å
390	C	96.6	Very high	84.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-45.4	173.2	-65.4	0	0	0	0	111.2	P363 F367 R386 L387 A388 S393 A394	P363-C390 WeakPolarHBondContact CB-O 3.24Å; F367-C390 HydrophobicContact CB-CB 4.01Å; F367-C390 HydrophobicContact CD2-CB 4.09Å; R386-C390 PolarHBondContact O-N 2.87Å; R386-C390 PolarHBondContact O-SG 3.26Å; L387-C390 WeakPolarHBondContact O-CB 3.46Å; L387-C390 PolarHBondContact O-N 3.18Å; A388-C390 VanDerWaalsContact C-N 3.3Å; A388-C390 PolarHBondContact O-N 3.45Å; C390-S393 PolarHBondContact O-N 3.47Å; C390-A394 VanDerWaalsContact O-CB 3.3Å; C390-A394 WeakPolarHBondContact O-CB 3.31Å; C390-A394 PolarHBondContact O-N 2.93Å
391	C	95.3	Very high	81.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-48.4	178.4	-60.3	0	0	0	0	111.8	L387 A388 S393 A394 N395 S449 A453	L387-C391 PolarHBondContact O-N 3.19Å; L387-C391 VanDerWaalsContact O-N 3.11Å; L387-C391 PolarHBondContact O-SG 3.18Å; A388-C391 WeakPolarHBondContact O-CB 3.44Å; A388-C391 PolarHBondContact O-N 3.42Å; A388-C391 VanDerWaalsContact O-N 3.15Å; C391-S393 VanDerWaalsContact C-N 3.32Å; C391-S393 PolarHBondContact O-N 3.29Å; C391-A394 PolarHBondContact O-N 2.89Å; C391-N395 PolarHBondContact O-N 3.48Å; C391-N395 PolarHBondContact O-ND2 2.82Å; C391-S449 VanDerWaalsContact CB-O 3.31Å; C391-S449 WeakPolarHBondContact CB-O 3.36Å; C391-A453 HydrophobicContact CB-CB 3.55Å
392	I	93.6	Very high	78.9	Confident	26 Å²	26	55.3 Å²	55.3	13%	0.133	30%	0.301	C	S	.	.	H	α-helix	trans	-57.9	-46.6	177	-70.6	165.2	0	0	0	110.5	A388 N395 K396 M450 C531 Y534 V535	A388-I392 WeakPolarHBondContact O-CG1 3.48Å; A388-I392 PolarHBondContact O-N 3.03Å; I392-N395 PolarHBondContact O-N 2.89Å; I392-K396 PolarHBondContact O-N 3Å; I392-M450 HydrophobicContact CG1-CE 4.49Å; I392-C531 HydrophobicContact CD1-CB 4Å; I392-Y534 HydrophobicContact CB-CE1 4.48Å; I392-Y534 HydrophobicContact CD1-CD1 4.28Å; I392-Y534 HydrophobicContact CG1-CD1 4.2Å; I392-Y534 HydrophobicContact CG1-CE1 4.26Å; I392-Y534 HydrophobicContact CG2-CD1 4.09Å; I392-Y534 HydrophobicContact CG2-CE1 3.64Å; I392-V535 HydrophobicContact CD1-CG2 3.77Å; I392-V535 HydrophobicContact CG1-CG2 3.74Å
393	S	91.3	Very high	76.1	Confident	50 Å²	50	57.7 Å²	57.7	35%	0.35	33%	0.325	S	S	.	.	H	α-helix	trans	-67.7	-36.5	-178.8	-176.2	0	0	0	0	112.7	E389 C390 C391 N395	E389-S393 WeakPolarHBondContact O-CB 3.45Å; E389-S393 PolarHBondContact O-N 3.45Å; C390-S393 PolarHBondContact O-N 3.47Å; C391-S393 VanDerWaalsContact C-N 3.32Å; C391-S393 PolarHBondContact O-N 3.29Å; S393-N395 VanDerWaalsContact C-N 3.34Å
394	A	90.7	Very high	72.9	Confident	38 Å²	38	66.9 Å²	66.9	31%	0.314	37%	0.365	S	S	.	.	H	α-helix	trans	-69	-30.6	176.3	0	0	0	0	0	113.2	P363 L364 C390 C391 A448	P363-A394 HydrophobicContact CB-CB 4.27Å; P363-A394 HydrophobicContact CG-CB 4.21Å; L364-A394 HydrophobicContact CD2-CB 3.79Å; L364-A394 HydrophobicContact CG-CB 4.48Å; C390-A394 VanDerWaalsContact O-CB 3.3Å; C390-A394 WeakPolarHBondContact O-CB 3.31Å; C390-A394 PolarHBondContact O-N 2.93Å; C391-A394 PolarHBondContact O-N 2.89Å; A394-A448 HydrophobicContact CB-CB 4.27Å
395	N	84.9	Confident	69.5	Low	75 Å²	75	69.2 Å²	69.2	40%	0.401	39%	0.387	S	S	.	.	H	α-helix	trans	-99.6	-1.4	-178.1	-68.1	-80.8	0	0	0	113.6	C391 I392 S393 G397 A448 M450	C391-N395 PolarHBondContact O-N 3.48Å; C391-N395 PolarHBondContact O-ND2 2.82Å; I392-N395 PolarHBondContact O-N 2.89Å; S393-N395 VanDerWaalsContact C-N 3.34Å; N395-G397 PolarHBondContact O-N 3.47Å; N395-A448 PolarHBondContact ND2-O 3.37Å; N395-M450 HydrophobicContact CB-CG 3.95Å; N395-M450 HydrophobicContact CB-SD 3.83Å
396	K	75	Confident	66.3	Low	144 Å²	144	76.5 Å²	76.5	63%	0.626	43%	0.425	S	S	*	.	S	Bend	trans	-67.2	99.5	172.1	-167.9	177.5	-178	-177.9	0	107.8	I392	I392-K396 PolarHBondContact O-N 3Å
397	G	54.5	Low	63.4	Low	49 Å²	49	80.2 Å²	80.2	51%	0.505	46%	0.457	S	S	.	.			trans	-39.1	137.7	-174.5	0	0	0	0	0	113.4	N395 S399	N395-G397 PolarHBondContact O-N 3.47Å; G397-S399 PolarHBondContact O-N 3.4Å
398	G	42.2	Very low	60.4	Low	52 Å²	52	83.9 Å²	83.9	54%	0.536	48%	0.483	S	S	.	.			trans	-65.9	50.4	-168.6	0	0	0	0	0	116.6	E400 Q401	G398-E400 PolarHBondContact O-N 3.29Å; G398-Q401 PolarHBondContact O-N 3.09Å
399	S	41.9	Very low	57.8	Low	81 Å²	81	94 Å²	94	57%	0.566	53%	0.526	S	S	*	.	H	α-helix	trans	-64.6	-19.7	174.9	-160.7	0	0	0	0	112.4	G397	G397-S399 PolarHBondContact O-N 3.4Å
400	E	39.9	Very low	55.6	Low	141 Å²	141	99.1 Å²	99.1	66%	0.659	55%	0.548	S	S	*	.	H	α-helix	trans	-75.6	-17.9	174.3	-69.8	-155	167.2	0	0	114.7	G398 S403	G398-E400 PolarHBondContact O-N 3.29Å; E400-S403 PolarHBondContact O-OG 3.13Å
401	Q	37	Very low	53.7	Low	170 Å²	170	101.4 Å²	101.4	79%	0.794	57%	0.572	S	S	*	*	H	α-helix	trans	-81.3	-21	176.5	-99.9	-178.2	-6	0	0	113.2	G398 S403	G398-Q401 PolarHBondContact O-N 3.09Å; Q401-S403 VanDerWaalsContact C-N 3.35Å
402	E	37.1	Very low	52.4	Low	145 Å²	145	101.8 Å²	101.8	68%	0.678	57%	0.574	S	S	*	*	H	α-helix	trans	-76.2	-21.7	176.4	-68.2	-168	152	0	0	113	K404 S405	E402-K404 VanDerWaalsContact C-N 3.29Å; E402-K404 PolarHBondContact O-N 3.45Å; E402-S405 PolarHBondContact O-OG 3.07Å
403	S	35.4	Very low	51.3	Low	98 Å²	98	102.3 Å²	102.3	69%	0.685	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-7.6	-178	83.4	0	0	0	0	114.4	E400 Q401	E400-S403 PolarHBondContact O-OG 3.13Å; Q401-S403 VanDerWaalsContact C-N 3.35Å
404	K	31.7	Very low	50.5	Low	193 Å²	193	105.4 Å²	105.4	84%	0.839	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-7	179.7	-74.9	-173.8	-179	174.7	0	114.5	E402	E402-K404 VanDerWaalsContact C-N 3.29Å; E402-K404 PolarHBondContact O-N 3.45Å
405	S	26	Very low	50	Low	83 Å²	83	106 Å²	106	58%	0.58	59%	0.589	S	S	*	*	S	Bend	trans	-98.4	120.2	166.7	57.2	0	0	0	0	109.4	E402	E402-S405 PolarHBondContact O-OG 3.07Å
406	L	29.3	Very low	49.9	Very low	154 Å²	154	105.7 Å²	105.7	81%	0.806	59%	0.589	S	S	*	*			trans	6.8	141.6	171.3	-76.6	96.1	0	0	0	119.3	S408	L406-S408 PolarHBondContact O-N 2.89Å
407	P	37.3	Very low	50.6	Low	140 Å²	140	103.7 Å²	103.7	91%	0.909	59%	0.585	S	S	*	*			trans	-69.8	77.7	175.8	32.7	-34.3	0	0	0	110.6
408	S	34.8	Very low	51.9	Low	78 Å²	78	103.5 Å²	103.5	55%	0.545	58%	0.583	S	S	.	*			trans	-98.6	133.5	170.1	87.1	0	0	0	0	108	L406 K410	L406-S408 PolarHBondContact O-N 2.89Å; S408-K410 PolarHBondContact O-N 3.03Å
409	K	43.3	Very low	53.7	Low	211 Å²	211	109.1 Å²	109.1	92%	0.917	60%	0.595	S	S	*	*	S	Bend	trans	-61	67	-176.6	-62.7	171.3	176.3	175.4	0	113
410	K	49.5	Very low	55.5	Low	154 Å²	154	108.4 Å²	108.4	67%	0.67	60%	0.6	S	S	*	*			trans	-115.1	49	173.4	-72.2	-172.9	175.5	-177.4	0	110.6	S408	S408-K410 PolarHBondContact O-N 3.03Å
411	G	58	Low	57.3	Low	48 Å²	48	111.6 Å²	111.6	50%	0.495	61%	0.608	S	S	.	*	S	Bend	trans	-82.4	-23.2	-176.8	0	0	0	0	0	114.7
412	I	66.3	Low	59.5	Low	7 Å²	7	108.9 Å²	108.9	4%	0.036	60%	0.595	C	S	.	*	S	Bend	trans	-154	-30.3	-174.9	-63.8	-177.9	0	0	0	110.7	L427 A428 P672 I675 L676 N698	I412-L427 HydrophobicContact CG2-CD2 3.86Å; I412-L427 CarbonylContact O-C 3.56Å; I412-L427 VanDerWaalsContact O-CA 3.27Å; I412-L427 WeakPolarHBondContact O-CA 3.5Å; I412-A428 PolarHBondContact O-N 3.11Å; I412-P672 HydrophobicContact CG1-CB 4.4Å; I412-I675 HydrophobicContact CD1-CB 3.66Å; I412-I675 HydrophobicContact CD1-CD1 4.19Å; I412-I675 HydrophobicContact CD1-CG2 3.38Å; I412-L676 HydrophobicContact CG2-CD2 3.56Å; I412-L676 HydrophobicContact CG2-CG 4.08Å; I412-N698 WeakPolarHBondContact CD1-OD1 3.44Å
413	V	71.5	Confident	61.8	Low	38 Å²	38	109.2 Å²	109.2	23%	0.23	59%	0.59	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	118.3	-178.8	179.4	0	0	0	0	110	V416 I425 V426 I695	V413-V416 HydrophobicContact CG1-CG2 4.06Å; V413-I425 HydrophobicContact CB-CG2 4.34Å; V413-I425 HydrophobicContact CG1-CG2 3.73Å; V413-I425 HydrophobicContact CG2-CG2 3.74Å; V413-V426 CarbonylContact C-O 3.39Å; V413-I695 HydrophobicContact CG2-CG2 3.77Å
414	Q	75.1	Confident	64.1	Low	115 Å²	115	111.8 Å²	111.8	54%	0.537	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	-46.4	175.3	-178	173.1	-0.6	0	0	111.6	V426 L427 A428	Q414-V426 HydrophobicContact CB-CG1 4.28Å; Q414-V426 PolarHBondContact N-O 2.91Å; Q414-L427 PolarHBondContact OE1-O 2.92Å; Q414-A428 HydrophobicContact CB-CB 4.15Å
415	S	80.3	Confident	66.5	Low	49 Å²	49	105.2 Å²	105.2	34%	0.343	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-158.2	166.1	178.6	69.2	0	0	0	0	111.8	V426	S415-V426 PolarHBondContact N-O 3.39Å; S415-V426 WeakPolarHBondContact O-CB 3.34Å; S415-V426 PolarHBondContact O-N 3.06Å; S415-V426 WeakPolarHBondContact OG-CB 3.3Å; S415-V426 WeakPolarHBondContact OG-CG2 3.28Å
416	V	82.6	Confident	69.1	Low	69 Å²	69	103.5 Å²	103.5	42%	0.418	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.9	172	178	0	0	0	0	106.9	V413 R423 K424 I425	V413-V416 HydrophobicContact CG1-CG2 4.06Å; V416-R423 HydrophobicContact CG1-CG 3.79Å; V416-K424 CarbonylContact C-O 3.37Å; V416-K424 WeakPolarHBondContact CA-O 3.44Å; V416-K424 WeakPolarHBondContact CG1-O 3.42Å; V416-I425 HydrophobicContact CG2-CG1 4.49Å
417	I	87.9	Confident	71.4	Confident	103 Å²	103	99.2 Å²	99.2	53%	0.528	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.8	-175.3	-52.2	174.7	0	0	0	108.6	R423 K424 V426	I417-R423 WeakPolarHBondContact O-CA 3.46Å; I417-K424 PolarHBondContact N-O 3.32Å; I417-K424 PolarHBondContact O-N 3.47Å; I417-V426 HydrophobicContact CD1-CG2 3.6Å; I417-V426 HydrophobicContact CG1-CG2 3.99Å
418	G	83.6	Confident	72.8	Confident	45 Å²	45	94.4 Å²	94.4	46%	0.464	50%	0.498	S	S	.	.	S	Bend	trans	78.4	176.7	178.1	0	0	0	0	0	114.6
419	Q	80.3	Confident	73.9	Confident	170 Å²	170	94.6 Å²	94.6	79%	0.794	50%	0.499	S	S	*	.			trans	-139.2	157.9	-176.5	-61.1	-175.6	9.4	0	0	111.3	Y421 H422	Q419-Y421 PolarHBondContact O-N 3.28Å; Q419-H422 PolarHBondContact O-N 3.21Å; Q419-H422 VanDerWaalsContact O-N 3.14Å
420	G	77.8	Confident	74.4	Confident	66 Å²	66	91.5 Å²	91.5	68%	0.68	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	60	-127.7	179.6	0	0	0	0	0	112.9	H422 R423	G420-H422 VanDerWaalsContact C-N 3.26Å; G420-H422 PolarHBondContact O-N 2.82Å; G420-R423 WeakPolarHBondContact O-CB 3.4Å; G420-R423 PolarHBondContact O-N 3.49Å
421	Y	79.4	Confident	74.2	Confident	207 Å²	207	88.9 Å²	88.9	81%	0.812	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-72.2	-16.7	179.3	55.4	-81.8	0	0	0	113.5	Q419	Q419-Y421 PolarHBondContact O-N 3.28Å
422	H	83.3	Confident	73.2	Confident	113 Å²	113	91.3 Å²	91.3	52%	0.523	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-94.5	8.7	176.4	-64.5	-54.3	0	0	0	113.6	Q419 G420 K424	Q419-H422 PolarHBondContact O-N 3.21Å; Q419-H422 VanDerWaalsContact O-N 3.14Å; G420-H422 VanDerWaalsContact C-N 3.26Å; G420-H422 PolarHBondContact O-N 2.82Å; H422-K424 PolarHBondContact O-N 3.49Å
423	R	83.8	Confident	72.1	Confident	153 Å²	153	97.8 Å²	97.8	58%	0.577	53%	0.529	S	S	*	.			trans	-70.7	120.2	-177.6	-174.9	-175.9	176.9	-167.1	1.3	110.8	V416 I417 G420	V416-R423 HydrophobicContact CG1-CG 3.79Å; I417-R423 WeakPolarHBondContact O-CA 3.46Å; G420-R423 WeakPolarHBondContact O-CB 3.4Å; G420-R423 PolarHBondContact O-N 3.49Å
424	K	83.9	Confident	70.5	Confident	151 Å²	151	102.7 Å²	102.7	66%	0.657	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.8	141.1	177.5	-62	-178.5	-177.4	-178	0	110.6	V416 I417 H422	V416-K424 CarbonylContact C-O 3.37Å; V416-K424 WeakPolarHBondContact CA-O 3.44Å; V416-K424 WeakPolarHBondContact CG1-O 3.42Å; I417-K424 PolarHBondContact N-O 3.32Å; I417-K424 PolarHBondContact O-N 3.47Å; H422-K424 PolarHBondContact O-N 3.49Å
425	I	82.5	Confident	68.7	Low	56 Å²	56	102.9 Å²	102.9	29%	0.287	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	122.5	174.9	-58.1	176.7	0	0	0	107.2	V413 V416 L427 L692	V413-I425 HydrophobicContact CB-CG2 4.34Å; V413-I425 HydrophobicContact CG1-CG2 3.73Å; V413-I425 HydrophobicContact CG2-CG2 3.74Å; V416-I425 HydrophobicContact CG2-CG1 4.49Å; I425-L427 HydrophobicContact CG2-CD2 4.28Å; I425-L692 HydrophobicContact CD1-CD2 3.88Å
426	V	80.9	Confident	66.7	Low	47 Å²	47	108.3 Å²	108.3	29%	0.285	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	120.1	174.7	-175.2	0	0	0	0	107.8	V413 Q414 S415 I417	V413-V426 CarbonylContact C-O 3.39Å; Q414-V426 HydrophobicContact CB-CG1 4.28Å; Q414-V426 PolarHBondContact N-O 2.91Å; S415-V426 PolarHBondContact N-O 3.39Å; S415-V426 WeakPolarHBondContact O-CB 3.34Å; S415-V426 PolarHBondContact O-N 3.06Å; S415-V426 WeakPolarHBondContact OG-CB 3.3Å; S415-V426 WeakPolarHBondContact OG-CG2 3.28Å; I417-V426 HydrophobicContact CD1-CG2 3.6Å; I417-V426 HydrophobicContact CG1-CG2 3.99Å
427	L	77.3	Confident	64.7	Low	63 Å²	63	114 Å²	114	33%	0.33	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.7	145	176.7	-55.3	175.7	0	0	0	109.5	I412 Q414 I425 S429 L676 I695	I412-L427 HydrophobicContact CG2-CD2 3.86Å; I412-L427 CarbonylContact O-C 3.56Å; I412-L427 VanDerWaalsContact O-CA 3.27Å; I412-L427 WeakPolarHBondContact O-CA 3.5Å; Q414-L427 PolarHBondContact OE1-O 2.92Å; I425-L427 HydrophobicContact CG2-CD2 4.28Å; L427-S429 PolarHBondContact O-N 3.3Å; L427-L676 HydrophobicContact CD1-CD2 3.96Å; L427-I695 HydrophobicContact CD2-CD1 4.25Å
428	A	67.4	Low	62.4	Low	39 Å²	39	113.1 Å²	113.1	32%	0.322	61%	0.606	S	S	.	*			trans	-66.9	112.2	176	0	0	0	0	0	109.7	I412 Q414	I412-A428 PolarHBondContact O-N 3.11Å; Q414-A428 HydrophobicContact CB-CB 4.15Å
429	S	56.9	Low	60.3	Low	82 Å²	82	119.7 Å²	119.7	57%	0.573	63%	0.625	S	S	*	*			trans	-84.7	113.6	171.9	-153.6	0	0	0	0	108.6	L427 S431	L427-S429 PolarHBondContact O-N 3.3Å; S429-S431 PolarHBondContact O-N 3.49Å; S429-S431 PolarHBondContact OG-OG 2.67Å
430	Q	53.7	Low	58.6	Low	147 Å²	147	115.3 Å²	115.3	69%	0.687	63%	0.625	S	S	*	*			trans	-78.2	-3.1	173.2	-66.1	-172.1	19.2	0	0	112.6	S432 E673	Q430-S432 VanDerWaalsContact C-N 3.28Å; Q430-S432 PolarHBondContact O-N 3.5Å; Q430-E673 PolarHBondContact NE2-OE1 3.12Å
431	S	45.2	Very low	57.2	Low	98 Å²	98	118.1 Å²	118.1	69%	0.685	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	35.7	-167.4	60.4	0	0	0	0	115.8	S429	S429-S431 PolarHBondContact O-N 3.49Å; S429-S431 PolarHBondContact OG-OG 2.67Å
432	S	37.8	Very low	55.7	Low	100 Å²	100	112.1 Å²	112.1	70%	0.699	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.7	15	-178.5	-50.1	0	0	0	0	116.1	Q430	Q430-S432 VanDerWaalsContact C-N 3.28Å; Q430-S432 PolarHBondContact O-N 3.5Å
433	Q	42.3	Very low	54.2	Low	143 Å²	143	112 Å²	112	67%	0.668	63%	0.628	S	S	*	*	S	Bend	trans	-98.4	-0.5	-179.7	-71.6	-165.2	0.2	0	0	116.2
434	N	38.8	Very low	52.9	Low	141 Å²	141	108.8 Å²	108.8	75%	0.754	63%	0.634	S	S	*	*	S	Bend	trans	-113	58	-177	-74	-5.2	0	0	0	113.1
435	T	38.1	Very low	52.1	Low	118 Å²	118	107.4 Å²	107.4	72%	0.724	63%	0.632	S	S	*	*			trans	-162.7	57.6	154	51.3	0	0	0	0	109.7	Y437	T435-Y437 PolarHBondContact O-N 3.4Å
436	N	37.8	Very low	52	Low	164 Å²	164	107.6 Å²	107.6	88%	0.877	64%	0.637	S	S	*	*			trans	-87.7	75.4	154.3	-77.1	-21	0	0	0	106.7	S438	N436-S438 PolarHBondContact O-N 3.38Å
437	Y	39.6	Very low	52.3	Low	189 Å²	189	108.1 Å²	108.1	74%	0.741	64%	0.64	S	S	*	*			trans	-58.7	108.2	159.1	-113.4	-95.4	0	0	0	105.7	T435 E439	T435-Y437 PolarHBondContact O-N 3.4Å; Y437-E439 PolarHBondContact O-N 3.45Å
438	S	40.4	Very low	53	Low	84 Å²	84	105.7 Å²	105.7	59%	0.587	63%	0.629	S	S	*	*			trans	-73.5	75.8	167.8	-163.9	0	0	0	0	106.8	N436 G440	N436-S438 PolarHBondContact O-N 3.38Å; S438-G440 PolarHBondContact O-N 2.87Å
439	E	38.7	Very low	54.2	Low	182 Å²	182	105.1 Å²	105.1	85%	0.85	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	103.2	167.5	-81.9	-174.1	154	0	0	107.5	Y437	Y437-E439 PolarHBondContact O-N 3.45Å
440	G	45.9	Very low	55.8	Low	78 Å²	78	102.2 Å²	102.2	80%	0.804	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.2	-5.1	171.7	0	0	0	0	0	117.1	S438	S438-G440 PolarHBondContact O-N 2.87Å
441	Q	47.8	Very low	57.7	Low	125 Å²	125	99.7 Å²	99.7	58%	0.584	59%	0.589	S	S	*	*			trans	-93.3	122.1	176	-70	-179.9	-5.5	0	0	110.9	A443	Q441-A443 PolarHBondContact O-N 3.33Å
442	S	46.9	Very low	60	Low	81 Å²	81	96.7 Å²	96.7	57%	0.566	56%	0.563	S	S	*	*			trans	-52.3	129.4	177.1	177.9	0	0	0	0	110.9	A444 I445	S442-A444 PolarHBondContact O-N 3.3Å; S442-I445 PolarHBondContact O-N 3.01Å
443	A	52.4	Low	62.8	Low	112 Å²	112	92 Å²	92	93%	0.926	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-6.3	178.1	0	0	0	0	0	114.4	Q441	Q441-A443 PolarHBondContact O-N 3.33Å
444	A	57.4	Low	65.4	Low	85 Å²	85	86.9 Å²	86.9	70%	0.702	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-17.7	-179.4	0	0	0	0	0	114.4	S442	S442-A444 PolarHBondContact O-N 3.3Å
445	I	67.2	Low	68.1	Low	122 Å²	122	84.6 Å²	84.6	63%	0.626	50%	0.499	S	S	*	.	S	Bend	trans	-103.5	123.2	-179	-58.1	177.1	0	0	0	108.9	S442 V447	S442-I445 PolarHBondContact O-N 3.01Å; I445-V447 PolarHBondContact O-N 3.01Å
446	P	80.1	Confident	70.9	Confident	60 Å²	60	79 Å²	79	39%	0.39	47%	0.465	S	S	.	.			trans	-60.4	122.5	174.8	-22.9	34.4	0	0	0	110.6	F367 M371 F452	F367-P446 HydrophobicContact CE1-CB 4.29Å; F367-P446 HydrophobicContact CZ-CB 4.16Å; M371-P446 HydrophobicContact CE-CB 3.51Å; M371-P446 HydrophobicContact CE-CG 3.49Å; M371-P446 VanDerWaalsContact CE-CG 3.49Å; M371-P446 HydrophobicContact SD-CB 4.23Å; P446-F452 HydrophobicContact CB-CE2 4.05Å; P446-F452 HydrophobicContact CB-CZ 4.08Å
447	V	87.6	Confident	73.8	Confident	58 Å²	58	71.2 Å²	71.2	35%	0.352	42%	0.424	S	S	.	.			trans	-116.3	144.4	175.2	-178.7	0	0	0	0	108.4	I445 S449 F452	I445-V447 PolarHBondContact O-N 3.01Å; V447-S449 PolarHBondContact O-N 2.96Å; V447-F452 WeakPolarHBondContact O-CB 3.4Å
448	A	91.5	Very high	76.5	Confident	11 Å²	11	70.8 Å²	70.8	9%	0.091	42%	0.421	C	S	.	.			trans	-71.5	72.9	176	0	0	0	0	0	110.8	L364 F367 A394 N395	L364-A448 HydrophobicContact CD2-CB 3.86Å; F367-A448 HydrophobicContact CB-CB 4.49Å; F367-A448 HydrophobicContact CD1-CB 4.21Å; F367-A448 HydrophobicContact CD2-CB 3.96Å; F367-A448 HydrophobicContact CE1-CB 4.41Å; F367-A448 HydrophobicContact CE2-CB 4.18Å; F367-A448 HydrophobicContact CG-CB 3.97Å; F367-A448 HydrophobicContact CZ-CB 4.4Å; A394-A448 HydrophobicContact CB-CB 4.27Å; N395-A448 PolarHBondContact ND2-O 3.37Å
449	S	91.9	Very high	79.2	Confident	28 Å²	28	69 Å²	69	20%	0.196	41%	0.405	C	S	.	.			trans	-112	165.8	-178.8	86.5	0	0	0	0	112	C391 V447 E451 F452 A453	C391-S449 VanDerWaalsContact CB-O 3.31Å; C391-S449 WeakPolarHBondContact CB-O 3.36Å; V447-S449 PolarHBondContact O-N 2.96Å; S449-E451 VanDerWaalsContact C-N 3.31Å; S449-E451 WeakPolarHBondContact CB-OE2 3.33Å; S449-E451 PolarHBondContact O-N 2.87Å; S449-E451 PolarHBondContact OG-N 3.07Å; S449-E451 PolarHBondContact OG-OE2 3.3Å; S449-F452 PolarHBondContact O-N 3.18Å; S449-F452 PolarHBondContact OG-N 3.41Å; S449-A453 PolarHBondContact O-N 3.14Å
450	M	91.1	Very high	82	Confident	20 Å²	20	60.4 Å²	60.4	10%	0.099	36%	0.364	C	S	.	.	H	α-helix	trans	-66.4	-33.1	177.5	-68	-57.4	-76.2	0	0	112.3	I392 N395 A453 A454 Y534 V535 A538 L539	I392-M450 HydrophobicContact CG1-CE 4.49Å; N395-M450 HydrophobicContact CB-CG 3.95Å; N395-M450 HydrophobicContact CB-SD 3.83Å; M450-A453 VanDerWaalsContact O-CB 3.29Å; M450-A453 WeakPolarHBondContact O-CB 3.32Å; M450-A453 PolarHBondContact O-N 2.8Å; M450-A454 PolarHBondContact O-N 3.29Å; M450-A454 VanDerWaalsContact O-N 3.07Å; M450-Y534 HydrophobicContact CE-CD1 4.21Å; M450-Y534 HydrophobicContact CE-CE1 3.82Å; M450-V535 HydrophobicContact CE-CB 4.15Å; M450-V535 HydrophobicContact CE-CG1 4.26Å; M450-V535 HydrophobicContact CE-CG2 3.77Å; M450-V535 VanDerWaalsContact O-CG1 3.29Å; M450-V535 WeakPolarHBondContact O-CG1 3.32Å; M450-A538 HydrophobicContact CE-CB 3.38Å; M450-L539 HydrophobicContact CB-CD2 3.73Å; M450-L539 HydrophobicContact CB-CG 4.21Å
451	E	92.8	Very high	84.3	Confident	94 Å²	94	59 Å²	59	44%	0.439	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-43.8	174.8	-55.2	74.9	-164.7	0	0	111	S449 A453 A454 I455 L539	S449-E451 VanDerWaalsContact C-N 3.31Å; S449-E451 WeakPolarHBondContact CB-OE2 3.33Å; S449-E451 PolarHBondContact O-N 2.87Å; S449-E451 PolarHBondContact OG-N 3.07Å; S449-E451 PolarHBondContact OG-OE2 3.3Å; E451-A453 VanDerWaalsContact C-N 3.28Å; E451-A453 PolarHBondContact O-N 3.28Å; E451-A454 WeakPolarHBondContact O-CB 3.4Å; E451-A454 PolarHBondContact O-N 3.46Å; E451-I455 PolarHBondContact O-N 2.96Å; E451-I455 VanDerWaalsContact O-N 3.16Å; E451-L539 HydrophobicContact CG-CD2 3.98Å
452	F	94.6	Very high	86.6	Confident	36 Å²	36	59.1 Å²	59.1	16%	0.158	34%	0.342	C	S	.	.	H	α-helix	trans	-65.3	-34.9	175.7	-167.3	-99.1	0	0	0	111.7	F367 M371 P446 V447 S449 A454 I455 C456	F367-F452 AromaticContact CE2-CD1 3.59Å; F367-F452 HydrophobicContact CE2-CD1 3.59Å; F367-F452 AromaticContact CE2-CE1 3.49Å; F367-F452 HydrophobicContact CE2-CE1 3.49Å; F367-F452 VanDerWaalsContact CE2-CE1 3.49Å; F367-F452 AromaticContact CZ-CD1 3.73Å; F367-F452 HydrophobicContact CZ-CD1 3.73Å; F367-F452 AromaticContact CZ-CE1 3.57Å; F367-F452 HydrophobicContact CZ-CE1 3.57Å; F367-F452 HydrophobicContact CZ-CZ 4.32Å; M371-F452 HydrophobicContact CE-CZ 4.03Å; M371-F452 HydrophobicContact SD-CE1 3.78Å; M371-F452 HydrophobicContact SD-CZ 3.66Å; P446-F452 HydrophobicContact CB-CE2 4.05Å; P446-F452 HydrophobicContact CB-CZ 4.08Å; V447-F452 WeakPolarHBondContact O-CB 3.4Å; S449-F452 PolarHBondContact O-N 3.18Å; S449-F452 PolarHBondContact OG-N 3.41Å; F452-A454 VanDerWaalsContact C-N 3.33Å; F452-A454 PolarHBondContact O-N 3.46Å; F452-I455 PolarHBondContact O-N 3.48Å; F452-C456 WeakPolarHBondContact CE1-SG 3.18Å; F452-C456 PolarHBondContact O-N 3.49Å; F452-C456 PolarHBondContact O-SG 2.95Å
453	A	96.4	Very high	88.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-44	171.8	0	0	0	0	0	111.7	A388 C391 S449 M450 E451 I455 C456 L457 V535	A388-A453 HydrophobicContact CB-CB 4.42Å; C391-A453 HydrophobicContact CB-CB 3.55Å; S449-A453 PolarHBondContact O-N 3.14Å; M450-A453 VanDerWaalsContact O-CB 3.29Å; M450-A453 WeakPolarHBondContact O-CB 3.32Å; M450-A453 PolarHBondContact O-N 2.8Å; E451-A453 VanDerWaalsContact C-N 3.28Å; E451-A453 PolarHBondContact O-N 3.28Å; A453-I455 VanDerWaalsContact C-N 3.34Å; A453-I455 PolarHBondContact O-N 3.32Å; A453-C456 WeakPolarHBondContact O-CB 3.41Å; A453-C456 PolarHBondContact O-N 2.98Å; A453-L457 VanDerWaalsContact O-CG 3.27Å; A453-L457 WeakPolarHBondContact O-CG 3.3Å; A453-L457 PolarHBondContact O-N 3.27Å; A453-V535 HydrophobicContact CB-CG1 4.26Å; A453-V535 HydrophobicContact CB-CG2 3.93Å
454	A	95.8	Very high	90.7	Very high	37 Å²	37	53.6 Å²	53.6	31%	0.306	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-42.2	177.8	0	0	0	0	0	111.9	M450 E451 F452 L457 R458 V535 L539	M450-A454 PolarHBondContact O-N 3.29Å; M450-A454 VanDerWaalsContact O-N 3.07Å; E451-A454 WeakPolarHBondContact O-CB 3.4Å; E451-A454 PolarHBondContact O-N 3.46Å; F452-A454 VanDerWaalsContact C-N 3.33Å; F452-A454 PolarHBondContact O-N 3.46Å; A454-L457 PolarHBondContact O-N 3.28Å; A454-R458 WeakPolarHBondContact O-CB 3.36Å; A454-R458 PolarHBondContact O-N 3.37Å; A454-V535 HydrophobicContact CB-CG1 3.84Å; A454-L539 HydrophobicContact CB-CD1 4.09Å
455	I	95.9	Very high	92.1	Very high	92 Å²	92	51.7 Å²	51.7	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-61.1	-47.6	174.8	-62.7	169.3	0	0	0	110.4	E451 F452 A453 L457 R458 N459	E451-I455 PolarHBondContact O-N 2.96Å; E451-I455 VanDerWaalsContact O-N 3.16Å; F452-I455 PolarHBondContact O-N 3.48Å; A453-I455 VanDerWaalsContact C-N 3.34Å; A453-I455 PolarHBondContact O-N 3.32Å; I455-L457 PolarHBondContact O-N 3.15Å; I455-R458 PolarHBondContact O-N 3.38Å; I455-N459 PolarHBondContact O-N 2.92Å
456	C	97.7	Very high	92.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-45.2	178.7	-69.3	0	0	0	0	111.9	W384 L387 A388 F452 A453 N459 A460	W384-C456 WeakPolarHBondContact CB-O 3.43Å; W384-C456 HydrophobicContact CE3-CB 4.09Å; W384-C456 WeakPolarHBondContact O-CB 3.43Å; L387-C456 HydrophobicContact CB-CB 4.41Å; A388-C456 HydrophobicContact CB-CB 3.94Å; F452-C456 WeakPolarHBondContact CE1-SG 3.18Å; F452-C456 PolarHBondContact O-N 3.49Å; F452-C456 PolarHBondContact O-SG 2.95Å; A453-C456 WeakPolarHBondContact O-CB 3.41Å; A453-C456 PolarHBondContact O-N 2.98Å; C456-N459 PolarHBondContact O-N 3.12Å; C456-A460 WeakPolarHBondContact O-CB 3.41Å; C456-A460 PolarHBondContact O-N 3.18Å
457	L	98.1	Very high	91.7	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-38.3	-179.8	-69	165.1	0	0	0	112.3	L385 A388 A453 A454 I455 A460 L461 I528 C531 V535	L385-L457 HydrophobicContact CD1-CD2 3.81Å; A388-L457 HydrophobicContact CB-CD1 4.16Å; A388-L457 HydrophobicContact CB-CD2 3.67Å; A388-L457 HydrophobicContact CB-CG 3.57Å; A453-L457 VanDerWaalsContact O-CG 3.27Å; A453-L457 WeakPolarHBondContact O-CG 3.3Å; A453-L457 PolarHBondContact O-N 3.27Å; A454-L457 PolarHBondContact O-N 3.28Å; I455-L457 PolarHBondContact O-N 3.15Å; L457-A460 PolarHBondContact O-N 3.14Å; L457-L461 WeakPolarHBondContact O-CB 3.36Å; L457-L461 PolarHBondContact O-N 3.29Å; L457-I528 HydrophobicContact CB-CG2 4.45Å; L457-I528 HydrophobicContact CD2-CG2 4.14Å; L457-C531 HydrophobicContact CD1-CB 3.87Å; L457-C531 HydrophobicContact CD2-CB 3.59Å; L457-C531 HydrophobicContact CG-CB 4.41Å; L457-V535 HydrophobicContact CD1-CB 4.19Å; L457-V535 HydrophobicContact CD1-CG2 3.76Å
458	R	96.8	Very high	89.8	Confident	181 Å²	181	59.6 Å²	59.6	68%	0.683	30%	0.301	S	S	*	.	H	α-helix	trans	-61.5	-46.4	172.7	-176.8	178	176.6	178.3	-0.8	111.5	A454 I455 A460 L461 L462	A454-R458 WeakPolarHBondContact O-CB 3.36Å; A454-R458 PolarHBondContact O-N 3.37Å; I455-R458 PolarHBondContact O-N 3.38Å; R458-A460 VanDerWaalsContact C-N 3.35Å; R458-L461 PolarHBondContact O-N 3.15Å; R458-L462 HydrophobicContact CG-CD1 4.07Å; R458-L462 WeakPolarHBondContact O-CB 3.36Å; R458-L462 WeakPolarHBondContact O-CG 3.47Å; R458-L462 PolarHBondContact O-N 3.04Å
459	N	96.6	Very high	87.5	Confident	47 Å²	47	66 Å²	66	25%	0.251	33%	0.329	S	S	.	.	H	α-helix	trans	-61	-44.8	175.7	-70.1	-9.4	0	0	0	111.3	W384 I455 C456 L461 L462 L463	W384-N459 HydrophobicContact CD2-CB 3.77Å; W384-N459 HydrophobicContact CE3-CB 4.15Å; W384-N459 HydrophobicContact CG-CB 4Å; W384-N459 WeakPolarHBondContact CH2-ND2 3.11Å; W384-N459 HydrophobicContact CZ2-CB 4.4Å; W384-N459 WeakPolarHBondContact CZ3-ND2 3.11Å; I455-N459 PolarHBondContact O-N 2.92Å; C456-N459 PolarHBondContact O-N 3.12Å; N459-L461 VanDerWaalsContact C-N 3.32Å; N459-L461 PolarHBondContact O-N 3.48Å; N459-L462 PolarHBondContact O-N 3.31Å; N459-L463 VanDerWaalsContact O-CG 3.31Å; N459-L463 WeakPolarHBondContact O-CG 3.4Å; N459-L463 PolarHBondContact O-N 2.84Å
460	A	97	Very high	84.9	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-58.6	-44.3	177.6	0	0	0	0	0	111.6	W384 C456 L457 R458 L463 I528	W384-A460 HydrophobicContact CB-CB 3.68Å; C456-A460 WeakPolarHBondContact O-CB 3.41Å; C456-A460 PolarHBondContact O-N 3.18Å; L457-A460 PolarHBondContact O-N 3.14Å; R458-A460 VanDerWaalsContact C-N 3.35Å; A460-L463 PolarHBondContact O-N 2.94Å; A460-I528 HydrophobicContact CB-CD1 3.58Å; A460-I528 HydrophobicContact CB-CG1 4Å; A460-I528 HydrophobicContact CB-CG2 4.39Å
461	L	95.1	Very high	82.2	Confident	49 Å²	49	76.8 Å²	76.8	26%	0.257	39%	0.392	S	S	.	.	H	α-helix	trans	-68.3	-41.2	-179.6	-169.6	62.5	0	0	0	112.3	L457 R458 N459 L463 L464 R525 I528 L529	L457-L461 WeakPolarHBondContact O-CB 3.36Å; L457-L461 PolarHBondContact O-N 3.29Å; R458-L461 PolarHBondContact O-N 3.15Å; N459-L461 VanDerWaalsContact C-N 3.32Å; N459-L461 PolarHBondContact O-N 3.48Å; L461-L463 PolarHBondContact O-N 2.95Å; L461-L464 PolarHBondContact O-N 3.45Å; L461-R525 HydrophobicContact CD1-CG 4.34Å; L461-I528 HydrophobicContact CB-CG2 4.06Å; L461-I528 HydrophobicContact CD1-CG2 4.4Å; L461-L529 HydrophobicContact CD2-CD2 4.35Å
462	L	95	Very high	79.5	Confident	127 Å²	127	77 Å²	77	67%	0.665	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-30.2	177.7	-79.3	167.1	0	0	0	113.2	R458 N459 L464	R458-L462 HydrophobicContact CG-CD1 4.07Å; R458-L462 WeakPolarHBondContact O-CB 3.36Å; R458-L462 WeakPolarHBondContact O-CG 3.47Å; R458-L462 PolarHBondContact O-N 3.04Å; N459-L462 PolarHBondContact O-N 3.31Å; L462-L464 VanDerWaalsContact C-N 3.32Å
463	L	94.3	Very high	76.5	Confident	70 Å²	70	84.7 Å²	84.7	37%	0.366	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-10.6	179.5	-70.6	167.9	0	0	0	113.3	H378 P381 W384 N459 A460 L461	H378-L463 WeakPolarHBondContact O-CD1 3.42Å; P381-L463 HydrophobicContact CB-CB 4.04Å; P381-L463 HydrophobicContact CG-CB 4.5Å; W384-L463 VanDerWaalsContact CD1-CD1 3.43Å; N459-L463 VanDerWaalsContact O-CG 3.31Å; N459-L463 WeakPolarHBondContact O-CG 3.4Å; N459-L463 PolarHBondContact O-N 2.84Å; A460-L463 PolarHBondContact O-N 2.94Å; L461-L463 PolarHBondContact O-N 2.95Å
464	L	92.1	Very high	73.7	Confident	8 Å²	8	89.5 Å²	89.5	4%	0.042	48%	0.482	C	S	.	.	S	Bend	trans	-84.4	141.1	175.5	-62.6	-176.9	0	0	0	110.7	P381 L461 L462 V521 L524 R525 I528	P381-L464 HydrophobicContact CB-CD2 3.76Å; P381-L464 HydrophobicContact CB-CG 4.34Å; P381-L464 HydrophobicContact CG-CD2 3.69Å; L461-L464 PolarHBondContact O-N 3.45Å; L462-L464 VanDerWaalsContact C-N 3.32Å; L464-V521 HydrophobicContact CD2-CG1 4.27Å; L464-L524 HydrophobicContact CD1-CG 4.46Å; L464-L524 HydrophobicContact CD2-CD2 3.91Å; L464-L524 HydrophobicContact CD2-CG 4.42Å; L464-R525 HydrophobicContact CD1-CB 3.84Å; L464-I528 HydrophobicContact CD1-CD1 3.77Å; L464-I528 HydrophobicContact CG-CD1 4.45Å
465	P	86.8	Confident	70.7	Confident	45 Å²	45	96.8 Å²	96.8	29%	0.292	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-62.9	137.1	177.3	29.3	-38.1	0	0	0	110.7	F508 V521 R525	P465-F508 HydrophobicContact CB-CD1 4.41Å; P465-F508 HydrophobicContact CB-CE1 3.68Å; P465-F508 HydrophobicContact CB-CZ 4.03Å; P465-F508 HydrophobicContact CG-CD1 4.02Å; P465-F508 HydrophobicContact CG-CE1 3.5Å; P465-F508 HydrophobicContact CG-CE2 4.14Å; P465-F508 HydrophobicContact CG-CZ 3.58Å; P465-V521 HydrophobicContact CG-CG1 3.8Å; P465-R525 PolarHBondContact O-NH2 3.41Å
466	D	76.1	Confident	67.5	Low	155 Å²	155	98.4 Å²	98.4	83%	0.829	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-54.9	143.4	-179.2	-77.4	-38.8	0	0	0	112.6	Q468	D466-Q468 PolarHBondContact O-N 2.91Å
467	H	61.6	Low	64.1	Low	70 Å²	70	101.9 Å²	101.9	32%	0.324	57%	0.565	S	S	.	*			trans	-70.2	98	175.1	-169	67.9	0	0	0	107.9	Q469	H467-Q469 VanDerWaalsContact C-N 3.32Å; H467-Q469 PolarHBondContact O-N 3.49Å
468	Q	49.1	Very low	60.7	Low	181 Å²	181	107.9 Å²	107.9	85%	0.846	61%	0.607	S	S	*	*			trans	-62	100.9	162.2	-72.8	178.4	-16.6	0	0	106.5	D466	D466-Q468 PolarHBondContact O-N 2.91Å
469	Q	42.9	Very low	57.7	Low	146 Å²	146	108 Å²	108	68%	0.682	61%	0.613	S	S	*	*			trans	-58.1	136	160.7	-75.5	-165.2	-26	0	0	106.8	H467 D471	H467-Q469 VanDerWaalsContact C-N 3.32Å; H467-Q469 PolarHBondContact O-N 3.49Å; Q469-D471 PolarHBondContact O-N 3.15Å
470	P	37.9	Very low	54.4	Low	123 Å²	123	113.1 Å²	113.1	80%	0.799	64%	0.64	S	S	*	*			trans	-59.9	108.7	163.5	-10.8	24.3	0	0	0	106.2	A472	P470-A472 PolarHBondContact O-N 3.04Å; P470-A472 VanDerWaalsContact O-N 3.17Å
471	D	32.9	Very low	51.1	Low	151 Å²	151	118.4 Å²	118.4	81%	0.807	68%	0.677	S	S	*	*			trans	-50.7	122.8	-173.3	-75	-47.1	0	0	0	111.1	Q469 K473	Q469-D471 PolarHBondContact O-N 3.15Å; D471-K473 PolarHBondContact O-N 3Å
472	A	36	Very low	47.9	Very low	97 Å²	97	121.5 Å²	121.5	80%	0.802	70%	0.703	S	S	*	*	S	Bend	trans	-64.3	103.8	155.9	0	0	0	0	0	107.3	P470	P470-A472 PolarHBondContact O-N 3.04Å; P470-A472 VanDerWaalsContact O-N 3.17Å
473	K	33.3	Very low	44.8	Very low	199 Å²	199	123.5 Å²	123.5	87%	0.865	71%	0.709	S	S	*	*			trans	44.2	109.7	159.8	-65.3	-176.6	177.8	-178.3	0	116.5	D471 E475	D471-K473 PolarHBondContact O-N 3Å; K473-E475 PolarHBondContact O-N 3.43Å; K473-E475 VanDerWaalsContact O-N 3.17Å
474	A	36.9	Very low	41.5	Very low	101 Å²	101	126.3 Å²	126.3	84%	0.835	74%	0.735	S	S	*	*			trans	-46.9	116.4	159.9	0	0	0	0	0	112.4
475	E	31.6	Very low	38.2	Very low	190 Å²	190	128.6 Å²	128.6	89%	0.888	76%	0.76	S	S	*	*			trans	-145.3	113.7	148	-78.3	-164.1	162.8	0	0	110.6	K473	K473-E475 PolarHBondContact O-N 3.43Å; K473-E475 VanDerWaalsContact O-N 3.17Å
476	S	30.1	Very low	35.4	Very low	125 Å²	125	130.9 Å²	130.9	87%	0.874	78%	0.777	S	S	*	*			trans	58.6	106.6	141.9	-159.3	0	0	0	0	121.6
477	G	25.9	Very low	33	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	77%	0.774	S	S	*	*				81.2	105.5	113.5	0	0	0	0	0	119.9
478	S	27	Very low	31.3	Very low	128 Å²	128	134.7 Å²	134.7	90%	0.895	80%	0.798	S	S	*	*				166	151.9	105.2	-162.3	0	0	0	0	112.2
479	K	34.2	Very low	30.3	Very low	182 Å²	182	131.9 Å²	131.9	79%	0.791	80%	0.799	S	S	*	*			trans	-89	170.1	-160	-63.6	170.2	167.8	174.7	0	115.6
480	N	26.9	Very low	29.3	Very low	155 Å²	155	129 Å²	129	83%	0.829	81%	0.808	S	S	*	*			trans	116.9	136.9	144.1	-66.9	-10.3	0	0	0	112.9
481	S	27.6	Very low	28.6	Very low	111 Å²	111	127.1 Å²	127.1	78%	0.776	81%	0.811	S	S	*	*			cis	-162.7	162.8	0.8	56.5	0	0	0	0	105.2
482	S	27.9	Very low	28.3	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	81%	0.813	S	S	*	*			cis	-167.7	137.1	42.4	44.8	0	0	0	0	110.5
483	Q	29.7	Very low	27.9	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	82%	0.816	S	S	*	*			trans	-90.2	152.4	173.2	179	179.2	-2.3	0	0	110.4
484	S	24.3	Very low	27.6	Very low	129 Å²	129	127.2 Å²	127.2	90%	0.902	81%	0.81	S	S	*	*			trans	-168.2	123.6	148.6	-177.4	0	0	0	0	106.8
485	G	23.8	Very low	27	Very low	56 Å²	56	130.1 Å²	130.1	58%	0.577	81%	0.812	S	S	*	*			cis	169.5	114.6	0.5	0	0	0	0	0	104.5
486	S	27.5	Very low	27.3	Very low	93 Å²	93	126.3 Å²	126.3	65%	0.65	80%	0.804	S	S	*	*				61.5	128.3	101.5	-58.8	0	0	0	0	113.5
487	T	25.2	Very low	27	Very low	123 Å²	123	126.7 Å²	126.7	76%	0.755	81%	0.805	S	S	*	*				-163	128.7	66.8	32.7	0	0	0	0	111
488	E	27.3	Very low	27.1	Very low	181 Å²	181	128.6 Å²	128.6	85%	0.846	81%	0.807	S	S	*	*				61.6	127.4	94.5	-63.4	-169.7	-167.7	0	0	114.1
489	S	26.5	Very low	27.2	Very low	122 Å²	122	126 Å²	126	85%	0.853	80%	0.801	S	S	*	*			cis	-160.1	157.6	49.6	51.9	0	0	0	0	109.8
490	G	23.3	Very low	26.9	Very low	85 Å²	85	126.7 Å²	126.7	88%	0.876	80%	0.803	S	S	*	*			cis	128.8	114.2	27	0	0	0	0	0	108.1
491	G	23.1	Very low	27.1	Very low	84 Å²	84	124.5 Å²	124.5	87%	0.866	80%	0.8	S	S	*	*			trans	177.8	107.1	176.6	0	0	0	0	0	113
492	E	27	Very low	27.4	Very low	181 Å²	181	127.7 Å²	127.7	85%	0.846	80%	0.803	S	S	*	*			trans	-89.5	168.7	-170.7	-62.1	176	141.3	0	0	114.3
493	N	25.7	Very low	27.7	Very low	160 Å²	160	131 Å²	131	86%	0.856	81%	0.806	S	S	*	*			trans	90.9	123.9	173	-55.1	-28.5	0	0	0	114.4
494	S	27.6	Very low	28.2	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	80%	0.803	S	S	*	*			cis	-160.9	140.4	39.2	52.7	0	0	0	0	114.3
495	D	24.5	Very low	29.6	Very low	162 Å²	162	125.5 Å²	125.5	87%	0.866	78%	0.784	S	S	*	*			trans	65.2	140.7	143.8	-79.1	-24.9	0	0	0	125.4
496	P	37.1	Very low	31.7	Very low	111 Å²	111	130.6 Å²	130.6	72%	0.721	79%	0.79	S	S	*	*			trans	-105.1	128.3	-163.1	35.7	-20.7	0	0	0	111.6
497	C	24.1	Very low	34.3	Very low	133 Å²	133	129.5 Å²	129.5	90%	0.899	77%	0.773	S	S	*	*			trans	-139.6	108.6	169.6	-108.2	0	0	0	0	113.1
498	S	29.7	Very low	37.1	Very low	113 Å²	113	126.2 Å²	126.2	79%	0.79	75%	0.749	S	S	*	*			trans	66.3	63.6	149.3	-172.1	0	0	0	0	118.2	K500	S498-K500 VanDerWaalsContact C-N 3.28Å; S498-K500 PolarHBondContact O-N 3.03Å; S498-K500 VanDerWaalsContact O-N 3.1Å
499	G	27.6	Very low	39.8	Very low	74 Å²	74	121.5 Å²	121.5	76%	0.763	74%	0.736	S	S	*	*			trans	-77.5	71	155.9	0	0	0	0	0	112.4	S501	G499-S501 VanDerWaalsContact C-N 3.35Å
500	K	29.3	Very low	42.8	Very low	195 Å²	195	115.8 Å²	115.8	85%	0.848	70%	0.696	S	S	*	*			trans	-102.7	67.8	146.7	-81.6	-170.4	179.4	178.6	0	107.3	S498 Q502	S498-K500 VanDerWaalsContact C-N 3.28Å; S498-K500 PolarHBondContact O-N 3.03Å; S498-K500 VanDerWaalsContact O-N 3.1Å; K500-Q502 VanDerWaalsContact C-N 3.32Å; K500-Q502 PolarHBondContact O-N 2.99Å
501	S	30.6	Very low	45.9	Very low	109 Å²	109	114.7 Å²	114.7	76%	0.762	67%	0.673	S	S	*	*			trans	-63.3	100.7	163.4	-49.2	0	0	0	0	106.2	G499 E503	G499-S501 VanDerWaalsContact C-N 3.35Å; S501-E503 PolarHBondContact O-N 3.4Å
502	Q	32.6	Very low	49	Very low	178 Å²	178	112.7 Å²	112.7	83%	0.832	64%	0.644	S	S	*	*			trans	-46.5	130.8	151.7	-73.2	177.7	-17.7	0	0	105.8	K500 A504	K500-Q502 VanDerWaalsContact C-N 3.32Å; K500-Q502 PolarHBondContact O-N 2.99Å; Q502-A504 PolarHBondContact O-N 3.37Å
503	E	34.6	Very low	51.8	Low	185 Å²	185	105.3 Å²	105.3	86%	0.864	61%	0.612	S	S	*	*			trans	-55	88.3	169.8	-75.1	-172.6	147.1	0	0	107.7	S501 D505	S501-E503 PolarHBondContact O-N 3.4Å; E503-D505 PolarHBondContact O-N 3.34Å
504	A	40.6	Very low	54.7	Low	88 Å²	88	101.5 Å²	101.5	73%	0.727	60%	0.598	S	S	*	*			trans	-62.9	121.6	173.4	0	0	0	0	0	105.5	Q502 K506	Q502-A504 PolarHBondContact O-N 3.37Å; A504-K506 PolarHBondContact O-N 2.99Å
505	D	54.3	Low	57.6	Low	94 Å²	94	97.4 Å²	97.4	50%	0.503	57%	0.569	S	S	.	*			trans	-40.2	103.8	178.2	-91.3	-32.3	0	0	0	109.7	E503 F507	E503-D505 PolarHBondContact O-N 3.34Å; D505-F507 VanDerWaalsContact O-CD2 3.24Å; D505-F507 WeakPolarHBondContact O-CD2 3.38Å; D505-F507 PolarHBondContact O-N 3.18Å
506	K	68.5	Low	60.8	Low	164 Å²	164	89.8 Å²	89.8	71%	0.713	53%	0.529	S	S	*	.			trans	-65.6	104.3	179.1	-168.6	174.6	-176.7	176.9	0	107.2	A504 F508	A504-K506 PolarHBondContact O-N 2.99Å; K506-F508 WeakPolarHBondContact O-CD2 3.21Å; K506-F508 VanDerWaalsContact O-CE2 3.29Å; K506-F508 WeakPolarHBondContact O-CE2 3.33Å
507	F	80.6	Confident	63.2	Low	69 Å²	69	87.8 Å²	87.8	30%	0.303	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-73.8	135	176.1	-70.6	-78	0	0	0	109.9	F160 D505 P515 R517	F160-F507 HydrophobicContact CD1-CD1 4.33Å; F160-F507 HydrophobicContact CD1-CE1 4.33Å; F160-F507 HydrophobicContact CE1-CD1 4.4Å; F160-F507 HydrophobicContact CE1-CE1 4.05Å; F160-F507 HydrophobicContact CE1-CZ 4.35Å; D505-F507 VanDerWaalsContact O-CD2 3.24Å; D505-F507 WeakPolarHBondContact O-CD2 3.38Å; D505-F507 PolarHBondContact O-N 3.18Å; F507-P515 HydrophobicContact CB-CB 3.9Å; F507-P515 HydrophobicContact CD1-CB 4.01Å; F507-P515 HydrophobicContact CG-CB 4.32Å; F507-R517 HydrophobicContact CD1-CG 4.11Å; F507-R517 HydrophobicContact CE1-CG 3.69Å
508	F	85.1	Confident	66.2	Low	55 Å²	55	87.5 Å²	87.5	24%	0.241	49%	0.49	C	S	.	.	B	Isolated β-bridge	trans	-101.6	129.6	172.8	-56.7	-89.8	0	0	0	109.7	P465 K506 A510 P515 L516 V521	P465-F508 HydrophobicContact CB-CD1 4.41Å; P465-F508 HydrophobicContact CB-CE1 3.68Å; P465-F508 HydrophobicContact CB-CZ 4.03Å; P465-F508 HydrophobicContact CG-CD1 4.02Å; P465-F508 HydrophobicContact CG-CE1 3.5Å; P465-F508 HydrophobicContact CG-CE2 4.14Å; P465-F508 HydrophobicContact CG-CZ 3.58Å; K506-F508 WeakPolarHBondContact O-CD2 3.21Å; K506-F508 VanDerWaalsContact O-CE2 3.29Å; K506-F508 WeakPolarHBondContact O-CE2 3.33Å; F508-A510 PolarHBondContact O-N 2.9Å; F508-P515 CarbonylContact O-C 3.55Å; F508-P515 VanDerWaalsContact O-CA 3.29Å; F508-P515 WeakPolarHBondContact O-CA 3.5Å; F508-P515 WeakPolarHBondContact O-CB 3.45Å; F508-L516 HydrophobicContact CB-CB 4.08Å; F508-L516 PolarHBondContact N-O 3.09Å; F508-L516 PolarHBondContact O-N 3.11Å; F508-V521 HydrophobicContact CD2-CG2 3.57Å; F508-V521 HydrophobicContact CE2-CG2 4.01Å; F508-V521 HydrophobicContact CG-CG2 4.27Å
509	S	84.1	Confident	69	Low	82 Å²	82	85.4 Å²	85.4	57%	0.573	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-58.8	135.3	179.5	-174.3	0	0	0	0	110.8
510	A	87.9	Confident	72	Confident	1 Å²	1	84.9 Å²	84.9	1%	0.008	45%	0.445	C	S	.	.			trans	-147.5	38.1	-179.4	0	0	0	0	0	111	N380 F508 S513 L516	N380-A510 PolarHBondContact ND2-O 3.34Å; F508-A510 PolarHBondContact O-N 2.9Å; A510-S513 CarbonylContact C-O 3.52Å; A510-S513 CarbonylContact O-C 3.48Å; A510-S513 VanDerWaalsContact O-CA 3.31Å; A510-S513 WeakPolarHBondContact O-CA 3.31Å; A510-S513 WeakPolarHBondContact O-CB 3.31Å; A510-S513 PolarHBondContact O-N 3.18Å; A510-S513 PolarHBondContact O-OG 2.83Å; A510-L516 HydrophobicContact CB-CD1 4.01Å; A510-L516 HydrophobicContact CB-CG 4.07Å
511	T	88.4	Confident	75	Confident	63 Å²	63	75.8 Å²	75.8	39%	0.387	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	142.4	178.8	51.5	0	0	0	0	111	N380 S513	N380-T511 VanDerWaalsContact CB-O 3.29Å; N380-T511 WeakPolarHBondContact CB-O 3.34Å; N380-T511 PolarHBondContact ND2-O 3.28Å; T511-S513 VanDerWaalsContact C-N 3.31Å
512	P	88.4	Confident	77.9	Confident	42 Å²	42	72 Å²	72	27%	0.273	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84.3	2.6	4.2	36.6	-33.9	0	0	0	113.5	E348 Y351 Y377	E348-P512 HydrophobicContact CB-CB 4.4Å; E348-P512 HydrophobicContact CG-CB 3.94Å; Y351-P512 HydrophobicContact CD1-CG 3.73Å; Y351-P512 HydrophobicContact CD2-CG 4.02Å; Y351-P512 HydrophobicContact CE1-CG 4.34Å; Y351-P512 HydrophobicContact CG-CG 3.56Å; Y377-P512 HydrophobicContact CD2-CB 4.43Å; Y377-P512 HydrophobicContact CD2-CG 3.98Å; Y377-P512 HydrophobicContact CE1-CB 4.24Å; Y377-P512 HydrophobicContact CE2-CB 4.03Å; Y377-P512 HydrophobicContact CE2-CG 3.98Å; Y377-P512 HydrophobicContact CG-CG 4.35Å
513	S	87.4	Confident	80.7	Confident	25 Å²	25	65.9 Å²	65.9	18%	0.175	35%	0.349	C	S	.	.	S	Bend	trans	-81.1	163.9	176	69.8	0	0	0	0	112.4	R382 A510 T511	R382-S513 PolarHBondContact NH1-OG 3.44Å; A510-S513 CarbonylContact C-O 3.52Å; A510-S513 CarbonylContact O-C 3.48Å; A510-S513 VanDerWaalsContact O-CA 3.31Å; A510-S513 WeakPolarHBondContact O-CA 3.31Å; A510-S513 WeakPolarHBondContact O-CB 3.31Å; A510-S513 PolarHBondContact O-N 3.18Å; A510-S513 PolarHBondContact O-OG 2.83Å; T511-S513 VanDerWaalsContact C-N 3.31Å
514	S	86.6	Confident	83.5	Confident	80 Å²	80	57.7 Å²	57.7	56%	0.559	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-57	145.4	174.7	-53.4	0	0	0	0	111.2	R382	R382-S514 PolarHBondContact NH1-O 3.24Å
515	P	88.8	Confident	86.1	Confident	22 Å²	22	54.5 Å²	54.5	14%	0.143	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-54.8	148.6	178	-28.2	37.9	0	0	0	113.2	F160 F507 F508	F160-P515 HydrophobicContact CB-CG 3.61Å; F160-P515 HydrophobicContact CD1-CB 4.33Å; F160-P515 HydrophobicContact CD1-CG 3.72Å; F160-P515 VanDerWaalsContact CD2-CD 3.49Å; F160-P515 HydrophobicContact CD2-CG 3.87Å; F160-P515 HydrophobicContact CE1-CG 4.32Å; F160-P515 HydrophobicContact CE2-CG 4.44Å; F160-P515 HydrophobicContact CG-CG 3.47Å; F160-P515 VanDerWaalsContact CG-CG 3.47Å; F507-P515 HydrophobicContact CB-CB 3.9Å; F507-P515 HydrophobicContact CD1-CB 4.01Å; F507-P515 HydrophobicContact CG-CB 4.32Å; F508-P515 CarbonylContact O-C 3.55Å; F508-P515 VanDerWaalsContact O-CA 3.29Å; F508-P515 WeakPolarHBondContact O-CA 3.5Å; F508-P515 WeakPolarHBondContact O-CB 3.45Å
516	L	89.8	Confident	88.1	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.016	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-78.5	128.7	178.9	-79.1	156.5	0	0	0	110.2	P381 R382 F508 A510 E520 V521 L524	P381-L516 HydrophobicContact CG-CD1 3.73Å; R382-L516 VanDerWaalsContact CZ-CG 3.48Å; F508-L516 HydrophobicContact CB-CB 4.08Å; F508-L516 PolarHBondContact N-O 3.09Å; F508-L516 PolarHBondContact O-N 3.11Å; A510-L516 HydrophobicContact CB-CD1 4.01Å; A510-L516 HydrophobicContact CB-CG 4.07Å; L516-E520 WeakPolarHBondContact CA-OE2 3.44Å; L516-E520 HydrophobicContact CD2-CB 3.77Å; L516-V521 HydrophobicContact CB-CG2 3.8Å; L516-V521 HydrophobicContact CD1-CG2 4.46Å; L516-V521 HydrophobicContact CD2-CG2 4.46Å; L516-V521 HydrophobicContact CG-CG2 4.48Å; L516-L524 HydrophobicContact CD1-CD2 4.08Å; L516-L524 HydrophobicContact CD2-CD2 4.03Å
517	R	88.6	Confident	89.4	Confident	69 Å²	69	44.3 Å²	44.3	26%	0.26	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-82.7	160.8	165.2	-63.6	-177.8	-174.8	-177	-5.8	110.7	F507 Q519 E520 V521	F507-R517 HydrophobicContact CD1-CG 4.11Å; F507-R517 HydrophobicContact CE1-CG 3.69Å; R517-Q519 VanDerWaalsContact C-N 3.31Å; R517-Q519 PolarHBondContact O-N 2.91Å; R517-E520 HydrophobicContact CB-CG 4.29Å; R517-E520 PolarHBondContact N-OE2 3.03Å; R517-E520 WeakPolarHBondContact O-CA 3.23Å; R517-E520 WeakPolarHBondContact O-CB 3.42Å; R517-E520 PolarHBondContact O-N 3.27Å; R517-V521 PolarHBondContact O-N 3.24Å
518	K	87.6	Confident	90.2	Very high	126 Å²	126	41 Å²	41	55%	0.548	22%	0.223	S	C	.	.	H	α-helix	trans	-48.7	-48.5	178.4	-173.9	176.9	-179.8	176.1	0	113.1	E520 V521 E522	K518-E520 VanDerWaalsContact C-N 3.31Å; K518-E520 PolarHBondContact O-N 2.97Å; K518-V521 WeakPolarHBondContact O-CB 3.46Å; K518-V521 PolarHBondContact O-N 3.29Å; K518-E522 PolarHBondContact O-N 3.23Å; K518-E522 VanDerWaalsContact O-N 3.09Å
519	Q	87.9	Confident	90.8	Very high	70 Å²	70	38.6 Å²	38.6	33%	0.327	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-34.4	178.2	-170.9	60.6	72.3	0	0	113.1	R517 E522 N523	R517-Q519 VanDerWaalsContact C-N 3.31Å; R517-Q519 PolarHBondContact O-N 2.91Å; Q519-E522 PolarHBondContact NE2-OE2 2.93Å; Q519-N523 PolarHBondContact NE2-OD1 3.08Å; Q519-N523 PolarHBondContact O-N 2.98Å; Q519-N523 PolarHBondContact O-ND2 3.38Å; Q519-N523 PolarHBondContact O-OD1 3.01Å
520	E	89.9	Confident	91.4	Very high	62 Å²	62	34.9 Å²	34.9	29%	0.29	19%	0.187	S	C	.	.	H	α-helix	trans	-72.3	-34.1	177.8	-61.2	176.4	156.2	0	0	111.4	R382 L516 R517 K518 N523 L524	R382-E520 IonicContact NH2-OE2 3.5Å; R382-E520 PolarHBondContact NH2-OE2 3.5Å; L516-E520 WeakPolarHBondContact CA-OE2 3.44Å; L516-E520 HydrophobicContact CD2-CB 3.77Å; R517-E520 HydrophobicContact CB-CG 4.29Å; R517-E520 PolarHBondContact N-OE2 3.03Å; R517-E520 WeakPolarHBondContact O-CA 3.23Å; R517-E520 WeakPolarHBondContact O-CB 3.42Å; R517-E520 PolarHBondContact O-N 3.27Å; K518-E520 VanDerWaalsContact C-N 3.31Å; K518-E520 PolarHBondContact O-N 2.97Å; E520-N523 PolarHBondContact O-N 3.25Å; E520-L524 WeakPolarHBondContact O-CB 3.23Å; E520-L524 PolarHBondContact O-N 3.07Å
521	V	92.3	Very high	91.8	Very high	5 Å²	5	36 Å²	36	3%	0.03	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-46.7	171.9	171.8	0	0	0	0	110.9	L464 P465 F508 L516 R517 K518 L524 R525	L464-V521 HydrophobicContact CD2-CG1 4.27Å; P465-V521 HydrophobicContact CG-CG1 3.8Å; F508-V521 HydrophobicContact CD2-CG2 3.57Å; F508-V521 HydrophobicContact CE2-CG2 4.01Å; F508-V521 HydrophobicContact CG-CG2 4.27Å; L516-V521 HydrophobicContact CB-CG2 3.8Å; L516-V521 HydrophobicContact CD1-CG2 4.46Å; L516-V521 HydrophobicContact CD2-CG2 4.46Å; L516-V521 HydrophobicContact CG-CG2 4.48Å; R517-V521 PolarHBondContact O-N 3.24Å; K518-V521 WeakPolarHBondContact O-CB 3.46Å; K518-V521 PolarHBondContact O-N 3.29Å; V521-L524 PolarHBondContact O-N 3.38Å; V521-R525 WeakPolarHBondContact O-CB 3.26Å; V521-R525 PolarHBondContact O-N 3.46Å
522	E	91.3	Very high	92.3	Very high	28 Å²	28	33.5 Å²	33.5	13%	0.131	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-48.2	176.3	-69.7	169.8	-174.8	0	0	111.2	K518 Q519 L524 R525 C526	K518-E522 PolarHBondContact O-N 3.23Å; K518-E522 VanDerWaalsContact O-N 3.09Å; Q519-E522 PolarHBondContact NE2-OE2 2.93Å; E522-L524 PolarHBondContact O-N 3.29Å; E522-R525 WeakPolarHBondContact O-CB 3.31Å; E522-R525 PolarHBondContact O-N 3.17Å; E522-C526 PolarHBondContact O-N 3Å; E522-C526 VanDerWaalsContact O-N 3.11Å; E522-C526 PolarHBondContact O-SG 3.4Å; E522-C526 VanDerWaalsContact O-SG 3.38Å
523	N	91.2	Very high	92.7	Very high	50 Å²	50	31.5 Å²	31.5	27%	0.267	17%	0.167	S	C	.	.	H	α-helix	trans	-63.1	-42.3	178.8	-67.2	-12.5	0	0	0	111.9	Q519 E520 R525 C526 S527	Q519-N523 PolarHBondContact NE2-OD1 3.08Å; Q519-N523 PolarHBondContact O-N 2.98Å; Q519-N523 PolarHBondContact O-ND2 3.38Å; Q519-N523 PolarHBondContact O-OD1 3.01Å; E520-N523 PolarHBondContact O-N 3.25Å; N523-R525 VanDerWaalsContact C-N 3.32Å; N523-R525 PolarHBondContact O-N 3.43Å; N523-C526 PolarHBondContact O-N 3.34Å; N523-S527 PolarHBondContact O-N 2.68Å; N523-S527 VanDerWaalsContact O-N 3.09Å; N523-S527 PolarHBondContact O-OG 3.09Å
524	L	94	Very high	93.2	Very high	14 Å²	14	33.7 Å²	33.7	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-39.8	178.5	-177.9	57.9	0	0	0	111.3	P381 R382 L385 L464 L516 E520 V521 E522 S527 I528	P381-L524 HydrophobicContact CB-CD2 4.09Å; P381-L524 HydrophobicContact CG-CD2 3.99Å; R382-L524 HydrophobicContact CG-CD1 4.39Å; R382-L524 HydrophobicContact CG-CD2 3.73Å; L385-L524 HydrophobicContact CB-CD1 4.4Å; L385-L524 HydrophobicContact CD2-CD1 3.42Å; L385-L524 VanDerWaalsContact CD2-CD1 3.42Å; L464-L524 HydrophobicContact CD1-CG 4.46Å; L464-L524 HydrophobicContact CD2-CD2 3.91Å; L464-L524 HydrophobicContact CD2-CG 4.42Å; L516-L524 HydrophobicContact CD1-CD2 4.08Å; L516-L524 HydrophobicContact CD2-CD2 4.03Å; E520-L524 WeakPolarHBondContact O-CB 3.23Å; E520-L524 PolarHBondContact O-N 3.07Å; V521-L524 PolarHBondContact O-N 3.38Å; E522-L524 PolarHBondContact O-N 3.29Å; L524-S527 PolarHBondContact O-N 3.05Å; L524-I528 HydrophobicContact CD1-CD1 4.12Å; L524-I528 HydrophobicContact CD1-CG1 4.38Å; L524-I528 HydrophobicContact CG-CD1 3.84Å; L524-I528 WeakPolarHBondContact O-CD1 3.38Å; L524-I528 VanDerWaalsContact O-CG1 3.28Å; L524-I528 WeakPolarHBondContact O-CG1 3.48Å; L524-I528 PolarHBondContact O-N 3.27Å
525	R	95.3	Very high	93.6	Very high	21 Å²	21	30 Å²	30	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-58.6	-47.1	173.3	179.6	175.4	-70.1	109.3	5.3	111.6	L461 L464 P465 V521 E522 N523 S527 I528 L529	L461-R525 HydrophobicContact CD1-CG 4.34Å; L464-R525 HydrophobicContact CD1-CB 3.84Å; P465-R525 PolarHBondContact O-NH2 3.41Å; V521-R525 WeakPolarHBondContact O-CB 3.26Å; V521-R525 PolarHBondContact O-N 3.46Å; E522-R525 WeakPolarHBondContact O-CB 3.31Å; E522-R525 PolarHBondContact O-N 3.17Å; N523-R525 VanDerWaalsContact C-N 3.32Å; N523-R525 PolarHBondContact O-N 3.43Å; R525-S527 VanDerWaalsContact C-N 3.33Å; R525-S527 PolarHBondContact O-N 3.25Å; R525-I528 PolarHBondContact O-N 3.15Å; R525-L529 HydrophobicContact CG-CD1 3.83Å; R525-L529 HydrophobicContact CG-CG 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.29Å; R525-L529 WeakPolarHBondContact O-CG 3.31Å; R525-L529 PolarHBondContact O-N 2.93Å
526	C	95.6	Very high	93.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-59.3	-44.3	178	-65.2	0	0	0	0	111.6	E522 N523 L529 A530 L552 K557 L562	E522-C526 PolarHBondContact O-N 3Å; E522-C526 VanDerWaalsContact O-N 3.11Å; E522-C526 PolarHBondContact O-SG 3.4Å; E522-C526 VanDerWaalsContact O-SG 3.38Å; N523-C526 PolarHBondContact O-N 3.34Å; C526-L529 PolarHBondContact O-N 3.19Å; C526-A530 WeakPolarHBondContact O-CB 3.29Å; C526-A530 PolarHBondContact O-N 3.46Å; C526-L552 HydrophobicContact CB-CD1 3.72Å; C526-L552 WeakPolarHBondContact O-CD1 3.46Å; C526-K557 PolarHBondContact SG-O 3.19Å; C526-L562 HydrophobicContact CB-CD1 3.69Å
527	S	95.8	Very high	94	Very high	42 Å²	42	30 Å²	30	29%	0.294	15%	0.145	S	C	.	.	H	α-helix	trans	-63	-43.9	176.1	-62.5	0	0	0	0	112.8	N523 L524 R525 A530 C531	N523-S527 PolarHBondContact O-N 2.68Å; N523-S527 VanDerWaalsContact O-N 3.09Å; N523-S527 PolarHBondContact O-OG 3.09Å; L524-S527 PolarHBondContact O-N 3.05Å; R525-S527 VanDerWaalsContact C-N 3.33Å; R525-S527 PolarHBondContact O-N 3.25Å; S527-A530 PolarHBondContact O-N 2.9Å; S527-C531 PolarHBondContact O-N 3.44Å; S527-C531 PolarHBondContact O-SG 3.01Å
528	I	97.5	Very high	94.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-44.9	178.3	-69	160.7	0	0	0	110.6	L385 L457 A460 L461 L464 L524 R525 C531 S532	L385-I528 HydrophobicContact CB-CG1 4.36Å; L385-I528 HydrophobicContact CD1-CG1 4.05Å; L385-I528 HydrophobicContact CD2-CG1 4.33Å; L385-I528 HydrophobicContact CG-CG1 4.48Å; L457-I528 HydrophobicContact CB-CG2 4.45Å; L457-I528 HydrophobicContact CD2-CG2 4.14Å; A460-I528 HydrophobicContact CB-CD1 3.58Å; A460-I528 HydrophobicContact CB-CG1 4Å; A460-I528 HydrophobicContact CB-CG2 4.39Å; L461-I528 HydrophobicContact CB-CG2 4.06Å; L461-I528 HydrophobicContact CD1-CG2 4.4Å; L464-I528 HydrophobicContact CD1-CD1 3.77Å; L464-I528 HydrophobicContact CG-CD1 4.45Å; L524-I528 HydrophobicContact CD1-CD1 4.12Å; L524-I528 HydrophobicContact CD1-CG1 4.38Å; L524-I528 HydrophobicContact CG-CD1 3.84Å; L524-I528 WeakPolarHBondContact O-CD1 3.38Å; L524-I528 VanDerWaalsContact O-CG1 3.28Å; L524-I528 WeakPolarHBondContact O-CG1 3.48Å; L524-I528 PolarHBondContact O-N 3.27Å; R525-I528 PolarHBondContact O-N 3.15Å; I528-C531 PolarHBondContact O-N 3.46Å; I528-S532 WeakPolarHBondContact O-CB 3.47Å; I528-S532 PolarHBondContact O-N 3.08Å; I528-S532 PolarHBondContact O-OG 3.15Å
529	L	97.6	Very high	94.1	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-42.1	179.1	-70.8	169.5	0	0	0	111.9	L461 R525 C526 S532 A533 K551 L552 Q555	L461-L529 HydrophobicContact CD2-CD2 4.35Å; R525-L529 HydrophobicContact CG-CD1 3.83Å; R525-L529 HydrophobicContact CG-CG 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.29Å; R525-L529 WeakPolarHBondContact O-CG 3.31Å; R525-L529 PolarHBondContact O-N 2.93Å; C526-L529 PolarHBondContact O-N 3.19Å; L529-S532 PolarHBondContact O-N 3.39Å; L529-A533 PolarHBondContact O-N 3.22Å; L529-K551 HydrophobicContact CD1-CB 4.15Å; L529-K551 HydrophobicContact CD2-CB 4.03Å; L529-L552 HydrophobicContact CB-CB 3.98Å; L529-L552 HydrophobicContact CB-CD1 4.37Å; L529-L552 HydrophobicContact CD1-CB 4.42Å; L529-Q555 HydrophobicContact CD1-CG 4.27Å
530	A	96.9	Very high	94.1	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-46.6	175.8	0	0	0	0	0	112.1	C526 S527 S532 A533 Y534 L552 L562 Y569	C526-A530 WeakPolarHBondContact O-CB 3.29Å; C526-A530 PolarHBondContact O-N 3.46Å; S527-A530 PolarHBondContact O-N 2.9Å; A530-S532 VanDerWaalsContact C-N 3.3Å; A530-S532 PolarHBondContact O-N 2.88Å; A530-A533 PolarHBondContact O-N 3.11Å; A530-Y534 PolarHBondContact O-N 3.21Å; A530-Y534 VanDerWaalsContact O-N 3.08Å; A530-L552 HydrophobicContact CB-CD2 3.77Å; A530-L562 HydrophobicContact CB-CD2 3.68Å; A530-Y569 WeakPolarHBondContact O-CE2 3.32Å
531	C	97.4	Very high	94.3	Very high	26 Å²	26	25.6 Å²	25.6	18%	0.176	15%	0.154	C	C	.	.	H	α-helix	trans	-63.3	-36.3	174.4	-71.4	0	0	0	0	112	L385 I392 L457 S527 I528 Y534 V535	L385-C531 HydrophobicContact CD1-CB 4.48Å; I392-C531 HydrophobicContact CD1-CB 4Å; L457-C531 HydrophobicContact CD1-CB 3.87Å; L457-C531 HydrophobicContact CD2-CB 3.59Å; L457-C531 HydrophobicContact CG-CB 4.41Å; S527-C531 PolarHBondContact O-N 3.44Å; S527-C531 PolarHBondContact O-SG 3.01Å; I528-C531 PolarHBondContact O-N 3.46Å; C531-Y534 PolarHBondContact O-N 3.02Å; C531-V535 WeakPolarHBondContact O-CB 3.22Å; C531-V535 VanDerWaalsContact O-CG2 3.26Å; C531-V535 WeakPolarHBondContact O-CG2 3.43Å; C531-V535 PolarHBondContact O-N 2.94Å
532	S	98.2	Very high	94.4	Very high	10 Å²	10	27 Å²	27	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-66.2	-42.6	178.8	-56.1	0	0	0	0	111.4	I528 L529 A530 V535 A536	I528-S532 WeakPolarHBondContact O-CB 3.47Å; I528-S532 PolarHBondContact O-N 3.08Å; I528-S532 PolarHBondContact O-OG 3.15Å; L529-S532 PolarHBondContact O-N 3.39Å; A530-S532 VanDerWaalsContact C-N 3.3Å; A530-S532 PolarHBondContact O-N 2.88Å; S532-V535 PolarHBondContact O-N 3.41Å; S532-A536 VanDerWaalsContact O-CB 3.26Å; S532-A536 WeakPolarHBondContact O-CB 3.29Å; S532-A536 PolarHBondContact O-N 3.26Å
533	A	97.8	Very high	94.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-46.6	174.4	0	0	0	0	0	111.6	L529 A530 A536 L537 H548 A549 Y569	L529-A533 PolarHBondContact O-N 3.22Å; A530-A533 PolarHBondContact O-N 3.11Å; A533-A536 PolarHBondContact O-N 2.94Å; A533-L537 WeakPolarHBondContact O-CG 3.5Å; A533-L537 PolarHBondContact O-N 3.39Å; A533-H548 HydrophobicContact CB-CB 3.96Å; A533-A549 HydrophobicContact CB-CB 4.26Å; A533-Y569 HydrophobicContact CB-CD2 3.74Å; A533-Y569 HydrophobicContact CB-CG 4.25Å
534	Y	96.3	Very high	95	Very high	71 Å²	71	32.6 Å²	32.6	28%	0.278	19%	0.191	S	C	.	.	H	α-helix	trans	-59.9	-47.2	176.5	175	-100.2	0	0	0	112.8	I392 M450 A530 C531 L537 A538 Y569	I392-Y534 HydrophobicContact CB-CE1 4.48Å; I392-Y534 HydrophobicContact CD1-CD1 4.28Å; I392-Y534 HydrophobicContact CG1-CD1 4.2Å; I392-Y534 HydrophobicContact CG1-CE1 4.26Å; I392-Y534 HydrophobicContact CG2-CD1 4.09Å; I392-Y534 HydrophobicContact CG2-CE1 3.64Å; M450-Y534 HydrophobicContact CE-CD1 4.21Å; M450-Y534 HydrophobicContact CE-CE1 3.82Å; A530-Y534 PolarHBondContact O-N 3.21Å; A530-Y534 VanDerWaalsContact O-N 3.08Å; C531-Y534 PolarHBondContact O-N 3.02Å; Y534-L537 PolarHBondContact O-N 3.35Å; Y534-A538 PolarHBondContact O-N 3.49Å; Y534-Y569 HydrophobicContact CD2-CE1 4.1Å
535	V	95.9	Very high	95.1	Very high	2 Å²	2	32 Å²	32	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-41.5	179.8	170	0	0	0	0	110.9	I392 M450 A453 A454 L457 C531 S532 A538 L539	I392-V535 HydrophobicContact CD1-CG2 3.77Å; I392-V535 HydrophobicContact CG1-CG2 3.74Å; M450-V535 HydrophobicContact CE-CB 4.15Å; M450-V535 HydrophobicContact CE-CG1 4.26Å; M450-V535 HydrophobicContact CE-CG2 3.77Å; M450-V535 VanDerWaalsContact O-CG1 3.29Å; M450-V535 WeakPolarHBondContact O-CG1 3.32Å; A453-V535 HydrophobicContact CB-CG1 4.26Å; A453-V535 HydrophobicContact CB-CG2 3.93Å; A454-V535 HydrophobicContact CB-CG1 3.84Å; L457-V535 HydrophobicContact CD1-CB 4.19Å; L457-V535 HydrophobicContact CD1-CG2 3.76Å; C531-V535 WeakPolarHBondContact O-CB 3.22Å; C531-V535 VanDerWaalsContact O-CG2 3.26Å; C531-V535 WeakPolarHBondContact O-CG2 3.43Å; C531-V535 PolarHBondContact O-N 2.94Å; S532-V535 PolarHBondContact O-N 3.41Å; V535-A538 PolarHBondContact O-N 2.85Å; V535-L539 HydrophobicContact CG1-CD1 3.82Å; V535-L539 HydrophobicContact CG1-CG 4.36Å; V535-L539 VanDerWaalsContact O-CG 3.31Å; V535-L539 WeakPolarHBondContact O-CG 3.33Å; V535-L539 PolarHBondContact O-N 3.44Å
536	A	95.4	Very high	95.3	Very high	5 Å²	5	31.5 Å²	31.5	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-42.3	176.8	0	0	0	0	0	112.2	S532 A533 A538 L539 G540 D541 L544 A545	S532-A536 VanDerWaalsContact O-CB 3.26Å; S532-A536 WeakPolarHBondContact O-CB 3.29Å; S532-A536 PolarHBondContact O-N 3.26Å; A533-A536 PolarHBondContact O-N 2.94Å; A536-A538 PolarHBondContact O-N 3.48Å; A536-L539 CarbonylContact O-C 3.53Å; A536-L539 PolarHBondContact O-N 3.11Å; A536-G540 PolarHBondContact O-N 3.47Å; A536-G540 VanDerWaalsContact O-N 3.08Å; A536-D541 PolarHBondContact O-N 3.38Å; A536-L544 HydrophobicContact CB-CB 4.26Å; A536-L544 HydrophobicContact CB-CG 4.41Å; A536-A545 HydrophobicContact CB-CB 3.78Å
537	L	92.5	Very high	95.4	Very high	19 Å²	19	35.7 Å²	35.7	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-59.4	-46.3	172.5	-73.9	171.2	0	0	0	111.8	A533 Y534 L539 G540 A545 Y569 E572 A573	A533-L537 WeakPolarHBondContact O-CG 3.5Å; A533-L537 PolarHBondContact O-N 3.39Å; Y534-L537 PolarHBondContact O-N 3.35Å; L537-L539 PolarHBondContact O-N 3.28Å; L537-G540 PolarHBondContact O-N 2.81Å; L537-A545 HydrophobicContact CD2-CB 3.71Å; L537-A545 HydrophobicContact CG-CB 3.65Å; L537-Y569 HydrophobicContact CD1-CD1 3.63Å; L537-Y569 HydrophobicContact CD1-CG 3.95Å; L537-E572 HydrophobicContact CD1-CB 4.38Å; L537-E572 HydrophobicContact CD1-CG 4.47Å; L537-E572 HydrophobicContact CD2-CB 4.36Å; L537-E572 HydrophobicContact CD2-CG 4.13Å; L537-A573 HydrophobicContact CD2-CB 4Å
538	A	89.6	Confident	95.5	Very high	43 Å²	43	34.9 Å²	34.9	36%	0.355	20%	0.197	S	C	.	.	H	α-helix	trans	-64.5	-29.2	179.8	0	0	0	0	0	113.3	M450 Y534 V535 A536 G540	M450-A538 HydrophobicContact CE-CB 3.38Å; Y534-A538 PolarHBondContact O-N 3.49Å; V535-A538 PolarHBondContact O-N 2.85Å; A536-A538 PolarHBondContact O-N 3.48Å; A538-G540 VanDerWaalsContact C-N 3.33Å
539	L	88.8	Confident	95.5	Very high	72 Å²	72	34.9 Å²	34.9	38%	0.377	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.8	173.8	-66.7	173.4	0	0	0	113	M450 E451 A454 V535 A536 L537 D541	M450-L539 HydrophobicContact CB-CD2 3.73Å; M450-L539 HydrophobicContact CB-CG 4.21Å; E451-L539 HydrophobicContact CG-CD2 3.98Å; A454-L539 HydrophobicContact CB-CD1 4.09Å; V535-L539 HydrophobicContact CG1-CD1 3.82Å; V535-L539 HydrophobicContact CG1-CG 4.36Å; V535-L539 VanDerWaalsContact O-CG 3.31Å; V535-L539 WeakPolarHBondContact O-CG 3.33Å; V535-L539 PolarHBondContact O-N 3.44Å; A536-L539 CarbonylContact O-C 3.53Å; A536-L539 PolarHBondContact O-N 3.11Å; L537-L539 PolarHBondContact O-N 3.28Å; L539-D541 VanDerWaalsContact C-N 3.34Å
540	G	87.9	Confident	95.5	Very high	48 Å²	48	37.1 Å²	37.1	50%	0.495	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	7.5	-177.8	0	0	0	0	0	115.2	A536 L537 A538 N542	A536-G540 PolarHBondContact O-N 3.47Å; A536-G540 VanDerWaalsContact O-N 3.08Å; L537-G540 PolarHBondContact O-N 2.81Å; A538-G540 VanDerWaalsContact C-N 3.33Å; G540-N542 PolarHBondContact O-N 3.42Å; G540-N542 VanDerWaalsContact O-N 3.11Å
541	D	92.9	Very high	95.5	Very high	73 Å²	73	41.4 Å²	41.4	39%	0.39	23%	0.227	S	C	.	.			trans	-84.9	79.7	174.6	-169.9	-16.9	0	0	0	110.6	A536 L539 L543 L544 A545	A536-D541 PolarHBondContact O-N 3.38Å; L539-D541 VanDerWaalsContact C-N 3.34Å; D541-L543 VanDerWaalsContact C-N 3.3Å; D541-L543 PolarHBondContact O-N 3.3Å; D541-L543 PolarHBondContact OD1-N 2.69Å; D541-L544 HydrophobicContact CB-CB 4.22Å; D541-L544 PolarHBondContact O-N 3.07Å; D541-L544 WeakPolarHBondContact OD1-CB 3.43Å; D541-L544 PolarHBondContact OD1-N 3.37Å; D541-L544 WeakPolarHBondContact OD2-CB 3.34Å; D541-A545 WeakPolarHBondContact O-CB 3.39Å; D541-A545 PolarHBondContact O-N 3.12Å
542	N	95.2	Very high	95.4	Very high	35 Å²	35	40.1 Å²	40.1	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-28.7	-176.1	-61.5	-51.6	0	0	0	113.3	G540 L546 A573 S576 L577	G540-N542 PolarHBondContact O-N 3.42Å; G540-N542 VanDerWaalsContact O-N 3.11Å; N542-L546 WeakPolarHBondContact O-CB 3.3Å; N542-L546 PolarHBondContact O-N 3.21Å; N542-A573 HydrophobicContact CB-CB 4.45Å; N542-A573 WeakPolarHBondContact O-CB 3.44Å; N542-S576 VanDerWaalsContact CG-CB 3.41Å; N542-S576 VanDerWaalsContact ND2-CB 3.26Å; N542-S576 WeakPolarHBondContact ND2-CB 3.26Å; N542-L577 HydrophobicContact CB-CD1 4.31Å; N542-L577 HydrophobicContact CB-CD2 4Å; N542-L577 HydrophobicContact CB-CG 3.87Å
543	L	96.9	Very high	95.3	Very high	121 Å²	121	41.4 Å²	41.4	63%	0.634	22%	0.224	S	C	*	.	H	α-helix	trans	-69.2	-47.1	177.5	-72	174.4	0	0	0	110.7	D541 A545 L546 H547 L577	D541-L543 VanDerWaalsContact C-N 3.3Å; D541-L543 PolarHBondContact O-N 3.3Å; D541-L543 PolarHBondContact OD1-N 2.69Å; L543-A545 VanDerWaalsContact C-N 3.33Å; L543-L546 PolarHBondContact O-N 2.86Å; L543-H547 PolarHBondContact O-N 2.92Å; L543-L577 HydrophobicContact CD2-CD1 3.86Å; L543-L577 HydrophobicContact CD2-CD2 3.84Å; L543-L577 HydrophobicContact CG-CD2 4.04Å
544	L	96.4	Very high	95.2	Very high	74 Å²	74	48.5 Å²	48.5	39%	0.387	26%	0.258	S	S	.	.	H	α-helix	trans	-67.8	-37	178.3	-169.8	63.6	0	0	0	111.5	A536 D541 H547 H548	A536-L544 HydrophobicContact CB-CB 4.26Å; A536-L544 HydrophobicContact CB-CG 4.41Å; D541-L544 HydrophobicContact CB-CB 4.22Å; D541-L544 PolarHBondContact O-N 3.07Å; D541-L544 WeakPolarHBondContact OD1-CB 3.43Å; D541-L544 PolarHBondContact OD1-N 3.37Å; D541-L544 WeakPolarHBondContact OD2-CB 3.34Å; L544-H547 PolarHBondContact O-N 3.41Å; L544-H548 PolarHBondContact O-CD2 2.96Å; L544-H548 PolarHBondContact O-N 3.26Å
545	A	97.6	Very high	95	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.3	-50.9	173.3	0	0	0	0	0	112.3	A536 L537 D541 L543 H547 H548 A549 A573	A536-A545 HydrophobicContact CB-CB 3.78Å; L537-A545 HydrophobicContact CD2-CB 3.71Å; L537-A545 HydrophobicContact CG-CB 3.65Å; D541-A545 WeakPolarHBondContact O-CB 3.39Å; D541-A545 PolarHBondContact O-N 3.12Å; L543-A545 VanDerWaalsContact C-N 3.33Å; A545-H547 PolarHBondContact O-N 3.15Å; A545-H548 PolarHBondContact O-N 3Å; A545-A549 WeakPolarHBondContact O-CB 3.37Å; A545-A549 PolarHBondContact O-N 3.4Å; A545-A573 HydrophobicContact CB-CB 4.14Å
546	L	98.1	Very high	94.5	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-46.4	177.7	-179.4	58.3	0	0	0	111.2	N542 L543 H548 A549 D550 A570 A573 L574 L577	N542-L546 WeakPolarHBondContact O-CB 3.3Å; N542-L546 PolarHBondContact O-N 3.21Å; L543-L546 PolarHBondContact O-N 2.86Å; L546-H548 VanDerWaalsContact C-N 3.34Å; L546-H548 PolarHBondContact O-N 2.86Å; L546-A549 PolarHBondContact O-N 3.19Å; L546-D550 WeakPolarHBondContact O-CB 3.37Å; L546-D550 PolarHBondContact O-N 3.39Å; L546-A570 HydrophobicContact CD1-CB 3.95Å; L546-A573 HydrophobicContact CB-CB 3.92Å; L546-L574 HydrophobicContact CD1-CD1 4.13Å; L546-L574 HydrophobicContact CD1-CD2 4.2Å; L546-L574 HydrophobicContact CD1-CG 3.85Å; L546-L574 HydrophobicContact CD2-CD2 3.56Å; L546-L574 HydrophobicContact CD2-CG 4.07Å; L546-L577 HydrophobicContact CD2-CD1 4.14Å
547	H	98.1	Very high	94	Very high	89 Å²	89	55.5 Å²	55.5	41%	0.412	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-43.8	178.1	178	72.1	0	0	0	113.1	L543 L544 A545 K551	L543-H547 PolarHBondContact O-N 2.92Å; L544-H547 PolarHBondContact O-N 3.41Å; A545-H547 PolarHBondContact O-N 3.15Å; H547-K551 WeakPolarHBondContact CE1-CE 3.15Å; H547-K551 WeakPolarHBondContact NE2-CE 3.47Å; H547-K551 PolarHBondContact NE2-NZ 3.42Å; H547-K551 WeakPolarHBondContact O-CB 3.29Å; H547-K551 WeakPolarHBondContact O-CG 3.3Å; H547-K551 PolarHBondContact O-N 3.17Å
548	H	98.1	Very high	93.8	Very high	25 Å²	25	55.1 Å²	55.1	12%	0.116	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-39.5	177.2	-73.3	-53.8	0	0	0	112.7	A533 L544 A545 L546 K551 L552	A533-H548 HydrophobicContact CB-CB 3.96Å; L544-H548 PolarHBondContact O-CD2 2.96Å; L544-H548 PolarHBondContact O-N 3.26Å; A545-H548 PolarHBondContact O-N 3Å; L546-H548 VanDerWaalsContact C-N 3.34Å; L546-H548 PolarHBondContact O-N 2.86Å; H548-K551 PolarHBondContact O-N 3.33Å; H548-L552 WeakPolarHBondContact O-CB 3.35Å; H548-L552 PolarHBondContact O-N 3.47Å
549	A	97.9	Very high	93.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-43.7	176.6	0	0	0	0	0	111.7	A533 A545 L546 L552 L553 A570	A533-A549 HydrophobicContact CB-CB 4.26Å; A545-A549 WeakPolarHBondContact O-CB 3.37Å; A545-A549 PolarHBondContact O-N 3.4Å; L546-A549 PolarHBondContact O-N 3.19Å; A549-L552 WeakPolarHBondContact O-CB 3.49Å; A549-L552 PolarHBondContact O-N 3.24Å; A549-L553 WeakPolarHBondContact O-CG 3.33Å; A549-L553 PolarHBondContact O-N 3.02Å; A549-A570 HydrophobicContact CB-CB 3.92Å
550	D	97.5	Very high	93.8	Very high	51 Å²	51	50.3 Å²	50.3	27%	0.273	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-49	174.4	-76.1	-24.2	0	0	0	110.6	L546 L552 L553 H554 H586	L546-D550 WeakPolarHBondContact O-CB 3.37Å; L546-D550 PolarHBondContact O-N 3.39Å; D550-L552 PolarHBondContact O-N 2.87Å; D550-L553 PolarHBondContact O-N 3.42Å; D550-H554 PolarHBondContact O-N 3.25Å; D550-H554 PolarHBondContact O-ND1 3.45Å; D550-H586 IonicContact OD1-CE1 2.92Å
551	K	96.6	Very high	93.9	Very high	93 Å²	93	48.5 Å²	48.5	40%	0.404	25%	0.246	S	C	.	.	H	α-helix	trans	-56.3	-34.6	176.3	-81.8	-174.4	171.2	-175.3	0	113.2	L529 H547 H548 Q555	L529-K551 HydrophobicContact CD1-CB 4.15Å; L529-K551 HydrophobicContact CD2-CB 4.03Å; H547-K551 WeakPolarHBondContact CE1-CE 3.15Å; H547-K551 WeakPolarHBondContact NE2-CE 3.47Å; H547-K551 PolarHBondContact NE2-NZ 3.42Å; H547-K551 WeakPolarHBondContact O-CB 3.29Å; H547-K551 WeakPolarHBondContact O-CG 3.3Å; H547-K551 PolarHBondContact O-N 3.17Å; H548-K551 PolarHBondContact O-N 3.33Å; K551-Q555 WeakPolarHBondContact O-CG 3.47Å; K551-Q555 PolarHBondContact O-NE2 2.99Å
552	L	96.5	Very high	93.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-49.9	174.3	173.9	61.8	0	0	0	111	C526 L529 A530 H548 A549 D550 H554 Q555 V558 L562	C526-L552 HydrophobicContact CB-CD1 3.72Å; C526-L552 WeakPolarHBondContact O-CD1 3.46Å; L529-L552 HydrophobicContact CB-CB 3.98Å; L529-L552 HydrophobicContact CB-CD1 4.37Å; L529-L552 HydrophobicContact CD1-CB 4.42Å; A530-L552 HydrophobicContact CB-CD2 3.77Å; H548-L552 WeakPolarHBondContact O-CB 3.35Å; H548-L552 PolarHBondContact O-N 3.47Å; A549-L552 WeakPolarHBondContact O-CB 3.49Å; A549-L552 PolarHBondContact O-N 3.24Å; D550-L552 PolarHBondContact O-N 2.87Å; L552-H554 PolarHBondContact O-N 3.29Å; L552-Q555 WeakPolarHBondContact O-CB 3.35Å; L552-Q555 WeakPolarHBondContact O-CG 3.28Å; L552-Q555 PolarHBondContact O-N 3.45Å; L552-Q555 VanDerWaalsContact O-N 3.12Å; L552-V558 HydrophobicContact CD1-CG1 4.1Å; L552-V558 VanDerWaalsContact O-CG2 3.27Å; L552-V558 WeakPolarHBondContact O-CG2 3.28Å; L552-L562 HydrophobicContact CD1-CB 4.45Å; L552-L562 WeakPolarHBondContact CD2-O 3.45Å
553	L	95.4	Very high	93.9	Very high	36 Å²	36	48.5 Å²	48.5	19%	0.188	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-27	-178.7	-67.8	173.5	0	0	0	113	A549 D550 Q555 R563	A549-L553 WeakPolarHBondContact O-CG 3.33Å; A549-L553 PolarHBondContact O-N 3.02Å; D550-L553 PolarHBondContact O-N 3.42Å; L553-Q555 VanDerWaalsContact C-N 3.33Å; L553-R563 HydrophobicContact CD2-CG 3.94Å
554	H	95.1	Very high	93.7	Very high	150 Å²	150	43.2 Å²	43.2	69%	0.694	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.8	175.1	-71.8	86.5	0	0	0	114.3	D550 L552	D550-H554 PolarHBondContact O-N 3.25Å; D550-H554 PolarHBondContact O-ND1 3.45Å; L552-H554 PolarHBondContact O-N 3.29Å
555	Q	92.1	Very high	93.6	Very high	26 Å²	26	41.8 Å²	41.8	12%	0.121	20%	0.204	C	C	.	.	S	Bend	trans	-67.9	140.9	175.2	-60	-60.3	-59.5	0	0	110.6	L529 K551 L552 L553 K557 V558	L529-Q555 HydrophobicContact CD1-CG 4.27Å; K551-Q555 WeakPolarHBondContact O-CG 3.47Å; K551-Q555 PolarHBondContact O-NE2 2.99Å; L552-Q555 WeakPolarHBondContact O-CB 3.35Å; L552-Q555 WeakPolarHBondContact O-CG 3.28Å; L552-Q555 PolarHBondContact O-N 3.45Å; L552-Q555 VanDerWaalsContact O-N 3.12Å; L553-Q555 VanDerWaalsContact C-N 3.33Å; Q555-K557 VanDerWaalsContact C-N 3.29Å; Q555-K557 PolarHBondContact O-N 2.93Å; Q555-V558 HydrophobicContact CB-CG2 3.62Å
556	T	85.8	Confident	93.5	Very high	102 Å²	102	41.8 Å²	41.8	63%	0.626	20%	0.204	S	C	*	.	S	Bend	trans	-64.8	-31	-176.8	55.5	0	0	0	0	113.5
557	K	84.4	Confident	93.4	Very high	97 Å²	97	42.4 Å²	42.4	42%	0.422	21%	0.207	S	C	.	.	S	Bend	trans	-130.2	103.1	-179.3	-71.1	176.9	178	170.6	0	110.1	C526 Q555 M599	C526-K557 PolarHBondContact SG-O 3.19Å; Q555-K557 VanDerWaalsContact C-N 3.29Å; Q555-K557 PolarHBondContact O-N 2.93Å; K557-M599 HydrophobicContact CB-CE 3.98Å
558	V	88.2	Confident	93.3	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	20%	0.195	C	C	.	.			trans	-125.3	135.4	177.5	-173	0	0	0	0	108.6	L552 Q555 L562 R563	L552-V558 HydrophobicContact CD1-CG1 4.1Å; L552-V558 VanDerWaalsContact O-CG2 3.27Å; L552-V558 WeakPolarHBondContact O-CG2 3.28Å; Q555-V558 HydrophobicContact CB-CG2 3.62Å; V558-L562 HydrophobicContact CG1-CB 3.68Å; V558-R563 HydrophobicContact CG1-CB 4.07Å
559	S	89.6	Confident	93.3	Very high	10 Å²	10	40.2 Å²	40.2	7%	0.07	20%	0.196	C	C	.	.			trans	-66.5	153.8	174.6	66.3	0	0	0	0	111	S561 L562 R563 M599	S559-S561 PolarHBondContact O-N 2.94Å; S559-S561 PolarHBondContact OG-OG 3.46Å; S559-L562 PolarHBondContact O-N 3Å; S559-L562 VanDerWaalsContact O-N 3.12Å; S559-L562 WeakPolarHBondContact OG-CB 3.34Å; S559-L562 VanDerWaalsContact OG-CG 3.28Å; S559-L562 WeakPolarHBondContact OG-CG 3.35Å; S559-L562 PolarHBondContact OG-N 3.5Å; S559-R563 PolarHBondContact O-N 3.05Å; S559-M599 WeakPolarHBondContact CA-SD 3.49Å; S559-M599 VanDerWaalsContact CB-SD 3.59Å; S559-M599 PolarHBondContact N-SD 3.35Å; S559-M599 VanDerWaalsContact N-SD 3.4Å
560	G	89.5	Confident	93.3	Very high	4 Å²	4	40.2 Å²	40.2	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-52.6	-42.5	176.2	0	0	0	0	0	112.5	L562 R563 F564 D594	G560-L562 PolarHBondContact O-N 3.38Å; G560-R563 PolarHBondContact O-N 3.12Å; G560-F564 WeakPolarHBondContact O-CB 3.41Å; G560-F564 PolarHBondContact O-N 3.19Å; G560-D594 CarbonylContact C-O 3.57Å; G560-D594 WeakPolarHBondContact CA-O 3.41Å; G560-D594 PolarHBondContact N-OD2 3.31Å
561	S	90.6	Very high	93.3	Very high	10 Å²	10	37.9 Å²	37.9	7%	0.07	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-44.5	176.5	61.5	0	0	0	0	114.9	S559 L565 S596 Y626	S559-S561 PolarHBondContact O-N 2.94Å; S559-S561 PolarHBondContact OG-OG 3.46Å; S561-L565 WeakPolarHBondContact O-CG 3.32Å; S561-L565 PolarHBondContact O-N 3.42Å; S561-S596 WeakPolarHBondContact CB-O 3.48Å; S561-S596 PolarHBondContact N-O 3.45Å; S561-S596 PolarHBondContact OG-O 3.36Å; S561-Y626 WeakPolarHBondContact CA-OH 3.31Å; S561-Y626 WeakPolarHBondContact CB-OH 3.44Å
562	L	92.6	Very high	93.2	Very high	29 Å²	29	38.4 Å²	38.4	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-74.9	-32.4	-179.1	-66.6	176.7	0	0	0	111.1	C526 A530 L552 V558 S559 G560 L565 G566	C526-L562 HydrophobicContact CB-CD1 3.69Å; A530-L562 HydrophobicContact CB-CD2 3.68Å; L552-L562 HydrophobicContact CD1-CB 4.45Å; L552-L562 WeakPolarHBondContact CD2-O 3.45Å; V558-L562 HydrophobicContact CG1-CB 3.68Å; S559-L562 PolarHBondContact O-N 3Å; S559-L562 VanDerWaalsContact O-N 3.12Å; S559-L562 WeakPolarHBondContact OG-CB 3.34Å; S559-L562 VanDerWaalsContact OG-CG 3.28Å; S559-L562 WeakPolarHBondContact OG-CG 3.35Å; S559-L562 PolarHBondContact OG-N 3.5Å; G560-L562 PolarHBondContact O-N 3.38Å; L562-L565 PolarHBondContact O-N 2.85Å; L562-G566 PolarHBondContact O-N 3.27Å
563	R	93.8	Very high	93.3	Very high	79 Å²	79	38.4 Å²	38.4	30%	0.298	19%	0.188	S	C	.	.	H	α-helix	trans	-65	-46.2	172.7	-177.6	174.5	-66.5	142.9	2.2	111.1	L553 V558 S559 G560 L565 G566 H567	L553-R563 HydrophobicContact CD2-CG 3.94Å; V558-R563 HydrophobicContact CG1-CB 4.07Å; S559-R563 PolarHBondContact O-N 3.05Å; G560-R563 PolarHBondContact O-N 3.12Å; R563-L565 PolarHBondContact O-N 3.03Å; R563-G566 PolarHBondContact O-N 2.77Å; R563-H567 PolarHBondContact O-CD2 3.4Å; R563-H567 VanDerWaalsContact O-CD2 3.28Å; R563-H567 PolarHBondContact O-N 3.41Å
564	F	94.1	Very high	93.4	Very high	10 Å²	10	36.9 Å²	36.9	4%	0.044	18%	0.18	C	C	.	.	H	α-helix	trans	-55.5	-49.9	174.4	172	-103.2	0	0	0	111.6	G560 G566 H567 L568 I592 Y626 P627 A633 M636 M637	G560-F564 WeakPolarHBondContact O-CB 3.41Å; G560-F564 PolarHBondContact O-N 3.19Å; F564-G566 PolarHBondContact O-N 2.9Å; F564-H567 PolarHBondContact O-N 3.01Å; F564-L568 HydrophobicContact CD1-CD1 4.15Å; F564-L568 HydrophobicContact CE1-CD1 3.47Å; F564-L568 VanDerWaalsContact CE1-CD1 3.47Å; F564-L568 HydrophobicContact CE1-CG 4.4Å; F564-L568 HydrophobicContact CE2-CD1 4.25Å; F564-L568 HydrophobicContact CE2-CG 4.49Å; F564-L568 HydrophobicContact CZ-CD1 3.53Å; F564-L568 HydrophobicContact CZ-CG 4.23Å; F564-L568 PolarHBondContact O-N 2.92Å; F564-L568 VanDerWaalsContact O-N 3.12Å; F564-I592 HydrophobicContact CD2-CD1 3.6Å; F564-I592 HydrophobicContact CD2-CG1 4.03Å; F564-I592 HydrophobicContact CE2-CD1 3.74Å; F564-Y626 HydrophobicContact CD1-CE2 4.27Å; F564-P627 HydrophobicContact CD1-CG 4.5Å; F564-P627 HydrophobicContact CE1-CG 4Å; F564-P627 HydrophobicContact CZ-CG 4.13Å; F564-A633 HydrophobicContact CD2-CB 4.05Å; F564-A633 HydrophobicContact CE2-CB 3.75Å; F564-A633 HydrophobicContact CZ-CB 4.34Å; F564-M636 HydrophobicContact CE1-CE 4.43Å; F564-M636 HydrophobicContact CZ-CE 3.83Å; F564-M637 HydrophobicContact CD2-CE 3.46Å; F564-M637 VanDerWaalsContact CD2-CE 3.46Å; F564-M637 HydrophobicContact CE2-CE 3.3Å; F564-M637 HydrophobicContact CE2-CG 4.35Å; F564-M637 HydrophobicContact CG-CE 4.41Å; F564-M637 HydrophobicContact CZ-CE 4.14Å
565	L	93.6	Very high	93.4	Very high	43 Å²	43	32 Å²	32	23%	0.225	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-40.2	176.2	-69.9	177.3	0	0	0	112.4	S561 L562 R563 H567 L568 Y569	S561-L565 WeakPolarHBondContact O-CG 3.32Å; S561-L565 PolarHBondContact O-N 3.42Å; L562-L565 PolarHBondContact O-N 2.85Å; R563-L565 PolarHBondContact O-N 3.03Å; L565-H567 PolarHBondContact O-N 3.48Å; L565-L568 PolarHBondContact O-N 3.2Å; L565-Y569 HydrophobicContact CB-CD2 4.34Å; L565-Y569 HydrophobicContact CB-CE2 3.85Å; L565-Y569 HydrophobicContact CD2-CE1 4.47Å; L565-Y569 WeakPolarHBondContact O-CB 3.19Å; L565-Y569 VanDerWaalsContact O-CD2 3.3Å; L565-Y569 WeakPolarHBondContact O-CD2 3.27Å; L565-Y569 PolarHBondContact O-N 3.35Å
566	G	95.6	Very high	93.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58	-45.6	176.9	0	0	0	0	0	112.7	L562 R563 F564 A570	L562-G566 PolarHBondContact O-N 3.27Å; R563-G566 PolarHBondContact O-N 2.77Å; F564-G566 PolarHBondContact O-N 2.9Å; G566-A570 VanDerWaalsContact O-CB 3.31Å; G566-A570 WeakPolarHBondContact O-CB 3.47Å; G566-A570 PolarHBondContact O-N 2.93Å
567	H	97.1	Very high	93.9	Very high	26 Å²	26	31.8 Å²	31.8	12%	0.12	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-40.4	174.9	-76.5	-71.9	0	0	0	112.8	R563 F564 L565 A571 H586 M637	R563-H567 PolarHBondContact O-CD2 3.4Å; R563-H567 VanDerWaalsContact O-CD2 3.28Å; R563-H567 PolarHBondContact O-N 3.41Å; F564-H567 PolarHBondContact O-N 3.01Å; L565-H567 PolarHBondContact O-N 3.48Å; H567-A571 VanDerWaalsContact O-CB 3.29Å; H567-A571 WeakPolarHBondContact O-CB 3.32Å; H567-A571 PolarHBondContact O-N 3.2Å; H567-H586 HydrophobicContact CB-CB 4.33Å; H567-H586 AromaticContact CE1-ND1 3.94Å; H567-H586 AromaticContact ND1-CG 3.79Å; H567-H586 AromaticContact ND1-ND1 3.18Å; H567-H586 PolarHBondContact ND1-ND1 3.42Å; H567-H586 VanDerWaalsContact ND1-ND1 3.18Å; H567-M637 HydrophobicContact CB-CE 4.43Å
568	L	95.3	Very high	94.5	Very high	33 Å²	33	33.5 Å²	33.5	17%	0.173	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-49.6	175.5	-75.7	-178.5	0	0	0	111.9	F564 L565 A570 A571 E572 L587 M637 N640	F564-L568 HydrophobicContact CD1-CD1 4.15Å; F564-L568 HydrophobicContact CE1-CD1 3.47Å; F564-L568 VanDerWaalsContact CE1-CD1 3.47Å; F564-L568 HydrophobicContact CE1-CG 4.4Å; F564-L568 HydrophobicContact CE2-CD1 4.25Å; F564-L568 HydrophobicContact CE2-CG 4.49Å; F564-L568 HydrophobicContact CZ-CD1 3.53Å; F564-L568 HydrophobicContact CZ-CG 4.23Å; F564-L568 PolarHBondContact O-N 2.92Å; F564-L568 VanDerWaalsContact O-N 3.12Å; L565-L568 PolarHBondContact O-N 3.2Å; L568-A570 PolarHBondContact O-N 3.4Å; L568-A571 PolarHBondContact O-N 2.94Å; L568-E572 WeakPolarHBondContact O-CB 3.37Å; L568-E572 PolarHBondContact O-N 3.4Å; L568-L587 HydrophobicContact CD2-CD2 4.49Å; L568-M637 HydrophobicContact CD1-CE 4.32Å; L568-M637 HydrophobicContact CD2-CE 3.3Å; L568-M637 HydrophobicContact CD2-SD 3.7Å; L568-M637 HydrophobicContact CG-CE 3.41Å; L568-M637 VanDerWaalsContact CG-CE 3.41Å; L568-M637 HydrophobicContact CG-SD 4.45Å; L568-N640 VanDerWaalsContact CD2-ND2 3.35Å; L568-N640 WeakPolarHBondContact CD2-ND2 3.44Å
569	Y	97.2	Very high	94.9	Very high	34 Å²	34	38.7 Å²	38.7	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-40	-178.2	-61.3	-26.8	0	0	0	112.1	A530 A533 Y534 L537 L565 A573	A530-Y569 WeakPolarHBondContact O-CE2 3.32Å; A533-Y569 HydrophobicContact CB-CD2 3.74Å; A533-Y569 HydrophobicContact CB-CG 4.25Å; Y534-Y569 HydrophobicContact CD2-CE1 4.1Å; L537-Y569 HydrophobicContact CD1-CD1 3.63Å; L537-Y569 HydrophobicContact CD1-CG 3.95Å; L565-Y569 HydrophobicContact CB-CD2 4.34Å; L565-Y569 HydrophobicContact CB-CE2 3.85Å; L565-Y569 HydrophobicContact CD2-CE1 4.47Å; L565-Y569 WeakPolarHBondContact O-CB 3.19Å; L565-Y569 VanDerWaalsContact O-CD2 3.3Å; L565-Y569 WeakPolarHBondContact O-CD2 3.27Å; L565-Y569 PolarHBondContact O-N 3.35Å; Y569-A573 WeakPolarHBondContact O-CB 3.21Å; Y569-A573 PolarHBondContact O-N 3.2Å
570	A	98.1	Very high	95.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-45.2	173.7	0	0	0	0	0	111.6	L546 A549 G566 L568 A573 L574	L546-A570 HydrophobicContact CD1-CB 3.95Å; A549-A570 HydrophobicContact CB-CB 3.92Å; G566-A570 VanDerWaalsContact O-CB 3.31Å; G566-A570 WeakPolarHBondContact O-CB 3.47Å; G566-A570 PolarHBondContact O-N 2.93Å; L568-A570 PolarHBondContact O-N 3.4Å; A570-A573 PolarHBondContact O-N 3.44Å; A570-L574 WeakPolarHBondContact O-CB 3.4Å; A570-L574 WeakPolarHBondContact O-CD1 3.48Å; A570-L574 WeakPolarHBondContact O-CG 3.16Å; A570-L574 PolarHBondContact O-N 3.22Å
571	A	97.8	Very high	95.5	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-44.3	178.8	0	0	0	0	0	112.6	H567 L568 L574 I575 A583 H586 L587	H567-A571 VanDerWaalsContact O-CB 3.29Å; H567-A571 WeakPolarHBondContact O-CB 3.32Å; H567-A571 PolarHBondContact O-N 3.2Å; L568-A571 PolarHBondContact O-N 2.94Å; A571-L574 PolarHBondContact O-N 3.49Å; A571-I575 WeakPolarHBondContact O-CB 3.44Å; A571-I575 VanDerWaalsContact O-CG1 3.29Å; A571-I575 WeakPolarHBondContact O-CG1 3.18Å; A571-I575 PolarHBondContact O-N 3.26Å; A571-A583 HydrophobicContact CB-CB 4.39Å; A571-H586 HydrophobicContact CB-CB 4.17Å; A571-L587 HydrophobicContact CB-CD1 4.11Å; A571-L587 HydrophobicContact CB-CD2 3.61Å; A571-L587 HydrophobicContact CB-CG 3.6Å
572	E	95.6	Very high	95.8	Very high	105 Å²	105	44.7 Å²	44.7	49%	0.491	23%	0.226	S	C	.	.	H	α-helix	trans	-63.4	-44	177.5	-174.9	174.7	176.2	0	0	112.1	L537 L568 I575 S576	L537-E572 HydrophobicContact CD1-CB 4.38Å; L537-E572 HydrophobicContact CD1-CG 4.47Å; L537-E572 HydrophobicContact CD2-CB 4.36Å; L537-E572 HydrophobicContact CD2-CG 4.13Å; L568-E572 WeakPolarHBondContact O-CB 3.37Å; L568-E572 PolarHBondContact O-N 3.4Å; E572-I575 PolarHBondContact O-N 2.91Å; E572-S576 WeakPolarHBondContact O-CB 3.49Å; E572-S576 PolarHBondContact O-N 3.44Å; E572-S576 PolarHBondContact O-OG 3.42Å
573	A	97.3	Very high	96	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-46.5	174.9	0	0	0	0	0	111.6	L537 N542 A545 L546 Y569 A570 S576 L577	L537-A573 HydrophobicContact CD2-CB 4Å; N542-A573 HydrophobicContact CB-CB 4.45Å; N542-A573 WeakPolarHBondContact O-CB 3.44Å; A545-A573 HydrophobicContact CB-CB 4.14Å; L546-A573 HydrophobicContact CB-CB 3.92Å; Y569-A573 WeakPolarHBondContact O-CB 3.21Å; Y569-A573 PolarHBondContact O-N 3.2Å; A570-A573 PolarHBondContact O-N 3.44Å; A573-S576 PolarHBondContact O-N 3.05Å; A573-L577 WeakPolarHBondContact O-CB 3.3Å; A573-L577 VanDerWaalsContact O-CG 3.23Å; A573-L577 WeakPolarHBondContact O-CG 3.23Å; A573-L577 PolarHBondContact O-N 3.25Å
574	L	97.8	Very high	96.1	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-39.9	179.3	-74.9	165.1	0	0	0	112.5	L546 A570 A571 S576 L577 D578 R579 D582 A583	L546-L574 HydrophobicContact CD1-CD1 4.13Å; L546-L574 HydrophobicContact CD1-CD2 4.2Å; L546-L574 HydrophobicContact CD1-CG 3.85Å; L546-L574 HydrophobicContact CD2-CD2 3.56Å; L546-L574 HydrophobicContact CD2-CG 4.07Å; A570-L574 WeakPolarHBondContact O-CB 3.4Å; A570-L574 WeakPolarHBondContact O-CD1 3.48Å; A570-L574 WeakPolarHBondContact O-CG 3.16Å; A570-L574 PolarHBondContact O-N 3.22Å; A571-L574 PolarHBondContact O-N 3.49Å; L574-S576 VanDerWaalsContact C-N 3.33Å; L574-L577 CarbonylContact O-C 3.51Å; L574-L577 PolarHBondContact O-N 2.94Å; L574-D578 PolarHBondContact O-N 3.05Å; L574-R579 HydrophobicContact CB-CB 4.37Å; L574-R579 HydrophobicContact CD2-CB 3.81Å; L574-R579 WeakPolarHBondContact O-CA 3.23Å; L574-R579 PolarHBondContact O-N 3.37Å; L574-D582 HydrophobicContact CD1-CB 3.92Å; L574-D582 HydrophobicContact CD2-CB 4.01Å; L574-D582 HydrophobicContact CG-CB 4.49Å; L574-A583 HydrophobicContact CB-CB 3.78Å
575	I	96.1	Very high	96.2	Very high	48 Å²	48	44.5 Å²	44.5	25%	0.246	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-45.3	173.4	-73.1	167.6	0	0	0	110.3	A571 E572 L577 D578 A583 L587 A644 L647	A571-I575 WeakPolarHBondContact O-CB 3.44Å; A571-I575 VanDerWaalsContact O-CG1 3.29Å; A571-I575 WeakPolarHBondContact O-CG1 3.18Å; A571-I575 PolarHBondContact O-N 3.26Å; E572-I575 PolarHBondContact O-N 2.91Å; I575-L577 PolarHBondContact O-N 3.44Å; I575-D578 PolarHBondContact O-N 2.67Å; I575-A583 HydrophobicContact CD1-CB 4.31Å; I575-A583 HydrophobicContact CG1-CB 3.7Å; I575-L587 HydrophobicContact CD1-CD1 4.5Å; I575-A644 HydrophobicContact CD1-CB 4.38Å; I575-L647 HydrophobicContact CG2-CD1 3.57Å
576	S	93.8	Very high	96.4	Very high	67 Å²	67	43.9 Å²	43.9	47%	0.469	23%	0.231	S	C	.	.	H	α-helix	trans	-67.1	-21.4	178.8	-56.1	0	0	0	0	113.5	N542 E572 A573 L574	N542-S576 VanDerWaalsContact CG-CB 3.41Å; N542-S576 VanDerWaalsContact ND2-CB 3.26Å; N542-S576 WeakPolarHBondContact ND2-CB 3.26Å; E572-S576 WeakPolarHBondContact O-CB 3.49Å; E572-S576 PolarHBondContact O-N 3.44Å; E572-S576 PolarHBondContact O-OG 3.42Å; A573-S576 PolarHBondContact O-N 3.05Å; L574-S576 VanDerWaalsContact C-N 3.33Å
577	L	94.9	Very high	96.4	Very high	55 Å²	55	44 Å²	44	29%	0.288	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9.2	173.1	-66.6	168.8	0	0	0	113.3	N542 L543 L546 A573 L574 I575 R579	N542-L577 HydrophobicContact CB-CD1 4.31Å; N542-L577 HydrophobicContact CB-CD2 4Å; N542-L577 HydrophobicContact CB-CG 3.87Å; L543-L577 HydrophobicContact CD2-CD1 3.86Å; L543-L577 HydrophobicContact CD2-CD2 3.84Å; L543-L577 HydrophobicContact CG-CD2 4.04Å; L546-L577 HydrophobicContact CD2-CD1 4.14Å; A573-L577 WeakPolarHBondContact O-CB 3.3Å; A573-L577 VanDerWaalsContact O-CG 3.23Å; A573-L577 WeakPolarHBondContact O-CG 3.23Å; A573-L577 PolarHBondContact O-N 3.25Å; L574-L577 CarbonylContact O-C 3.51Å; L574-L577 PolarHBondContact O-N 2.94Å; I575-L577 PolarHBondContact O-N 3.44Å; L577-R579 PolarHBondContact O-N 3.25Å
578	D	95.3	Very high	96.3	Very high	133 Å²	133	45.4 Å²	45.4	71%	0.711	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	20.8	-176.1	-159.8	35.2	0	0	0	114.6	L574 I575 I580	L574-D578 PolarHBondContact O-N 3.05Å; I575-D578 PolarHBondContact O-N 2.67Å; D578-I580 VanDerWaalsContact C-N 3.34Å; D578-I580 PolarHBondContact O-N 2.98Å
579	R	97.2	Very high	96.1	Very high	120 Å²	120	44.7 Å²	44.7	45%	0.453	24%	0.237	S	C	.	.			trans	-96.5	53.8	176.1	-69	176.3	60.8	-167.5	-1	111.2	L574 L577 S581 D582 A583	L574-R579 HydrophobicContact CB-CB 4.37Å; L574-R579 HydrophobicContact CD2-CB 3.81Å; L574-R579 WeakPolarHBondContact O-CA 3.23Å; L574-R579 PolarHBondContact O-N 3.37Å; L577-R579 PolarHBondContact O-N 3.25Å; R579-S581 VanDerWaalsContact C-N 3.29Å; R579-S581 PolarHBondContact O-N 2.91Å; R579-D582 HydrophobicContact CB-CB 4.49Å; R579-D582 IonicContact CZ-OD2 3.89Å; R579-D582 IonicContact NE-OD2 3.49Å; R579-D582 PolarHBondContact NE-OD2 2.8Å; R579-D582 IonicContact NH2-OD2 3.12Å; R579-D582 PolarHBondContact NH2-OD2 2.81Å; R579-D582 PolarHBondContact O-N 3.03Å; R579-D582 VanDerWaalsContact O-N 3.12Å; R579-A583 PolarHBondContact O-N 2.93Å; R579-A583 VanDerWaalsContact O-N 3.15Å
580	I	96.1	Very high	95.8	Very high	21 Å²	21	50.7 Å²	50.7	11%	0.108	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-34.3	-170.3	-53.3	162.7	0	0	0	112.3	D578 D582 A583 I584 A644 L647 R648	D578-I580 VanDerWaalsContact C-N 3.34Å; D578-I580 PolarHBondContact O-N 2.98Å; I580-D582 VanDerWaalsContact C-N 3.32Å; I580-D582 PolarHBondContact O-N 2.98Å; I580-A583 WeakPolarHBondContact O-CB 3.32Å; I580-A583 PolarHBondContact O-N 2.65Å; I580-I584 WeakPolarHBondContact O-CG1 3.32Å; I580-I584 PolarHBondContact O-N 3.23Å; I580-I584 VanDerWaalsContact O-N 3.09Å; I580-A644 HydrophobicContact CG2-CB 4.04Å; I580-L647 HydrophobicContact CD1-CB 3.79Å; I580-R648 HydrophobicContact CB-CG 4.27Å; I580-R648 HydrophobicContact CD1-CG 4.38Å; I580-R648 HydrophobicContact CG2-CG 3.83Å
581	S	96.1	Very high	95.4	Very high	68 Å²	68	53.2 Å²	53.2	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-40.5	176.7	-65.3	0	0	0	0	112.6	R579 R648	R579-S581 VanDerWaalsContact C-N 3.29Å; R579-S581 PolarHBondContact O-N 2.91Å; S581-R648 PolarHBondContact OG-NH1 3.18Å
582	D	96.3	Very high	95	Very high	62 Å²	62	53.5 Å²	53.5	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-71.9	-38.9	178	-59.6	-20.8	0	0	0	109.9	L574 R579 I580 I584 T585	L574-D582 HydrophobicContact CD1-CB 3.92Å; L574-D582 HydrophobicContact CD2-CB 4.01Å; L574-D582 HydrophobicContact CG-CB 4.49Å; R579-D582 HydrophobicContact CB-CB 4.49Å; R579-D582 IonicContact CZ-OD2 3.89Å; R579-D582 IonicContact NE-OD2 3.49Å; R579-D582 PolarHBondContact NE-OD2 2.8Å; R579-D582 IonicContact NH2-OD2 3.12Å; R579-D582 PolarHBondContact NH2-OD2 2.81Å; R579-D582 PolarHBondContact O-N 3.03Å; R579-D582 VanDerWaalsContact O-N 3.12Å; I580-D582 VanDerWaalsContact C-N 3.32Å; I580-D582 PolarHBondContact O-N 2.98Å; D582-I584 VanDerWaalsContact C-N 3.27Å; D582-I584 PolarHBondContact O-N 3.31Å; D582-T585 WeakPolarHBondContact O-CB 3.43Å; D582-T585 PolarHBondContact O-N 3.2Å; D582-T585 PolarHBondContact O-OG1 2.79Å
583	A	97.1	Very high	94.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-38.2	176.9	0	0	0	0	0	112.7	A571 L574 I575 R579 I580 T585 H586 L587	A571-A583 HydrophobicContact CB-CB 4.39Å; L574-A583 HydrophobicContact CB-CB 3.78Å; I575-A583 HydrophobicContact CD1-CB 4.31Å; I575-A583 HydrophobicContact CG1-CB 3.7Å; R579-A583 PolarHBondContact O-N 2.93Å; R579-A583 VanDerWaalsContact O-N 3.15Å; I580-A583 WeakPolarHBondContact O-CB 3.32Å; I580-A583 PolarHBondContact O-N 2.65Å; A583-T585 PolarHBondContact O-N 3.32Å; A583-H586 PolarHBondContact O-N 3.07Å; A583-H586 VanDerWaalsContact O-N 3.15Å; A583-L587 WeakPolarHBondContact O-CG 3.48Å; A583-L587 PolarHBondContact O-N 3.22Å
584	I	96.5	Very high	94	Very high	27 Å²	27	55.7 Å²	55.7	14%	0.138	30%	0.303	C	S	.	.	H	α-helix	trans	-57.6	-35.4	176.4	-73.8	166.1	0	0	0	111.7	I580 D582 H586 L587 N588 L641 A644 Y645	I580-I584 WeakPolarHBondContact O-CG1 3.32Å; I580-I584 PolarHBondContact O-N 3.23Å; I580-I584 VanDerWaalsContact O-N 3.09Å; D582-I584 VanDerWaalsContact C-N 3.27Å; D582-I584 PolarHBondContact O-N 3.31Å; I584-H586 PolarHBondContact O-N 3.3Å; I584-L587 PolarHBondContact O-N 3.24Å; I584-N588 PolarHBondContact O-N 3.29Å; I584-L641 HydrophobicContact CB-CD1 4.18Å; I584-L641 HydrophobicContact CG1-CD1 3.91Å; I584-L641 HydrophobicContact CG2-CD1 3.83Å; I584-A644 HydrophobicContact CG1-CB 4.03Å; I584-Y645 HydrophobicContact CD1-CD1 4.11Å; I584-Y645 HydrophobicContact CD1-CE1 3.81Å
585	T	96.3	Very high	93.2	Very high	87 Å²	87	56.3 Å²	56.3	53%	0.534	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-37.5	179.4	71.8	0	0	0	0	111.9	D582 A583 N591	D582-T585 WeakPolarHBondContact O-CB 3.43Å; D582-T585 PolarHBondContact O-N 3.2Å; D582-T585 PolarHBondContact O-OG1 2.79Å; A583-T585 PolarHBondContact O-N 3.32Å; T585-N591 PolarHBondContact O-ND2 3.47Å
586	H	96.6	Very high	92.6	Very high	29 Å²	29	56.2 Å²	56.2	13%	0.134	31%	0.311	C	S	.	.	H	α-helix	trans	-72.3	-32.7	175.5	-72.2	-94.4	0	0	0	112.3	D550 H567 A571 A583 I584 N588 N591	D550-H586 IonicContact OD1-CE1 2.92Å; H567-H586 HydrophobicContact CB-CB 4.33Å; H567-H586 AromaticContact CE1-ND1 3.94Å; H567-H586 AromaticContact ND1-CG 3.79Å; H567-H586 AromaticContact ND1-ND1 3.18Å; H567-H586 PolarHBondContact ND1-ND1 3.42Å; H567-H586 VanDerWaalsContact ND1-ND1 3.18Å; A571-H586 HydrophobicContact CB-CB 4.17Å; A583-H586 PolarHBondContact O-N 3.07Å; A583-H586 VanDerWaalsContact O-N 3.15Å; I584-H586 PolarHBondContact O-N 3.3Å; H586-N588 PolarHBondContact O-N 3.4Å; H586-N591 PolarHBondContact O-ND2 2.91Å
587	L	96.3	Very high	91.6	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.016	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	5	178.8	-65.2	172.4	0	0	0	114.4	L568 A571 I575 A583 I584 P589 M637 N640 L641 A644	L568-L587 HydrophobicContact CD2-CD2 4.49Å; A571-L587 HydrophobicContact CB-CD1 4.11Å; A571-L587 HydrophobicContact CB-CD2 3.61Å; A571-L587 HydrophobicContact CB-CG 3.6Å; I575-L587 HydrophobicContact CD1-CD1 4.5Å; A583-L587 WeakPolarHBondContact O-CG 3.48Å; A583-L587 PolarHBondContact O-N 3.22Å; I584-L587 PolarHBondContact O-N 3.24Å; L587-P589 WeakPolarHBondContact O-CD 3.3Å; L587-M637 HydrophobicContact CD2-SD 3.81Å; L587-N640 HydrophobicContact CD1-CB 4.31Å; L587-N640 HydrophobicContact CD2-CB 3.68Å; L587-L641 HydrophobicContact CB-CB 4.09Å; L587-L641 HydrophobicContact CB-CD1 4.13Å; L587-A644 HydrophobicContact CD1-CB 4.02Å
588	N	94.3	Very high	89.9	Confident	55 Å²	55	56.2 Å²	56.2	29%	0.294	31%	0.313	S	S	.	.			trans	-64.1	121.7	173.9	-176.1	-3.3	0	0	0	110.2	I584 H586 E590 N591	I584-N588 PolarHBondContact O-N 3.29Å; H586-N588 PolarHBondContact O-N 3.4Å; N588-E590 PolarHBondContact ND2-OE2 3.42Å; N588-E590 VanDerWaalsContact ND2-OE2 3.13Å; N588-E590 PolarHBondContact O-N 3.21Å; N588-E590 VanDerWaalsContact O-N 3.11Å; N588-E590 PolarHBondContact OD1-N 3.4Å; N588-E590 VanDerWaalsContact OD1-N 3.07Å; N588-N591 VanDerWaalsContact O-CB 3.3Å; N588-N591 WeakPolarHBondContact O-CB 3.45Å; N588-N591 PolarHBondContact O-N 2.96Å; N588-N591 PolarHBondContact O-ND2 3.42Å
589	P	91.9	Very high	87.8	Confident	19 Å²	19	53.5 Å²	53.5	12%	0.123	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-57.6	-24.8	178	-25.3	35.2	0	0	0	114.5	L587 N591 I592 Q634 M637 L638	L587-P589 WeakPolarHBondContact O-CD 3.3Å; P589-N591 PolarHBondContact O-N 3.15Å; P589-I592 PolarHBondContact O-N 3.48Å; P589-I592 VanDerWaalsContact O-N 3.14Å; P589-Q634 HydrophobicContact CB-CB 4.09Å; P589-Q634 HydrophobicContact CB-CG 4.05Å; P589-Q634 PolarHBondContact O-NE2 3.24Å; P589-M637 HydrophobicContact CG-CB 4.42Å; P589-L638 HydrophobicContact CG-CD1 4.5Å; P589-L638 HydrophobicContact CG-CD2 3.61Å; P589-L638 HydrophobicContact CG-CG 3.68Å
590	E	90.8	Very high	84.9	Confident	159 Å²	159	56 Å²	56	74%	0.743	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-65.6	-21.1	177.1	-63.7	176.6	159	0	0	113	N588 I592	N588-E590 PolarHBondContact ND2-OE2 3.42Å; N588-E590 VanDerWaalsContact ND2-OE2 3.13Å; N588-E590 PolarHBondContact O-N 3.21Å; N588-E590 VanDerWaalsContact O-N 3.11Å; N588-E590 PolarHBondContact OD1-N 3.4Å; N588-E590 VanDerWaalsContact OD1-N 3.07Å; E590-I592 PolarHBondContact O-N 2.99Å
591	N	89.1	Confident	81.8	Confident	53 Å²	53	59.3 Å²	59.3	28%	0.283	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-66.6	-14.4	174.7	-64.4	-23.7	0	0	0	112.4	T585 H586 N588 P589	T585-N591 PolarHBondContact O-ND2 3.47Å; H586-N591 PolarHBondContact O-ND2 2.91Å; N588-N591 VanDerWaalsContact O-CB 3.3Å; N588-N591 WeakPolarHBondContact O-CB 3.45Å; N588-N591 PolarHBondContact O-N 2.96Å; N588-N591 PolarHBondContact O-ND2 3.42Å; P589-N591 PolarHBondContact O-N 3.15Å
592	I	89.3	Confident	78.5	Confident	8 Å²	8	62 Å²	62	4%	0.041	36%	0.362	C	S	.	.			trans	-99.3	101.5	179.9	-53.2	172.3	0	0	0	109.9	F564 P589 E590 V595 V630 A633 Q634 M637	F564-I592 HydrophobicContact CD2-CD1 3.6Å; F564-I592 HydrophobicContact CD2-CG1 4.03Å; F564-I592 HydrophobicContact CE2-CD1 3.74Å; P589-I592 PolarHBondContact O-N 3.48Å; P589-I592 VanDerWaalsContact O-N 3.14Å; E590-I592 PolarHBondContact O-N 2.99Å; I592-V595 HydrophobicContact CG2-CG1 3.96Å; I592-V630 HydrophobicContact CG2-CG1 4.1Å; I592-A633 VanDerWaalsContact CD1-C 3.49Å; I592-A633 HydrophobicContact CD1-CB 3.89Å; I592-A633 WeakPolarHBondContact CD1-O 3.24Å; I592-A633 HydrophobicContact CG2-CB 4.01Å; I592-Q634 HydrophobicContact CB-CG 4.15Å; I592-Q634 HydrophobicContact CD1-CG 4.23Å; I592-Q634 PolarHBondContact O-NE2 2.98Å; I592-M637 HydrophobicContact CD1-CB 4.26Å; I592-M637 HydrophobicContact CD1-CE 4.1Å; I592-M637 HydrophobicContact CD1-CG 3.26Å; I592-M637 HydrophobicContact CG1-CG 4.23Å
593	S	86.1	Confident	75.5	Confident	91 Å²	91	65.5 Å²	65.5	64%	0.636	38%	0.376	S	S	*	.	S	Bend	trans	-102.4	-19.8	172.4	65.1	0	0	0	0	113.5
594	D	85.4	Confident	72.3	Confident	60 Å²	60	74.5 Å²	74.5	32%	0.321	42%	0.419	S	S	.	.			trans	-153.6	145	-174.7	179.4	27.7	0	0	0	110.4	G560 S596	G560-D594 CarbonylContact C-O 3.57Å; G560-D594 WeakPolarHBondContact CA-O 3.41Å; G560-D594 PolarHBondContact N-OD2 3.31Å; D594-S596 WeakPolarHBondContact OD1-CB 3.22Å; D594-S596 PolarHBondContact OD1-N 3.37Å; D594-S596 PolarHBondContact OD1-OG 3.17Å; D594-S596 PolarHBondContact OD2-OG 3.08Å
595	V	83	Confident	69.1	Low	17 Å²	17	80.1 Å²	80.1	10%	0.103	45%	0.449	C	S	.	.			trans	-124.2	8.8	175.9	-64.4	0	0	0	0	112.2	I592 Y626 V630 A633	I592-V595 HydrophobicContact CG2-CG1 3.96Å; V595-Y626 HydrophobicContact CB-CE1 4.33Å; V595-Y626 VanDerWaalsContact O-CE1 3.27Å; V595-Y626 WeakPolarHBondContact O-CE1 3.41Å; V595-Y626 PolarHBondContact O-OH 3.25Å; V595-V630 HydrophobicContact CG1-CG2 4.28Å; V595-V630 HydrophobicContact CG2-CG2 4.1Å; V595-A633 HydrophobicContact CG1-CB 3.46Å; V595-A633 VanDerWaalsContact CG1-CB 3.46Å
596	S	82.8	Confident	66.2	Low	47 Å²	47	82.4 Å²	82.4	33%	0.329	45%	0.454	S	S	.	.			trans	-61.7	136.2	-177.1	75.1	0	0	0	0	112.1	S561 D594 G598	S561-S596 WeakPolarHBondContact CB-O 3.48Å; S561-S596 PolarHBondContact N-O 3.45Å; S561-S596 PolarHBondContact OG-O 3.36Å; D594-S596 WeakPolarHBondContact OD1-CB 3.22Å; D594-S596 PolarHBondContact OD1-N 3.37Å; D594-S596 PolarHBondContact OD1-OG 3.17Å; D594-S596 PolarHBondContact OD2-OG 3.08Å; S596-G598 VanDerWaalsContact C-N 3.28Å; S596-G598 PolarHBondContact O-N 3.41Å; S596-G598 PolarHBondContact OG-O 3.02Å
597	L	73.4	Confident	63.1	Low	90 Å²	90	83.6 Å²	83.6	47%	0.471	47%	0.474	S	S	.	.	S	Bend	trans	-81	-3.2	-178.8	-71.4	167.9	0	0	0	113.3	Y626	L597-Y626 HydrophobicContact CD2-CD1 4.24Å; L597-Y626 HydrophobicContact CD2-CE1 4.03Å; L597-Y626 HydrophobicContact CD2-CE2 4.35Å; L597-Y626 HydrophobicContact CD2-CG 4.49Å; L597-Y626 HydrophobicContact CG-CD1 4.47Å; L597-Y626 HydrophobicContact CG-CE1 4.21Å
598	G	58.3	Low	60	Low	32 Å²	32	91.7 Å²	91.7	33%	0.33	51%	0.511	S	S	.	.	S	Bend	trans	-134.9	139.5	-176.5	0	0	0	0	0	111.8	S596	S596-G598 VanDerWaalsContact C-N 3.28Å; S596-G598 PolarHBondContact O-N 3.41Å; S596-G598 PolarHBondContact OG-O 3.02Å
599	M	51.8	Low	56.9	Low	75 Å²	75	96.9 Å²	96.9	37%	0.369	53%	0.534	S	S	.	.			trans	-72.2	131.9	167.1	-68.1	-66.8	-79.7	0	0	108.9	K557 S559 S601	K557-M599 HydrophobicContact CB-CE 3.98Å; S559-M599 WeakPolarHBondContact CA-SD 3.49Å; S559-M599 VanDerWaalsContact CB-SD 3.59Å; S559-M599 PolarHBondContact N-SD 3.35Å; S559-M599 VanDerWaalsContact N-SD 3.4Å; M599-S601 PolarHBondContact O-N 2.88Å
600	L	35.3	Very low	54.2	Low	172 Å²	172	106.1 Å²	106.1	90%	0.901	57%	0.572	S	S	*	*			trans	-60.3	101.5	169.2	-68.4	168	0	0	0	108	S602	L600-S602 PolarHBondContact O-N 3.17Å
601	S	32.2	Very low	51.5	Low	91 Å²	91	101.6 Å²	101.6	64%	0.636	57%	0.568	S	S	*	*			trans	-61.9	126.8	160.9	31.7	0	0	0	0	107.1	M599 E603	M599-S601 PolarHBondContact O-N 2.88Å; S601-E603 PolarHBondContact O-N 3.46Å
602	S	26.6	Very low	48.7	Very low	124 Å²	124	107.1 Å²	107.1	87%	0.867	60%	0.598	S	S	*	*			trans	-60.5	85.4	174.2	-53.9	0	0	0	0	109.8	L600 Q604	L600-S602 PolarHBondContact O-N 3.17Å; S602-Q604 PolarHBondContact O-N 3.49Å
603	E	33.3	Very low	45.9	Very low	136 Å²	136	115 Å²	115	64%	0.636	64%	0.635	S	S	*	*			trans	-80.3	53.2	174.3	-66.8	-148.1	134.7	0	0	111.1	S601 Q606	S601-E603 PolarHBondContact O-N 3.46Å; E603-Q606 PolarHBondContact OE1-NE2 2.77Å; E603-Q606 VanDerWaalsContact OE1-NE2 3.08Å
604	Q	29.8	Very low	43.2	Very low	189 Å²	189	116.6 Å²	116.6	88%	0.883	64%	0.642	S	S	*	*			trans	-104.4	63.7	167.4	-78.3	-174.7	-6.8	0	0	109.9	S602	S602-Q604 PolarHBondContact O-N 3.49Å
605	D	27.8	Very low	40.7	Very low	146 Å²	146	120.9 Å²	120.9	78%	0.781	66%	0.664	S	S	*	*			trans	-158.4	12.1	152.1	-148.3	10.4	0	0	0	114.3	G607	D605-G607 PolarHBondContact O-N 3.29Å
606	Q	37.1	Very low	38	Very low	135 Å²	135	128.8 Å²	128.8	63%	0.631	70%	0.699	S	S	*	*			trans	-80.7	92.1	172	-64.8	-156.8	41.7	0	0	109.1	E603 H608	E603-Q606 PolarHBondContact OE1-NE2 2.77Å; E603-Q606 VanDerWaalsContact OE1-NE2 3.08Å; Q606-H608 VanDerWaalsContact C-N 3.34Å; Q606-H608 PolarHBondContact O-N 3.1Å
607	G	31.4	Very low	35.4	Very low	54 Å²	54	132 Å²	132	56%	0.557	72%	0.719	S	S	*	*			trans	-57	98.5	162.9	0	0	0	0	0	109.7	D605 E609	D605-G607 PolarHBondContact O-N 3.29Å; G607-E609 PolarHBondContact O-N 2.99Å
608	H	30.3	Very low	33.5	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.796	73%	0.725	S	S	*	*			trans	-64.1	98.8	169.7	-100.5	-82.4	0	0	0	109	Q606 K610	Q606-H608 VanDerWaalsContact C-N 3.34Å; Q606-H608 PolarHBondContact O-N 3.1Å; H608-K610 PolarHBondContact O-N 3.49Å
609	E	30.1	Very low	32.2	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	75%	0.745	S	S	*	*			trans	-71.5	119	152.1	-78.9	-171.5	154.2	0	0	107.1	G607 G611	G607-E609 PolarHBondContact O-N 2.99Å; E609-G611 PolarHBondContact O-N 3.3Å
610	K	34.9	Very low	31.7	Very low	212 Å²	212	138.8 Å²	138.8	92%	0.922	76%	0.762	S	S	*	*	S	Bend	trans	-59.4	127.4	176.9	-74.1	180	173.7	179.6	0	110.1	H608	H608-K610 PolarHBondContact O-N 3.49Å
611	G	34.7	Very low	32	Very low	65 Å²	65	139.9 Å²	139.9	67%	0.67	76%	0.759	S	S	*	*			trans	125	78.6	167.8	0	0	0	0	0	113.3	E609	E609-G611 PolarHBondContact O-N 3.3Å
612	D	30.3	Very low	32.5	Very low	168 Å²	168	139.2 Å²	139.2	90%	0.898	75%	0.751	S	S	*	*	S	Bend	trans	176.8	153	131.9	-91.1	-19.3	0	0	0	109.6
613	E	30.3	Very low	33.9	Very low	175 Å²	175	136.5 Å²	136.5	82%	0.818	73%	0.73	S	S	*	*			trans	-34.7	153	-164.9	-65.9	-167.8	160.5	0	0	119.5	I615	E613-I615 PolarHBondContact O-N 3.45Å
614	P	28.5	Very low	34.8	Very low	123 Å²	123	137.2 Å²	137.2	80%	0.799	74%	0.738	S	S	*	*			trans	-56.6	125.4	-178.9	22.4	-32.4	0	0	0	111.4	E616	P614-E616 PolarHBondContact O-N 3.42Å
615	I	33.2	Very low	36.3	Very low	151 Å²	151	136.1 Å²	136.1	77%	0.774	73%	0.73	S	S	*	*			trans	-52.1	107.5	167.7	-63.3	164.6	0	0	0	107.3	E613 P617	E613-I615 PolarHBondContact O-N 3.45Å; I615-P617 VanDerWaalsContact O-CD 3.23Å; I615-P617 WeakPolarHBondContact O-CD 3.4Å; I615-P617 VanDerWaalsContact O-N 3.16Å
616	E	25.2	Very low	38.7	Very low	182 Å²	182	130.9 Å²	130.9	85%	0.85	70%	0.7	S	S	*	*			trans	-60.9	116.8	164.3	-82.6	-166.6	158.5	0	0	106.9	P614 S618	P614-E616 PolarHBondContact O-N 3.42Å; E616-S618 PolarHBondContact O-N 2.99Å
617	P	28.8	Very low	40.9	Very low	114 Å²	114	124.9 Å²	124.9	74%	0.74	67%	0.673	S	S	*	*			trans	-62.5	116.7	173.1	25.4	-29.9	0	0	0	106.6	I615 A619	I615-P617 VanDerWaalsContact O-CD 3.23Å; I615-P617 WeakPolarHBondContact O-CD 3.4Å; I615-P617 VanDerWaalsContact O-N 3.16Å; P617-A619 PolarHBondContact O-N 3.04Å
618	S	33.2	Very low	43.2	Very low	86 Å²	86	127 Å²	127	60%	0.601	68%	0.679	S	S	*	*			trans	-37.4	116.7	168.1	171.7	0	0	0	0	108	E616 K620	E616-S618 PolarHBondContact O-N 2.99Å; S618-K620 PolarHBondContact O-N 3.45Å
619	A	31.3	Very low	45.9	Very low	90 Å²	90	121.1 Å²	121.1	74%	0.744	66%	0.657	S	S	*	*			trans	-59.5	86.8	-174.7	0	0	0	0	0	109.4	P617 K621	P617-A619 PolarHBondContact O-N 3.04Å; A619-K621 PolarHBondContact O-N 3.41Å
620	K	40.4	Very low	48.8	Very low	165 Å²	165	115.5 Å²	115.5	72%	0.717	63%	0.634	S	S	*	*			trans	-65.1	89.9	164.5	-69.8	179.7	-177.9	177.8	0	104.7	S618 T622	S618-K620 PolarHBondContact O-N 3.45Å; K620-T622 VanDerWaalsContact C-N 3.31Å; K620-T622 PolarHBondContact O-N 3.31Å
621	K	41.6	Very low	51.5	Low	195 Å²	195	107.3 Å²	107.3	85%	0.848	61%	0.606	S	S	*	*			trans	-57.8	103.6	166	-72.1	-174.8	-178.7	-177.2	0	105.7	A619	A619-K621 PolarHBondContact O-N 3.41Å
622	T	44.4	Very low	54	Low	76 Å²	76	104.6 Å²	104.6	47%	0.466	58%	0.577	S	S	.	*			trans	-52.1	131.5	171.7	-43.7	0	0	0	0	106.9	K620 L624 Y626	K620-T622 VanDerWaalsContact C-N 3.31Å; K620-T622 PolarHBondContact O-N 3.31Å; T622-L624 PolarHBondContact O-N 3.24Å; T622-Y626 HydrophobicContact CG2-CD1 4.42Å
623	P	55.7	Low	56.9	Low	67 Å²	67	96.6 Å²	96.6	44%	0.435	53%	0.534	S	S	.	.			trans	-51.9	133.7	177.1	-21.2	29.4	0	0	0	108.9	F625 Y626	P623-F625 PolarHBondContact O-N 3.1Å; P623-Y626 PolarHBondContact O-N 2.95Å
624	L	51.7	Low	59.8	Low	152 Å²	152	90.5 Å²	90.5	80%	0.796	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-15.6	-175.7	-84.1	152.7	0	0	0	114.3	T622	T622-L624 PolarHBondContact O-N 3.24Å
625	F	61.1	Low	62.9	Low	165 Å²	165	84.7 Å²	84.7	72%	0.724	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	9.7	-175.3	-61.3	-81	0	0	0	114.3	P623	P623-F625 PolarHBondContact O-N 3.1Å
626	Y	78.9	Confident	65.6	Low	36 Å²	36	79.8 Å²	79.8	14%	0.141	44%	0.443	C	S	.	.	S	Bend	trans	-97.7	140.9	175.2	-176.4	-91	0	0	0	109.9	S561 F564 V595 L597 T622 P623 S628	S561-Y626 WeakPolarHBondContact CA-OH 3.31Å; S561-Y626 WeakPolarHBondContact CB-OH 3.44Å; F564-Y626 HydrophobicContact CD1-CE2 4.27Å; V595-Y626 HydrophobicContact CB-CE1 4.33Å; V595-Y626 VanDerWaalsContact O-CE1 3.27Å; V595-Y626 WeakPolarHBondContact O-CE1 3.41Å; V595-Y626 PolarHBondContact O-OH 3.25Å; L597-Y626 HydrophobicContact CD2-CD1 4.24Å; L597-Y626 HydrophobicContact CD2-CE1 4.03Å; L597-Y626 HydrophobicContact CD2-CE2 4.35Å; L597-Y626 HydrophobicContact CD2-CG 4.49Å; L597-Y626 HydrophobicContact CG-CD1 4.47Å; L597-Y626 HydrophobicContact CG-CE1 4.21Å; T622-Y626 HydrophobicContact CG2-CD1 4.42Å; P623-Y626 PolarHBondContact O-N 2.95Å; Y626-S628 PolarHBondContact O-N 3.07Å
627	P	82.1	Confident	68.9	Low	10 Å²	10	71.2 Å²	71.2	7%	0.065	40%	0.402	C	S	.	.			trans	-55.9	126.2	-178.6	16.3	-27.1	0	0	0	111.6	F564 S629 A632 A633 M636	F564-P627 HydrophobicContact CD1-CG 4.5Å; F564-P627 HydrophobicContact CE1-CG 4Å; F564-P627 HydrophobicContact CZ-CG 4.13Å; P627-S629 VanDerWaalsContact C-N 3.28Å; P627-S629 PolarHBondContact O-N 3.45Å; P627-A632 HydrophobicContact CB-CB 4.11Å; P627-A633 HydrophobicContact CB-CB 3.72Å; P627-A633 HydrophobicContact CG-CB 3.77Å; P627-M636 HydrophobicContact CB-CE 3.41Å; P627-M636 VanDerWaalsContact CB-CE 3.41Å; P627-M636 HydrophobicContact CG-CE 3.38Å
628	S	80.6	Confident	72	Confident	98 Å²	98	66 Å²	66	69%	0.685	37%	0.368	S	S	*	.	S	Bend	trans	-77.1	-14.8	177.9	57.3	0	0	0	0	113.3	Y626	Y626-S628 PolarHBondContact O-N 3.07Å
629	S	87.7	Confident	74.9	Confident	48 Å²	48	62.2 Å²	62.2	34%	0.336	34%	0.341	S	S	.	.	S	Bend	trans	-148.9	161.8	-179.2	69.3	0	0	0	0	111.9	P627 A631 A632 A633	P627-S629 VanDerWaalsContact C-N 3.28Å; P627-S629 PolarHBondContact O-N 3.45Å; S629-A631 VanDerWaalsContact C-N 3.25Å; S629-A631 PolarHBondContact O-N 3.18Å; S629-A632 PolarHBondContact O-N 2.92Å; S629-A632 WeakPolarHBondContact OG-CB 3.48Å; S629-A632 PolarHBondContact OG-N 3.34Å; S629-A632 VanDerWaalsContact OG-N 3.1Å; S629-A633 PolarHBondContact O-N 3.03Å
630	V	90.4	Very high	77.9	Confident	48 Å²	48	61.1 Å²	61.1	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-58.3	-40	172.4	175.5	0	0	0	0	110.8	I592 V595 A632 A633 Q634	I592-V630 HydrophobicContact CG2-CG1 4.1Å; V595-V630 HydrophobicContact CG1-CG2 4.28Å; V595-V630 HydrophobicContact CG2-CG2 4.1Å; V630-A632 PolarHBondContact O-N 2.82Å; V630-A633 PolarHBondContact O-N 3.49Å; V630-Q634 HydrophobicContact CG1-CG 4.21Å; V630-Q634 WeakPolarHBondContact O-CB 3.42Å; V630-Q634 VanDerWaalsContact O-CG 3.32Å; V630-Q634 WeakPolarHBondContact O-CG 3.42Å; V630-Q634 PolarHBondContact O-N 3.26Å
631	A	90.4	Very high	80.5	Confident	39 Å²	39	53.9 Å²	53.9	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-42.2	177	0	0	0	0	0	112.3	S629 Q634 A635 M664	S629-A631 VanDerWaalsContact C-N 3.25Å; S629-A631 PolarHBondContact O-N 3.18Å; A631-Q634 PolarHBondContact O-N 3.1Å; A631-A635 WeakPolarHBondContact O-CB 3.38Å; A631-A635 PolarHBondContact O-N 2.88Å; A631-M664 HydrophobicContact CB-CE 4.36Å
632	A	89	Confident	83	Confident	8 Å²	8	44.6 Å²	44.6	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-39.1	175.4	0	0	0	0	0	112	P627 S629 V630 A635 M636	P627-A632 HydrophobicContact CB-CB 4.11Å; S629-A632 PolarHBondContact O-N 2.92Å; S629-A632 WeakPolarHBondContact OG-CB 3.48Å; S629-A632 PolarHBondContact OG-N 3.34Å; S629-A632 VanDerWaalsContact OG-N 3.1Å; V630-A632 PolarHBondContact O-N 2.82Å; A632-A635 PolarHBondContact O-N 2.84Å; A632-M636 PolarHBondContact O-N 3.07Å
633	A	89.9	Confident	85.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-43	175.6	0	0	0	0	0	112.5	F564 I592 V595 P627 S629 V630 A635 M636 M637	F564-A633 HydrophobicContact CD2-CB 4.05Å; F564-A633 HydrophobicContact CE2-CB 3.75Å; F564-A633 HydrophobicContact CZ-CB 4.34Å; I592-A633 VanDerWaalsContact CD1-C 3.49Å; I592-A633 HydrophobicContact CD1-CB 3.89Å; I592-A633 WeakPolarHBondContact CD1-O 3.24Å; I592-A633 HydrophobicContact CG2-CB 4.01Å; V595-A633 HydrophobicContact CG1-CB 3.46Å; V595-A633 VanDerWaalsContact CG1-CB 3.46Å; P627-A633 HydrophobicContact CB-CB 3.72Å; P627-A633 HydrophobicContact CG-CB 3.77Å; S629-A633 PolarHBondContact O-N 3.03Å; V630-A633 PolarHBondContact O-N 3.49Å; A633-A635 VanDerWaalsContact C-N 3.35Å; A633-M636 PolarHBondContact O-N 3.31Å; A633-M637 PolarHBondContact O-N 3.18Å
634	Q	92.7	Very high	87.3	Confident	48 Å²	48	39.9 Å²	39.9	22%	0.224	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-39.8	174.9	-74.5	178.1	-20.4	0	0	112.1	P589 I592 V630 A631 M637 L638 M664	P589-Q634 HydrophobicContact CB-CB 4.09Å; P589-Q634 HydrophobicContact CB-CG 4.05Å; P589-Q634 PolarHBondContact O-NE2 3.24Å; I592-Q634 HydrophobicContact CB-CG 4.15Å; I592-Q634 HydrophobicContact CD1-CG 4.23Å; I592-Q634 PolarHBondContact O-NE2 2.98Å; V630-Q634 HydrophobicContact CG1-CG 4.21Å; V630-Q634 WeakPolarHBondContact O-CB 3.42Å; V630-Q634 VanDerWaalsContact O-CG 3.32Å; V630-Q634 WeakPolarHBondContact O-CG 3.42Å; V630-Q634 PolarHBondContact O-N 3.26Å; A631-Q634 PolarHBondContact O-N 3.1Å; Q634-M637 WeakPolarHBondContact O-CB 3.5Å; Q634-M637 PolarHBondContact O-N 3.23Å; Q634-L638 WeakPolarHBondContact O-CG 3.47Å; Q634-L638 PolarHBondContact O-N 2.99Å; Q634-M664 HydrophobicContact CB-CE 3.65Å
635	A	91.8	Very high	89.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-39.1	174.7	0	0	0	0	0	112.4	A631 A632 A633 L638 F639 A661 M664 M665	A631-A635 WeakPolarHBondContact O-CB 3.38Å; A631-A635 PolarHBondContact O-N 2.88Å; A632-A635 PolarHBondContact O-N 2.84Å; A633-A635 VanDerWaalsContact C-N 3.35Å; A635-L638 WeakPolarHBondContact O-CB 3.37Å; A635-L638 PolarHBondContact O-N 3.03Å; A635-F639 VanDerWaalsContact O-CD2 3.24Å; A635-F639 WeakPolarHBondContact O-CD2 3.38Å; A635-F639 PolarHBondContact O-N 3.2Å; A635-A661 HydrophobicContact CB-CB 4.27Å; A635-M664 HydrophobicContact CB-CB 4.03Å; A635-M665 HydrophobicContact CB-CG 3.4Å; A635-M665 HydrophobicContact CB-SD 3.38Å; A635-M665 WeakPolarHBondContact CB-SD 3.37Å
636	M	90.9	Very high	91	Very high	49 Å²	49	27 Å²	27	24%	0.241	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-40.4	172.1	-74.1	-168.5	-73.1	0	0	112.6	F564 P627 A632 A633 L638 F639 N640	F564-M636 HydrophobicContact CE1-CE 4.43Å; F564-M636 HydrophobicContact CZ-CE 3.83Å; P627-M636 HydrophobicContact CB-CE 3.41Å; P627-M636 VanDerWaalsContact CB-CE 3.41Å; P627-M636 HydrophobicContact CG-CE 3.38Å; A632-M636 PolarHBondContact O-N 3.07Å; A633-M636 PolarHBondContact O-N 3.31Å; M636-L638 VanDerWaalsContact C-N 3.31Å; M636-L638 PolarHBondContact O-N 3.12Å; M636-F639 PolarHBondContact O-N 3.21Å; M636-N640 PolarHBondContact O-N 3.03Å; M636-N640 VanDerWaalsContact O-N 3.1Å
637	M	93.6	Very high	91.7	Very high	1 Å²	1	30 Å²	30	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-42.3	172.6	-73.3	-62.7	164.6	0	0	112	F564 H567 L568 L587 P589 I592 A633 Q634 F639 N640 L641	F564-M637 HydrophobicContact CD2-CE 3.46Å; F564-M637 VanDerWaalsContact CD2-CE 3.46Å; F564-M637 HydrophobicContact CE2-CE 3.3Å; F564-M637 HydrophobicContact CE2-CG 4.35Å; F564-M637 HydrophobicContact CG-CE 4.41Å; F564-M637 HydrophobicContact CZ-CE 4.14Å; H567-M637 HydrophobicContact CB-CE 4.43Å; L568-M637 HydrophobicContact CD1-CE 4.32Å; L568-M637 HydrophobicContact CD2-CE 3.3Å; L568-M637 HydrophobicContact CD2-SD 3.7Å; L568-M637 HydrophobicContact CG-CE 3.41Å; L568-M637 VanDerWaalsContact CG-CE 3.41Å; L568-M637 HydrophobicContact CG-SD 4.45Å; L587-M637 HydrophobicContact CD2-SD 3.81Å; P589-M637 HydrophobicContact CG-CB 4.42Å; I592-M637 HydrophobicContact CD1-CB 4.26Å; I592-M637 HydrophobicContact CD1-CE 4.1Å; I592-M637 HydrophobicContact CD1-CG 3.26Å; I592-M637 HydrophobicContact CG1-CG 4.23Å; A633-M637 PolarHBondContact O-N 3.18Å; Q634-M637 WeakPolarHBondContact O-CB 3.5Å; Q634-M637 PolarHBondContact O-N 3.23Å; M637-F639 PolarHBondContact O-N 2.91Å; M637-N640 PolarHBondContact O-N 2.91Å; M637-L641 WeakPolarHBondContact O-CB 3.47Å; M637-L641 PolarHBondContact O-N 3.12Å
638	L	94.5	Very high	92.3	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-38.8	177.3	-74.6	169.5	0	0	0	112.7	P589 Q634 A635 M636 L641 G642 C657 Q660 A661 M664	P589-L638 HydrophobicContact CG-CD1 4.5Å; P589-L638 HydrophobicContact CG-CD2 3.61Å; P589-L638 HydrophobicContact CG-CG 3.68Å; Q634-L638 WeakPolarHBondContact O-CG 3.47Å; Q634-L638 PolarHBondContact O-N 2.99Å; A635-L638 WeakPolarHBondContact O-CB 3.37Å; A635-L638 PolarHBondContact O-N 3.03Å; M636-L638 VanDerWaalsContact C-N 3.31Å; M636-L638 PolarHBondContact O-N 3.12Å; L638-L641 HydrophobicContact CD2-CD2 4.45Å; L638-L641 PolarHBondContact O-N 3.22Å; L638-G642 PolarHBondContact O-N 2.99Å; L638-C657 HydrophobicContact CD2-CB 4.36Å; L638-C657 WeakPolarHBondContact O-CB 3.43Å; L638-Q660 HydrophobicContact CD1-CB 3.99Å; L638-Q660 HydrophobicContact CD1-CG 3.65Å; L638-A661 HydrophobicContact CB-CB 3.75Å; L638-A661 HydrophobicContact CD1-CB 4.24Å; L638-M664 HydrophobicContact CD1-SD 3.71Å
639	F	93.3	Very high	92.9	Very high	7 Å²	7	33 Å²	33	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-47.1	173.6	-68.9	-48.2	0	0	0	111.4	A635 M636 M637 L641 G642 S643 L658 A661 M665 I670 P671 A674 L677 L700	A635-F639 VanDerWaalsContact O-CD2 3.24Å; A635-F639 WeakPolarHBondContact O-CD2 3.38Å; A635-F639 PolarHBondContact O-N 3.2Å; M636-F639 PolarHBondContact O-N 3.21Å; M637-F639 PolarHBondContact O-N 2.91Å; F639-L641 PolarHBondContact O-N 2.85Å; F639-G642 WeakPolarHBondContact O-CA 3.35Å; F639-G642 PolarHBondContact O-N 3.44Å; F639-G642 VanDerWaalsContact O-N 3.17Å; F639-S643 PolarHBondContact O-N 3.07Å; F639-S643 VanDerWaalsContact O-N 3.07Å; F639-S643 PolarHBondContact O-OG 2.92Å; F639-L658 HydrophobicContact CD1-CG 4.35Å; F639-A661 HydrophobicContact CD1-CB 3.7Å; F639-A661 HydrophobicContact CD2-CB 4.29Å; F639-A661 HydrophobicContact CE1-CB 3.35Å; F639-A661 HydrophobicContact CE2-CB 3.99Å; F639-A661 HydrophobicContact CG-CB 4.15Å; F639-A661 HydrophobicContact CZ-CB 3.51Å; F639-M665 HydrophobicContact CE2-SD 3.85Å; F639-I670 HydrophobicContact CZ-CG1 4.45Å; F639-I670 HydrophobicContact CZ-CG2 4.05Å; F639-P671 HydrophobicContact CD2-CG 4.31Å; F639-P671 HydrophobicContact CE2-CG 4.47Å; F639-A674 HydrophobicContact CB-CB 4.38Å; F639-A674 HydrophobicContact CD1-CB 3.57Å; F639-A674 HydrophobicContact CD2-CB 4.03Å; F639-A674 HydrophobicContact CE1-CB 3.75Å; F639-A674 HydrophobicContact CE2-CB 4.18Å; F639-A674 HydrophobicContact CG-CB 3.74Å; F639-A674 HydrophobicContact CZ-CB 4.05Å; F639-L677 WeakPolarHBondContact O-CD2 3.32Å; F639-L700 HydrophobicContact CE1-CD2 3.53Å; F639-L700 HydrophobicContact CZ-CD2 4.14Å
640	N	94.3	Very high	93.2	Very high	67 Å²	67	33 Å²	33	36%	0.358	18%	0.18	S	C	.	.	H	α-helix	trans	-66	-37.9	178.1	-70.1	-15.9	0	0	0	112.3	L568 L587 M636 M637 G642 S643 A644	L568-N640 VanDerWaalsContact CD2-ND2 3.35Å; L568-N640 WeakPolarHBondContact CD2-ND2 3.44Å; L587-N640 HydrophobicContact CD1-CB 4.31Å; L587-N640 HydrophobicContact CD2-CB 3.68Å; M636-N640 PolarHBondContact O-N 3.03Å; M636-N640 VanDerWaalsContact O-N 3.1Å; M637-N640 PolarHBondContact O-N 2.91Å; N640-G642 VanDerWaalsContact C-N 3.29Å; N640-G642 PolarHBondContact O-N 3.36Å; N640-S643 VanDerWaalsContact O-CB 3.32Å; N640-S643 WeakPolarHBondContact O-CB 3.49Å; N640-S643 PolarHBondContact O-N 3.15Å; N640-S643 VanDerWaalsContact O-N 3.15Å; N640-A644 PolarHBondContact O-N 3.41Å
641	L	95.9	Very high	93.4	Very high	14 Å²	14	33 Å²	33	7%	0.073	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-38.9	173.2	-178.9	59.1	0	0	0	111.2	I584 L587 M637 L638 F639 S643 A644 Y645	I584-L641 HydrophobicContact CB-CD1 4.18Å; I584-L641 HydrophobicContact CG1-CD1 3.91Å; I584-L641 HydrophobicContact CG2-CD1 3.83Å; L587-L641 HydrophobicContact CB-CB 4.09Å; L587-L641 HydrophobicContact CB-CD1 4.13Å; M637-L641 WeakPolarHBondContact O-CB 3.47Å; M637-L641 PolarHBondContact O-N 3.12Å; L638-L641 HydrophobicContact CD2-CD2 4.45Å; L638-L641 PolarHBondContact O-N 3.22Å; F639-L641 PolarHBondContact O-N 2.85Å; L641-S643 VanDerWaalsContact C-N 3.33Å; L641-S643 PolarHBondContact O-N 3.19Å; L641-A644 PolarHBondContact O-N 3.12Å; L641-Y645 HydrophobicContact CD1-CD2 4.16Å; L641-Y645 HydrophobicContact CD1-CE2 3.68Å; L641-Y645 HydrophobicContact CD2-CE2 4.03Å; L641-Y645 HydrophobicContact CG-CD2 3.97Å; L641-Y645 HydrophobicContact CG-CE2 3.59Å; L641-Y645 WeakPolarHBondContact O-CD2 3.35Å; L641-Y645 PolarHBondContact O-N 3.04Å
642	G	94.9	Very high	93.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-43.3	171.3	0	0	0	0	0	112.4	L638 F639 N640 Y645 C646 A654	L638-G642 PolarHBondContact O-N 2.99Å; F639-G642 WeakPolarHBondContact O-CA 3.35Å; F639-G642 PolarHBondContact O-N 3.44Å; F639-G642 VanDerWaalsContact O-N 3.17Å; N640-G642 VanDerWaalsContact C-N 3.29Å; N640-G642 PolarHBondContact O-N 3.36Å; G642-Y645 PolarHBondContact O-N 3.17Å; G642-C646 PolarHBondContact O-N 3.37Å; G642-C646 PolarHBondContact O-SG 2.93Å; G642-A654 WeakPolarHBondContact O-CB 3.37Å
643	S	94.2	Very high	93.7	Very high	44 Å²	44	41 Å²	41	31%	0.308	21%	0.206	S	C	.	.	H	α-helix	trans	-60.8	-45.8	173.4	-58.1	0	0	0	0	111.9	F639 N640 L641 Y645 C646 L647 L677	F639-S643 PolarHBondContact O-N 3.07Å; F639-S643 VanDerWaalsContact O-N 3.07Å; F639-S643 PolarHBondContact O-OG 2.92Å; N640-S643 VanDerWaalsContact O-CB 3.32Å; N640-S643 WeakPolarHBondContact O-CB 3.49Å; N640-S643 PolarHBondContact O-N 3.15Å; N640-S643 VanDerWaalsContact O-N 3.15Å; L641-S643 VanDerWaalsContact C-N 3.33Å; L641-S643 PolarHBondContact O-N 3.19Å; S643-Y645 VanDerWaalsContact C-N 3.35Å; S643-Y645 PolarHBondContact O-N 3.39Å; S643-C646 WeakPolarHBondContact O-CB 3.39Å; S643-C646 PolarHBondContact O-N 3.04Å; S643-C646 VanDerWaalsContact O-N 3.12Å; S643-L647 WeakPolarHBondContact O-CG 3.25Å; S643-L647 PolarHBondContact O-N 3.46Å; S643-L677 WeakPolarHBondContact OG-CD2 3.4Å
644	A	95.8	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-41.3	177.9	0	0	0	0	0	112.4	I575 I580 I584 L587 N640 L641 L647 R648	I575-A644 HydrophobicContact CD1-CB 4.38Å; I580-A644 HydrophobicContact CG2-CB 4.04Å; I584-A644 HydrophobicContact CG1-CB 4.03Å; L587-A644 HydrophobicContact CD1-CB 4.02Å; N640-A644 PolarHBondContact O-N 3.41Å; L641-A644 PolarHBondContact O-N 3.12Å; A644-L647 PolarHBondContact O-N 3.18Å; A644-R648 PolarHBondContact O-N 3.48Å
645	Y	96.1	Very high	93.9	Very high	39 Å²	39	41.9 Å²	41.9	15%	0.153	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-35.2	173.7	-76	-49.9	0	0	0	113	I584 L641 G642 S643 L647 R648 S649 E650 K653	I584-Y645 HydrophobicContact CD1-CD1 4.11Å; I584-Y645 HydrophobicContact CD1-CE1 3.81Å; L641-Y645 HydrophobicContact CD1-CD2 4.16Å; L641-Y645 HydrophobicContact CD1-CE2 3.68Å; L641-Y645 HydrophobicContact CD2-CE2 4.03Å; L641-Y645 HydrophobicContact CG-CD2 3.97Å; L641-Y645 HydrophobicContact CG-CE2 3.59Å; L641-Y645 WeakPolarHBondContact O-CD2 3.35Å; L641-Y645 PolarHBondContact O-N 3.04Å; G642-Y645 PolarHBondContact O-N 3.17Å; S643-Y645 VanDerWaalsContact C-N 3.35Å; S643-Y645 PolarHBondContact O-N 3.39Å; Y645-L647 VanDerWaalsContact C-N 3.34Å; Y645-R648 CarbonylContact O-C 3.6Å; Y645-R648 PolarHBondContact O-N 3.37Å; Y645-S649 PolarHBondContact O-N 2.99Å; Y645-E650 HydrophobicContact CD1-CB 4.08Å; Y645-E650 PolarHBondContact O-N 3.36Å; Y645-K653 HydrophobicContact CD1-CB 4.04Å; Y645-K653 HydrophobicContact CD1-CD 4.02Å; Y645-K653 HydrophobicContact CD2-CB 3.73Å; Y645-K653 HydrophobicContact CE1-CB 4.25Å; Y645-K653 HydrophobicContact CE1-CD 3.64Å; Y645-K653 HydrophobicContact CE2-CB 3.93Å; Y645-K653 HydrophobicContact CE2-CD 4.43Å; Y645-K653 HydrophobicContact CG-CB 3.8Å
646	C	94	Very high	94	Very high	7 Å²	7	48.8 Å²	48.8	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-43	173.2	-69.8	0	0	0	0	111.8	G642 S643 R648 S649 A654 L677 Y680 L681	G642-C646 PolarHBondContact O-N 3.37Å; G642-C646 PolarHBondContact O-SG 2.93Å; S643-C646 WeakPolarHBondContact O-CB 3.39Å; S643-C646 PolarHBondContact O-N 3.04Å; S643-C646 VanDerWaalsContact O-N 3.12Å; C646-R648 PolarHBondContact O-N 3.36Å; C646-S649 WeakPolarHBondContact O-CA 3.48Å; C646-S649 PolarHBondContact O-N 2.68Å; C646-A654 VanDerWaalsContact SG-CB 3.58Å; C646-L677 HydrophobicContact CB-CD1 4.41Å; C646-Y680 HydrophobicContact CB-CD1 4.39Å; C646-Y680 HydrophobicContact CB-CE1 3.95Å; C646-L681 VanDerWaalsContact SG-CD2 3.54Å
647	L	93.1	Very high	94.1	Very high	99 Å²	99	47 Å²	47	52%	0.518	23%	0.229	S	C	.	.	H	α-helix	trans	-61.7	-30.3	176.7	-66	173.3	0	0	0	112.3	I575 I580 S643 A644 Y645 S649	I575-L647 HydrophobicContact CG2-CD1 3.57Å; I580-L647 HydrophobicContact CD1-CB 3.79Å; S643-L647 WeakPolarHBondContact O-CG 3.25Å; S643-L647 PolarHBondContact O-N 3.46Å; A644-L647 PolarHBondContact O-N 3.18Å; Y645-L647 VanDerWaalsContact C-N 3.34Å; L647-S649 VanDerWaalsContact C-N 3.31Å
648	R	94.4	Very high	94	Very high	97 Å²	97	47.3 Å²	47.3	37%	0.366	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3.7	172.2	-72.7	175.6	57.3	150.4	1.4	114.6	I580 S581 A644 Y645 C646 E650	I580-R648 HydrophobicContact CB-CG 4.27Å; I580-R648 HydrophobicContact CD1-CG 4.38Å; I580-R648 HydrophobicContact CG2-CG 3.83Å; S581-R648 PolarHBondContact OG-NH1 3.18Å; A644-R648 PolarHBondContact O-N 3.48Å; Y645-R648 CarbonylContact O-C 3.6Å; Y645-R648 PolarHBondContact O-N 3.37Å; C646-R648 PolarHBondContact O-N 3.36Å; R648-E650 HydrophobicContact CB-CG 4.12Å; R648-E650 IonicContact CZ-OE1 3.55Å; R648-E650 IonicContact NE-OE1 3.05Å; R648-E650 PolarHBondContact NE-OE1 2.97Å; R648-E650 IonicContact NH2-OE1 3.98Å; R648-E650 PolarHBondContact NH2-OE1 3.27Å; R648-E650 PolarHBondContact O-N 2.89Å
649	S	93.9	Very high	93.9	Very high	75 Å²	75	51 Å²	51	52%	0.524	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	23.1	-172	-56.4	0	0	0	0	114.6	Y645 C646 L647 Y651	Y645-S649 PolarHBondContact O-N 2.99Å; C646-S649 WeakPolarHBondContact O-CA 3.48Å; C646-S649 PolarHBondContact O-N 2.68Å; L647-S649 VanDerWaalsContact C-N 3.31Å; S649-Y651 VanDerWaalsContact C-N 3.32Å; S649-Y651 PolarHBondContact O-N 3.19Å
650	E	94.7	Very high	93.8	Very high	47 Å²	47	55.6 Å²	55.6	22%	0.22	27%	0.27	C	S	.	.			trans	-91.4	61.1	177.4	-66.5	-177.4	-155.8	0	0	110.9	Y645 R648 D652 K653 A654	Y645-E650 HydrophobicContact CD1-CB 4.08Å; Y645-E650 PolarHBondContact O-N 3.36Å; R648-E650 HydrophobicContact CB-CG 4.12Å; R648-E650 IonicContact CZ-OE1 3.55Å; R648-E650 IonicContact NE-OE1 3.05Å; R648-E650 PolarHBondContact NE-OE1 2.97Å; R648-E650 IonicContact NH2-OE1 3.98Å; R648-E650 PolarHBondContact NH2-OE1 3.27Å; R648-E650 PolarHBondContact O-N 2.89Å; E650-D652 VanDerWaalsContact C-N 3.3Å; E650-D652 PolarHBondContact O-N 3.07Å; E650-K653 PolarHBondContact O-N 3.37Å; E650-K653 VanDerWaalsContact O-N 3.12Å; E650-K653 VanDerWaalsContact OE2-CD 3.23Å; E650-K653 WeakPolarHBondContact OE2-CD 3.36Å; E650-K653 VanDerWaalsContact OE2-CE 3.23Å; E650-K653 WeakPolarHBondContact OE2-CE 3.42Å; E650-K653 IonicContact OE2-NZ 3.9Å; E650-K653 PolarHBondContact OE2-NZ 3.27Å; E650-A654 PolarHBondContact O-N 3.29Å; E650-A654 VanDerWaalsContact O-N 3.15Å
651	Y	93.3	Very high	93.7	Very high	49 Å²	49	52.4 Å²	52.4	19%	0.192	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-32.2	-168.8	-53.8	-58.5	0	0	0	114.5	S649 A654 R655 Y680 L681 Q684	S649-Y651 VanDerWaalsContact C-N 3.32Å; S649-Y651 PolarHBondContact O-N 3.19Å; Y651-A654 PolarHBondContact O-N 3.01Å; Y651-R655 WeakPolarHBondContact O-CB 3.19Å; Y651-R655 PolarHBondContact O-N 3.43Å; Y651-Y680 HydrophobicContact CE1-CE1 4.3Å; Y651-L681 HydrophobicContact CD1-CD2 3.84Å; Y651-L681 HydrophobicContact CG-CD2 4.36Å; Y651-Q684 HydrophobicContact CD1-CB 4.38Å; Y651-Q684 HydrophobicContact CE1-CB 4.01Å; Y651-Q684 HydrophobicContact CE1-CG 3.92Å; Y651-Q684 HydrophobicContact CE2-CB 4.39Å; Y651-Q684 PolarHBondContact OH-OE1 3.15Å
652	D	91.8	Very high	93.3	Very high	117 Å²	117	52.6 Å²	52.6	63%	0.626	26%	0.256	S	S	*	.	H	α-helix	trans	-65.7	-38.9	177.2	-71.9	-44	0	0	0	112.5	E650 K656	E650-D652 VanDerWaalsContact C-N 3.3Å; E650-D652 PolarHBondContact O-N 3.07Å; D652-K656 WeakPolarHBondContact O-CG 3.28Å; D652-K656 PolarHBondContact O-N 3.13Å
653	K	94.6	Very high	93.1	Very high	97 Å²	97	58.1 Å²	58.1	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-70.8	-42.4	176.4	-64.4	-171.2	-167.1	163.6	0	110.5	Y645 E650 R655 K656 C657	Y645-K653 HydrophobicContact CD1-CB 4.04Å; Y645-K653 HydrophobicContact CD1-CD 4.02Å; Y645-K653 HydrophobicContact CD2-CB 3.73Å; Y645-K653 HydrophobicContact CE1-CB 4.25Å; Y645-K653 HydrophobicContact CE1-CD 3.64Å; Y645-K653 HydrophobicContact CE2-CB 3.93Å; Y645-K653 HydrophobicContact CE2-CD 4.43Å; Y645-K653 HydrophobicContact CG-CB 3.8Å; E650-K653 PolarHBondContact O-N 3.37Å; E650-K653 VanDerWaalsContact O-N 3.12Å; E650-K653 VanDerWaalsContact OE2-CD 3.23Å; E650-K653 WeakPolarHBondContact OE2-CD 3.36Å; E650-K653 VanDerWaalsContact OE2-CE 3.23Å; E650-K653 WeakPolarHBondContact OE2-CE 3.42Å; E650-K653 IonicContact OE2-NZ 3.9Å; E650-K653 PolarHBondContact OE2-NZ 3.27Å; K653-R655 VanDerWaalsContact C-N 3.33Å; K653-R655 PolarHBondContact O-N 3.37Å; K653-K656 WeakPolarHBondContact O-CB 3.36Å; K653-K656 PolarHBondContact O-N 3.3Å; K653-C657 PolarHBondContact O-N 2.92Å; K653-C657 PolarHBondContact O-SG 2.86Å; K653-C657 VanDerWaalsContact O-SG 3.35Å
654	A	94.4	Very high	92.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-46.6	174.5	0	0	0	0	0	111.9	G642 C646 E650 Y651 K656 C657 L658 L681	G642-A654 WeakPolarHBondContact O-CB 3.37Å; C646-A654 VanDerWaalsContact SG-CB 3.58Å; E650-A654 PolarHBondContact O-N 3.29Å; E650-A654 VanDerWaalsContact O-N 3.15Å; Y651-A654 PolarHBondContact O-N 3.01Å; A654-K656 VanDerWaalsContact C-N 3.34Å; A654-K656 PolarHBondContact O-N 3.48Å; A654-C657 WeakPolarHBondContact O-CB 3.49Å; A654-C657 PolarHBondContact O-N 3.45Å; A654-L658 VanDerWaalsContact O-CD1 3.25Å; A654-L658 WeakPolarHBondContact O-CD1 3.44Å; A654-L658 PolarHBondContact O-N 3.43Å; A654-L681 HydrophobicContact CB-CD1 4.09Å; A654-L681 HydrophobicContact CB-CD2 3.82Å
655	R	92	Very high	92	Very high	66 Å²	66	60 Å²	60	25%	0.249	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-44.1	176.3	-175.3	-175	-68.9	-89.3	0.5	112	Y651 K653 L658 H659 E682 N685	Y651-R655 WeakPolarHBondContact O-CB 3.19Å; Y651-R655 PolarHBondContact O-N 3.43Å; K653-R655 VanDerWaalsContact C-N 3.33Å; K653-R655 PolarHBondContact O-N 3.37Å; R655-L658 PolarHBondContact O-N 3Å; R655-H659 PolarHBondContact O-CD2 3.4Å; R655-H659 PolarHBondContact O-N 3.17Å; R655-E682 IonicContact CZ-OE1 3.94Å; R655-E682 VanDerWaalsContact CZ-OE1 3.3Å; R655-E682 IonicContact NH1-OE1 2.69Å; R655-E682 PolarHBondContact NH1-OE1 3.42Å; R655-E682 IonicContact NH1-OE2 3.85Å; R655-E682 IonicContact NH2-OE1 2.71Å; R655-E682 PolarHBondContact NH2-OE1 3Å; R655-E682 VanDerWaalsContact NH2-OE1 3.13Å; R655-E682 IonicContact NH2-OE2 3.79Å; R655-E682 PolarHBondContact NH2-OE2 2.94Å; R655-N685 PolarHBondContact NH2-ND2 2.79Å
656	K	93.7	Very high	91	Very high	146 Å²	146	63.1 Å²	63.1	64%	0.635	32%	0.315	S	S	*	.	H	α-helix	trans	-60.4	-44.4	176	-71.4	173.7	-175.5	178.6	0	111.9	D652 K653 A654 L658 H659 Q660	D652-K656 WeakPolarHBondContact O-CG 3.28Å; D652-K656 PolarHBondContact O-N 3.13Å; K653-K656 WeakPolarHBondContact O-CB 3.36Å; K653-K656 PolarHBondContact O-N 3.3Å; A654-K656 VanDerWaalsContact C-N 3.34Å; A654-K656 PolarHBondContact O-N 3.48Å; K656-L658 PolarHBondContact O-N 3.17Å; K656-H659 PolarHBondContact O-N 3.3Å; K656-Q660 WeakPolarHBondContact O-CB 3.43Å; K656-Q660 PolarHBondContact O-N 2.71Å
657	C	94.3	Very high	90.1	Very high	10 Å²	10	66.9 Å²	66.9	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-59.6	-45.9	177.1	-65.7	0	0	0	0	112	L638 K653 A654 Q660 A661	L638-C657 HydrophobicContact CD2-CB 4.36Å; L638-C657 WeakPolarHBondContact O-CB 3.43Å; K653-C657 PolarHBondContact O-N 2.92Å; K653-C657 PolarHBondContact O-SG 2.86Å; K653-C657 VanDerWaalsContact O-SG 3.35Å; A654-C657 WeakPolarHBondContact O-CB 3.49Å; A654-C657 PolarHBondContact O-N 3.45Å; C657-Q660 PolarHBondContact O-N 3.23Å; C657-A661 WeakPolarHBondContact O-CB 3.42Å; C657-A661 PolarHBondContact O-N 3.18Å
658	L	91.7	Very high	89	Confident	9 Å²	9	71.8 Å²	71.8	5%	0.047	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-43.3	178.2	-91.7	66.8	0	0	0	112.5	F639 A654 R655 K656 A661 A662 L677 L681 L700	F639-L658 HydrophobicContact CD1-CG 4.35Å; A654-L658 VanDerWaalsContact O-CD1 3.25Å; A654-L658 WeakPolarHBondContact O-CD1 3.44Å; A654-L658 PolarHBondContact O-N 3.43Å; R655-L658 PolarHBondContact O-N 3Å; K656-L658 PolarHBondContact O-N 3.17Å; L658-A661 PolarHBondContact O-N 3.13Å; L658-A662 VanDerWaalsContact O-CB 3.28Å; L658-A662 WeakPolarHBondContact O-CB 3.06Å; L658-A662 PolarHBondContact O-N 3.02Å; L658-L677 HydrophobicContact CD1-CD2 3.68Å; L658-L677 HydrophobicContact CD1-CG 4.14Å; L658-L677 HydrophobicContact CD2-CG 4.29Å; L658-L677 HydrophobicContact CG-CD2 4.48Å; L658-L681 HydrophobicContact CD1-CD1 4.18Å; L658-L681 HydrophobicContact CD2-CD1 3.58Å; L658-L681 HydrophobicContact CG-CD1 4.49Å; L658-L700 HydrophobicContact CB-CD2 4.37Å; L658-L700 HydrophobicContact CD2-CD1 3.93Å; L658-L700 HydrophobicContact CG-CD2 4.35Å
659	H	91.1	Very high	88	Confident	82 Å²	82	71.8 Å²	71.8	38%	0.38	36%	0.362	S	S	.	.	H	α-helix	trans	-61.9	-45.6	176.3	-82.7	-69	0	0	0	111.5	R655 K656 A662 T663 L701	R655-H659 PolarHBondContact O-CD2 3.4Å; R655-H659 PolarHBondContact O-N 3.17Å; K656-H659 PolarHBondContact O-N 3.3Å; H659-A662 PolarHBondContact O-N 3.48Å; H659-T663 WeakPolarHBondContact O-CG2 3.42Å; H659-T663 PolarHBondContact O-N 2.93Å; H659-L701 WeakPolarHBondContact CE1-CD2 3.33Å; H659-L701 VanDerWaalsContact ND1-CD2 3.33Å; H659-L701 WeakPolarHBondContact ND1-CD2 3.48Å
660	Q	92.6	Very high	87.4	Confident	102 Å²	102	69.2 Å²	69.2	48%	0.477	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-48	177.8	-171.8	179.2	-4.3	0	0	111	L638 K656 C657 A662 T663 M664	L638-Q660 HydrophobicContact CD1-CB 3.99Å; L638-Q660 HydrophobicContact CD1-CG 3.65Å; K656-Q660 WeakPolarHBondContact O-CB 3.43Å; K656-Q660 PolarHBondContact O-N 2.71Å; C657-Q660 PolarHBondContact O-N 3.23Å; Q660-A662 VanDerWaalsContact C-N 3.33Å; Q660-A662 PolarHBondContact O-N 3.36Å; Q660-T663 PolarHBondContact O-N 3.45Å; Q660-T663 VanDerWaalsContact O-N 3.13Å; Q660-T663 PolarHBondContact O-OG1 3.35Å; Q660-M664 HydrophobicContact CG-SD 4.32Å; Q660-M664 WeakPolarHBondContact O-CG 3.45Å; Q660-M664 PolarHBondContact O-N 3.15Å
661	A	91.1	Very high	86.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-42.6	177.2	0	0	0	0	0	112.6	A635 L638 F639 C657 L658 T663 M664 M665	A635-A661 HydrophobicContact CB-CB 4.27Å; L638-A661 HydrophobicContact CB-CB 3.75Å; L638-A661 HydrophobicContact CD1-CB 4.24Å; F639-A661 HydrophobicContact CD1-CB 3.7Å; F639-A661 HydrophobicContact CD2-CB 4.29Å; F639-A661 HydrophobicContact CE1-CB 3.35Å; F639-A661 HydrophobicContact CE2-CB 3.99Å; F639-A661 HydrophobicContact CG-CB 4.15Å; F639-A661 HydrophobicContact CZ-CB 3.51Å; C657-A661 WeakPolarHBondContact O-CB 3.42Å; C657-A661 PolarHBondContact O-N 3.18Å; L658-A661 PolarHBondContact O-N 3.13Å; A661-T663 PolarHBondContact O-N 3.01Å; A661-M664 PolarHBondContact O-N 2.95Å; A661-M665 PolarHBondContact O-N 3.13Å
662	A	88.6	Confident	86.1	Confident	18 Å²	18	69.1 Å²	69.1	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-64.5	-26	178.6	0	0	0	0	0	113.6	L658 H659 Q660 L700 L701	L658-A662 VanDerWaalsContact O-CB 3.28Å; L658-A662 WeakPolarHBondContact O-CB 3.06Å; L658-A662 PolarHBondContact O-N 3.02Å; H659-A662 PolarHBondContact O-N 3.48Å; Q660-A662 VanDerWaalsContact C-N 3.33Å; Q660-A662 PolarHBondContact O-N 3.36Å; A662-L700 HydrophobicContact CB-CD2 4.18Å; A662-L701 HydrophobicContact CB-CD1 3.55Å; A662-L701 HydrophobicContact CB-CG 4.12Å
663	T	88.9	Confident	85.8	Confident	116 Å²	116	68 Å²	68	71%	0.712	34%	0.343	S	S	*	.	H	α-helix	trans	-79.6	-19.9	174.4	60.4	0	0	0	0	113.4	H659 Q660 A661	H659-T663 WeakPolarHBondContact O-CG2 3.42Å; H659-T663 PolarHBondContact O-N 2.93Å; Q660-T663 PolarHBondContact O-N 3.45Å; Q660-T663 VanDerWaalsContact O-N 3.13Å; Q660-T663 PolarHBondContact O-OG1 3.35Å; A661-T663 PolarHBondContact O-N 3.01Å
664	M	85.8	Confident	85.4	Confident	61 Å²	61	63.5 Å²	63.5	30%	0.3	32%	0.324	S	S	.	.	H	α-helix	trans	-92.5	-14.4	-177.4	-64.6	176.4	73.7	0	0	113.2	A631 Q634 A635 L638 Q660 A661	A631-M664 HydrophobicContact CB-CE 4.36Å; Q634-M664 HydrophobicContact CB-CE 3.65Å; A635-M664 HydrophobicContact CB-CB 4.03Å; L638-M664 HydrophobicContact CD1-SD 3.71Å; Q660-M664 HydrophobicContact CG-SD 4.32Å; Q660-M664 WeakPolarHBondContact O-CG 3.45Å; Q660-M664 PolarHBondContact O-N 3.15Å; A661-M664 PolarHBondContact O-N 2.95Å
665	M	81.7	Confident	85	Confident	24 Å²	24	63.9 Å²	63.9	12%	0.118	33%	0.326	C	S	.	.	S	Bend	trans	-125.4	151.8	-177.6	-68.1	-175.8	72.5	0	0	112.2	A635 F639 A661 E669	A635-M665 HydrophobicContact CB-CG 3.4Å; A635-M665 HydrophobicContact CB-SD 3.38Å; A635-M665 WeakPolarHBondContact CB-SD 3.37Å; F639-M665 HydrophobicContact CE2-SD 3.85Å; A661-M665 PolarHBondContact O-N 3.13Å; M665-E669 HydrophobicContact CE-CB 3.74Å; M665-E669 WeakPolarHBondContact CE-O 3.33Å
666	N	76.3	Confident	84.8	Confident	104 Å²	104	63.2 Å²	63.2	56%	0.556	33%	0.327	S	S	*	.			trans	-67	144	170.9	-65.9	-36	0	0	0	110.1	K668 E669	N666-K668 PolarHBondContact O-N 2.98Å; N666-E669 HydrophobicContact CB-CB 4.47Å; N666-E669 HydrophobicContact CB-CG 4.13Å; N666-E669 PolarHBondContact ND2-OE1 2.86Å; N666-E669 PolarHBondContact O-N 3.39Å
667	S	73.2	Confident	84.6	Confident	85 Å²	85	57.1 Å²	57.1	59%	0.594	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.4	-179	59.9	0	0	0	0	114.7
668	K	71.1	Confident	84.3	Confident	203 Å²	203	56.9 Å²	56.9	88%	0.883	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-14.2	175.7	-65	-177.6	-179.9	177.7	0	114	N666	N666-K668 PolarHBondContact O-N 2.98Å
669	E	73.7	Confident	84.2	Confident	96 Å²	96	56.7 Å²	56.7	45%	0.449	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-4.2	-178.3	-65.9	167.5	-161.5	0	0	112.1	M665 N666	M665-E669 HydrophobicContact CE-CB 3.74Å; M665-E669 WeakPolarHBondContact CE-O 3.33Å; N666-E669 HydrophobicContact CB-CB 4.47Å; N666-E669 HydrophobicContact CB-CG 4.13Å; N666-E669 PolarHBondContact ND2-OE1 2.86Å; N666-E669 PolarHBondContact O-N 3.39Å
670	I	80.3	Confident	84.2	Confident	21 Å²	21	57.2 Å²	57.2	11%	0.108	30%	0.299	C	S	.	.	S	Bend	trans	-69.9	124.5	177.6	-60.7	177.4	0	0	0	109	F639 A674 I675 L700	F639-I670 HydrophobicContact CZ-CG1 4.45Å; F639-I670 HydrophobicContact CZ-CG2 4.05Å; I670-A674 HydrophobicContact CG2-CB 3.85Å; I670-I675 HydrophobicContact CG2-CG1 4.09Å; I670-L700 HydrophobicContact CD1-CB 4.09Å; I670-L700 HydrophobicContact CD1-CD2 4.43Å; I670-L700 HydrophobicContact CG2-CB 4.38Å; I670-L700 HydrophobicContact CG2-CD2 4.34Å
671	P	80.2	Confident	84.1	Confident	41 Å²	41	52.5 Å²	52.5	27%	0.266	28%	0.277	S	S	.	.			trans	-66.4	145.2	179.9	24.8	-31.4	0	0	0	111.4	F639 E673 A674 I675	F639-P671 HydrophobicContact CD2-CG 4.31Å; F639-P671 HydrophobicContact CE2-CG 4.47Å; P671-E673 WeakPolarHBondContact CB-OE2 3.49Å; P671-E673 PolarHBondContact O-N 3.18Å; P671-E673 VanDerWaalsContact O-N 3.15Å; P671-A674 HydrophobicContact CG-CB 3.88Å; P671-A674 WeakPolarHBondContact O-CB 3.45Å; P671-A674 PolarHBondContact O-N 3.46Å; P671-I675 PolarHBondContact O-N 3.29Å
672	P	81.9	Confident	84	Confident	54 Å²	54	53.1 Å²	53.1	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-52.6	-34.2	176.4	-26.4	34.3	0	0	0	113.7	I412 A674 I675 L676	I412-P672 HydrophobicContact CG1-CB 4.4Å; P672-A674 VanDerWaalsContact C-N 3.32Å; P672-A674 PolarHBondContact O-N 3.02Å; P672-I675 WeakPolarHBondContact O-CB 3.24Å; P672-I675 PolarHBondContact O-N 3.33Å; P672-I675 VanDerWaalsContact O-N 3.13Å; P672-L676 PolarHBondContact O-N 2.8Å
673	E	84.3	Confident	84.1	Confident	93 Å²	93	56.4 Å²	56.4	44%	0.435	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-38.1	178.2	-63.2	72	-156.1	0	0	111.6	Q430 P671 L676 L677	Q430-E673 PolarHBondContact NE2-OE1 3.12Å; P671-E673 WeakPolarHBondContact CB-OE2 3.49Å; P671-E673 PolarHBondContact O-N 3.18Å; P671-E673 VanDerWaalsContact O-N 3.15Å; E673-L676 WeakPolarHBondContact O-CB 3.34Å; E673-L676 PolarHBondContact O-N 3.4Å; E673-L677 PolarHBondContact O-N 2.91Å
674	A	86.1	Confident	84.1	Confident	3 Å²	3	55.1 Å²	55.1	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-36.5	174.4	0	0	0	0	0	111.6	F639 I670 P671 P672 L677 G678 L700	F639-A674 HydrophobicContact CB-CB 4.38Å; F639-A674 HydrophobicContact CD1-CB 3.57Å; F639-A674 HydrophobicContact CD2-CB 4.03Å; F639-A674 HydrophobicContact CE1-CB 3.75Å; F639-A674 HydrophobicContact CE2-CB 4.18Å; F639-A674 HydrophobicContact CG-CB 3.74Å; F639-A674 HydrophobicContact CZ-CB 4.05Å; I670-A674 HydrophobicContact CG2-CB 3.85Å; P671-A674 HydrophobicContact CG-CB 3.88Å; P671-A674 WeakPolarHBondContact O-CB 3.45Å; P671-A674 PolarHBondContact O-N 3.46Å; P672-A674 VanDerWaalsContact C-N 3.32Å; P672-A674 PolarHBondContact O-N 3.02Å; A674-L677 WeakPolarHBondContact O-CB 3.5Å; A674-L677 PolarHBondContact O-N 2.8Å; A674-G678 PolarHBondContact O-N 3.2Å; A674-L700 WeakPolarHBondContact O-CD1 3.42Å
675	I	87.1	Confident	84.1	Confident	7 Å²	7	55.2 Å²	55.2	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-43.8	174.4	-56.5	174.8	0	0	0	110.2	I412 I670 P671 P672 L677 G678 V679 I694	I412-I675 HydrophobicContact CD1-CB 3.66Å; I412-I675 HydrophobicContact CD1-CD1 4.19Å; I412-I675 HydrophobicContact CD1-CG2 3.38Å; I670-I675 HydrophobicContact CG2-CG1 4.09Å; P671-I675 PolarHBondContact O-N 3.29Å; P672-I675 WeakPolarHBondContact O-CB 3.24Å; P672-I675 PolarHBondContact O-N 3.33Å; P672-I675 VanDerWaalsContact O-N 3.13Å; I675-L677 VanDerWaalsContact C-N 3.33Å; I675-L677 PolarHBondContact O-N 2.87Å; I675-G678 PolarHBondContact O-N 3.01Å; I675-V679 WeakPolarHBondContact O-CG2 3.2Å; I675-V679 PolarHBondContact O-N 3.42Å; I675-I694 HydrophobicContact CG2-CG2 3.61Å
676	L	87.3	Confident	84.4	Confident	53 Å²	53	56.7 Å²	56.7	28%	0.277	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-40.2	174.4	-80	172.6	0	0	0	112.5	I412 L427 P672 E673 G678 V679 Y680	I412-L676 HydrophobicContact CG2-CD2 3.56Å; I412-L676 HydrophobicContact CG2-CG 4.08Å; L427-L676 HydrophobicContact CD1-CD2 3.96Å; P672-L676 PolarHBondContact O-N 2.8Å; E673-L676 WeakPolarHBondContact O-CB 3.34Å; E673-L676 PolarHBondContact O-N 3.4Å; L676-G678 VanDerWaalsContact C-N 3.31Å; L676-G678 PolarHBondContact O-N 3.42Å; L676-V679 WeakPolarHBondContact O-CB 3.44Å; L676-V679 PolarHBondContact O-N 3.22Å; L676-Y680 PolarHBondContact O-N 2.87Å
677	L	89.1	Confident	85	Confident	18 Å²	18	55.1 Å²	55.1	9%	0.094	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-40.5	173.6	-178.7	61	0	0	0	111.9	F639 S643 C646 L658 E673 A674 I675 Y680 L681	F639-L677 WeakPolarHBondContact O-CD2 3.32Å; S643-L677 WeakPolarHBondContact OG-CD2 3.4Å; C646-L677 HydrophobicContact CB-CD1 4.41Å; L658-L677 HydrophobicContact CD1-CD2 3.68Å; L658-L677 HydrophobicContact CD1-CG 4.14Å; L658-L677 HydrophobicContact CD2-CG 4.29Å; L658-L677 HydrophobicContact CG-CD2 4.48Å; E673-L677 PolarHBondContact O-N 2.91Å; A674-L677 WeakPolarHBondContact O-CB 3.5Å; A674-L677 PolarHBondContact O-N 2.8Å; I675-L677 VanDerWaalsContact C-N 3.33Å; I675-L677 PolarHBondContact O-N 2.87Å; L677-Y680 PolarHBondContact O-N 3.29Å; L677-L681 WeakPolarHBondContact O-CG 3.42Å; L677-L681 PolarHBondContact O-N 2.86Å
678	G	88.9	Confident	85.7	Confident	5 Å²	5	55 Å²	55	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-41.8	172.6	0	0	0	0	0	113	A674 I675 L676 L681 E682	A674-G678 PolarHBondContact O-N 3.2Å; I675-G678 PolarHBondContact O-N 3.01Å; L676-G678 VanDerWaalsContact C-N 3.31Å; L676-G678 PolarHBondContact O-N 3.42Å; G678-L681 PolarHBondContact O-N 2.69Å; G678-E682 PolarHBondContact O-N 3.43Å; G678-E682 VanDerWaalsContact O-N 3.13Å
679	V	89.4	Confident	86.5	Confident	4 Å²	4	53 Å²	53	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-47.1	173.9	173.4	0	0	0	0	110.8	I675 L676 L681 E682 L683 A691 I694 I695	I675-V679 WeakPolarHBondContact O-CG2 3.2Å; I675-V679 PolarHBondContact O-N 3.42Å; L676-V679 WeakPolarHBondContact O-CB 3.44Å; L676-V679 PolarHBondContact O-N 3.22Å; V679-L681 VanDerWaalsContact C-N 3.33Å; V679-L681 PolarHBondContact O-N 3.13Å; V679-E682 PolarHBondContact O-N 3.35Å; V679-L683 HydrophobicContact CG1-CD1 3.95Å; V679-L683 HydrophobicContact CG1-CG 4.4Å; V679-L683 WeakPolarHBondContact O-CG 3.44Å; V679-L683 PolarHBondContact O-N 3.46Å; V679-A691 HydrophobicContact CG1-CB 4.26Å; V679-I694 HydrophobicContact CG2-CB 4.11Å; V679-I694 HydrophobicContact CG2-CG2 3.58Å; V679-I695 HydrophobicContact CG1-CD1 3.93Å; V679-I695 HydrophobicContact CG1-CG1 4.2Å; V679-I695 HydrophobicContact CG2-CD1 4.26Å; V679-I695 HydrophobicContact CG2-CG1 3.6Å
680	Y	90.3	Very high	87.1	Confident	93 Å²	93	51 Å²	51	37%	0.365	28%	0.276	S	S	.	.	H	α-helix	trans	-57.1	-46.7	178.1	174.8	-94	0	0	0	111.5	C646 Y651 L676 L677 E682 L683 Q684	C646-Y680 HydrophobicContact CB-CD1 4.39Å; C646-Y680 HydrophobicContact CB-CE1 3.95Å; Y651-Y680 HydrophobicContact CE1-CE1 4.3Å; L676-Y680 PolarHBondContact O-N 2.87Å; L677-Y680 PolarHBondContact O-N 3.29Å; Y680-E682 PolarHBondContact O-N 3.19Å; Y680-L683 PolarHBondContact O-N 3.36Å; Y680-Q684 HydrophobicContact CD1-CG 4.12Å; Y680-Q684 HydrophobicContact CD2-CG 4.46Å; Y680-Q684 HydrophobicContact CE1-CG 3.63Å; Y680-Q684 HydrophobicContact CE2-CG 4.04Å; Y680-Q684 WeakPolarHBondContact O-CG 3.32Å; Y680-Q684 PolarHBondContact O-N 3.26Å; Y680-Q684 PolarHBondContact OH-NE2 3.45Å
681	L	90.6	Very high	87.4	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-39.9	178.6	-82.7	164.8	0	0	0	113.7	C646 Y651 A654 L658 L677 G678 V679 N685	C646-L681 VanDerWaalsContact SG-CD2 3.54Å; Y651-L681 HydrophobicContact CD1-CD2 3.84Å; Y651-L681 HydrophobicContact CG-CD2 4.36Å; A654-L681 HydrophobicContact CB-CD1 4.09Å; A654-L681 HydrophobicContact CB-CD2 3.82Å; L658-L681 HydrophobicContact CD1-CD1 4.18Å; L658-L681 HydrophobicContact CD2-CD1 3.58Å; L658-L681 HydrophobicContact CG-CD1 4.49Å; L677-L681 WeakPolarHBondContact O-CG 3.42Å; L677-L681 PolarHBondContact O-N 2.86Å; G678-L681 PolarHBondContact O-N 2.69Å; V679-L681 VanDerWaalsContact C-N 3.33Å; V679-L681 PolarHBondContact O-N 3.13Å; L681-N685 WeakPolarHBondContact O-CB 3.35Å; L681-N685 PolarHBondContact O-N 3.42Å; L681-N685 PolarHBondContact O-ND2 2.98Å
682	E	90.4	Very high	87.6	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-34.2	176.7	-65.9	-51.6	156.9	0	0	112.1	R655 G678 V679 Y680 N685 G686 N687 L690 A691 I694	R655-E682 IonicContact CZ-OE1 3.94Å; R655-E682 VanDerWaalsContact CZ-OE1 3.3Å; R655-E682 IonicContact NH1-OE1 2.69Å; R655-E682 PolarHBondContact NH1-OE1 3.42Å; R655-E682 IonicContact NH1-OE2 3.85Å; R655-E682 IonicContact NH2-OE1 2.71Å; R655-E682 PolarHBondContact NH2-OE1 3Å; R655-E682 VanDerWaalsContact NH2-OE1 3.13Å; R655-E682 IonicContact NH2-OE2 3.79Å; R655-E682 PolarHBondContact NH2-OE2 2.94Å; G678-E682 PolarHBondContact O-N 3.43Å; G678-E682 VanDerWaalsContact O-N 3.13Å; V679-E682 PolarHBondContact O-N 3.35Å; Y680-E682 PolarHBondContact O-N 3.19Å; E682-N685 PolarHBondContact O-N 3.04Å; E682-G686 PolarHBondContact O-N 3.01Å; E682-N687 HydrophobicContact CB-CB 4.15Å; E682-N687 WeakPolarHBondContact O-CA 3.48Å; E682-N687 WeakPolarHBondContact O-CB 3.46Å; E682-N687 PolarHBondContact O-N 3.33Å; E682-N687 WeakPolarHBondContact OE2-CB 3.27Å; E682-N687 PolarHBondContact OE2-ND2 3.08Å; E682-L690 VanDerWaalsContact CD-CD2 3.42Å; E682-L690 HydrophobicContact CG-CB 4.23Å; E682-L690 HydrophobicContact CG-CD2 3.95Å; E682-L690 HydrophobicContact CG-CG 3.99Å; E682-A691 HydrophobicContact CB-CB 3.98Å; E682-I694 HydrophobicContact CG-CD1 3.82Å
683	L	89.8	Confident	87.9	Confident	86 Å²	86	52.4 Å²	52.4	45%	0.45	28%	0.276	S	S	.	.	H	α-helix	trans	-67.5	-43.1	174.6	-68.9	175.5	0	0	0	112.1	V679 Y680 N685 G686 T688 A691	V679-L683 HydrophobicContact CG1-CD1 3.95Å; V679-L683 HydrophobicContact CG1-CG 4.4Å; V679-L683 WeakPolarHBondContact O-CG 3.44Å; V679-L683 PolarHBondContact O-N 3.46Å; Y680-L683 PolarHBondContact O-N 3.36Å; L683-N685 PolarHBondContact O-N 3.31Å; L683-G686 PolarHBondContact O-N 3.1Å; L683-T688 HydrophobicContact CD2-CG2 4.44Å; L683-A691 HydrophobicContact CD2-CB 3.75Å; L683-A691 HydrophobicContact CG-CB 3.89Å
684	Q	88.8	Confident	88	Confident	90 Å²	90	48.1 Å²	48.1	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-33	175.8	-71.7	-59.4	-28.7	0	0	112.4	Y651 Y680 G686	Y651-Q684 HydrophobicContact CD1-CB 4.38Å; Y651-Q684 HydrophobicContact CE1-CB 4.01Å; Y651-Q684 HydrophobicContact CE1-CG 3.92Å; Y651-Q684 HydrophobicContact CE2-CB 4.39Å; Y651-Q684 PolarHBondContact OH-OE1 3.15Å; Y680-Q684 HydrophobicContact CD1-CG 4.12Å; Y680-Q684 HydrophobicContact CD2-CG 4.46Å; Y680-Q684 HydrophobicContact CE1-CG 3.63Å; Y680-Q684 HydrophobicContact CE2-CG 4.04Å; Y680-Q684 WeakPolarHBondContact O-CG 3.32Å; Y680-Q684 PolarHBondContact O-N 3.26Å; Y680-Q684 PolarHBondContact OH-NE2 3.45Å; Q684-G686 VanDerWaalsContact C-N 3.29Å; Q684-G686 PolarHBondContact O-N 3.11Å
685	N	85.9	Confident	87.9	Confident	63 Å²	63	49.2 Å²	49.2	34%	0.337	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	2.3	175.6	-71.8	-45.3	0	0	0	114	R655 L681 E682 L683 N687	R655-N685 PolarHBondContact NH2-ND2 2.79Å; L681-N685 WeakPolarHBondContact O-CB 3.35Å; L681-N685 PolarHBondContact O-N 3.42Å; L681-N685 PolarHBondContact O-ND2 2.98Å; E682-N685 PolarHBondContact O-N 3.04Å; L683-N685 PolarHBondContact O-N 3.31Å; N685-N687 VanDerWaalsContact C-N 3.28Å; N685-N687 PolarHBondContact O-N 2.8Å
686	G	88	Confident	87.6	Confident	54 Å²	54	56.3 Å²	56.3	56%	0.557	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	6.4	-178.2	0	0	0	0	0	115.3	E682 L683 Q684 T688	E682-G686 PolarHBondContact O-N 3.01Å; L683-G686 PolarHBondContact O-N 3.1Å; Q684-G686 VanDerWaalsContact C-N 3.29Å; Q684-G686 PolarHBondContact O-N 3.11Å; G686-T688 VanDerWaalsContact C-N 3.29Å; G686-T688 PolarHBondContact O-N 3.08Å
687	N	88.7	Confident	87.4	Confident	72 Å²	72	59.4 Å²	59.4	39%	0.385	30%	0.3	S	S	.	.			trans	-85.8	57.9	-177	-67.3	-27.8	0	0	0	112.6	E682 N685 Q689 L690 A691	E682-N687 HydrophobicContact CB-CB 4.15Å; E682-N687 WeakPolarHBondContact O-CA 3.48Å; E682-N687 WeakPolarHBondContact O-CB 3.46Å; E682-N687 PolarHBondContact O-N 3.33Å; E682-N687 WeakPolarHBondContact OE2-CB 3.27Å; E682-N687 PolarHBondContact OE2-ND2 3.08Å; N685-N687 VanDerWaalsContact C-N 3.28Å; N685-N687 PolarHBondContact O-N 2.8Å; N687-Q689 PolarHBondContact O-N 3.5Å; N687-Q689 VanDerWaalsContact O-N 3.1Å; N687-L690 HydrophobicContact CB-CB 4.2Å; N687-L690 PolarHBondContact O-N 3.41Å; N687-A691 PolarHBondContact O-N 3.35Å; N687-A691 VanDerWaalsContact O-N 3.11Å
688	T	87.9	Confident	86.9	Confident	81 Å²	81	62.4 Å²	62.4	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-56.2	-33.3	-176.3	-48.5	0	0	0	0	113.4	L683 G686 L692	L683-T688 HydrophobicContact CD2-CG2 4.44Å; G686-T688 VanDerWaalsContact C-N 3.29Å; G686-T688 PolarHBondContact O-N 3.08Å; T688-L692 HydrophobicContact CG2-CD1 4.47Å; T688-L692 WeakPolarHBondContact O-CG 3.42Å; T688-L692 PolarHBondContact O-N 3.44Å; T688-L692 VanDerWaalsContact O-N 3.08Å
689	Q	87.1	Confident	86.6	Confident	162 Å²	162	65.7 Å²	65.7	76%	0.757	33%	0.33	S	S	*	.	H	α-helix	trans	-66.2	-40	177.8	-64.8	-171.5	8	0	0	112.4	N687 L692 Q693	N687-Q689 PolarHBondContact O-N 3.5Å; N687-Q689 VanDerWaalsContact O-N 3.1Å; Q689-L692 PolarHBondContact O-N 2.93Å; Q689-Q693 WeakPolarHBondContact O-CG 3.47Å; Q689-Q693 PolarHBondContact O-N 3.33Å; Q689-Q693 VanDerWaalsContact O-N 3.11Å
690	L	86.7	Confident	86	Confident	54 Å²	54	65.8 Å²	65.8	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-73.8	-41.2	-179.3	-170.3	57.7	0	0	0	110.8	E682 N687 L692 Q693 I694 P702	E682-L690 VanDerWaalsContact CD-CD2 3.42Å; E682-L690 HydrophobicContact CG-CB 4.23Å; E682-L690 HydrophobicContact CG-CD2 3.95Å; E682-L690 HydrophobicContact CG-CG 3.99Å; N687-L690 HydrophobicContact CB-CB 4.2Å; N687-L690 PolarHBondContact O-N 3.41Å; L690-L692 VanDerWaalsContact C-N 3.3Å; L690-L692 PolarHBondContact O-N 3.46Å; L690-Q693 WeakPolarHBondContact O-CA 3.39Å; L690-Q693 WeakPolarHBondContact O-CB 3.5Å; L690-Q693 PolarHBondContact O-N 3.34Å; L690-I694 HydrophobicContact CG-CD1 4.49Å; L690-I694 WeakPolarHBondContact O-CG1 3.19Å; L690-I694 PolarHBondContact O-N 2.7Å; L690-P702 HydrophobicContact CD1-CG 3.56Å
691	A	86.5	Confident	85.1	Confident	2 Å²	2	64.5 Å²	64.5	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-53.3	-46.7	170.9	0	0	0	0	0	111.8	V679 E682 L683 N687 Q693 I694 I695	V679-A691 HydrophobicContact CG1-CB 4.26Å; E682-A691 HydrophobicContact CB-CB 3.98Å; L683-A691 HydrophobicContact CD2-CB 3.75Å; L683-A691 HydrophobicContact CG-CB 3.89Å; N687-A691 PolarHBondContact O-N 3.35Å; N687-A691 VanDerWaalsContact O-N 3.11Å; A691-Q693 VanDerWaalsContact C-N 3.32Å; A691-Q693 PolarHBondContact O-N 2.99Å; A691-I694 PolarHBondContact O-N 2.93Å; A691-I695 WeakPolarHBondContact O-CG1 3.33Å; A691-I695 PolarHBondContact O-N 3.43Å; A691-I695 VanDerWaalsContact O-N 3.08Å
692	L	85.5	Confident	83.6	Confident	65 Å²	65	65.8 Å²	65.8	34%	0.34	34%	0.338	S	S	.	.	H	α-helix	trans	-64.7	-33.1	175.5	-73.6	171.9	0	0	0	113.1	I425 T688 Q689 L690 K696	I425-L692 HydrophobicContact CD1-CD2 3.88Å; T688-L692 HydrophobicContact CG2-CD1 4.47Å; T688-L692 WeakPolarHBondContact O-CG 3.42Å; T688-L692 PolarHBondContact O-N 3.44Å; T688-L692 VanDerWaalsContact O-N 3.08Å; Q689-L692 PolarHBondContact O-N 2.93Å; L690-L692 VanDerWaalsContact C-N 3.3Å; L690-L692 PolarHBondContact O-N 3.46Å; L692-K696 WeakPolarHBondContact O-CB 3.41Å; L692-K696 WeakPolarHBondContact O-CG 3.39Å; L692-K696 PolarHBondContact O-N 3.47Å
693	Q	87.3	Confident	81.5	Confident	79 Å²	79	69.4 Å²	69.4	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-69	-42.1	175.3	-74.3	-172	25.9	0	0	112.1	Q689 L690 A691 K696 R697	Q689-Q693 WeakPolarHBondContact O-CG 3.47Å; Q689-Q693 PolarHBondContact O-N 3.33Å; Q689-Q693 VanDerWaalsContact O-N 3.11Å; L690-Q693 WeakPolarHBondContact O-CA 3.39Å; L690-Q693 WeakPolarHBondContact O-CB 3.5Å; L690-Q693 PolarHBondContact O-N 3.34Å; A691-Q693 VanDerWaalsContact C-N 3.32Å; A691-Q693 PolarHBondContact O-N 2.99Å; Q693-K696 PolarHBondContact O-N 2.67Å; Q693-R697 WeakPolarHBondContact O-CB 3.39Å; Q693-R697 PolarHBondContact O-N 3Å
694	I	86.3	Confident	79	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.015	38%	0.382	C	S	.	.	H	α-helix	trans	-58.5	-49.3	175.7	-68.4	169.1	0	0	0	109.7	I675 V679 E682 L690 A691 K696 R697 N698 Q699	I675-I694 HydrophobicContact CG2-CG2 3.61Å; V679-I694 HydrophobicContact CG2-CB 4.11Å; V679-I694 HydrophobicContact CG2-CG2 3.58Å; E682-I694 HydrophobicContact CG-CD1 3.82Å; L690-I694 HydrophobicContact CG-CD1 4.49Å; L690-I694 WeakPolarHBondContact O-CG1 3.19Å; L690-I694 PolarHBondContact O-N 2.7Å; A691-I694 PolarHBondContact O-N 2.93Å; I694-K696 PolarHBondContact O-N 2.88Å; I694-R697 PolarHBondContact O-N 2.86Å; I694-N698 WeakPolarHBondContact O-CA 3.41Å; I694-N698 PolarHBondContact O-N 2.88Å; I694-Q699 WeakPolarHBondContact CG2-O 3.5Å; I694-Q699 PolarHBondContact O-N 3.11Å
695	I	83.8	Confident	76.3	Confident	26 Å²	26	74.6 Å²	74.6	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-60.2	-47.6	177.2	-64.5	166.5	0	0	0	111.3	V413 L427 V679 A691 R697 N698	V413-I695 HydrophobicContact CG2-CG2 3.77Å; L427-I695 HydrophobicContact CD2-CD1 4.25Å; V679-I695 HydrophobicContact CG1-CD1 3.93Å; V679-I695 HydrophobicContact CG1-CG1 4.2Å; V679-I695 HydrophobicContact CG2-CD1 4.26Å; V679-I695 HydrophobicContact CG2-CG1 3.6Å; A691-I695 WeakPolarHBondContact O-CG1 3.33Å; A691-I695 PolarHBondContact O-N 3.43Å; A691-I695 VanDerWaalsContact O-N 3.08Å; I695-R697 PolarHBondContact O-N 2.91Å; I695-N698 PolarHBondContact O-N 2.8Å
696	K	82.3	Confident	73.6	Confident	156 Å²	156	80.2 Å²	80.2	68%	0.678	42%	0.424	S	S	*	.	H	α-helix	trans	-65.5	-37.7	-177.2	-78.2	173.9	-177.1	178.7	0	113.1	L692 Q693 I694	L692-K696 WeakPolarHBondContact O-CB 3.41Å; L692-K696 WeakPolarHBondContact O-CG 3.39Å; L692-K696 PolarHBondContact O-N 3.47Å; Q693-K696 PolarHBondContact O-N 2.67Å; I694-K696 PolarHBondContact O-N 2.88Å
697	R	82.1	Confident	70.8	Confident	117 Å²	117	89.4 Å²	89.4	44%	0.442	44%	0.442	S	S	.	.	H	α-helix	trans	-88.2	-13.9	-178.4	-68.6	-167.2	172.4	102.6	-3.3	113.1	Q693 I694 I695 Q699	Q693-R697 WeakPolarHBondContact O-CB 3.39Å; Q693-R697 PolarHBondContact O-N 3Å; I694-R697 PolarHBondContact O-N 2.86Å; I695-R697 PolarHBondContact O-N 2.91Å; R697-Q699 HydrophobicContact CB-CB 4.23Å; R697-Q699 HydrophobicContact CB-CG 4.47Å; R697-Q699 WeakPolarHBondContact O-CG 3.32Å; R697-Q699 PolarHBondContact O-N 3.02Å
698	N	79.5	Confident	68	Low	82 Å²	82	91 Å²	91	44%	0.439	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	45.1	-172.5	-163	54.8	0	0	0	111.6	I412 I694 I695	I412-N698 WeakPolarHBondContact CD1-OD1 3.44Å; I694-N698 WeakPolarHBondContact O-CA 3.41Å; I694-N698 PolarHBondContact O-N 2.88Å; I695-N698 PolarHBondContact O-N 2.8Å
699	Q	81.2	Confident	65.3	Low	73 Å²	73	92.2 Å²	92.2	34%	0.341	47%	0.47	S	S	.	.			trans	-139.6	129.1	-175.3	-76	172.9	4.3	0	0	108.8	I694 R697 L701	I694-Q699 WeakPolarHBondContact CG2-O 3.5Å; I694-Q699 PolarHBondContact O-N 3.11Å; R697-Q699 HydrophobicContact CB-CB 4.23Å; R697-Q699 HydrophobicContact CB-CG 4.47Å; R697-Q699 WeakPolarHBondContact O-CG 3.32Å; R697-Q699 PolarHBondContact O-N 3.02Å; Q699-L701 VanDerWaalsContact C-N 3.32Å; Q699-L701 PolarHBondContact O-N 3.12Å
700	L	78.4	Confident	62.9	Low	7 Å²	7	90 Å²	90	4%	0.037	47%	0.47	C	S	.	.	S	Bend	trans	-60.9	-40.5	-178	-172.3	65.7	0	0	0	112.7	F639 L658 A662 I670 A674	F639-L700 HydrophobicContact CE1-CD2 3.53Å; F639-L700 HydrophobicContact CZ-CD2 4.14Å; L658-L700 HydrophobicContact CB-CD2 4.37Å; L658-L700 HydrophobicContact CD2-CD1 3.93Å; L658-L700 HydrophobicContact CG-CD2 4.35Å; A662-L700 HydrophobicContact CB-CD2 4.18Å; I670-L700 HydrophobicContact CD1-CB 4.09Å; I670-L700 HydrophobicContact CD1-CD2 4.43Å; I670-L700 HydrophobicContact CG2-CB 4.38Å; I670-L700 HydrophobicContact CG2-CD2 4.34Å; A674-L700 WeakPolarHBondContact O-CD1 3.42Å
701	L	71.4	Confident	60.4	Low	65 Å²	65	93.2 Å²	93.2	34%	0.34	49%	0.487	S	S	.	.	S	Bend	trans	-117.6	111.7	176.9	-62.2	179.9	0	0	0	109	H659 A662 Q699 S703	H659-L701 WeakPolarHBondContact CE1-CD2 3.33Å; H659-L701 VanDerWaalsContact ND1-CD2 3.33Å; H659-L701 WeakPolarHBondContact ND1-CD2 3.48Å; A662-L701 HydrophobicContact CB-CD1 3.55Å; A662-L701 HydrophobicContact CB-CG 4.12Å; Q699-L701 VanDerWaalsContact C-N 3.32Å; Q699-L701 PolarHBondContact O-N 3.12Å; L701-S703 PolarHBondContact O-N 3.33Å
702	P	57.9	Low	58.1	Low	31 Å²	31	98.7 Å²	98.7	20%	0.201	52%	0.523	C	S	.	.			trans	-66.7	122	171.6	21.9	-24.4	0	0	0	108.6	L690 T704	L690-P702 HydrophobicContact CD1-CG 3.56Å; P702-T704 PolarHBondContact O-N 3.27Å; P702-T704 VanDerWaalsContact O-N 3.15Å
703	S	47	Very low	55.8	Low	89 Å²	89	105.5 Å²	105.5	62%	0.622	54%	0.544	S	S	*	.			trans	-56.9	120.8	175.6	31.1	0	0	0	0	109.8	L701 L705	L701-S703 PolarHBondContact O-N 3.33Å; S703-L705 VanDerWaalsContact C-N 3.28Å; S703-L705 PolarHBondContact O-N 3.39Å
704	T	37	Very low	53.3	Low	132 Å²	132	111.8 Å²	111.8	81%	0.81	57%	0.57	S	S	*	*			trans	-65.4	92.5	169.3	48.7	0	0	0	0	107.7	P702 H706	P702-T704 PolarHBondContact O-N 3.27Å; P702-T704 VanDerWaalsContact O-N 3.15Å; T704-H706 PolarHBondContact O-N 2.78Å
705	L	32.5	Very low	50.7	Low	153 Å²	153	121.2 Å²	121.2	80%	0.801	61%	0.611	S	S	*	*			trans	-59.6	107.9	160.5	-89.6	155.5	0	0	0	106.4	S703 R707	S703-L705 VanDerWaalsContact C-N 3.28Å; S703-L705 PolarHBondContact O-N 3.39Å; L705-R707 PolarHBondContact O-N 2.89Å
706	H	28.6	Very low	48.3	Very low	182 Å²	182	126.2 Å²	126.2	84%	0.843	65%	0.645	S	S	*	*			trans	-48.5	106.7	162.3	-106.7	-75.1	0	0	0	107	T704 S708	T704-H706 PolarHBondContact O-N 2.78Å; H706-S708 PolarHBondContact O-N 3.43Å
707	R	29.1	Very low	45.9	Very low	247 Å²	247	124.5 Å²	124.5	93%	0.932	65%	0.653	S	S	*	*			trans	-75.7	81.8	172.2	-144.8	-178.8	-163.5	-164.1	3.9	105.8	L705 S709	L705-R707 PolarHBondContact O-N 2.89Å; R707-S709 PolarHBondContact O-N 3.14Å; R707-S709 VanDerWaalsContact O-N 3.12Å
708	S	29.8	Very low	43.7	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	67%	0.673	S	S	*	*			trans	-61.1	113.6	164.1	53.9	0	0	0	0	106.9	H706	H706-S708 PolarHBondContact O-N 3.43Å
709	S	30.8	Very low	41.5	Very low	106 Å²	106	129.6 Å²	129.6	74%	0.741	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-50.1	137.9	174.2	-170.7	0	0	0	0	110.1	R707 D711	R707-S709 PolarHBondContact O-N 3.14Å; R707-S709 VanDerWaalsContact O-N 3.12Å; S709-D711 PolarHBondContact O-N 3.38Å
710	P	37.2	Very low	39.1	Very low	116 Å²	116	134.6 Å²	134.6	75%	0.753	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-71.1	120.9	174.4	27.4	-27.4	0	0	0	109.2
711	D	35.3	Very low	36.8	Very low	121 Å²	121	143.1 Å²	143.1	65%	0.647	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-64.1	122.5	171.4	-170.6	-1.4	0	0	0	109.3	S709 R713	S709-D711 PolarHBondContact O-N 3.38Å; D711-R713 PolarHBondContact O-N 2.9Å
712	P	37.3	Very low	35	Very low	118 Å²	118	148 Å²	148	77%	0.766	78%	0.783	S	S	*	*	S	Bend	trans	-83.2	51.6	-172.3	36.3	-36.6	0	0	0	111.1
713	R	37.1	Very low	33.7	Very low	207 Å²	207	152.2 Å²	152.2	78%	0.781	81%	0.81	S	S	*	*			trans	-145.4	75.4	175	-78.2	-172.7	-81.8	-173.7	-6.5	111.8	D711	D711-R713 PolarHBondContact O-N 2.9Å
714	K	34.9	Very low	32.9	Very low	212 Å²	212	153.4 Å²	153.4	92%	0.922	82%	0.819	S	S	*	*			trans	-158.7	122.8	151	-106.5	161.2	-170.7	-176.4	0	110.3
715	K	32	Very low	32.7	Very low	201 Å²	201	152.6 Å²	152.6	87%	0.874	82%	0.819	S	S	*	*			trans	-67.8	156.3	-179.1	-73.9	178.6	175.3	179.6	0	111.9
716	P	33.8	Very low	32.7	Very low	130 Å²	130	154.3 Å²	154.3	84%	0.844	82%	0.82	S	S	*	*			trans	-83.8	135	-178.1	33.1	-31.2	0	0	0	111.8
717	S	32.2	Very low	32.9	Very low	120 Å²	120	152.4 Å²	152.4	84%	0.839	82%	0.822	S	S	*	*			trans	-105.7	140.9	163.8	52.8	0	0	0	0	110.2
718	Q	34.1	Very low	33.1	Very low	184 Å²	184	148.1 Å²	148.1	86%	0.86	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-57.4	163.8	-165.7	-75	172.6	-19.6	0	0	117.4
719	P	33.7	Very low	33.3	Very low	123 Å²	123	148.8 Å²	148.8	80%	0.799	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.8	136.7	-172.8	33.1	-31.4	0	0	0	113
720	L	30.7	Very low	33.2	Very low	178 Å²	178	152.4 Å²	152.4	93%	0.932	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-78.6	131.3	166.9	-98.5	98.5	0	0	0	111
721	Q	29.5	Very low	33.2	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.864	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-63.1	140.8	176.2	-76.4	165.1	-50.8	0	0	113.4
722	L	33.8	Very low	33.3	Very low	167 Å²	167	166.1 Å²	166.1	87%	0.874	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-71.1	143.9	158.6	-79.7	144.2	0	0	0	110.5
723	P	32.3	Very low	33.2	Very low	120 Å²	120	168.6 Å²	168.6	78%	0.779	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-93.6	122.9	155.2	6.1	13.1	0	0	0	110.3
724	S	30.3	Very low	32.9	Very low	114 Å²	114	166.5 Å²	166.5	80%	0.797	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-75.8	138	162.1	51.9	0	0	0	0	111.2
725	S	31.6	Very low	32.8	Very low	116 Å²	116	164 Å²	164	81%	0.811	86%	0.857	S	S	*	*			trans	-146.4	109.1	150.3	44.2	0	0	0	0	111
726	F	32.3	Very low	32.9	Very low	188 Å²	188	161.8 Å²	161.8	83%	0.825	86%	0.856	S	S	*	*			trans	-71.8	134.2	159.9	-109.7	-103.1	0	0	0	108.9
727	T	32.9	Very low	32.8	Very low	143 Å²	143	163.8 Å²	163.8	88%	0.877	86%	0.857	S	S	*	*			trans	-146.6	112.8	145.7	-6.5	0	0	0	0	109.6
728	Q	34.1	Very low	32.9	Very low	157 Å²	157	166.7 Å²	166.7	73%	0.734	86%	0.858	S	S	*	*			trans	-78	173.4	163.4	-87.1	-177.6	-25.9	0	0	110.7
729	V	32.8	Very low	32.8	Very low	119 Å²	119	165.5 Å²	165.5	72%	0.721	86%	0.858	S	S	*	*			trans	101.2	123.8	158.9	-172.2	0	0	0	0	111.9
730	Q	30	Very low	32.7	Very low	182 Å²	182	168.8 Å²	168.8	85%	0.85	86%	0.862	S	S	*	*			cis	-161.6	161.6	13.5	-133.2	158.7	18.5	0	0	110.8
731	R	35.9	Very low	32.9	Very low	243 Å²	243	168 Å²	168	92%	0.917	86%	0.856	S	S	*	*			trans	-59.4	134.7	165.3	-76.9	174.2	168.7	165.9	-4.5	112.8
732	K	39.2	Very low	33.2	Very low	282 Å²	282	166.5 Å²	166.5	100%	1.226	86%	0.856	S	S	*	*				-155.1	0	113.6	-121.8	-176.9	-176.5	-179	0	109.7

Retrieved 732 of 732 residues in 214.3 ms (Link to these results)

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