A0A670KI84_PODMU Loading...

COP9 signalosome complex subunit 2

AlphaFold DB , UniProt , Accession A0A670KI84, Species PODMU (Podarcis muralis, Wall lizard), Gene COPS2, Length 450 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	30.3	Very low	30.4	Very low	242 Å²	242	164.8 Å²	164.8	100%	1.192	86%	0.86	S	S	*	*				0	114	0	-83.7	171.5	163.2	0	0	105.9
2	S	34.9	Very low	30.6	Very low	109 Å²	109	162.5 Å²	162.5	76%	0.762	85%	0.849	S	S	*	*			trans	-84.7	119.1	-176.3	44.5	0	0	0	0	108.9
3	D	29.3	Very low	31	Very low	160 Å²	160	164.8 Å²	164.8	86%	0.856	85%	0.853	S	S	*	*			trans	-153.4	68.5	169.9	-77.5	-42.8	0	0	0	108.9
4	M	29.6	Very low	31.5	Very low	189 Å²	189	162.1 Å²	162.1	93%	0.931	84%	0.835	S	S	*	*			trans	-150.8	36.7	172.9	-151.4	150.5	-168	0	0	113.8
5	E	29.7	Very low	31.5	Very low	191 Å²	191	160.7 Å²	160.7	89%	0.893	83%	0.829	S	S	*	*			trans	-136.7	68.5	173.4	-72.4	-173.9	167.6	0	0	109.4
6	D	29	Very low	31.8	Very low	151 Å²	151	164.9 Å²	164.9	81%	0.807	83%	0.833	S	S	*	*			trans	-158.6	35.3	167.5	-144.4	11.4	0	0	0	115.6
7	D	28.3	Very low	31.9	Very low	160 Å²	160	162.1 Å²	162.1	86%	0.856	82%	0.821	S	S	*	*			trans	-131.3	34.4	-175.1	-139.5	13.1	0	0	0	114.4
8	F	30.2	Very low	31.9	Very low	198 Å²	198	159.9 Å²	159.9	87%	0.868	81%	0.811	S	S	*	*			trans	-134.1	41.5	175.2	-122.5	-91.8	0	0	0	113.8
9	M	32.8	Very low	31.9	Very low	160 Å²	160	159.7 Å²	159.7	79%	0.788	81%	0.807	S	S	*	*			trans	-95.7	66.1	159.1	-66.5	-64.5	-157.6	0	0	109.1	D11	M9-D11 PolarHBondContact O-N 2.86Å
10	C	29.8	Very low	32.1	Very low	109 Å²	109	161.3 Å²	161.3	74%	0.736	80%	0.804	S	S	*	*			trans	-78.4	88.4	151.7	-80.3	0	0	0	0	106.1	D12	C10-D12 VanDerWaalsContact C-N 3.32Å; C10-D12 PolarHBondContact O-N 3.05Å
11	D	30.7	Very low	32.1	Very low	144 Å²	144	158 Å²	158	77%	0.77	80%	0.797	S	S	*	*			trans	-50.4	106.8	150.8	-94.3	-31.4	0	0	0	106.2	M9 E13	M9-D11 PolarHBondContact O-N 2.86Å; D11-E13 VanDerWaalsContact C-N 3.3Å; D11-E13 PolarHBondContact O-N 3.07Å
12	D	32.7	Very low	32.4	Very low	137 Å²	137	154.9 Å²	154.9	73%	0.733	78%	0.779	S	S	*	*			trans	-58	105.2	159.3	-77.5	-38.6	0	0	0	105.2	C10 E14	C10-D12 VanDerWaalsContact C-N 3.32Å; C10-D12 PolarHBondContact O-N 3.05Å; D12-E14 PolarHBondContact O-N 2.78Å
13	E	36.1	Very low	32.5	Very low	193 Å²	193	157.6 Å²	157.6	90%	0.902	79%	0.785	S	S	*	*			trans	-54.8	75.7	159.7	-71.9	179	151.4	0	0	108.1	D11 D15	D11-E13 VanDerWaalsContact C-N 3.3Å; D11-E13 PolarHBondContact O-N 3.07Å; E13-D15 VanDerWaalsContact C-N 3.33Å; E13-D15 PolarHBondContact O-N 3.45Å
14	E	37.7	Very low	32.6	Very low	127 Å²	127	153.6 Å²	153.6	59%	0.593	77%	0.769	S	S	*	*			trans	-75	95.9	159	-83.4	-173.3	169.1	0	0	105.2	D12 K73	D12-E14 PolarHBondContact O-N 2.78Å; E14-K73 IonicContact OE1-NZ 2.77Å; E14-K73 PolarHBondContact OE1-NZ 3.04Å; E14-K73 IonicContact OE2-NZ 3.78Å
15	D	30.9	Very low	33	Very low	141 Å²	141	153.6 Å²	153.6	75%	0.754	77%	0.773	S	S	*	*			trans	-4.4	124.1	166.3	-80.3	-46.9	0	0	0	114.9	E13 D17	E13-D15 VanDerWaalsContact C-N 3.33Å; E13-D15 PolarHBondContact O-N 3.45Å; D15-D17 HydrophobicContact CB-CB 4.34Å; D15-D17 PolarHBondContact O-N 2.8Å
16	Y	37.2	Very low	33.4	Very low	227 Å²	227	148.5 Å²	148.5	89%	0.89	76%	0.759	S	S	*	*			trans	-63	70.3	152.6	-95.9	-92.8	0	0	0	108.6	L18	Y16-L18 PolarHBondContact O-N 2.83Å
17	D	33.4	Very low	33.9	Very low	118 Å²	118	150.3 Å²	150.3	63%	0.631	76%	0.762	S	S	*	*			trans	-80.2	79.6	170.5	-142.4	5.6	0	0	0	106.8	D15 E19	D15-D17 HydrophobicContact CB-CB 4.34Å; D15-D17 PolarHBondContact O-N 2.8Å; D17-E19 PolarHBondContact O-N 3.06Å
18	L	32.5	Very low	34.8	Very low	123 Å²	123	147.3 Å²	147.3	64%	0.644	75%	0.752	S	S	*	*			trans	-66.2	68.3	158.7	-83.4	158.3	0	0	0	107.5	Y16 Y20	Y16-L18 PolarHBondContact O-N 2.83Å; L18-Y20 HydrophobicContact CB-CD2 4.44Å; L18-Y20 HydrophobicContact CB-CE2 4.37Å; L18-Y20 HydrophobicContact CD2-CE2 4.18Å; L18-Y20 PolarHBondContact O-N 3.41Å
19	E	31.9	Very low	36.1	Very low	155 Å²	155	142.3 Å²	142.3	72%	0.724	73%	0.734	S	S	*	*			trans	-67.9	88.8	162.2	-85.6	-168.9	156.4	0	0	106.6	D17 S21	D17-E19 PolarHBondContact O-N 3.06Å; E19-S21 PolarHBondContact O-N 2.96Å
20	Y	34.9	Very low	37.4	Very low	192 Å²	192	138.5 Å²	138.5	75%	0.753	72%	0.719	S	S	*	*			trans	-61.9	93.3	155.2	-78	-89	0	0	0	106.4	L18 E22	L18-Y20 HydrophobicContact CB-CD2 4.44Å; L18-Y20 HydrophobicContact CB-CE2 4.37Å; L18-Y20 HydrophobicContact CD2-CE2 4.18Å; L18-Y20 PolarHBondContact O-N 3.41Å; Y20-E22 PolarHBondContact O-N 2.91Å
21	S	32.1	Very low	39	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	71%	0.714	S	S	*	*			trans	-68.3	80.5	166.8	59.9	0	0	0	0	108.3	E19 D23	E19-S21 PolarHBondContact O-N 2.96Å; S21-D23 PolarHBondContact O-N 3.14Å
22	E	36	Very low	40.8	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.822	68%	0.68	S	S	*	*			trans	-68.7	75.1	160.5	-71.8	-171.2	171.7	0	0	107.9	Y20	Y20-E22 PolarHBondContact O-N 2.91Å
23	D	37.1	Very low	42.6	Very low	166 Å²	166	129 Å²	129	89%	0.888	66%	0.66	S	S	*	*			trans	160.5	70.5	152.3	-85.1	-25.6	0	0	0	111.1	S21	S21-D23 PolarHBondContact O-N 3.14Å
24	S	32	Very low	44.3	Very low	75 Å²	75	124 Å²	124	52%	0.524	64%	0.639	S	S	.	*			trans	-152.3	119	144.9	63.1	0	0	0	0	109.6	S26	S24-S26 PolarHBondContact O-N 2.69Å
25	N	37.2	Very low	46	Very low	189 Å²	189	120.3 Å²	120.3	100%	1.011	62%	0.621	S	S	*	*			trans	-72.3	68.1	173.5	-88.3	-37.4	0	0	0	110.6
26	S	39.7	Very low	48.3	Very low	84 Å²	84	114.5 Å²	114.5	59%	0.587	59%	0.589	S	S	*	*	S	Bend	trans	-137.3	113.6	164.1	41.2	0	0	0	0	106.8	S24	S24-S26 PolarHBondContact O-N 2.69Å
27	E	39.7	Very low	50.2	Low	189 Å²	189	109.3 Å²	109.3	88%	0.883	57%	0.569	S	S	*	*			trans	-46.9	128	179.6	-68.4	177.2	156.1	0	0	110.2	N29	E27-N29 PolarHBondContact O-N 3.17Å
28	P	46.2	Very low	52.3	Low	97 Å²	97	108.8 Å²	108.8	63%	0.63	57%	0.566	S	S	*	*			trans	-62	125.2	174.3	25	-29.9	0	0	0	107.1	V30	P28-V30 WeakPolarHBondContact O-CG2 3.42Å; P28-V30 PolarHBondContact O-N 3.16Å
29	N	57.1	Low	54.3	Low	93 Å²	93	103 Å²	103	50%	0.497	54%	0.536	S	S	.	.			trans	-75.2	77.7	-175.7	-148	-11.6	0	0	0	108.4	E27 D31 L32 E33	E27-N29 PolarHBondContact O-N 3.17Å; N29-D31 PolarHBondContact O-N 3.43Å; N29-L32 HydrophobicContact CB-CB 4.46Å; N29-L32 HydrophobicContact CB-CD1 3.92Å; N29-L32 HydrophobicContact CB-CG 4.24Å; N29-L32 WeakPolarHBondContact ND2-CD1 3.4Å; N29-L32 WeakPolarHBondContact O-CB 3.47Å; N29-L32 PolarHBondContact O-N 3.44Å; N29-E33 PolarHBondContact O-N 2.94Å
30	V	60.5	Low	56.4	Low	80 Å²	80	100.4 Å²	100.4	49%	0.485	52%	0.522	S	S	.	.	H	α-helix	trans	-49.8	-30.9	-170.9	177	0	0	0	0	112.2	P28 N34	P28-V30 WeakPolarHBondContact O-CG2 3.42Å; P28-V30 PolarHBondContact O-N 3.16Å; V30-N34 WeakPolarHBondContact CG1-ND2 3.37Å; V30-N34 WeakPolarHBondContact O-CB 3.49Å; V30-N34 VanDerWaalsContact O-CG 3.24Å; V30-N34 PolarHBondContact O-N 3.49Å; V30-N34 PolarHBondContact O-ND2 3.4Å; V30-N34 VanDerWaalsContact O-ND2 3.15Å
31	D	63.5	Low	58.4	Low	117 Å²	117	94.5 Å²	94.5	63%	0.626	51%	0.513	S	S	*	.	H	α-helix	trans	-68.9	-37.5	178.5	-65.8	-29.1	0	0	0	113.1	N29 Q35	N29-D31 PolarHBondContact O-N 3.43Å; D31-Q35 VanDerWaalsContact O-CB 3.27Å; D31-Q35 WeakPolarHBondContact O-CB 3.41Å; D31-Q35 PolarHBondContact O-N 3Å; D31-Q35 VanDerWaalsContact O-N 3.11Å
32	L	68.2	Low	60.6	Low	10 Å²	10	92.8 Å²	92.8	5%	0.052	50%	0.496	C	S	.	.	H	α-helix	trans	-69.7	-40	177.3	-69.3	177.5	0	0	0	111.6	N29 Q35 Y36 V57 L60 E61	N29-L32 HydrophobicContact CB-CB 4.46Å; N29-L32 HydrophobicContact CB-CD1 3.92Å; N29-L32 HydrophobicContact CB-CG 4.24Å; N29-L32 WeakPolarHBondContact ND2-CD1 3.4Å; N29-L32 WeakPolarHBondContact O-CB 3.47Å; N29-L32 PolarHBondContact O-N 3.44Å; L32-Q35 PolarHBondContact O-N 2.95Å; L32-Y36 WeakPolarHBondContact O-CB 3.47Å; L32-Y36 PolarHBondContact O-N 3.23Å; L32-V57 HydrophobicContact CD2-CG1 4.4Å; L32-L60 HydrophobicContact CD2-CB 3.55Å; L32-E61 HydrophobicContact CD1-CB 4.46Å
33	E	70	Confident	62.4	Low	65 Å²	65	86.4 Å²	86.4	30%	0.304	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-49.1	178.9	-179.6	166.4	-159.1	0	0	111.4	N29 Q35 Y36 Y37 W67	N29-E33 PolarHBondContact O-N 2.94Å; E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 3.02Å; E33-Y36 PolarHBondContact O-N 3.41Å; E33-Y37 HydrophobicContact CG-CD2 3.76Å; E33-Y37 HydrophobicContact CG-CE2 3.43Å; E33-Y37 VanDerWaalsContact CG-CE2 3.43Å; E33-Y37 WeakPolarHBondContact O-CD2 3.4Å; E33-Y37 PolarHBondContact O-N 2.93Å; E33-Y37 WeakPolarHBondContact OE1-CE2 3.34Å; E33-W67 HydrophobicContact CB-CH2 4.13Å; E33-W67 HydrophobicContact CB-CZ2 3.87Å; E33-W67 HydrophobicContact CG-CH2 3.59Å; E33-W67 HydrophobicContact CG-CZ2 3.69Å; E33-W67 HydrophobicContact CG-CZ3 4.33Å
34	N	73.1	Confident	64	Low	86 Å²	86	84.7 Å²	84.7	46%	0.46	45%	0.453	S	S	.	.	H	α-helix	trans	-58.2	-41	176.1	-76.3	-28.4	0	0	0	111.7	V30 N38	V30-N34 WeakPolarHBondContact CG1-ND2 3.37Å; V30-N34 WeakPolarHBondContact O-CB 3.49Å; V30-N34 VanDerWaalsContact O-CG 3.24Å; V30-N34 PolarHBondContact O-N 3.49Å; V30-N34 PolarHBondContact O-ND2 3.4Å; V30-N34 VanDerWaalsContact O-ND2 3.15Å; N34-N38 WeakPolarHBondContact O-CB 3.45Å; N34-N38 PolarHBondContact O-N 3.38Å; N34-N38 PolarHBondContact O-ND2 3.25Å; N34-N38 VanDerWaalsContact O-ND2 3.08Å
35	Q	73.3	Confident	66.1	Low	50 Å²	50	87.1 Å²	87.1	23%	0.234	46%	0.46	C	S	.	.	H	α-helix	trans	-72.7	-32.4	179.6	-167.1	162.9	-5.2	0	0	113.1	D31 L32 E33 S39 V57	D31-Q35 VanDerWaalsContact O-CB 3.27Å; D31-Q35 WeakPolarHBondContact O-CB 3.41Å; D31-Q35 PolarHBondContact O-N 3Å; D31-Q35 VanDerWaalsContact O-N 3.11Å; L32-Q35 PolarHBondContact O-N 2.95Å; E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 3.02Å; Q35-S39 WeakPolarHBondContact O-CB 3.46Å; Q35-S39 PolarHBondContact O-N 3.5Å; Q35-S39 PolarHBondContact O-OG 3.47Å; Q35-V57 HydrophobicContact CB-CG2 4.12Å; Q35-V57 HydrophobicContact CG-CG2 3.8Å
36	Y	79.3	Confident	68.2	Low	19 Å²	19	83 Å²	83	8%	0.075	44%	0.437	C	S	.	.	H	α-helix	trans	-64.6	-47.5	172.6	176.7	-95.7	0	0	0	111.8	L32 E33 S39 K40 F54 W67 K70 A71 Q74	L32-Y36 WeakPolarHBondContact O-CB 3.47Å; L32-Y36 PolarHBondContact O-N 3.23Å; E33-Y36 PolarHBondContact O-N 3.41Å; Y36-S39 WeakPolarHBondContact O-CB 3.37Å; Y36-S39 PolarHBondContact O-N 3.04Å; Y36-K40 PolarHBondContact O-N 3.34Å; Y36-F54 HydrophobicContact CD2-CD1 4.15Å; Y36-F54 AromaticContact CD2-CE1 3.72Å; Y36-F54 HydrophobicContact CD2-CE1 3.72Å; Y36-F54 HydrophobicContact CE2-CD1 4.36Å; Y36-F54 AromaticContact CE2-CE1 3.74Å; Y36-F54 HydrophobicContact CE2-CE1 3.74Å; Y36-W67 AromaticContact CD1-CE3 3.97Å; Y36-W67 HydrophobicContact CD1-CE3 3.97Å; Y36-W67 AromaticContact CD1-CZ3 3.59Å; Y36-W67 HydrophobicContact CD1-CZ3 3.59Å; Y36-W67 HydrophobicContact CD2-CE3 4.42Å; Y36-W67 HydrophobicContact CE1-CZ3 4.12Å; Y36-W67 AromaticContact CG-CE3 3.87Å; Y36-W67 HydrophobicContact CG-CE3 3.87Å; Y36-W67 AromaticContact CG-CZ3 3.98Å; Y36-W67 HydrophobicContact CG-CZ3 3.98Å; Y36-K70 HydrophobicContact CD2-CB 4.48Å; Y36-K70 HydrophobicContact CE2-CB 3.75Å; Y36-A71 HydrophobicContact CD2-CB 4.26Å; Y36-A71 HydrophobicContact CE2-CB 4.44Å; Y36-Q74 HydrophobicContact CE2-CG 4.39Å
37	Y	76.1	Confident	70.1	Confident	118 Å²	118	81.1 Å²	81.1	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-66.8	-39	179	-73	-64.9	0	0	0	112.6	E33 S39 K40 A41 W67	E33-Y37 HydrophobicContact CG-CD2 3.76Å; E33-Y37 HydrophobicContact CG-CE2 3.43Å; E33-Y37 VanDerWaalsContact CG-CE2 3.43Å; E33-Y37 WeakPolarHBondContact O-CD2 3.4Å; E33-Y37 PolarHBondContact O-N 2.93Å; E33-Y37 WeakPolarHBondContact OE1-CE2 3.34Å; Y37-S39 VanDerWaalsContact C-N 3.29Å; Y37-S39 PolarHBondContact O-N 3.03Å; Y37-K40 PolarHBondContact O-N 3.41Å; Y37-K40 VanDerWaalsContact O-N 3.16Å; Y37-A41 PolarHBondContact O-N 3.39Å; Y37-W67 HydrophobicContact CE2-CH2 4.22Å
38	N	77.1	Confident	72.1	Confident	107 Å²	107	80 Å²	80	57%	0.572	42%	0.415	S	S	*	.	H	α-helix	trans	-59.3	-41	171.6	-74	-27.6	0	0	0	111.7	N34 K40 A41 L42	N34-N38 WeakPolarHBondContact O-CB 3.45Å; N34-N38 PolarHBondContact O-N 3.38Å; N34-N38 PolarHBondContact O-ND2 3.25Å; N34-N38 VanDerWaalsContact O-ND2 3.08Å; N38-K40 VanDerWaalsContact C-N 3.35Å; N38-A41 PolarHBondContact O-N 3.46Å; N38-L42 WeakPolarHBondContact O-CD1 3.34Å; N38-L42 WeakPolarHBondContact O-CG 3.43Å; N38-L42 PolarHBondContact O-N 3.29Å
39	S	76.2	Confident	73.7	Confident	1 Å²	1	77 Å²	77	1%	0.007	40%	0.399	C	S	.	.	H	α-helix	trans	-68.6	-32.7	176.6	-55.9	0	0	0	0	112.7	Q35 Y36 Y37 S53 F54	Q35-S39 WeakPolarHBondContact O-CB 3.46Å; Q35-S39 PolarHBondContact O-N 3.5Å; Q35-S39 PolarHBondContact O-OG 3.47Å; Y36-S39 WeakPolarHBondContact O-CB 3.37Å; Y36-S39 PolarHBondContact O-N 3.04Å; Y37-S39 VanDerWaalsContact C-N 3.29Å; Y37-S39 PolarHBondContact O-N 3.03Å; S39-S53 WeakPolarHBondContact OG-CB 3.24Å; S39-F54 VanDerWaalsContact C-CZ 3.47Å; S39-F54 WeakPolarHBondContact O-CE2 3.48Å
40	K	75.1	Confident	74.9	Confident	102 Å²	102	72.6 Å²	72.6	44%	0.443	38%	0.376	S	S	.	.	H	α-helix	trans	-70.4	-39.9	176.5	-169.2	-179.4	177.6	-171.5	0	111.8	Y36 Y37 N38 L42 K43 F54	Y36-K40 PolarHBondContact O-N 3.34Å; Y37-K40 PolarHBondContact O-N 3.41Å; Y37-K40 VanDerWaalsContact O-N 3.16Å; N38-K40 VanDerWaalsContact C-N 3.35Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 3.37Å; K40-K43 WeakPolarHBondContact O-CB 3.12Å; K40-K43 PolarHBondContact O-N 2.94Å; K40-K43 VanDerWaalsContact O-N 3.17Å; K40-F54 HydrophobicContact CB-CZ 4.35Å
41	A	77	Confident	76	Confident	68 Å²	68	70.1 Å²	70.1	56%	0.562	36%	0.36	S	S	*	.	H	α-helix	trans	-61	-40.5	174.4	0	0	0	0	0	111.7	Y37 N38 K43	Y37-A41 PolarHBondContact O-N 3.39Å; N38-A41 PolarHBondContact O-N 3.46Å; A41-K43 PolarHBondContact O-N 3.47Å; A41-K43 VanDerWaalsContact O-N 3.1Å
42	L	77.4	Confident	76.9	Confident	57 Å²	57	67.4 Å²	67.4	30%	0.298	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-9.9	177.1	-75.3	158.9	0	0	0	114.6	N38 K40 D46 A50	N38-L42 WeakPolarHBondContact O-CD1 3.34Å; N38-L42 WeakPolarHBondContact O-CG 3.43Å; N38-L42 PolarHBondContact O-N 3.29Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 3.37Å; L42-D46 CarbonylContact O-C 3.39Å; L42-D46 PolarHBondContact O-N 2.94Å; L42-A50 HydrophobicContact CB-CB 4.1Å
43	K	74.6	Confident	77.5	Confident	41 Å²	41	68 Å²	68	18%	0.178	35%	0.354	C	S	.	.	H	α-helix	trans	-66.3	-36.7	-176.9	-178.1	179.2	171.1	-171.3	0	112.9	K40 A41 I78	K40-K43 WeakPolarHBondContact O-CB 3.12Å; K40-K43 PolarHBondContact O-N 2.94Å; K40-K43 VanDerWaalsContact O-N 3.17Å; A41-K43 PolarHBondContact O-N 3.47Å; A41-K43 VanDerWaalsContact O-N 3.1Å; K43-I78 HydrophobicContact CB-CD1 4.49Å; K43-I78 HydrophobicContact CD-CD1 4.27Å; K43-I78 HydrophobicContact CD-CG1 4.24Å; K43-I78 HydrophobicContact CG-CD1 3.93Å; K43-I78 HydrophobicContact CG-CG1 3.98Å
44	E	71.8	Confident	78.1	Confident	131 Å²	131	64.9 Å²	64.9	61%	0.612	34%	0.34	S	S	*	.	H	α-helix	trans	-81.8	-31.3	-178.8	-60.8	-55.3	132.4	0	0	111.5
45	D	74.3	Confident	78.6	Confident	126 Å²	126	63 Å²	63	67%	0.674	33%	0.328	S	S	*	.	H	α-helix	trans	-84.1	-52.3	-178.3	-64.3	-35.9	0	0	0	113
46	D	81.9	Confident	79	Confident	101 Å²	101	65.7 Å²	65.7	54%	0.54	34%	0.34	S	S	.	.			trans	-145	91.1	-173.2	-92.8	-45	0	0	0	111.8	L42 K48 A49 A50	L42-D46 CarbonylContact O-C 3.39Å; L42-D46 PolarHBondContact O-N 2.94Å; D46-K48 PolarHBondContact O-N 3.49Å; D46-K48 VanDerWaalsContact O-N 3.13Å; D46-A49 HydrophobicContact CB-CB 3.77Å; D46-A49 PolarHBondContact O-N 2.73Å; D46-A50 PolarHBondContact O-N 2.9Å
47	P	79.8	Confident	79.1	Confident	45 Å²	45	64.8 Å²	64.8	29%	0.292	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-27.8	-173.1	23.9	-34.7	0	0	0	113.4	L51 I78 L82	P47-L51 WeakPolarHBondContact O-CG 3.39Å; P47-L51 PolarHBondContact O-N 3.39Å; P47-I78 HydrophobicContact CB-CG2 3.71Å; P47-L82 HydrophobicContact CB-CD1 4.09Å; P47-L82 HydrophobicContact CB-CD2 4.2Å; P47-L82 HydrophobicContact CB-CG 4.3Å; P47-L82 HydrophobicContact CG-CD1 4.47Å; P47-L82 HydrophobicContact CG-CD2 3.88Å
48	K	81.3	Confident	79.2	Confident	165 Å²	165	60.2 Å²	60.2	72%	0.717	32%	0.319	S	S	*	.	H	α-helix	trans	-73.3	-38.6	174.5	-70.8	179.9	-177.6	174.4	0	112.6	D46 L51 S52 L82	D46-K48 PolarHBondContact O-N 3.49Å; D46-K48 VanDerWaalsContact O-N 3.13Å; K48-L51 PolarHBondContact O-N 3.35Å; K48-S52 PolarHBondContact O-N 2.89Å; K48-L82 HydrophobicContact CG-CD1 4.26Å
49	A	80.4	Confident	79.3	Confident	36 Å²	36	61.5 Å²	61.5	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-68.6	-41.2	175.7	0	0	0	0	0	110.3	D46 L51 S52 S53	D46-A49 HydrophobicContact CB-CB 3.77Å; D46-A49 PolarHBondContact O-N 2.73Å; A49-L51 VanDerWaalsContact C-N 3.32Å; A49-L51 PolarHBondContact O-N 2.8Å; A49-S52 PolarHBondContact O-N 3Å; A49-S52 VanDerWaalsContact O-N 3.09Å; A49-S52 PolarHBondContact O-OG 3.22Å; A49-S53 PolarHBondContact O-N 3.44Å; A49-S53 PolarHBondContact O-OG 3.05Å
50	A	82.4	Confident	79.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-55.8	-43.5	174.3	0	0	0	0	0	112.4	L42 D46 S52 S53 F54 I78	L42-A50 HydrophobicContact CB-CB 4.1Å; D46-A50 PolarHBondContact O-N 2.9Å; A50-S52 VanDerWaalsContact C-N 3.32Å; A50-S52 PolarHBondContact O-N 3.42Å; A50-S53 PolarHBondContact O-N 3Å; A50-S53 VanDerWaalsContact O-N 3.15Å; A50-F54 HydrophobicContact CB-CD2 4.4Å; A50-F54 HydrophobicContact CB-CE2 4.22Å; A50-F54 WeakPolarHBondContact O-CD2 3.48Å; A50-F54 PolarHBondContact O-N 2.82Å; A50-I78 HydrophobicContact CB-CD1 4.16Å
51	L	82.8	Confident	79	Confident	28 Å²	28	62.2 Å²	62.2	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-42	175.5	-73.2	170.6	0	0	0	112.6	P47 K48 A49 S53 Q55 M75 I78 N79 L82	P47-L51 WeakPolarHBondContact O-CG 3.39Å; P47-L51 PolarHBondContact O-N 3.39Å; K48-L51 PolarHBondContact O-N 3.35Å; A49-L51 VanDerWaalsContact C-N 3.32Å; A49-L51 PolarHBondContact O-N 2.8Å; L51-S53 VanDerWaalsContact C-N 3.34Å; L51-Q55 WeakPolarHBondContact O-CB 3.33Å; L51-Q55 PolarHBondContact O-N 2.91Å; L51-M75 HydrophobicContact CD2-CB 3.88Å; L51-M75 HydrophobicContact CD2-CE 4.29Å; L51-M75 HydrophobicContact CD2-CG 3.98Å; L51-I78 HydrophobicContact CD1-CG2 4.2Å; L51-I78 HydrophobicContact CD2-CB 4.15Å; L51-I78 HydrophobicContact CD2-CG2 4.06Å; L51-I78 HydrophobicContact CG-CG2 3.91Å; L51-N79 VanDerWaalsContact CD1-OD1 3.24Å; L51-N79 WeakPolarHBondContact CD1-OD1 3.31Å; L51-L82 HydrophobicContact CD1-CD1 4.02Å
52	S	82.4	Confident	78.3	Confident	60 Å²	60	62.8 Å²	62.8	42%	0.42	34%	0.342	S	S	.	.	H	α-helix	trans	-68.5	-34.2	177.6	76.2	0	0	0	0	112.4	K48 A49 A50 Q55 K56	K48-S52 PolarHBondContact O-N 2.89Å; A49-S52 PolarHBondContact O-N 3Å; A49-S52 VanDerWaalsContact O-N 3.09Å; A49-S52 PolarHBondContact O-OG 3.22Å; A50-S52 VanDerWaalsContact C-N 3.32Å; A50-S52 PolarHBondContact O-N 3.42Å; S52-Q55 PolarHBondContact O-N 3.42Å; S52-K56 WeakPolarHBondContact O-CG 3.39Å; S52-K56 PolarHBondContact O-N 2.94Å
53	S	81.5	Confident	77.8	Confident	21 Å²	21	68.5 Å²	68.5	15%	0.147	37%	0.367	C	S	.	.	H	α-helix	trans	-72.7	-41.3	177.2	-59.7	0	0	0	0	111.7	S39 A49 A50 L51 Q55 K56 V57	S39-S53 WeakPolarHBondContact OG-CB 3.24Å; A49-S53 PolarHBondContact O-N 3.44Å; A49-S53 PolarHBondContact O-OG 3.05Å; A50-S53 PolarHBondContact O-N 3Å; A50-S53 VanDerWaalsContact O-N 3.15Å; L51-S53 VanDerWaalsContact C-N 3.34Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; S53-Q55 PolarHBondContact O-N 3.11Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.1Å; S53-V57 PolarHBondContact O-N 3.05Å
54	F	83.4	Confident	77.8	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-35.4	171.8	-74.1	-59	0	0	0	112.4	Y36 S39 K40 A50 K56 V57 L58 A71 Q74 M75 I78	Y36-F54 HydrophobicContact CD2-CD1 4.15Å; Y36-F54 AromaticContact CD2-CE1 3.72Å; Y36-F54 HydrophobicContact CD2-CE1 3.72Å; Y36-F54 HydrophobicContact CE2-CD1 4.36Å; Y36-F54 AromaticContact CE2-CE1 3.74Å; Y36-F54 HydrophobicContact CE2-CE1 3.74Å; S39-F54 VanDerWaalsContact C-CZ 3.47Å; S39-F54 WeakPolarHBondContact O-CE2 3.48Å; K40-F54 HydrophobicContact CB-CZ 4.35Å; A50-F54 HydrophobicContact CB-CD2 4.4Å; A50-F54 HydrophobicContact CB-CE2 4.22Å; A50-F54 WeakPolarHBondContact O-CD2 3.48Å; A50-F54 PolarHBondContact O-N 2.82Å; F54-K56 VanDerWaalsContact C-N 3.29Å; F54-K56 PolarHBondContact O-N 3.19Å; F54-V57 WeakPolarHBondContact O-CB 3.45Å; F54-V57 PolarHBondContact O-N 2.92Å; F54-V57 VanDerWaalsContact O-N 3.15Å; F54-L58 WeakPolarHBondContact O-CD1 3.45Å; F54-L58 PolarHBondContact O-N 3.02Å; F54-A71 HydrophobicContact CB-CB 4.39Å; F54-A71 HydrophobicContact CD1-CB 3.89Å; F54-Q74 HydrophobicContact CE1-CB 4.26Å; F54-Q74 HydrophobicContact CE2-CB 4.07Å; F54-Q74 HydrophobicContact CZ-CB 3.87Å; F54-Q74 HydrophobicContact CZ-CG 4.31Å; F54-M75 HydrophobicContact CB-CG 3.47Å; F54-M75 VanDerWaalsContact CB-CG 3.47Å; F54-M75 HydrophobicContact CB-SD 3.69Å; F54-M75 HydrophobicContact CD2-CG 4.19Å; F54-M75 HydrophobicContact CG-CG 4.04Å; F54-I78 HydrophobicContact CD2-CD1 4.1Å; F54-I78 HydrophobicContact CE2-CD1 3.74Å
55	Q	82.9	Confident	77.9	Confident	47 Å²	47	65.8 Å²	65.8	22%	0.22	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-37.6	173.8	178.7	59.9	33.6	0	0	112.1	L51 S52 S53 V57 L58 E59 M75	L51-Q55 WeakPolarHBondContact O-CB 3.33Å; L51-Q55 PolarHBondContact O-N 2.91Å; S52-Q55 PolarHBondContact O-N 3.42Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; S53-Q55 PolarHBondContact O-N 3.11Å; Q55-V57 VanDerWaalsContact C-N 3.31Å; Q55-V57 PolarHBondContact O-N 3.29Å; Q55-L58 WeakPolarHBondContact O-CB 3.39Å; Q55-L58 PolarHBondContact O-N 3.36Å; Q55-E59 PolarHBondContact NE2-OE1 3.27Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.16Å; Q55-E59 PolarHBondContact O-N 3.02Å; Q55-E59 VanDerWaalsContact O-N 3.1Å; Q55-M75 HydrophobicContact CB-CE 4.32Å
56	K	81.3	Confident	78	Confident	107 Å²	107	64.3 Å²	64.3	47%	0.465	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-33.6	174.9	-67.4	169.8	-175.9	174.3	0	112.4	S52 S53 F54 L58 E59 L60	S52-K56 WeakPolarHBondContact O-CG 3.39Å; S52-K56 PolarHBondContact O-N 2.94Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.1Å; F54-K56 VanDerWaalsContact C-N 3.29Å; F54-K56 PolarHBondContact O-N 3.19Å; K56-L58 VanDerWaalsContact C-N 3.27Å; K56-L58 PolarHBondContact O-N 3.25Å; K56-E59 PolarHBondContact O-N 2.62Å; K56-L60 WeakPolarHBondContact O-CB 3.36Å; K56-L60 WeakPolarHBondContact O-CD1 3.28Å; K56-L60 VanDerWaalsContact O-CG 3.27Å; K56-L60 WeakPolarHBondContact O-CG 3.46Å; K56-L60 PolarHBondContact O-N 2.75Å
57	V	80.8	Confident	77.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.8	-39.9	173.3	179.5	0	0	0	0	110.4	L32 Q35 S53 F54 Q55 E61 A71	L32-V57 HydrophobicContact CD2-CG1 4.4Å; Q35-V57 HydrophobicContact CB-CG2 4.12Å; Q35-V57 HydrophobicContact CG-CG2 3.8Å; S53-V57 PolarHBondContact O-N 3.05Å; F54-V57 WeakPolarHBondContact O-CB 3.45Å; F54-V57 PolarHBondContact O-N 2.92Å; F54-V57 VanDerWaalsContact O-N 3.15Å; Q55-V57 VanDerWaalsContact C-N 3.31Å; Q55-V57 PolarHBondContact O-N 3.29Å; V57-E61 WeakPolarHBondContact O-CB 3.48Å; V57-E61 PolarHBondContact O-N 2.94Å; V57-E61 VanDerWaalsContact O-N 3.11Å; V57-A71 HydrophobicContact CB-CB 4.37Å; V57-A71 HydrophobicContact CG1-CB 4.22Å
58	L	78.9	Confident	78	Confident	22 Å²	22	59.7 Å²	59.7	12%	0.115	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-34.7	175.4	-86.2	79.9	0	0	0	113.3	F54 Q55 K56 A71 L72 M75	F54-L58 WeakPolarHBondContact O-CD1 3.45Å; F54-L58 PolarHBondContact O-N 3.02Å; Q55-L58 WeakPolarHBondContact O-CB 3.39Å; Q55-L58 PolarHBondContact O-N 3.36Å; K56-L58 VanDerWaalsContact C-N 3.27Å; K56-L58 PolarHBondContact O-N 3.25Å; L58-A71 HydrophobicContact CD1-CB 3.69Å; L58-L72 HydrophobicContact CD1-CG 4.23Å; L58-L72 HydrophobicContact CD2-CD1 4.09Å; L58-L72 HydrophobicContact CD2-CD2 3.69Å; L58-L72 HydrophobicContact CD2-CG 3.81Å; L58-L72 HydrophobicContact CG-CG 4.42Å; L58-M75 HydrophobicContact CD1-SD 4.13Å
59	E	79.3	Confident	78	Confident	134 Å²	134	51.8 Å²	51.8	63%	0.626	28%	0.283	S	S	*	.	H	α-helix	trans	-74.7	-30.8	179.7	-72.7	168.6	-165.4	0	0	112.6	Q55 K56	Q55-E59 PolarHBondContact NE2-OE1 3.27Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.16Å; Q55-E59 PolarHBondContact O-N 3.02Å; Q55-E59 VanDerWaalsContact O-N 3.1Å; K56-E59 PolarHBondContact O-N 2.62Å
60	L	75.1	Confident	78.1	Confident	97 Å²	97	52.2 Å²	52.2	51%	0.508	28%	0.277	S	S	.	.	H	α-helix	trans	-79	-24.7	175.4	-70.4	165	0	0	0	112.4	L32 K56 G62	L32-L60 HydrophobicContact CD2-CB 3.55Å; K56-L60 WeakPolarHBondContact O-CB 3.36Å; K56-L60 WeakPolarHBondContact O-CD1 3.28Å; K56-L60 VanDerWaalsContact O-CG 3.27Å; K56-L60 WeakPolarHBondContact O-CG 3.46Å; K56-L60 PolarHBondContact O-N 2.75Å; L60-G62 PolarHBondContact O-N 3.28Å; L60-G62 VanDerWaalsContact O-N 3.08Å
61	E	70.5	Confident	78.1	Confident	21 Å²	21	52.2 Å²	52.2	10%	0.098	28%	0.277	C	S	.	.			trans	-77.9	89.1	174.7	-167.1	-179.3	-115.6	0	0	110.1	L32 V57 E63 G65 W67 G68	L32-E61 HydrophobicContact CD1-CB 4.46Å; V57-E61 WeakPolarHBondContact O-CB 3.48Å; V57-E61 PolarHBondContact O-N 2.94Å; V57-E61 VanDerWaalsContact O-N 3.11Å; E61-E63 WeakPolarHBondContact CG-O 3.34Å; E61-G65 WeakPolarHBondContact OE1-CA 3.48Å; E61-G65 PolarHBondContact OE1-N 3.31Å; E61-G65 PolarHBondContact OE2-N 2.88Å; E61-W67 PolarHBondContact OE1-N 3.33Å; E61-G68 VanDerWaalsContact CD-N 3.32Å; E61-G68 PolarHBondContact OE1-N 3.06Å; E61-G68 WeakPolarHBondContact OE2-CA 3.4Å; E61-G68 PolarHBondContact OE2-N 2.92Å
62	G	61.8	Low	78.2	Confident	80 Å²	80	50.9 Å²	50.9	83%	0.825	27%	0.27	S	S	*	.	S	Bend	trans	-68	-32.6	-178.1	0	0	0	0	0	114.8	L60	L60-G62 PolarHBondContact O-N 3.28Å; L60-G62 VanDerWaalsContact O-N 3.08Å
63	E	66.6	Low	78.3	Confident	177 Å²	177	48.6 Å²	48.6	83%	0.827	25%	0.253	S	S	*	.	S	Bend	trans	-115.5	134	170.4	-68.7	-168.8	164.9	0	0	109.4	E61 G65	E61-E63 WeakPolarHBondContact CG-O 3.34Å; E63-G65 PolarHBondContact O-N 3.08Å
64	K	74.2	Confident	78.4	Confident	95 Å²	95	48.2 Å²	48.2	41%	0.413	25%	0.249	S	C	.	.			trans	-53.3	117.1	-177.7	-65.9	-174.2	-176.7	-174.5	0	110.6	T97 Y98 A102	K64-T97 VanDerWaalsContact NZ-CB 3.29Å; K64-T97 PolarHBondContact NZ-O 3.4Å; K64-T97 PolarHBondContact NZ-OG1 3.28Å; K64-Y98 HydrophobicContact CB-CD1 3.75Å; K64-Y98 HydrophobicContact CB-CE1 3.59Å; K64-Y98 HydrophobicContact CD-CD1 4.21Å; K64-Y98 HydrophobicContact CD-CE1 4.21Å; K64-Y98 HydrophobicContact CD-CE2 4.49Å; K64-Y98 HydrophobicContact CD-CG 4.35Å; K64-Y98 HydrophobicContact CG-CD1 4.17Å; K64-Y98 HydrophobicContact CG-CE1 3.78Å; K64-A102 HydrophobicContact CB-CB 3.66Å; K64-A102 WeakPolarHBondContact O-CB 3.07Å
65	G	75.4	Confident	78.4	Confident	19 Å²	19	48.4 Å²	48.4	20%	0.196	25%	0.25	C	C	.	.			trans	-128.4	-174.4	-176.6	0	0	0	0	0	112.8	E61 E63	E61-G65 WeakPolarHBondContact OE1-CA 3.48Å; E61-G65 PolarHBondContact OE1-N 3.31Å; E61-G65 PolarHBondContact OE2-N 2.88Å; E63-G65 PolarHBondContact O-N 3.08Å
66	E	76.4	Confident	78.4	Confident	95 Å²	95	46.3 Å²	46.3	44%	0.444	24%	0.24	S	C	.	.	H	α-helix	trans	-71.8	-32.1	-178.2	-165.9	-176.3	151.1	0	0	112.3	F69 K70	E66-F69 WeakPolarHBondContact O-CB 3.3Å; E66-F69 PolarHBondContact O-N 3.11Å; E66-K70 HydrophobicContact CG-CD 4.5Å; E66-K70 WeakPolarHBondContact O-CG 3.46Å; E66-K70 PolarHBondContact O-N 3.41Å; E66-K70 WeakPolarHBondContact OE1-CE 3.23Å; E66-K70 IonicContact OE1-NZ 2.7Å; E66-K70 PolarHBondContact OE1-NZ 2.98Å
67	W	79.1	Confident	78.5	Confident	49 Å²	49	42.7 Å²	42.7	19%	0.186	22%	0.224	C	C	.	.	H	α-helix	trans	-72.6	-39.4	-177.2	-70.6	109.3	0	0	0	112.4	E33 Y36 Y37 E61 F69 K70 A71	E33-W67 HydrophobicContact CB-CH2 4.13Å; E33-W67 HydrophobicContact CB-CZ2 3.87Å; E33-W67 HydrophobicContact CG-CH2 3.59Å; E33-W67 HydrophobicContact CG-CZ2 3.69Å; E33-W67 HydrophobicContact CG-CZ3 4.33Å; Y36-W67 AromaticContact CD1-CE3 3.97Å; Y36-W67 HydrophobicContact CD1-CE3 3.97Å; Y36-W67 AromaticContact CD1-CZ3 3.59Å; Y36-W67 HydrophobicContact CD1-CZ3 3.59Å; Y36-W67 HydrophobicContact CD2-CE3 4.42Å; Y36-W67 HydrophobicContact CE1-CZ3 4.12Å; Y36-W67 AromaticContact CG-CE3 3.87Å; Y36-W67 HydrophobicContact CG-CE3 3.87Å; Y36-W67 AromaticContact CG-CZ3 3.98Å; Y36-W67 HydrophobicContact CG-CZ3 3.98Å; Y37-W67 HydrophobicContact CE2-CH2 4.22Å; E61-W67 PolarHBondContact OE1-N 3.33Å; W67-F69 VanDerWaalsContact C-N 3.29Å; W67-F69 PolarHBondContact O-N 3.42Å; W67-K70 HydrophobicContact CE3-CD 4.07Å; W67-K70 HydrophobicContact CZ3-CD 4.19Å; W67-K70 PolarHBondContact O-N 3.42Å; W67-A71 WeakPolarHBondContact O-CB 3.1Å; W67-A71 PolarHBondContact O-N 3.22Å
68	G	80.9	Confident	78.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-33.2	171.4	0	0	0	0	0	112.5	E61 A71 L72	E61-G68 VanDerWaalsContact CD-N 3.32Å; E61-G68 PolarHBondContact OE1-N 3.06Å; E61-G68 WeakPolarHBondContact OE2-CA 3.4Å; E61-G68 PolarHBondContact OE2-N 2.92Å; G68-A71 PolarHBondContact O-N 2.9Å; G68-L72 WeakPolarHBondContact O-CB 3.41Å; G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 3.37Å
69	F	81.9	Confident	78.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.6	-44.8	173	-171.8	-85.6	0	0	0	112.2	E66 W67 A71 L72 K73 L95 Y98 V103 Y107 S111	E66-F69 WeakPolarHBondContact O-CB 3.3Å; E66-F69 PolarHBondContact O-N 3.11Å; W67-F69 VanDerWaalsContact C-N 3.29Å; W67-F69 PolarHBondContact O-N 3.42Å; F69-A71 VanDerWaalsContact C-N 3.34Å; F69-L72 PolarHBondContact O-N 3.02Å; F69-K73 PolarHBondContact O-N 3.3Å; F69-L95 HydrophobicContact CD2-CD2 4.33Å; F69-L95 HydrophobicContact CD2-CG 4.03Å; F69-L95 HydrophobicContact CE2-CD1 4.31Å; F69-L95 HydrophobicContact CE2-CD2 3.45Å; F69-L95 VanDerWaalsContact CE2-CD2 3.45Å; F69-L95 HydrophobicContact CE2-CG 3.62Å; F69-L95 HydrophobicContact CZ-CD1 4.35Å; F69-L95 HydrophobicContact CZ-CD2 3.77Å; F69-L95 HydrophobicContact CZ-CG 4.1Å; F69-Y98 HydrophobicContact CB-CD1 4.42Å; F69-Y98 HydrophobicContact CD2-CG 4.25Å; F69-V103 HydrophobicContact CB-CG2 3.7Å; F69-V103 HydrophobicContact CD1-CG2 4.42Å; F69-V103 HydrophobicContact CD2-CB 4.44Å; F69-V103 HydrophobicContact CD2-CG2 3.8Å; F69-V103 HydrophobicContact CG-CG2 3.73Å; F69-Y107 AromaticContact CD1-CD1 3.99Å; F69-Y107 HydrophobicContact CD1-CD1 3.99Å; F69-Y107 AromaticContact CD1-CE1 3.61Å; F69-Y107 HydrophobicContact CD1-CE1 3.61Å; F69-Y107 AromaticContact CE1-CD1 3.81Å; F69-Y107 HydrophobicContact CE1-CD1 3.81Å; F69-Y107 AromaticContact CE1-CE1 3.7Å; F69-Y107 HydrophobicContact CE1-CE1 3.7Å; F69-S111 WeakPolarHBondContact CE1-OG 3.29Å
70	K	81.9	Confident	78.8	Confident	44 Å²	44	36.2 Å²	36.2	19%	0.191	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-42.7	174.3	-75	174.3	-178.4	169.2	0	111.4	Y36 E66 W67 K73 Q74 Y107	Y36-K70 HydrophobicContact CD2-CB 4.48Å; Y36-K70 HydrophobicContact CE2-CB 3.75Å; E66-K70 HydrophobicContact CG-CD 4.5Å; E66-K70 WeakPolarHBondContact O-CG 3.46Å; E66-K70 PolarHBondContact O-N 3.41Å; E66-K70 WeakPolarHBondContact OE1-CE 3.23Å; E66-K70 IonicContact OE1-NZ 2.7Å; E66-K70 PolarHBondContact OE1-NZ 2.98Å; W67-K70 HydrophobicContact CE3-CD 4.07Å; W67-K70 HydrophobicContact CZ3-CD 4.19Å; W67-K70 PolarHBondContact O-N 3.42Å; K70-K73 PolarHBondContact O-N 3.21Å; K70-Q74 PolarHBondContact O-N 2.94Å; K70-Q74 VanDerWaalsContact O-N 3.15Å; K70-Y107 WeakPolarHBondContact CE-OH 3.37Å; K70-Y107 WeakPolarHBondContact CG-OH 3.42Å
71	A	83.5	Confident	79	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-48.4	175.7	0	0	0	0	0	111.5	Y36 F54 V57 L58 W67 G68 F69 K73 Q74 M75	Y36-A71 HydrophobicContact CD2-CB 4.26Å; Y36-A71 HydrophobicContact CE2-CB 4.44Å; F54-A71 HydrophobicContact CB-CB 4.39Å; F54-A71 HydrophobicContact CD1-CB 3.89Å; V57-A71 HydrophobicContact CB-CB 4.37Å; V57-A71 HydrophobicContact CG1-CB 4.22Å; L58-A71 HydrophobicContact CD1-CB 3.69Å; W67-A71 WeakPolarHBondContact O-CB 3.1Å; W67-A71 PolarHBondContact O-N 3.22Å; G68-A71 PolarHBondContact O-N 2.9Å; F69-A71 VanDerWaalsContact C-N 3.34Å; A71-K73 PolarHBondContact O-N 3.11Å; A71-Q74 PolarHBondContact O-N 2.74Å; A71-Q74 VanDerWaalsContact O-N 3.15Å; A71-M75 VanDerWaalsContact O-CG 3.31Å; A71-M75 WeakPolarHBondContact O-CG 3.38Å; A71-M75 PolarHBondContact O-N 3.32Å
72	L	83.9	Confident	79.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-41.7	176.1	-78	169	0	0	0	112.6	L58 G68 F69 Q74 M75 I76 R91 Q94 L95 Y98	L58-L72 HydrophobicContact CD1-CG 4.23Å; L58-L72 HydrophobicContact CD2-CD1 4.09Å; L58-L72 HydrophobicContact CD2-CD2 3.69Å; L58-L72 HydrophobicContact CD2-CG 3.81Å; L58-L72 HydrophobicContact CG-CG 4.42Å; G68-L72 WeakPolarHBondContact O-CB 3.41Å; G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 3.37Å; F69-L72 PolarHBondContact O-N 3.02Å; L72-Q74 VanDerWaalsContact C-N 3.31Å; L72-Q74 PolarHBondContact O-N 3.16Å; L72-M75 HydrophobicContact CD2-SD 4.39Å; L72-M75 PolarHBondContact O-N 3.38Å; L72-I76 WeakPolarHBondContact O-CD1 3.44Å; L72-I76 VanDerWaalsContact O-CG1 3.27Å; L72-I76 WeakPolarHBondContact O-CG1 3.15Å; L72-I76 PolarHBondContact O-N 2.71Å; L72-R91 HydrophobicContact CD2-CB 4.22Å; L72-Q94 HydrophobicContact CD1-CB 4.32Å; L72-Q94 HydrophobicContact CD2-CB 4.3Å; L72-L95 HydrophobicContact CB-CB 4.3Å; L72-L95 HydrophobicContact CB-CD1 4.17Å; L72-L95 HydrophobicContact CB-CG 4.5Å; L72-L95 HydrophobicContact CD1-CB 4.28Å; L72-Y98 HydrophobicContact CD1-CD2 3.92Å; L72-Y98 HydrophobicContact CD1-CE2 3.41Å; L72-Y98 VanDerWaalsContact CD1-CE2 3.41Å
73	K	84.6	Confident	80.1	Confident	13 Å²	13	38.7 Å²	38.7	6%	0.057	19%	0.187	C	C	.	.	H	α-helix	trans	-56.5	-44.8	174.8	-177.8	-174.7	175.3	-168.8	0	111	E14 F69 K70 A71 K77 I115	E14-K73 IonicContact OE1-NZ 2.77Å; E14-K73 PolarHBondContact OE1-NZ 3.04Å; E14-K73 IonicContact OE2-NZ 3.78Å; F69-K73 PolarHBondContact O-N 3.3Å; K70-K73 PolarHBondContact O-N 3.21Å; A71-K73 PolarHBondContact O-N 3.11Å; K73-K77 PolarHBondContact O-N 3.38Å; K73-I115 HydrophobicContact CG-CD1 4.41Å
74	Q	83.3	Confident	80.8	Confident	13 Å²	13	33.7 Å²	33.7	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-41	177.8	-67.4	-59.8	-34.6	0	0	112.4	Y36 F54 K70 A71 L72 I76 K77 I78	Y36-Q74 HydrophobicContact CE2-CG 4.39Å; F54-Q74 HydrophobicContact CE1-CB 4.26Å; F54-Q74 HydrophobicContact CE2-CB 4.07Å; F54-Q74 HydrophobicContact CZ-CB 3.87Å; F54-Q74 HydrophobicContact CZ-CG 4.31Å; K70-Q74 PolarHBondContact O-N 2.94Å; K70-Q74 VanDerWaalsContact O-N 3.15Å; A71-Q74 PolarHBondContact O-N 2.74Å; A71-Q74 VanDerWaalsContact O-N 3.15Å; L72-Q74 VanDerWaalsContact C-N 3.31Å; L72-Q74 PolarHBondContact O-N 3.16Å; Q74-I76 VanDerWaalsContact C-N 3.27Å; Q74-I76 PolarHBondContact O-N 3.08Å; Q74-K77 PolarHBondContact O-N 3.41Å; Q74-K77 VanDerWaalsContact O-N 3.16Å; Q74-I78 VanDerWaalsContact O-CG1 3.3Å; Q74-I78 WeakPolarHBondContact O-CG1 3.49Å; Q74-I78 PolarHBondContact O-N 3.33Å
75	M	83.3	Confident	81	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-39.2	175.6	-68.6	176.1	79	0	0	111.9	L51 F54 Q55 L58 A71 L72 I78 N79	L51-M75 HydrophobicContact CD2-CB 3.88Å; L51-M75 HydrophobicContact CD2-CE 4.29Å; L51-M75 HydrophobicContact CD2-CG 3.98Å; F54-M75 HydrophobicContact CB-CG 3.47Å; F54-M75 VanDerWaalsContact CB-CG 3.47Å; F54-M75 HydrophobicContact CB-SD 3.69Å; F54-M75 HydrophobicContact CD2-CG 4.19Å; F54-M75 HydrophobicContact CG-CG 4.04Å; Q55-M75 HydrophobicContact CB-CE 4.32Å; L58-M75 HydrophobicContact CD1-SD 4.13Å; A71-M75 VanDerWaalsContact O-CG 3.31Å; A71-M75 WeakPolarHBondContact O-CG 3.38Å; A71-M75 PolarHBondContact O-N 3.32Å; L72-M75 HydrophobicContact CD2-SD 4.39Å; L72-M75 PolarHBondContact O-N 3.38Å; M75-I78 PolarHBondContact O-N 3.09Å; M75-N79 WeakPolarHBondContact O-CB 3.41Å; M75-N79 PolarHBondContact O-N 2.94Å; M75-N79 PolarHBondContact O-ND2 3.33Å
76	I	84.3	Confident	81.3	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-46.9	175.4	-71.7	158.7	0	0	0	110.9	L72 Q74 I78 N79 F80 M88 R91 Y92 L95 I115	L72-I76 WeakPolarHBondContact O-CD1 3.44Å; L72-I76 VanDerWaalsContact O-CG1 3.27Å; L72-I76 WeakPolarHBondContact O-CG1 3.15Å; L72-I76 PolarHBondContact O-N 2.71Å; Q74-I76 VanDerWaalsContact C-N 3.27Å; Q74-I76 PolarHBondContact O-N 3.08Å; I76-I78 VanDerWaalsContact C-N 3.31Å; I76-I78 PolarHBondContact O-N 3.33Å; I76-N79 PolarHBondContact O-N 3.46Å; I76-F80 VanDerWaalsContact O-CB 3.32Å; I76-F80 WeakPolarHBondContact O-CB 3.32Å; I76-F80 PolarHBondContact O-N 2.92Å; I76-M88 HydrophobicContact CG2-CG 4.03Å; I76-M88 HydrophobicContact CG2-SD 3.74Å; I76-R91 HydrophobicContact CG1-CB 4.07Å; I76-Y92 HydrophobicContact CD1-CD2 4.02Å; I76-L95 HydrophobicContact CD1-CB 4.18Å; I76-L95 HydrophobicContact CD1-CD1 3.44Å; I76-L95 VanDerWaalsContact CD1-CD1 3.44Å; I76-L95 HydrophobicContact CD1-CG 4.44Å; I76-I115 HydrophobicContact CD1-CD1 4.2Å; I76-I115 HydrophobicContact CG2-CD1 4.39Å; I76-I115 HydrophobicContact CG2-CG2 3.98Å
77	K	82.7	Confident	81.6	Confident	31 Å²	31	33.3 Å²	33.3	14%	0.135	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-40.3	176.4	-71.7	-173.9	175.8	-167.8	0	111.9	K73 Q74 K81	K73-K77 PolarHBondContact O-N 3.38Å; Q74-K77 PolarHBondContact O-N 3.41Å; Q74-K77 VanDerWaalsContact O-N 3.16Å; K77-K81 PolarHBondContact O-N 3.11Å; K77-K81 VanDerWaalsContact O-N 3.11Å
78	I	82.9	Confident	81.8	Confident	3 Å²	3	31 Å²	31	2%	0.015	16%	0.159	C	C	.	.	H	α-helix	trans	-70.3	-47.1	178.9	-64.7	165.4	0	0	0	111.1	K43 P47 A50 L51 F54 Q74 M75 I76 F80 K81 L82	K43-I78 HydrophobicContact CB-CD1 4.49Å; K43-I78 HydrophobicContact CD-CD1 4.27Å; K43-I78 HydrophobicContact CD-CG1 4.24Å; K43-I78 HydrophobicContact CG-CD1 3.93Å; K43-I78 HydrophobicContact CG-CG1 3.98Å; P47-I78 HydrophobicContact CB-CG2 3.71Å; A50-I78 HydrophobicContact CB-CD1 4.16Å; L51-I78 HydrophobicContact CD1-CG2 4.2Å; L51-I78 HydrophobicContact CD2-CB 4.15Å; L51-I78 HydrophobicContact CD2-CG2 4.06Å; L51-I78 HydrophobicContact CG-CG2 3.91Å; F54-I78 HydrophobicContact CD2-CD1 4.1Å; F54-I78 HydrophobicContact CE2-CD1 3.74Å; Q74-I78 VanDerWaalsContact O-CG1 3.3Å; Q74-I78 WeakPolarHBondContact O-CG1 3.49Å; Q74-I78 PolarHBondContact O-N 3.33Å; M75-I78 PolarHBondContact O-N 3.09Å; I76-I78 VanDerWaalsContact C-N 3.31Å; I76-I78 PolarHBondContact O-N 3.33Å; I78-F80 PolarHBondContact O-N 2.91Å; I78-K81 PolarHBondContact O-N 3.09Å; I78-K81 VanDerWaalsContact O-N 3.14Å; I78-L82 HydrophobicContact CG2-CD1 3.96Å; I78-L82 HydrophobicContact CG2-CG 4.33Å; I78-L82 WeakPolarHBondContact O-CB 3.37Å; I78-L82 WeakPolarHBondContact O-CG 3.47Å; I78-L82 PolarHBondContact O-N 2.82Å
79	N	82.2	Confident	81.8	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-33.9	177.8	-79.2	-35.5	0	0	0	112.2	L51 M75 I76 L82 T83 N84 M88	L51-N79 VanDerWaalsContact CD1-OD1 3.24Å; L51-N79 WeakPolarHBondContact CD1-OD1 3.31Å; M75-N79 WeakPolarHBondContact O-CB 3.41Å; M75-N79 PolarHBondContact O-N 2.94Å; M75-N79 PolarHBondContact O-ND2 3.33Å; I76-N79 PolarHBondContact O-N 3.46Å; N79-L82 PolarHBondContact O-N 2.88Å; N79-T83 PolarHBondContact O-N 2.86Å; N79-N84 PolarHBondContact O-N 3.22Å; N79-M88 HydrophobicContact CB-CB 3.81Å; N79-M88 HydrophobicContact CB-CG 3.91Å
80	F	80.6	Confident	82	Confident	14 Å²	14	35.3 Å²	35.3	6%	0.061	18%	0.182	C	C	.	.	H	α-helix	trans	-65.4	-47.6	172.6	-175	-97.7	0	0	0	111.9	I76 I78 L82 T83 F85 M88 Y118 I119 S122	I76-F80 VanDerWaalsContact O-CB 3.32Å; I76-F80 WeakPolarHBondContact O-CB 3.32Å; I76-F80 PolarHBondContact O-N 2.92Å; I78-F80 PolarHBondContact O-N 2.91Å; F80-L82 PolarHBondContact O-N 3.32Å; F80-T83 PolarHBondContact O-N 2.98Å; F80-T83 VanDerWaalsContact O-N 3.11Å; F80-F85 HydrophobicContact CD2-CE1 4.26Å; F80-F85 HydrophobicContact CE2-CE1 4.15Å; F80-M88 HydrophobicContact CB-CE 4.05Å; F80-M88 HydrophobicContact CD2-CE 3.49Å; F80-M88 VanDerWaalsContact CD2-CE 3.49Å; F80-M88 HydrophobicContact CE2-CE 4.43Å; F80-M88 HydrophobicContact CG-CE 4.18Å; F80-Y118 HydrophobicContact CD1-CD1 4.09Å; F80-Y118 AromaticContact CD1-CE1 3.68Å; F80-Y118 HydrophobicContact CD1-CE1 3.68Å; F80-Y118 HydrophobicContact CE1-CE1 4.28Å; F80-I119 HydrophobicContact CD2-CG1 4.17Å; F80-I119 HydrophobicContact CE2-CB 4.43Å; F80-I119 HydrophobicContact CE2-CG1 4.22Å; F80-I119 HydrophobicContact CE2-CG2 4Å; F80-S122 WeakPolarHBondContact CE1-OG 3.22Å; F80-S122 WeakPolarHBondContact CZ-OG 3.26Å
81	K	79.8	Confident	82.2	Confident	108 Å²	108	35 Å²	35	47%	0.47	18%	0.179	S	C	.	.	H	α-helix	trans	-59.5	-34.6	173.7	-77.1	-170.2	176.3	-169.2	0	112.8	K77 I78 T83	K77-K81 PolarHBondContact O-N 3.11Å; K77-K81 VanDerWaalsContact O-N 3.11Å; I78-K81 PolarHBondContact O-N 3.09Å; I78-K81 VanDerWaalsContact O-N 3.14Å; K81-T83 VanDerWaalsContact C-N 3.28Å; K81-T83 PolarHBondContact O-N 3.44Å
82	L	78.3	Confident	82.3	Confident	58 Å²	58	35 Å²	35	30%	0.304	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	4.3	179	-69.4	-179.1	0	0	0	114	P47 K48 L51 I78 N79 F80 N84	P47-L82 HydrophobicContact CB-CD1 4.09Å; P47-L82 HydrophobicContact CB-CD2 4.2Å; P47-L82 HydrophobicContact CB-CG 4.3Å; P47-L82 HydrophobicContact CG-CD1 4.47Å; P47-L82 HydrophobicContact CG-CD2 3.88Å; K48-L82 HydrophobicContact CG-CD1 4.26Å; L51-L82 HydrophobicContact CD1-CD1 4.02Å; I78-L82 HydrophobicContact CG2-CD1 3.96Å; I78-L82 HydrophobicContact CG2-CG 4.33Å; I78-L82 WeakPolarHBondContact O-CB 3.37Å; I78-L82 WeakPolarHBondContact O-CG 3.47Å; I78-L82 PolarHBondContact O-N 2.82Å; N79-L82 PolarHBondContact O-N 2.88Å; F80-L82 PolarHBondContact O-N 3.32Å; L82-N84 PolarHBondContact O-N 2.97Å; L82-N84 VanDerWaalsContact O-N 3.11Å
83	T	77	Confident	82.3	Confident	84 Å²	84	40.1 Å²	40.1	52%	0.515	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	18.3	-178.5	63.9	0	0	0	0	115.2	N79 F80 K81 F85	N79-T83 PolarHBondContact O-N 2.86Å; F80-T83 PolarHBondContact O-N 2.98Å; F80-T83 VanDerWaalsContact O-N 3.11Å; K81-T83 VanDerWaalsContact C-N 3.28Å; K81-T83 PolarHBondContact O-N 3.44Å; T83-F85 WeakPolarHBondContact O-CD2 3.23Å; T83-F85 PolarHBondContact O-N 3.21Å
84	N	80.8	Confident	82.3	Confident	73 Å²	73	43.2 Å²	43.2	39%	0.39	22%	0.216	S	C	.	.			trans	-91	76.5	178.6	-171.4	2.2	0	0	0	110.8	N79 L82 E87 M88	N79-N84 PolarHBondContact O-N 3.22Å; L82-N84 PolarHBondContact O-N 2.97Å; L82-N84 VanDerWaalsContact O-N 3.11Å; N84-E87 WeakPolarHBondContact ND2-CB 3.38Å; N84-M88 WeakPolarHBondContact O-CB 3.34Å; N84-M88 PolarHBondContact O-N 3.33Å; N84-M88 VanDerWaalsContact O-N 3.07Å
85	F	79.3	Confident	82.4	Confident	52 Å²	52	42.6 Å²	42.6	23%	0.228	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-41	-173.6	-51.9	-68.1	0	0	0	115.6	F80 T83 E87 M88 M89 L134	F80-F85 HydrophobicContact CD2-CE1 4.26Å; F80-F85 HydrophobicContact CE2-CE1 4.15Å; T83-F85 WeakPolarHBondContact O-CD2 3.23Å; T83-F85 PolarHBondContact O-N 3.21Å; F85-E87 VanDerWaalsContact C-N 3.35Å; F85-E87 PolarHBondContact O-N 2.88Å; F85-M88 WeakPolarHBondContact O-CB 3.28Å; F85-M88 PolarHBondContact O-N 3.11Å; F85-M89 PolarHBondContact O-N 3.42Å; F85-L134 HydrophobicContact CB-CD1 3.74Å; F85-L134 HydrophobicContact CB-CD2 3.56Å; F85-L134 HydrophobicContact CB-CG 4.3Å; F85-L134 HydrophobicContact CD1-CD1 3.42Å; F85-L134 VanDerWaalsContact CD1-CD1 3.42Å; F85-L134 HydrophobicContact CD2-CD1 3.56Å; F85-L134 HydrophobicContact CE1-CD1 3.8Å; F85-L134 HydrophobicContact CE2-CD1 3.92Å; F85-L134 HydrophobicContact CG-CD1 3.28Å; F85-L134 HydrophobicContact CG-CD2 4.12Å; F85-L134 HydrophobicContact CG-CG 4.33Å; F85-L134 HydrophobicContact CZ-CD1 4.03Å
86	P	81.6	Confident	82.3	Confident	93 Å²	93	43.1 Å²	43.1	60%	0.604	22%	0.216	S	C	*	.	H	α-helix	trans	-62.4	-42.1	179.2	-23.5	34.6	0	0	0	112.5	M89 N90	P86-M89 PolarHBondContact O-N 3.3Å; P86-N90 PolarHBondContact O-N 3.46Å; P86-N90 VanDerWaalsContact O-N 3.11Å; P86-N90 PolarHBondContact O-ND2 3.38Å
87	E	80.9	Confident	82.3	Confident	56 Å²	56	46.2 Å²	46.2	26%	0.262	24%	0.235	S	C	.	.	H	α-helix	trans	-70.7	-36.6	178.1	-169.6	58.9	-163.7	0	0	111.1	N84 F85 M89 N90 R91	N84-E87 WeakPolarHBondContact ND2-CB 3.38Å; F85-E87 VanDerWaalsContact C-N 3.35Å; F85-E87 PolarHBondContact O-N 2.88Å; E87-M89 VanDerWaalsContact C-N 3.29Å; E87-M89 PolarHBondContact O-N 3.14Å; E87-N90 WeakPolarHBondContact O-CB 3.12Å; E87-N90 PolarHBondContact O-N 2.88Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; E87-R91 WeakPolarHBondContact O-CG 3.46Å; E87-R91 PolarHBondContact O-N 3.15Å; E87-R91 IonicContact OE1-CZ 3.41Å; E87-R91 VanDerWaalsContact OE1-CZ 3.23Å; E87-R91 IonicContact OE1-NE 3.38Å; E87-R91 PolarHBondContact OE1-NE 3.37Å; E87-R91 IonicContact OE1-NH2 3.95Å; E87-R91 PolarHBondContact OE1-NH2 3.17Å
88	M	83.3	Confident	82	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-57.4	-43.7	173.2	-160.1	-98.2	-95	0	0	111.5	I76 N79 F80 N84 F85 R91 Y92 I119 F138	I76-M88 HydrophobicContact CG2-CG 4.03Å; I76-M88 HydrophobicContact CG2-SD 3.74Å; N79-M88 HydrophobicContact CB-CB 3.81Å; N79-M88 HydrophobicContact CB-CG 3.91Å; F80-M88 HydrophobicContact CB-CE 4.05Å; F80-M88 HydrophobicContact CD2-CE 3.49Å; F80-M88 VanDerWaalsContact CD2-CE 3.49Å; F80-M88 HydrophobicContact CE2-CE 4.43Å; F80-M88 HydrophobicContact CG-CE 4.18Å; N84-M88 WeakPolarHBondContact O-CB 3.34Å; N84-M88 PolarHBondContact O-N 3.33Å; N84-M88 VanDerWaalsContact O-N 3.07Å; F85-M88 WeakPolarHBondContact O-CB 3.28Å; F85-M88 PolarHBondContact O-N 3.11Å; M88-R91 PolarHBondContact O-N 3.24Å; M88-Y92 WeakPolarHBondContact O-CB 3.31Å; M88-Y92 PolarHBondContact O-N 2.72Å; M88-I119 HydrophobicContact CE-CD1 3.8Å; M88-I119 HydrophobicContact CE-CG1 4.16Å; M88-F138 HydrophobicContact CE-CE1 4.17Å; M88-F138 HydrophobicContact CE-CE2 3.71Å; M88-F138 HydrophobicContact CE-CZ 3.48Å; M88-F138 VanDerWaalsContact CE-CZ 3.48Å; M88-F138 HydrophobicContact SD-CE1 3.4Å; M88-F138 WeakPolarHBondContact SD-CE1 3.42Å; M88-F138 HydrophobicContact SD-CE2 3.95Å; M88-F138 HydrophobicContact SD-CZ 3.07Å; M88-F138 WeakPolarHBondContact SD-CZ 3.3Å
89	M	81.9	Confident	81.6	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.069	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-38.8	176.9	-172.3	57.7	149	0	0	112.9	F85 P86 E87 Y92 K93 E137 F138 T141	F85-M89 PolarHBondContact O-N 3.42Å; P86-M89 PolarHBondContact O-N 3.3Å; E87-M89 VanDerWaalsContact C-N 3.29Å; E87-M89 PolarHBondContact O-N 3.14Å; M89-Y92 PolarHBondContact O-N 3.32Å; M89-Y92 HydrophobicContact SD-CD1 4.48Å; M89-K93 WeakPolarHBondContact O-CG 3.41Å; M89-K93 PolarHBondContact O-N 3.49Å; M89-E137 HydrophobicContact CE-CB 3.84Å; M89-E137 WeakPolarHBondContact CE-O 3.13Å; M89-F138 HydrophobicContact CB-CZ 4.21Å; M89-F138 HydrophobicContact SD-CD1 4.04Å; M89-F138 HydrophobicContact SD-CE1 3.71Å; M89-F138 HydrophobicContact SD-CZ 3.91Å; M89-T141 HydrophobicContact CE-CG2 3.31Å; M89-T141 VanDerWaalsContact CE-OG1 3.28Å; M89-T141 WeakPolarHBondContact CE-OG1 3.33Å
90	N	86.2	Confident	80.9	Confident	76 Å²	76	53.8 Å²	53.8	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-45.2	174.1	-70.1	-26.2	0	0	0	111.5	P86 E87 Y92 K93 Q94	P86-N90 PolarHBondContact O-N 3.46Å; P86-N90 VanDerWaalsContact O-N 3.11Å; P86-N90 PolarHBondContact O-ND2 3.38Å; E87-N90 WeakPolarHBondContact O-CB 3.12Å; E87-N90 PolarHBondContact O-N 2.88Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; N90-Y92 VanDerWaalsContact C-N 3.33Å; N90-K93 PolarHBondContact O-N 3.47Å; N90-Q94 WeakPolarHBondContact O-CG 3.3Å; N90-Q94 PolarHBondContact O-N 2.93Å; N90-Q94 VanDerWaalsContact O-N 3.08Å
91	R	85.6	Confident	80.2	Confident	37 Å²	37	57.2 Å²	57.2	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-66.8	-35.2	176	-57.8	-49	168.7	161.3	4	112.4	L72 I76 E87 M88 Q94 L95	L72-R91 HydrophobicContact CD2-CB 4.22Å; I76-R91 HydrophobicContact CG1-CB 4.07Å; E87-R91 WeakPolarHBondContact O-CG 3.46Å; E87-R91 PolarHBondContact O-N 3.15Å; E87-R91 IonicContact OE1-CZ 3.41Å; E87-R91 VanDerWaalsContact OE1-CZ 3.23Å; E87-R91 IonicContact OE1-NE 3.38Å; E87-R91 PolarHBondContact OE1-NE 3.37Å; E87-R91 IonicContact OE1-NH2 3.95Å; E87-R91 PolarHBondContact OE1-NH2 3.17Å; M88-R91 PolarHBondContact O-N 3.24Å; R91-Q94 WeakPolarHBondContact O-CB 3.49Å; R91-Q94 PolarHBondContact O-N 2.86Å; R91-L95 PolarHBondContact O-N 3.12Å
92	Y	85.9	Confident	79.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-46.3	174.3	-168.8	-103.9	0	0	0	112	I76 M88 M89 N90 Q94 L95 L96 I115 F138 T142	I76-Y92 HydrophobicContact CD1-CD2 4.02Å; M88-Y92 WeakPolarHBondContact O-CB 3.31Å; M88-Y92 PolarHBondContact O-N 2.72Å; M89-Y92 PolarHBondContact O-N 3.32Å; M89-Y92 HydrophobicContact SD-CD1 4.48Å; N90-Y92 VanDerWaalsContact C-N 3.33Å; Y92-Q94 VanDerWaalsContact C-N 3.27Å; Y92-Q94 PolarHBondContact O-N 3.32Å; Y92-L95 WeakPolarHBondContact O-CB 3.21Å; Y92-L95 PolarHBondContact O-N 2.92Å; Y92-L95 VanDerWaalsContact O-N 3.08Å; Y92-L96 HydrophobicContact CD1-CD1 3.88Å; Y92-L96 HydrophobicContact CD1-CG 4.16Å; Y92-L96 HydrophobicContact CE1-CD1 3.68Å; Y92-L96 HydrophobicContact CE1-CD2 3.92Å; Y92-L96 HydrophobicContact CE1-CG 3.91Å; Y92-L96 WeakPolarHBondContact O-CG 3.39Å; Y92-L96 PolarHBondContact O-N 3.32Å; Y92-I115 HydrophobicContact CE2-CG2 4.22Å; Y92-F138 AromaticContact CD1-CD1 3.61Å; Y92-F138 HydrophobicContact CD1-CD1 3.61Å; Y92-F138 AromaticContact CD1-CE1 3.88Å; Y92-F138 HydrophobicContact CD1-CE1 3.88Å; Y92-F138 HydrophobicContact CD2-CD1 4.14Å; Y92-F138 HydrophobicContact CD2-CE1 4.12Å; Y92-F138 AromaticContact CE1-CD1 3.91Å; Y92-F138 HydrophobicContact CE1-CD1 3.91Å; Y92-F138 HydrophobicContact CE2-CD1 4.42Å; Y92-F138 AromaticContact CG-CD1 3.75Å; Y92-F138 HydrophobicContact CG-CD1 3.75Å; Y92-F138 AromaticContact CG-CE1 3.62Å; Y92-F138 HydrophobicContact CG-CE1 3.62Å; Y92-T142 VanDerWaalsContact CE1-OG1 3.3Å; Y92-T142 WeakPolarHBondContact CE1-OG1 3.49Å; Y92-T142 PolarHBondContact OH-OG1 3.26Å
93	K	84.9	Confident	78.9	Confident	107 Å²	107	51.6 Å²	51.6	47%	0.465	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-39.6	173.5	-73.4	176.4	-178.8	177.3	0	112	M89 N90 L96 T97	M89-K93 WeakPolarHBondContact O-CG 3.41Å; M89-K93 PolarHBondContact O-N 3.49Å; N90-K93 PolarHBondContact O-N 3.47Å; K93-L96 PolarHBondContact O-N 2.99Å; K93-T97 WeakPolarHBondContact O-CG2 3.2Å
94	Q	83.6	Confident	78.8	Confident	78 Å²	78	52.1 Å²	52.1	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-47.5	173.3	-71.9	175	-8.7	0	0	111.2	L72 N90 R91 Y92 L96 T97 Y98	L72-Q94 HydrophobicContact CD1-CB 4.32Å; L72-Q94 HydrophobicContact CD2-CB 4.3Å; N90-Q94 WeakPolarHBondContact O-CG 3.3Å; N90-Q94 PolarHBondContact O-N 2.93Å; N90-Q94 VanDerWaalsContact O-N 3.08Å; R91-Q94 WeakPolarHBondContact O-CB 3.49Å; R91-Q94 PolarHBondContact O-N 2.86Å; Y92-Q94 VanDerWaalsContact C-N 3.27Å; Y92-Q94 PolarHBondContact O-N 3.32Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 2.94Å; Q94-T97 WeakPolarHBondContact O-CB 3.47Å; Q94-T97 PolarHBondContact O-N 3.37Å; Q94-T97 PolarHBondContact O-OG1 3.3Å; Q94-Y98 VanDerWaalsContact O-CD2 3.24Å; Q94-Y98 WeakPolarHBondContact O-CD2 3.46Å
95	L	85.3	Confident	78.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-42.6	177.2	-173.4	156.9	0	0	0	111.9	F69 L72 I76 R91 Y92 T97 Y98 I115	F69-L95 HydrophobicContact CD2-CD2 4.33Å; F69-L95 HydrophobicContact CD2-CG 4.03Å; F69-L95 HydrophobicContact CE2-CD1 4.31Å; F69-L95 HydrophobicContact CE2-CD2 3.45Å; F69-L95 VanDerWaalsContact CE2-CD2 3.45Å; F69-L95 HydrophobicContact CE2-CG 3.62Å; F69-L95 HydrophobicContact CZ-CD1 4.35Å; F69-L95 HydrophobicContact CZ-CD2 3.77Å; F69-L95 HydrophobicContact CZ-CG 4.1Å; L72-L95 HydrophobicContact CB-CB 4.3Å; L72-L95 HydrophobicContact CB-CD1 4.17Å; L72-L95 HydrophobicContact CB-CG 4.5Å; L72-L95 HydrophobicContact CD1-CB 4.28Å; I76-L95 HydrophobicContact CD1-CB 4.18Å; I76-L95 HydrophobicContact CD1-CD1 3.44Å; I76-L95 VanDerWaalsContact CD1-CD1 3.44Å; I76-L95 HydrophobicContact CD1-CG 4.44Å; R91-L95 PolarHBondContact O-N 3.12Å; Y92-L95 WeakPolarHBondContact O-CB 3.21Å; Y92-L95 PolarHBondContact O-N 2.92Å; Y92-L95 VanDerWaalsContact O-N 3.08Å; L95-T97 PolarHBondContact O-N 3.13Å; L95-T97 VanDerWaalsContact O-N 3.11Å; L95-Y98 WeakPolarHBondContact O-CB 3.47Å; L95-Y98 PolarHBondContact O-N 2.83Å; L95-I115 HydrophobicContact CD1-CD1 4.08Å
96	L	81.6	Confident	78.4	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-24.6	178.3	-66.6	174.9	0	0	0	113	Y92 K93 Q94 Y98 I99 I112 T142 A145	Y92-L96 HydrophobicContact CD1-CD1 3.88Å; Y92-L96 HydrophobicContact CD1-CG 4.16Å; Y92-L96 HydrophobicContact CE1-CD1 3.68Å; Y92-L96 HydrophobicContact CE1-CD2 3.92Å; Y92-L96 HydrophobicContact CE1-CG 3.91Å; Y92-L96 WeakPolarHBondContact O-CG 3.39Å; Y92-L96 PolarHBondContact O-N 3.32Å; K93-L96 PolarHBondContact O-N 2.99Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 2.94Å; L96-Y98 VanDerWaalsContact C-N 3.31Å; L96-Y98 PolarHBondContact O-N 3.19Å; L96-I99 HydrophobicContact CB-CD1 4.23Å; L96-I99 HydrophobicContact CD2-CD1 3.57Å; L96-I99 WeakPolarHBondContact O-CB 3.42Å; L96-I99 WeakPolarHBondContact O-CD1 3.39Å; L96-I99 WeakPolarHBondContact O-CG1 3.35Å; L96-I99 PolarHBondContact O-N 2.91Å; L96-I112 HydrophobicContact CD2-CD1 4.38Å; L96-T142 HydrophobicContact CD2-CG2 4.37Å; L96-A145 HydrophobicContact CB-CB 3.85Å; L96-A145 HydrophobicContact CD1-CB 3.73Å; L96-A145 HydrophobicContact CD2-CB 4.23Å; L96-A145 HydrophobicContact CG-CB 4.14Å
97	T	82.9	Confident	78.2	Confident	67 Å²	67	58.3 Å²	58.3	41%	0.411	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-74.2	-18.2	177	75.9	0	0	0	0	114.2	K64 K93 Q94 L95 I99	K64-T97 VanDerWaalsContact NZ-CB 3.29Å; K64-T97 PolarHBondContact NZ-O 3.4Å; K64-T97 PolarHBondContact NZ-OG1 3.28Å; K93-T97 WeakPolarHBondContact O-CG2 3.2Å; Q94-T97 WeakPolarHBondContact O-CB 3.47Å; Q94-T97 PolarHBondContact O-N 3.37Å; Q94-T97 PolarHBondContact O-OG1 3.3Å; L95-T97 PolarHBondContact O-N 3.13Å; L95-T97 VanDerWaalsContact O-N 3.11Å; T97-I99 VanDerWaalsContact C-N 3.33Å
98	Y	78.3	Confident	78.1	Confident	20 Å²	20	55.7 Å²	55.7	8%	0.078	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-81	-15.6	178.9	-73	-106.4	0	0	0	112.4	K64 F69 L72 Q94 L95 L96 R100 S101 A102 V103	K64-Y98 HydrophobicContact CB-CD1 3.75Å; K64-Y98 HydrophobicContact CB-CE1 3.59Å; K64-Y98 HydrophobicContact CD-CD1 4.21Å; K64-Y98 HydrophobicContact CD-CE1 4.21Å; K64-Y98 HydrophobicContact CD-CE2 4.49Å; K64-Y98 HydrophobicContact CD-CG 4.35Å; K64-Y98 HydrophobicContact CG-CD1 4.17Å; K64-Y98 HydrophobicContact CG-CE1 3.78Å; F69-Y98 HydrophobicContact CB-CD1 4.42Å; F69-Y98 HydrophobicContact CD2-CG 4.25Å; L72-Y98 HydrophobicContact CD1-CD2 3.92Å; L72-Y98 HydrophobicContact CD1-CE2 3.41Å; L72-Y98 VanDerWaalsContact CD1-CE2 3.41Å; Q94-Y98 VanDerWaalsContact O-CD2 3.24Å; Q94-Y98 WeakPolarHBondContact O-CD2 3.46Å; L95-Y98 WeakPolarHBondContact O-CB 3.47Å; L95-Y98 PolarHBondContact O-N 2.83Å; L96-Y98 VanDerWaalsContact C-N 3.31Å; L96-Y98 PolarHBondContact O-N 3.19Å; Y98-R100 PolarHBondContact O-N 3.35Å; Y98-S101 PolarHBondContact O-N 3.1Å; Y98-A102 HydrophobicContact CD1-CB 3.81Å; Y98-A102 HydrophobicContact CG-CB 4.49Å; Y98-A102 PolarHBondContact O-N 3.12Å; Y98-V103 PolarHBondContact O-N 3.43Å
99	I	73.8	Confident	77.8	Confident	14 Å²	14	56.5 Å²	56.5	7%	0.072	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.9	-28.6	-176.9	-59.8	174	0	0	0	112.4	L96 T97 I112 A149	L96-I99 HydrophobicContact CB-CD1 4.23Å; L96-I99 HydrophobicContact CD2-CD1 3.57Å; L96-I99 WeakPolarHBondContact O-CB 3.42Å; L96-I99 WeakPolarHBondContact O-CD1 3.39Å; L96-I99 WeakPolarHBondContact O-CG1 3.35Å; L96-I99 PolarHBondContact O-N 2.91Å; T97-I99 VanDerWaalsContact C-N 3.33Å; I99-I112 HydrophobicContact CD1-CD1 3.7Å; I99-A149 HydrophobicContact CG2-CB 4.24Å
100	R	67.3	Low	77.8	Confident	162 Å²	162	63.3 Å²	63.3	61%	0.611	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-36.2	-176.4	-63	-170.4	-161.2	172.8	14.8	114.3	Y98 D148	Y98-R100 PolarHBondContact O-N 3.35Å; R100-D148 IonicContact CZ-OD2 3.23Å; R100-D148 IonicContact NH1-OD2 2.83Å; R100-D148 VanDerWaalsContact NH2-CG 3.26Å; R100-D148 IonicContact NH2-OD2 2.87Å; R100-D148 PolarHBondContact NH2-OD2 2.88Å
101	S	65.2	Low	77.6	Confident	87 Å²	87	59.8 Å²	59.8	61%	0.608	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-25.4	-159.4	60.5	0	0	0	0	115.1	Y98	Y98-S101 PolarHBondContact O-N 3.1Å
102	A	61.1	Low	77.4	Confident	29 Å²	29	58 Å²	58	24%	0.24	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-27.8	-163.6	0	0	0	0	0	114.3	K64 Y98	K64-A102 HydrophobicContact CB-CB 3.66Å; K64-A102 WeakPolarHBondContact O-CB 3.07Å; Y98-A102 HydrophobicContact CD1-CB 3.81Å; Y98-A102 HydrophobicContact CG-CB 4.49Å; Y98-A102 PolarHBondContact O-N 3.12Å
103	V	70.1	Confident	77.2	Confident	18 Å²	18	59.2 Å²	59.2	11%	0.109	29%	0.288	C	S	.	.	S	Bend	trans	-130.8	144	-166.8	176.8	0	0	0	0	110.2	F69 Y98 Y107	F69-V103 HydrophobicContact CB-CG2 3.7Å; F69-V103 HydrophobicContact CD1-CG2 4.42Å; F69-V103 HydrophobicContact CD2-CB 4.44Å; F69-V103 HydrophobicContact CD2-CG2 3.8Å; F69-V103 HydrophobicContact CG-CG2 3.73Å; Y98-V103 PolarHBondContact O-N 3.43Å; V103-Y107 HydrophobicContact CG1-CD1 3.52Å; V103-Y107 HydrophobicContact CG1-CG 4.15Å
104	T	75.3	Confident	77.2	Confident	96 Å²	96	56 Å²	56	59%	0.589	28%	0.279	S	S	*	.			trans	-62.3	144.9	177.5	69.4	0	0	0	0	111.2	N106 Y107 S108	T104-N106 PolarHBondContact O-N 3.25Å; T104-Y107 PolarHBondContact O-N 3.12Å; T104-Y107 VanDerWaalsContact O-N 3.15Å; T104-Y107 WeakPolarHBondContact OG1-CB 3.29Å; T104-Y107 PolarHBondContact OG1-N 3.08Å; T104-S108 PolarHBondContact O-N 3.43Å
105	R	73.7	Confident	77.1	Confident	164 Å²	164	52.4 Å²	52.4	62%	0.619	26%	0.263	S	S	*	.	H	α-helix	trans	-54.4	-41.1	-179.7	-67.2	178.6	179.9	173.7	-0.5	112.1	S108 E109	R105-S108 PolarHBondContact O-N 3.2Å; R105-S108 PolarHBondContact O-OG 2.93Å; R105-E109 WeakPolarHBondContact O-CB 3.46Å; R105-E109 PolarHBondContact O-N 3.06Å
106	N	77.4	Confident	76.8	Confident	117 Å²	117	52.5 Å²	52.5	63%	0.626	26%	0.263	S	S	*	.	H	α-helix	trans	-65.4	-43.3	179.9	-68.4	-17.6	0	0	0	112.6	T104 E109 K110	T104-N106 PolarHBondContact O-N 3.25Å; N106-E109 PolarHBondContact O-N 3.46Å; N106-K110 WeakPolarHBondContact O-CG 3.42Å; N106-K110 PolarHBondContact O-N 3.35Å
107	Y	78.8	Confident	76.7	Confident	67 Å²	67	55.1 Å²	55.1	26%	0.263	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-38.5	179.3	-169.4	-98.9	0	0	0	111.6	F69 K70 V103 T104 S111	F69-Y107 AromaticContact CD1-CD1 3.99Å; F69-Y107 HydrophobicContact CD1-CD1 3.99Å; F69-Y107 AromaticContact CD1-CE1 3.61Å; F69-Y107 HydrophobicContact CD1-CE1 3.61Å; F69-Y107 AromaticContact CE1-CD1 3.81Å; F69-Y107 HydrophobicContact CE1-CD1 3.81Å; F69-Y107 AromaticContact CE1-CE1 3.7Å; F69-Y107 HydrophobicContact CE1-CE1 3.7Å; K70-Y107 WeakPolarHBondContact CE-OH 3.37Å; K70-Y107 WeakPolarHBondContact CG-OH 3.42Å; V103-Y107 HydrophobicContact CG1-CD1 3.52Å; V103-Y107 HydrophobicContact CG1-CG 4.15Å; T104-Y107 PolarHBondContact O-N 3.12Å; T104-Y107 VanDerWaalsContact O-N 3.15Å; T104-Y107 WeakPolarHBondContact OG1-CB 3.29Å; T104-Y107 PolarHBondContact OG1-N 3.08Å; Y107-S111 WeakPolarHBondContact O-CB 3.25Å; Y107-S111 PolarHBondContact O-N 3.05Å; Y107-S111 PolarHBondContact O-OG 3.39Å
108	S	78.4	Confident	76.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-41.9	173.1	72.3	0	0	0	0	112.4	T104 R105 S111 I112	T104-S108 PolarHBondContact O-N 3.43Å; R105-S108 PolarHBondContact O-N 3.2Å; R105-S108 PolarHBondContact O-OG 2.93Å; S108-S111 PolarHBondContact O-N 3.27Å; S108-I112 WeakPolarHBondContact O-CB 3.49Å; S108-I112 VanDerWaalsContact O-CG1 3.24Å; S108-I112 WeakPolarHBondContact O-CG1 3.48Å; S108-I112 PolarHBondContact O-N 3.46Å
109	E	76.6	Confident	76.5	Confident	18 Å²	18	55.1 Å²	55.1	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-47.3	176.7	176.6	173.6	173.3	0	0	111.7	R105 N106 S111 I112 N113 L154 K157	R105-E109 WeakPolarHBondContact O-CB 3.46Å; R105-E109 PolarHBondContact O-N 3.06Å; N106-E109 PolarHBondContact O-N 3.46Å; E109-S111 VanDerWaalsContact C-N 3.31Å; E109-S111 PolarHBondContact O-N 3.17Å; E109-I112 PolarHBondContact O-N 2.95Å; E109-N113 WeakPolarHBondContact CG-ND2 3.4Å; E109-N113 WeakPolarHBondContact O-CB 3.42Å; E109-N113 PolarHBondContact O-N 3.41Å; E109-N113 PolarHBondContact O-ND2 3.2Å; E109-L154 HydrophobicContact CB-CD2 4.37Å; E109-L154 HydrophobicContact CG-CB 4.46Å; E109-L154 HydrophobicContact CG-CD1 4.2Å; E109-L154 HydrophobicContact CG-CD2 4.49Å; E109-K157 IonicContact OE1-NZ 2.75Å; E109-K157 PolarHBondContact OE1-NZ 2.97Å
110	K	81.9	Confident	76.4	Confident	156 Å²	156	57.5 Å²	57.5	68%	0.678	29%	0.288	S	S	*	.	H	α-helix	trans	-59.6	-44	176.5	-75	-176.5	178.1	-176	0	111.4	N106 N113 S114	N106-K110 WeakPolarHBondContact O-CG 3.42Å; N106-K110 PolarHBondContact O-N 3.35Å; K110-N113 PolarHBondContact O-N 2.9Å; K110-S114 VanDerWaalsContact O-CB 3.27Å; K110-S114 WeakPolarHBondContact O-CB 3.36Å; K110-S114 PolarHBondContact O-N 3.47Å
111	S	81.5	Confident	76.6	Confident	2 Å²	2	55 Å²	55	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-68.5	-42.1	-178.3	-62.1	0	0	0	0	112.5	F69 Y107 S108 E109 S114 I115	F69-S111 WeakPolarHBondContact CE1-OG 3.29Å; Y107-S111 WeakPolarHBondContact O-CB 3.25Å; Y107-S111 PolarHBondContact O-N 3.05Å; Y107-S111 PolarHBondContact O-OG 3.39Å; S108-S111 PolarHBondContact O-N 3.27Å; E109-S111 VanDerWaalsContact C-N 3.31Å; E109-S111 PolarHBondContact O-N 3.17Å; S111-S114 PolarHBondContact O-N 3.49Å; S111-I115 WeakPolarHBondContact O-CB 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.24Å; S111-I115 WeakPolarHBondContact O-CG1 3.22Å; S111-I115 PolarHBondContact O-N 3.37Å
112	I	82.6	Confident	76.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-46.4	175.4	-70.2	166.9	0	0	0	110.5	L96 I99 S108 E109 I115 L116 T142 L154	L96-I112 HydrophobicContact CD2-CD1 4.38Å; I99-I112 HydrophobicContact CD1-CD1 3.7Å; S108-I112 WeakPolarHBondContact O-CB 3.49Å; S108-I112 VanDerWaalsContact O-CG1 3.24Å; S108-I112 WeakPolarHBondContact O-CG1 3.48Å; S108-I112 PolarHBondContact O-N 3.46Å; E109-I112 PolarHBondContact O-N 2.95Å; I112-I115 PolarHBondContact O-N 3.03Å; I112-L116 HydrophobicContact CG2-CD1 3.68Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 WeakPolarHBondContact O-CB 3.28Å; I112-L116 VanDerWaalsContact O-CG 3.25Å; I112-L116 WeakPolarHBondContact O-CG 3.44Å; I112-L116 PolarHBondContact O-N 2.97Å; I112-T142 HydrophobicContact CG2-CG2 4.03Å; I112-L154 HydrophobicContact CD1-CD2 3.97Å; I112-L154 HydrophobicContact CG2-CD1 4.42Å
113	N	81.1	Confident	76.2	Confident	25 Å²	25	58.6 Å²	58.6	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-45.8	177.2	-74	-44.4	0	0	0	111.5	E109 K110 I115 L116 D117	E109-N113 WeakPolarHBondContact CG-ND2 3.4Å; E109-N113 WeakPolarHBondContact O-CB 3.42Å; E109-N113 PolarHBondContact O-N 3.41Å; E109-N113 PolarHBondContact O-ND2 3.2Å; K110-N113 PolarHBondContact O-N 2.9Å; N113-I115 VanDerWaalsContact C-N 3.34Å; N113-I115 PolarHBondContact O-N 3.5Å; N113-L116 PolarHBondContact O-N 3.29Å; N113-D117 VanDerWaalsContact O-CB 3.32Å; N113-D117 WeakPolarHBondContact O-CB 3.21Å; N113-D117 PolarHBondContact O-N 3.09Å
114	S	83.8	Confident	75.1	Confident	40 Å²	40	63.4 Å²	63.4	28%	0.28	31%	0.314	S	S	.	.	H	α-helix	trans	-58.4	-43.2	176.3	175.6	0	0	0	0	112.3	K110 S111 Y118	K110-S114 VanDerWaalsContact O-CB 3.27Å; K110-S114 WeakPolarHBondContact O-CB 3.36Å; K110-S114 PolarHBondContact O-N 3.47Å; S111-S114 PolarHBondContact O-N 3.49Å; S114-Y118 WeakPolarHBondContact O-CB 3.49Å; S114-Y118 PolarHBondContact O-N 2.93Å
115	I	82.5	Confident	73.6	Confident	3 Å²	3	66.6 Å²	66.6	2%	0.015	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-47.2	176.6	-69.8	166.1	0	0	0	110.6	K73 I76 Y92 L95 S111 I112 N113 D117 Y118 I119	K73-I115 HydrophobicContact CG-CD1 4.41Å; I76-I115 HydrophobicContact CD1-CD1 4.2Å; I76-I115 HydrophobicContact CG2-CD1 4.39Å; I76-I115 HydrophobicContact CG2-CG2 3.98Å; Y92-I115 HydrophobicContact CE2-CG2 4.22Å; L95-I115 HydrophobicContact CD1-CD1 4.08Å; S111-I115 WeakPolarHBondContact O-CB 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.24Å; S111-I115 WeakPolarHBondContact O-CG1 3.22Å; S111-I115 PolarHBondContact O-N 3.37Å; I112-I115 PolarHBondContact O-N 3.03Å; N113-I115 VanDerWaalsContact C-N 3.34Å; N113-I115 PolarHBondContact O-N 3.5Å; I115-D117 PolarHBondContact O-N 3.35Å; I115-Y118 PolarHBondContact O-N 2.98Å; I115-I119 HydrophobicContact CG2-CD1 3.57Å; I115-I119 HydrophobicContact CG2-CG1 4.37Å; I115-I119 WeakPolarHBondContact O-CD1 3.46Å; I115-I119 WeakPolarHBondContact O-CG1 3.44Å; I115-I119 PolarHBondContact O-N 3.29Å
116	L	78.9	Confident	72.3	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-40.9	-179.9	-70.6	170.1	0	0	0	112.1	I112 N113 I119 S120 L135 F138 Y139	I112-L116 HydrophobicContact CG2-CD1 3.68Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 WeakPolarHBondContact O-CB 3.28Å; I112-L116 VanDerWaalsContact O-CG 3.25Å; I112-L116 WeakPolarHBondContact O-CG 3.44Å; I112-L116 PolarHBondContact O-N 2.97Å; N113-L116 PolarHBondContact O-N 3.29Å; L116-I119 PolarHBondContact O-N 3.04Å; L116-S120 WeakPolarHBondContact O-CB 3.38Å; L116-S120 PolarHBondContact O-N 3.42Å; L116-L135 HydrophobicContact CD2-CD1 4.38Å; L116-F138 HydrophobicContact CD2-CB 4.43Å; L116-Y139 HydrophobicContact CD1-CD1 4.35Å; L116-Y139 HydrophobicContact CD1-CE1 3.75Å; L116-Y139 HydrophobicContact CD2-CD1 4.24Å; L116-Y139 HydrophobicContact CD2-CE1 3.91Å; L116-Y139 HydrophobicContact CG-CE1 4.33Å
117	D	79.3	Confident	71.2	Confident	71 Å²	71	63.7 Å²	63.7	38%	0.38	33%	0.333	S	S	.	.	H	α-helix	trans	-69.2	-36	177.3	-64.8	-25.7	0	0	0	110.6	N113 I115 S120 T121 K161	N113-D117 VanDerWaalsContact O-CB 3.32Å; N113-D117 WeakPolarHBondContact O-CB 3.21Å; N113-D117 PolarHBondContact O-N 3.09Å; I115-D117 PolarHBondContact O-N 3.35Å; D117-S120 PolarHBondContact O-N 3.36Å; D117-T121 VanDerWaalsContact O-CB 3.25Å; D117-T121 WeakPolarHBondContact O-CB 3.35Å; D117-T121 PolarHBondContact O-N 3.46Å; D117-T121 PolarHBondContact O-OG1 3.32Å; D117-K161 IonicContact OD1-NZ 3.69Å; D117-K161 PolarHBondContact OD1-NZ 2.85Å; D117-K161 IonicContact OD2-NZ 3.03Å
118	Y	79.9	Confident	70.1	Confident	83 Å²	83	67.7 Å²	67.7	33%	0.325	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-44.2	173.3	-170.6	-107.6	0	0	0	112.3	F80 S114 I115 S120 S122	F80-Y118 HydrophobicContact CD1-CD1 4.09Å; F80-Y118 AromaticContact CD1-CE1 3.68Å; F80-Y118 HydrophobicContact CD1-CE1 3.68Å; F80-Y118 HydrophobicContact CE1-CE1 4.28Å; S114-Y118 WeakPolarHBondContact O-CB 3.49Å; S114-Y118 PolarHBondContact O-N 2.93Å; I115-Y118 PolarHBondContact O-N 2.98Å; Y118-S120 VanDerWaalsContact C-N 3.34Å; Y118-S122 VanDerWaalsContact O-CB 3.28Å; Y118-S122 WeakPolarHBondContact O-CB 3.32Å; Y118-S122 PolarHBondContact O-N 2.68Å; Y118-S122 VanDerWaalsContact O-N 3.16Å; Y118-S122 PolarHBondContact O-OG 3.11Å
119	I	77.6	Confident	68.9	Low	4 Å²	4	74.1 Å²	74.1	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-69.4	-33.3	176.8	-61.7	162.9	0	0	0	111	F80 M88 I115 L116 S122 Q131 L135 F138	F80-I119 HydrophobicContact CD2-CG1 4.17Å; F80-I119 HydrophobicContact CE2-CB 4.43Å; F80-I119 HydrophobicContact CE2-CG1 4.22Å; F80-I119 HydrophobicContact CE2-CG2 4Å; M88-I119 HydrophobicContact CE-CD1 3.8Å; M88-I119 HydrophobicContact CE-CG1 4.16Å; I115-I119 HydrophobicContact CG2-CD1 3.57Å; I115-I119 HydrophobicContact CG2-CG1 4.37Å; I115-I119 WeakPolarHBondContact O-CD1 3.46Å; I115-I119 WeakPolarHBondContact O-CG1 3.44Å; I115-I119 PolarHBondContact O-N 3.29Å; L116-I119 PolarHBondContact O-N 3.04Å; I119-S122 WeakPolarHBondContact CA-OG 3.38Å; I119-S122 PolarHBondContact O-OG 2.95Å; I119-Q131 PolarHBondContact O-NE2 3.39Å; I119-L135 HydrophobicContact CB-CD1 4.45Å; I119-L135 HydrophobicContact CG2-CD1 3.97Å; I119-F138 HydrophobicContact CD1-CG 4.49Å
120	S	71.1	Confident	68.1	Low	64 Å²	64	76 Å²	76	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-74.9	-31.7	178.2	-173.1	0	0	0	0	113.2	L116 D117 Y118	L116-S120 WeakPolarHBondContact O-CB 3.38Å; L116-S120 PolarHBondContact O-N 3.42Å; D117-S120 PolarHBondContact O-N 3.36Å; Y118-S120 VanDerWaalsContact C-N 3.34Å
121	T	71.9	Confident	67.2	Low	109 Å²	109	70.1 Å²	70.1	67%	0.669	38%	0.375	S	S	*	.	H	α-helix	trans	-87.9	-27.5	-175.9	-55.1	0	0	0	0	112.5	D117 K123	D117-T121 VanDerWaalsContact O-CB 3.25Å; D117-T121 WeakPolarHBondContact O-CB 3.35Å; D117-T121 PolarHBondContact O-N 3.46Å; D117-T121 PolarHBondContact O-OG1 3.32Å; T121-K123 VanDerWaalsContact C-N 3.3Å; T121-K123 PolarHBondContact O-N 3.39Å
122	S	64.6	Low	66.6	Low	22 Å²	22	71.6 Å²	71.6	15%	0.154	38%	0.382	C	S	.	.			trans	-73	79.1	-176.7	44.7	0	0	0	0	112.2	F80 Y118 I119 Q124 Q131	F80-S122 WeakPolarHBondContact CE1-OG 3.22Å; F80-S122 WeakPolarHBondContact CZ-OG 3.26Å; Y118-S122 VanDerWaalsContact O-CB 3.28Å; Y118-S122 WeakPolarHBondContact O-CB 3.32Å; Y118-S122 PolarHBondContact O-N 2.68Å; Y118-S122 VanDerWaalsContact O-N 3.16Å; Y118-S122 PolarHBondContact O-OG 3.11Å; I119-S122 WeakPolarHBondContact CA-OG 3.38Å; I119-S122 PolarHBondContact O-OG 2.95Å; S122-Q124 PolarHBondContact O-N 3.27Å; S122-Q131 PolarHBondContact O-NE2 2.95Å; S122-Q131 PolarHBondContact O-OE1 3.17Å
123	K	52.8	Low	66.1	Low	170 Å²	170	74.5 Å²	74.5	74%	0.739	40%	0.398	S	S	*	.			trans	-74.8	72.7	171.5	-62	-172.5	-179.6	-174.7	0	110.3	T121	T121-K123 VanDerWaalsContact C-N 3.3Å; T121-K123 PolarHBondContact O-N 3.39Å
124	Q	47.6	Very low	65.9	Low	118 Å²	118	74.4 Å²	74.4	55%	0.551	40%	0.397	S	S	*	.			trans	-78.1	124	168.4	-76.6	-162.7	-21.4	0	0	110	S122 S126	S122-Q124 PolarHBondContact O-N 3.27Å; Q124-S126 PolarHBondContact O-N 3.29Å
125	N	44.6	Very low	65.6	Low	164 Å²	164	73.1 Å²	73.1	88%	0.877	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	55.7	-158.4	-77	-42.5	0	0	0	116.2
126	S	44.8	Very low	65.5	Low	106 Å²	106	73.7 Å²	73.7	74%	0.741	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.9	-33.4	168.7	40.6	0	0	0	0	117.5	Q124	Q124-S126 PolarHBondContact O-N 3.29Å
127	D	54.3	Low	65.6	Low	113 Å²	113	78.1 Å²	78.1	60%	0.604	41%	0.41	S	S	*	.			trans	-134.4	71.4	-176	-73.2	-37.6	0	0	0	112.8	L129 C130 Q131	D127-L129 PolarHBondContact O-N 3Å; D127-C130 HydrophobicContact CB-CB 3.86Å; D127-C130 PolarHBondContact O-N 3.07Å; D127-Q131 PolarHBondContact O-N 3.44Å; D127-Q131 VanDerWaalsContact O-N 3.14Å
128	F	55.5	Low	65.8	Low	151 Å²	151	74.8 Å²	74.8	66%	0.662	39%	0.392	S	S	*	.	H	α-helix	trans	-54.5	-37.6	178.5	-176.1	-102.3	0	0	0	113.1	M132	F128-M132 HydrophobicContact CD1-SD 4.22Å; F128-M132 HydrophobicContact CE1-CG 4.28Å; F128-M132 HydrophobicContact CE1-SD 3.45Å; F128-M132 WeakPolarHBondContact CE1-SD 3.44Å; F128-M132 HydrophobicContact CE2-SD 4.43Å; F128-M132 HydrophobicContact CZ-CG 4.3Å; F128-M132 HydrophobicContact CZ-SD 3.58Å; F128-M132 VanDerWaalsContact CZ-SD 3.58Å; F128-M132 WeakPolarHBondContact O-CG 3.44Å; F128-M132 PolarHBondContact O-N 3.3Å
129	L	54.3	Low	66	Low	137 Å²	137	71.3 Å²	71.3	72%	0.717	38%	0.379	S	S	*	.	H	α-helix	trans	-67.4	-44.1	179.1	-76.3	158	0	0	0	112.4	D127 Q131 M132 D133	D127-L129 PolarHBondContact O-N 3Å; L129-Q131 VanDerWaalsContact C-N 3.33Å; L129-Q131 PolarHBondContact O-N 2.72Å; L129-M132 PolarHBondContact O-N 3.24Å; L129-D133 PolarHBondContact O-N 3.15Å; L129-D133 VanDerWaalsContact O-N 3.11Å
130	C	59.7	Low	66.3	Low	57 Å²	57	74.1 Å²	74.1	39%	0.385	39%	0.392	S	S	.	.	H	α-helix	trans	-65.1	-39.5	179	-171.7	0	0	0	0	111.2	D127 D133 L134	D127-C130 HydrophobicContact CB-CB 3.86Å; D127-C130 PolarHBondContact O-N 3.07Å; C130-D133 PolarHBondContact O-N 3.18Å; C130-L134 WeakPolarHBondContact O-CB 3.38Å; C130-L134 WeakPolarHBondContact O-CD1 3.18Å; C130-L134 VanDerWaalsContact O-CG 3.23Å; C130-L134 WeakPolarHBondContact O-CG 3.35Å; C130-L134 PolarHBondContact O-N 3.49Å
131	Q	64	Low	66.9	Low	32 Å²	32	72.1 Å²	72.1	15%	0.15	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-39	178.4	-173.6	172.6	7.6	0	0	112.8	I119 S122 D127 L129 L135	I119-Q131 PolarHBondContact O-NE2 3.39Å; S122-Q131 PolarHBondContact O-NE2 2.95Å; S122-Q131 PolarHBondContact O-OE1 3.17Å; D127-Q131 PolarHBondContact O-N 3.44Å; D127-Q131 VanDerWaalsContact O-N 3.14Å; L129-Q131 VanDerWaalsContact C-N 3.33Å; L129-Q131 PolarHBondContact O-N 2.72Å; Q131-L135 VanDerWaalsContact O-CB 3.27Å; Q131-L135 WeakPolarHBondContact O-CB 3.04Å; Q131-L135 PolarHBondContact O-N 3.35Å
132	M	67.2	Low	67.5	Low	34 Å²	34	66.9 Å²	66.9	17%	0.167	35%	0.345	C	S	.	.	H	α-helix	trans	-69.6	-38.6	176.4	-68.8	-161.7	88.6	0	0	112.4	F128 L129 L135 Q136 L165 E168	F128-M132 HydrophobicContact CD1-SD 4.22Å; F128-M132 HydrophobicContact CE1-CG 4.28Å; F128-M132 HydrophobicContact CE1-SD 3.45Å; F128-M132 WeakPolarHBondContact CE1-SD 3.44Å; F128-M132 HydrophobicContact CE2-SD 4.43Å; F128-M132 HydrophobicContact CZ-CG 4.3Å; F128-M132 HydrophobicContact CZ-SD 3.58Å; F128-M132 VanDerWaalsContact CZ-SD 3.58Å; F128-M132 WeakPolarHBondContact O-CG 3.44Å; F128-M132 PolarHBondContact O-N 3.3Å; L129-M132 PolarHBondContact O-N 3.24Å; M132-L135 PolarHBondContact O-N 3.14Å; M132-Q136 PolarHBondContact O-N 3.1Å; M132-L165 HydrophobicContact CE-CD1 3.58Å; M132-L165 HydrophobicContact CE-CG 4.07Å; M132-E168 HydrophobicContact CE-CB 4.32Å
133	D	73.8	Confident	68.3	Low	61 Å²	61	66.4 Å²	66.4	33%	0.326	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-45.5	174	-76	-34	0	0	0	111.3	L129 C130 Q136 E137 R169	L129-D133 PolarHBondContact O-N 3.15Å; L129-D133 VanDerWaalsContact O-N 3.11Å; C130-D133 PolarHBondContact O-N 3.18Å; D133-Q136 WeakPolarHBondContact O-CB 3.43Å; D133-Q136 PolarHBondContact O-N 3.06Å; D133-E137 PolarHBondContact O-N 3.22Å; D133-R169 IonicContact OD1-CZ 2.71Å; D133-R169 IonicContact OD1-NH1 3.05Å; D133-R169 PolarHBondContact OD1-NH1 3.04Å; D133-R169 IonicContact OD1-NH2 2.8Å; D133-R169 PolarHBondContact OD1-NH2 2.93Å; D133-R169 IonicContact OD2-NH2 2.66Å
134	L	75.9	Confident	69.6	Low	23 Å²	23	64.3 Å²	64.3	12%	0.12	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-48.9	175.1	-75.7	162.7	0	0	0	111.7	F85 C130 Q136 E137 F138	F85-L134 HydrophobicContact CB-CD1 3.74Å; F85-L134 HydrophobicContact CB-CD2 3.56Å; F85-L134 HydrophobicContact CB-CG 4.3Å; F85-L134 HydrophobicContact CD1-CD1 3.42Å; F85-L134 VanDerWaalsContact CD1-CD1 3.42Å; F85-L134 HydrophobicContact CD2-CD1 3.56Å; F85-L134 HydrophobicContact CE1-CD1 3.8Å; F85-L134 HydrophobicContact CE2-CD1 3.92Å; F85-L134 HydrophobicContact CG-CD1 3.28Å; F85-L134 HydrophobicContact CG-CD2 4.12Å; F85-L134 HydrophobicContact CG-CG 4.33Å; F85-L134 HydrophobicContact CZ-CD1 4.03Å; C130-L134 WeakPolarHBondContact O-CB 3.38Å; C130-L134 WeakPolarHBondContact O-CD1 3.18Å; C130-L134 VanDerWaalsContact O-CG 3.23Å; C130-L134 WeakPolarHBondContact O-CG 3.35Å; C130-L134 PolarHBondContact O-N 3.49Å; L134-Q136 PolarHBondContact O-N 2.78Å; L134-E137 WeakPolarHBondContact O-CB 3.42Å; L134-E137 PolarHBondContact O-N 3.38Å; L134-F138 HydrophobicContact CB-CE2 4.5Å; L134-F138 WeakPolarHBondContact O-CD2 3.33Å; L134-F138 PolarHBondContact O-N 2.99Å
135	L	78.2	Confident	71.1	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.063	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-37.4	179.9	-175.6	58.5	0	0	0	111.4	L116 I119 Q131 M132 F138 Y139 L165	L116-L135 HydrophobicContact CD2-CD1 4.38Å; I119-L135 HydrophobicContact CB-CD1 4.45Å; I119-L135 HydrophobicContact CG2-CD1 3.97Å; Q131-L135 VanDerWaalsContact O-CB 3.27Å; Q131-L135 WeakPolarHBondContact O-CB 3.04Å; Q131-L135 PolarHBondContact O-N 3.35Å; M132-L135 PolarHBondContact O-N 3.14Å; L135-F138 PolarHBondContact O-N 3.28Å; L135-Y139 HydrophobicContact CD1-CD2 3.95Å; L135-Y139 HydrophobicContact CD1-CE2 3.48Å; L135-Y139 VanDerWaalsContact CD1-CE2 3.48Å; L135-Y139 HydrophobicContact CD2-CE2 4.02Å; L135-Y139 HydrophobicContact CG-CD2 3.82Å; L135-Y139 HydrophobicContact CG-CE2 3.49Å; L135-Y139 VanDerWaalsContact CG-CE2 3.49Å; L135-Y139 WeakPolarHBondContact O-CD2 3.45Å; L135-Y139 PolarHBondContact O-N 3.13Å; L135-L165 HydrophobicContact CD2-CD1 3.83Å; L135-L165 HydrophobicContact CG-CD1 4.34Å
136	Q	79.9	Confident	72.5	Confident	15 Å²	15	52.1 Å²	52.1	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-47.5	172.4	-167	-167	-54.8	0	0	111.6	M132 D133 L134 F138 Y139 E140 L162 L165 Y166	M132-Q136 PolarHBondContact O-N 3.1Å; D133-Q136 WeakPolarHBondContact O-CB 3.43Å; D133-Q136 PolarHBondContact O-N 3.06Å; L134-Q136 PolarHBondContact O-N 2.78Å; Q136-F138 VanDerWaalsContact C-N 3.32Å; Q136-F138 PolarHBondContact O-N 3.3Å; Q136-Y139 PolarHBondContact O-N 3.33Å; Q136-E140 PolarHBondContact NE2-OE1 2.85Å; Q136-E140 WeakPolarHBondContact O-CG 3.43Å; Q136-E140 PolarHBondContact O-N 3.3Å; Q136-L162 HydrophobicContact CG-CD1 4.05Å; Q136-L165 HydrophobicContact CB-CD2 3.8Å; Q136-L165 HydrophobicContact CG-CD2 4.18Å; Q136-Y166 HydrophobicContact CG-CE1 4.21Å; Q136-Y166 PolarHBondContact NE2-OH 3.02Å; Q136-Y166 VanDerWaalsContact NE2-OH 3.11Å
137	E	81.8	Confident	73.8	Confident	95 Å²	95	52.9 Å²	52.9	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-40.1	177.1	-69.3	-176.5	-174.1	0	0	112	M89 D133 L134 E140 T141	M89-E137 HydrophobicContact CE-CB 3.84Å; M89-E137 WeakPolarHBondContact CE-O 3.13Å; D133-E137 PolarHBondContact O-N 3.22Å; L134-E137 WeakPolarHBondContact O-CB 3.42Å; L134-E137 PolarHBondContact O-N 3.38Å; E137-E140 PolarHBondContact O-N 3.38Å; E137-T141 WeakPolarHBondContact O-CB 3.46Å; E137-T141 WeakPolarHBondContact O-CG2 3.41Å; E137-T141 PolarHBondContact O-N 3.43Å; E137-T141 PolarHBondContact O-OG1 3.38Å
138	F	82.1	Confident	74.4	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-50.8	172.7	-82	-75.4	0	0	0	110.8	M88 M89 Y92 L116 I119 L134 L135 Q136 E140 T141 T142	M88-F138 HydrophobicContact CE-CE1 4.17Å; M88-F138 HydrophobicContact CE-CE2 3.71Å; M88-F138 HydrophobicContact CE-CZ 3.48Å; M88-F138 VanDerWaalsContact CE-CZ 3.48Å; M88-F138 HydrophobicContact SD-CE1 3.4Å; M88-F138 WeakPolarHBondContact SD-CE1 3.42Å; M88-F138 HydrophobicContact SD-CE2 3.95Å; M88-F138 HydrophobicContact SD-CZ 3.07Å; M88-F138 WeakPolarHBondContact SD-CZ 3.3Å; M89-F138 HydrophobicContact CB-CZ 4.21Å; M89-F138 HydrophobicContact SD-CD1 4.04Å; M89-F138 HydrophobicContact SD-CE1 3.71Å; M89-F138 HydrophobicContact SD-CZ 3.91Å; Y92-F138 AromaticContact CD1-CD1 3.61Å; Y92-F138 HydrophobicContact CD1-CD1 3.61Å; Y92-F138 AromaticContact CD1-CE1 3.88Å; Y92-F138 HydrophobicContact CD1-CE1 3.88Å; Y92-F138 HydrophobicContact CD2-CD1 4.14Å; Y92-F138 HydrophobicContact CD2-CE1 4.12Å; Y92-F138 AromaticContact CE1-CD1 3.91Å; Y92-F138 HydrophobicContact CE1-CD1 3.91Å; Y92-F138 HydrophobicContact CE2-CD1 4.42Å; Y92-F138 AromaticContact CG-CD1 3.75Å; Y92-F138 HydrophobicContact CG-CD1 3.75Å; Y92-F138 AromaticContact CG-CE1 3.62Å; Y92-F138 HydrophobicContact CG-CE1 3.62Å; L116-F138 HydrophobicContact CD2-CB 4.43Å; I119-F138 HydrophobicContact CD1-CG 4.49Å; L134-F138 HydrophobicContact CB-CE2 4.5Å; L134-F138 WeakPolarHBondContact O-CD2 3.33Å; L134-F138 PolarHBondContact O-N 2.99Å; L135-F138 PolarHBondContact O-N 3.28Å; Q136-F138 VanDerWaalsContact C-N 3.32Å; Q136-F138 PolarHBondContact O-N 3.3Å; F138-E140 PolarHBondContact O-N 3.01Å; F138-T141 PolarHBondContact O-N 3.42Å; F138-T141 PolarHBondContact O-OG1 3.34Å; F138-T141 VanDerWaalsContact O-OG1 3.14Å; F138-T142 VanDerWaalsContact O-CB 3.29Å; F138-T142 WeakPolarHBondContact O-CB 3.45Å; F138-T142 PolarHBondContact O-N 3.46Å; F138-T142 PolarHBondContact O-OG1 3.36Å
139	Y	83.6	Confident	74.8	Confident	9 Å²	9	46.2 Å²	46.2	4%	0.035	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-44.9	178.3	-80.9	-62.3	0	0	0	112.4	L116 L135 Q136 T142 L143 T158 K161 L162	L116-Y139 HydrophobicContact CD1-CD1 4.35Å; L116-Y139 HydrophobicContact CD1-CE1 3.75Å; L116-Y139 HydrophobicContact CD2-CD1 4.24Å; L116-Y139 HydrophobicContact CD2-CE1 3.91Å; L116-Y139 HydrophobicContact CG-CE1 4.33Å; L135-Y139 HydrophobicContact CD1-CD2 3.95Å; L135-Y139 HydrophobicContact CD1-CE2 3.48Å; L135-Y139 VanDerWaalsContact CD1-CE2 3.48Å; L135-Y139 HydrophobicContact CD2-CE2 4.02Å; L135-Y139 HydrophobicContact CG-CD2 3.82Å; L135-Y139 HydrophobicContact CG-CE2 3.49Å; L135-Y139 VanDerWaalsContact CG-CE2 3.49Å; L135-Y139 WeakPolarHBondContact O-CD2 3.45Å; L135-Y139 PolarHBondContact O-N 3.13Å; Q136-Y139 PolarHBondContact O-N 3.33Å; Y139-T142 PolarHBondContact O-N 3.11Å; Y139-L143 WeakPolarHBondContact O-CB 3.38Å; Y139-L143 WeakPolarHBondContact O-CG 3.43Å; Y139-L143 PolarHBondContact O-N 2.87Å; Y139-T158 HydrophobicContact CD1-CG2 3.61Å; Y139-T158 HydrophobicContact CE1-CG2 4.2Å; Y139-K161 HydrophobicContact CE1-CB 3.8Å; Y139-K161 HydrophobicContact CE1-CD 4.25Å; Y139-K161 WeakPolarHBondContact OH-CD 3.38Å; Y139-L162 HydrophobicContact CD2-CD1 4.46Å; Y139-L162 HydrophobicContact CG-CB 4.28Å; Y139-L162 HydrophobicContact CG-CD1 4.38Å
140	E	84.6	Confident	75.3	Confident	64 Å²	64	48 Å²	48	30%	0.299	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-47.9	179.7	-74	177.4	-173	0	0	112	Q136 E137 F138 T142 L143 E144 L162 Y166	Q136-E140 PolarHBondContact NE2-OE1 2.85Å; Q136-E140 WeakPolarHBondContact O-CG 3.43Å; Q136-E140 PolarHBondContact O-N 3.3Å; E137-E140 PolarHBondContact O-N 3.38Å; F138-E140 PolarHBondContact O-N 3.01Å; E140-T142 PolarHBondContact O-N 3.17Å; E140-L143 PolarHBondContact O-N 3.34Å; E140-E144 WeakPolarHBondContact O-CG 3.44Å; E140-E144 PolarHBondContact O-N 3.1Å; E140-L162 HydrophobicContact CG-CD2 4.37Å; E140-Y166 PolarHBondContact OE1-OH 3.32Å
141	T	84.1	Confident	75.8	Confident	21 Å²	21	46.5 Å²	46.5	13%	0.129	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-34.3	178.4	54.3	0	0	0	0	113.2	M89 E137 F138 L143 E144 A145	M89-T141 HydrophobicContact CE-CG2 3.31Å; M89-T141 VanDerWaalsContact CE-OG1 3.28Å; M89-T141 WeakPolarHBondContact CE-OG1 3.33Å; E137-T141 WeakPolarHBondContact O-CB 3.46Å; E137-T141 WeakPolarHBondContact O-CG2 3.41Å; E137-T141 PolarHBondContact O-N 3.43Å; E137-T141 PolarHBondContact O-OG1 3.38Å; F138-T141 PolarHBondContact O-N 3.42Å; F138-T141 PolarHBondContact O-OG1 3.34Å; F138-T141 VanDerWaalsContact O-OG1 3.14Å; T141-L143 VanDerWaalsContact C-N 3.34Å; T141-E144 PolarHBondContact O-N 3.12Å; T141-A145 PolarHBondContact O-N 3.2Å; T141-A145 VanDerWaalsContact O-N 3.08Å
142	T	83.5	Confident	76.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-47.9	170.9	-51.4	0	0	0	0	109.9	Y92 L96 I112 F138 Y139 E140 E144 A145 L146 T158	Y92-T142 VanDerWaalsContact CE1-OG1 3.3Å; Y92-T142 WeakPolarHBondContact CE1-OG1 3.49Å; Y92-T142 PolarHBondContact OH-OG1 3.26Å; L96-T142 HydrophobicContact CD2-CG2 4.37Å; I112-T142 HydrophobicContact CG2-CG2 4.03Å; F138-T142 VanDerWaalsContact O-CB 3.29Å; F138-T142 WeakPolarHBondContact O-CB 3.45Å; F138-T142 PolarHBondContact O-N 3.46Å; F138-T142 PolarHBondContact O-OG1 3.36Å; Y139-T142 PolarHBondContact O-N 3.11Å; E140-T142 PolarHBondContact O-N 3.17Å; T142-E144 PolarHBondContact O-N 3.3Å; T142-A145 PolarHBondContact O-N 2.93Å; T142-L146 HydrophobicContact CG2-CD1 3.68Å; T142-L146 HydrophobicContact CG2-CG 4.17Å; T142-L146 WeakPolarHBondContact O-CB 3.45Å; T142-L146 WeakPolarHBondContact O-CG 3.39Å; T142-L146 PolarHBondContact O-N 3.34Å; T142-T158 HydrophobicContact CG2-CG2 4.21Å
143	L	81.3	Confident	76.6	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.063	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-38.6	-179.2	-73.6	169.9	0	0	0	112.6	Y139 E140 T141 L146 K147 W155 T158 N159 L162	Y139-L143 WeakPolarHBondContact O-CB 3.38Å; Y139-L143 WeakPolarHBondContact O-CG 3.43Å; Y139-L143 PolarHBondContact O-N 2.87Å; E140-L143 PolarHBondContact O-N 3.34Å; T141-L143 VanDerWaalsContact C-N 3.34Å; L143-L146 PolarHBondContact O-N 3.42Å; L143-K147 WeakPolarHBondContact O-CG 3.43Å; L143-K147 PolarHBondContact O-N 3.01Å; L143-W155 HydrophobicContact CD2-CG 4.43Å; L143-T158 HydrophobicContact CD1-CG2 4.46Å; L143-T158 HydrophobicContact CD2-CG2 3.71Å; L143-T158 HydrophobicContact CG-CG2 3.76Å; L143-N159 VanDerWaalsContact CD1-OD1 3.28Å; L143-N159 WeakPolarHBondContact CD1-OD1 3.36Å; L143-N159 HydrophobicContact CD2-CB 4.47Å; L143-N159 VanDerWaalsContact CD2-ND2 3.28Å; L143-N159 WeakPolarHBondContact CD2-ND2 3.38Å; L143-L162 HydrophobicContact CD1-CD2 3.55Å
144	E	81.6	Confident	76.7	Confident	125 Å²	125	53.3 Å²	53.3	58%	0.584	26%	0.256	S	S	*	.	H	α-helix	trans	-61.3	-45.9	173.7	-73.9	178.6	174.5	0	0	111.9	E140 T141 T142 L146	E140-E144 WeakPolarHBondContact O-CG 3.44Å; E140-E144 PolarHBondContact O-N 3.1Å; T141-E144 PolarHBondContact O-N 3.12Å; T142-E144 PolarHBondContact O-N 3.3Å; E144-L146 VanDerWaalsContact C-N 3.33Å; E144-L146 PolarHBondContact O-N 2.92Å
145	A	78.4	Confident	77.1	Confident	24 Å²	24	54 Å²	54	20%	0.198	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-32.6	177.1	0	0	0	0	0	113.1	L96 T141 T142	L96-A145 HydrophobicContact CB-CB 3.85Å; L96-A145 HydrophobicContact CD1-CB 3.73Å; L96-A145 HydrophobicContact CD2-CB 4.23Å; L96-A145 HydrophobicContact CG-CB 4.14Å; T141-A145 PolarHBondContact O-N 3.2Å; T141-A145 VanDerWaalsContact O-N 3.08Å; T142-A145 PolarHBondContact O-N 2.93Å
146	L	74.7	Confident	77.3	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-77.4	-26	-179.3	-72.4	175.4	0	0	0	114.1	T142 L143 E144 D148 A149 L154	T142-L146 HydrophobicContact CG2-CD1 3.68Å; T142-L146 HydrophobicContact CG2-CG 4.17Å; T142-L146 WeakPolarHBondContact O-CB 3.45Å; T142-L146 WeakPolarHBondContact O-CG 3.39Å; T142-L146 PolarHBondContact O-N 3.34Å; L143-L146 PolarHBondContact O-N 3.42Å; E144-L146 VanDerWaalsContact C-N 3.33Å; E144-L146 PolarHBondContact O-N 2.92Å; L146-D148 PolarHBondContact O-N 2.75Å; L146-A149 PolarHBondContact O-N 2.82Å; L146-L154 HydrophobicContact CD1-CB 4.5Å; L146-L154 HydrophobicContact CD1-CD2 3.8Å; L146-L154 HydrophobicContact CD1-CG 3.64Å; L146-L154 HydrophobicContact CD2-CD2 3.57Å; L146-L154 HydrophobicContact CD2-CG 4.24Å; L146-L154 HydrophobicContact CG-CD2 4.33Å
147	K	72	Confident	77.4	Confident	123 Å²	123	56.6 Å²	56.6	54%	0.535	27%	0.268	S	S	.	.	H	α-helix	trans	-54.3	-36.8	174.4	-82.8	172.7	-176.2	173.2	0	112	L143	L143-K147 WeakPolarHBondContact O-CG 3.43Å; L143-K147 PolarHBondContact O-N 3.01Å
148	D	66	Low	77.5	Confident	105 Å²	105	52.1 Å²	52.1	56%	0.561	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-18.9	-179.4	-69	-10.2	0	0	0	113.5	R100 L146	R100-D148 IonicContact CZ-OD2 3.23Å; R100-D148 IonicContact NH1-OD2 2.83Å; R100-D148 VanDerWaalsContact NH2-CG 3.26Å; R100-D148 IonicContact NH2-OD2 2.87Å; R100-D148 PolarHBondContact NH2-OD2 2.88Å; L146-D148 PolarHBondContact O-N 2.75Å
149	A	63.3	Low	77.8	Confident	19 Å²	19	52.2 Å²	52.2	16%	0.157	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.5	-174.7	0	0	0	0	0	114.1	I99 L146 N151	I99-A149 HydrophobicContact CG2-CB 4.24Å; L146-A149 PolarHBondContact O-N 2.82Å; A149-N151 VanDerWaalsContact C-N 3.29Å; A149-N151 PolarHBondContact O-N 2.9Å
150	K	66.4	Low	77.9	Confident	174 Å²	174	52 Å²	52	76%	0.757	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	44	-178.2	-63.8	-171.9	176.5	-174.3	0	113.6
151	N	68.7	Low	77.9	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.134	24%	0.244	C	C	.	.			trans	-103.9	85	175	-167.8	-7.5	0	0	0	110.5	A149 R153 L154 W155	A149-N151 VanDerWaalsContact C-N 3.29Å; A149-N151 PolarHBondContact O-N 2.9Å; N151-R153 VanDerWaalsContact C-N 3.29Å; N151-R153 PolarHBondContact O-N 2.88Å; N151-L154 HydrophobicContact CB-CB 4.45Å; N151-L154 PolarHBondContact O-N 2.65Å; N151-W155 VanDerWaalsContact O-CB 3.24Å; N151-W155 WeakPolarHBondContact O-CB 3.5Å; N151-W155 PolarHBondContact O-N 3.23Å
152	D	72.1	Confident	78	Confident	118 Å²	118	50.9 Å²	50.9	63%	0.631	24%	0.239	S	C	*	.	H	α-helix	trans	-60.1	-36.4	-172.3	-59.6	-24.7	0	0	0	113	F156	D152-F156 VanDerWaalsContact O-CB 3.31Å; D152-F156 WeakPolarHBondContact O-CB 3.46Å; D152-F156 PolarHBondContact O-N 3.25Å
153	R	75.9	Confident	78.2	Confident	152 Å²	152	51 Å²	51	57%	0.574	24%	0.24	S	C	*	.	H	α-helix	trans	-69.2	-49.1	-177.6	-172.5	-173.3	-170.3	-169	2.3	112.1	N151 F156 K157	N151-R153 VanDerWaalsContact C-N 3.29Å; N151-R153 PolarHBondContact O-N 2.88Å; R153-F156 PolarHBondContact O-N 3.35Å; R153-K157 PolarHBondContact O-N 3.26Å; R153-K157 VanDerWaalsContact O-N 3.09Å
154	L	76.3	Confident	78.5	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-43.7	178.3	177.6	58.1	0	0	0	109.8	E109 I112 L146 N151 F156 K157 T158	E109-L154 HydrophobicContact CB-CD2 4.37Å; E109-L154 HydrophobicContact CG-CB 4.46Å; E109-L154 HydrophobicContact CG-CD1 4.2Å; E109-L154 HydrophobicContact CG-CD2 4.49Å; I112-L154 HydrophobicContact CD1-CD2 3.97Å; I112-L154 HydrophobicContact CG2-CD1 4.42Å; L146-L154 HydrophobicContact CD1-CB 4.5Å; L146-L154 HydrophobicContact CD1-CD2 3.8Å; L146-L154 HydrophobicContact CD1-CG 3.64Å; L146-L154 HydrophobicContact CD2-CD2 3.57Å; L146-L154 HydrophobicContact CD2-CG 4.24Å; L146-L154 HydrophobicContact CG-CD2 4.33Å; N151-L154 HydrophobicContact CB-CB 4.45Å; N151-L154 PolarHBondContact O-N 2.65Å; L154-F156 VanDerWaalsContact C-N 3.3Å; L154-F156 PolarHBondContact O-N 3.39Å; L154-K157 PolarHBondContact O-N 2.89Å; L154-T158 VanDerWaalsContact O-CB 3.3Å; L154-T158 WeakPolarHBondContact O-CB 3.44Å; L154-T158 PolarHBondContact O-N 3.45Å; L154-T158 PolarHBondContact O-OG1 3.18Å
155	W	83.6	Confident	78.6	Confident	37 Å²	37	49.2 Å²	49.2	14%	0.14	23%	0.23	C	C	.	.	H	α-helix	trans	-55.4	-44.3	175.3	-179.1	88.9	0	0	0	112.3	L143 N151 N159 Q181 L182	L143-W155 HydrophobicContact CD2-CG 4.43Å; N151-W155 VanDerWaalsContact O-CB 3.24Å; N151-W155 WeakPolarHBondContact O-CB 3.5Å; N151-W155 PolarHBondContact O-N 3.23Å; W155-N159 WeakPolarHBondContact CZ2-ND2 3.34Å; W155-N159 PolarHBondContact NE1-ND2 3.41Å; W155-N159 WeakPolarHBondContact O-CB 3.25Å; W155-N159 PolarHBondContact O-N 2.97Å; W155-N159 PolarHBondContact O-ND2 2.88Å; W155-Q181 HydrophobicContact CH2-CB 4.2Å; W155-Q181 HydrophobicContact CZ2-CB 4.35Å; W155-L182 HydrophobicContact CH2-CD2 4.17Å; W155-L182 HydrophobicContact CZ3-CD2 3.81Å
156	F	83.7	Confident	79	Confident	7 Å²	7	48.4 Å²	48.4	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-53.9	176	-175.8	-88.3	0	0	0	111.5	D152 R153 L154 T158 N159 T160 L182 Q200 I204	D152-F156 VanDerWaalsContact O-CB 3.31Å; D152-F156 WeakPolarHBondContact O-CB 3.46Å; D152-F156 PolarHBondContact O-N 3.25Å; R153-F156 PolarHBondContact O-N 3.35Å; L154-F156 VanDerWaalsContact C-N 3.3Å; L154-F156 PolarHBondContact O-N 3.39Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 3Å; F156-N159 PolarHBondContact O-N 3.29Å; F156-T160 WeakPolarHBondContact CE1-OG1 3.48Å; F156-T160 WeakPolarHBondContact O-CB 3.4Å; F156-T160 PolarHBondContact O-N 3.29Å; F156-T160 PolarHBondContact O-OG1 3.45Å; F156-L182 HydrophobicContact CD2-CD2 3.66Å; F156-L182 HydrophobicContact CE2-CD2 3.9Å; F156-L182 HydrophobicContact CG-CD2 4.38Å; F156-Q200 HydrophobicContact CD1-CG 4.07Å; F156-Q200 HydrophobicContact CD2-CB 4.36Å; F156-Q200 HydrophobicContact CD2-CG 4.43Å; F156-Q200 HydrophobicContact CE1-CB 3.93Å; F156-Q200 HydrophobicContact CE1-CG 3.78Å; F156-Q200 HydrophobicContact CE2-CB 3.69Å; F156-Q200 HydrophobicContact CE2-CG 4.16Å; F156-Q200 HydrophobicContact CG-CG 4.41Å; F156-Q200 HydrophobicContact CZ-CB 3.46Å; F156-Q200 VanDerWaalsContact CZ-CB 3.46Å; F156-Q200 HydrophobicContact CZ-CG 3.85Å; F156-Q200 WeakPolarHBondContact CZ-O 3.43Å; F156-I204 HydrophobicContact CE2-CD1 3.89Å; F156-I204 HydrophobicContact CE2-CG1 3.97Å; F156-I204 HydrophobicContact CZ-CD1 4.42Å; F156-I204 HydrophobicContact CZ-CG1 4.07Å
157	K	82.6	Confident	79.6	Confident	75 Å²	75	49.5 Å²	49.5	33%	0.326	23%	0.228	S	C	.	.	H	α-helix	trans	-57.5	-44.6	-179.7	-76.1	179.2	176.9	176	0	112.5	E109 R153 L154 T160 K161	E109-K157 IonicContact OE1-NZ 2.75Å; E109-K157 PolarHBondContact OE1-NZ 2.97Å; R153-K157 PolarHBondContact O-N 3.26Å; R153-K157 VanDerWaalsContact O-N 3.09Å; L154-K157 PolarHBondContact O-N 2.89Å; K157-T160 PolarHBondContact O-N 3.07Å; K157-K161 WeakPolarHBondContact O-CG 3.38Å; K157-K161 PolarHBondContact O-N 3.37Å
158	T	83.9	Confident	80.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-43.9	-179.8	-57.5	0	0	0	0	111	Y139 T142 L143 L154 F156 K161 L162	Y139-T158 HydrophobicContact CD1-CG2 3.61Å; Y139-T158 HydrophobicContact CE1-CG2 4.2Å; T142-T158 HydrophobicContact CG2-CG2 4.21Å; L143-T158 HydrophobicContact CD1-CG2 4.46Å; L143-T158 HydrophobicContact CD2-CG2 3.71Å; L143-T158 HydrophobicContact CG-CG2 3.76Å; L154-T158 VanDerWaalsContact O-CB 3.3Å; L154-T158 WeakPolarHBondContact O-CB 3.44Å; L154-T158 PolarHBondContact O-N 3.45Å; L154-T158 PolarHBondContact O-OG1 3.18Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 3Å; T158-K161 PolarHBondContact O-N 2.73Å; T158-L162 WeakPolarHBondContact O-CB 3.5Å; T158-L162 PolarHBondContact O-N 2.97Å
159	N	86.8	Confident	81	Confident	3 Å²	3	50 Å²	50	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-40.8	174.1	-87.3	-61.5	0	0	0	112.8	L143 W155 F156 L162 G163 I178 L182	L143-N159 VanDerWaalsContact CD1-OD1 3.28Å; L143-N159 WeakPolarHBondContact CD1-OD1 3.36Å; L143-N159 HydrophobicContact CD2-CB 4.47Å; L143-N159 VanDerWaalsContact CD2-ND2 3.28Å; L143-N159 WeakPolarHBondContact CD2-ND2 3.38Å; W155-N159 WeakPolarHBondContact CZ2-ND2 3.34Å; W155-N159 PolarHBondContact NE1-ND2 3.41Å; W155-N159 WeakPolarHBondContact O-CB 3.25Å; W155-N159 PolarHBondContact O-N 2.97Å; W155-N159 PolarHBondContact O-ND2 2.88Å; F156-N159 PolarHBondContact O-N 3.29Å; N159-L162 PolarHBondContact O-N 3.11Å; N159-G163 PolarHBondContact O-N 3.28Å; N159-I178 HydrophobicContact CB-CG2 4.09Å; N159-L182 HydrophobicContact CB-CD1 4.23Å; N159-L182 HydrophobicContact CB-CD2 3.63Å; N159-L182 HydrophobicContact CB-CG 4.11Å
160	T	87.1	Confident	82	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-42.9	177.9	-62.7	0	0	0	0	111.2	F156 K157 G163 K164 E203 L207	F156-T160 WeakPolarHBondContact CE1-OG1 3.48Å; F156-T160 WeakPolarHBondContact O-CB 3.4Å; F156-T160 PolarHBondContact O-N 3.29Å; F156-T160 PolarHBondContact O-OG1 3.45Å; K157-T160 PolarHBondContact O-N 3.07Å; T160-G163 PolarHBondContact O-N 2.95Å; T160-K164 WeakPolarHBondContact O-CG 3.39Å; T160-K164 PolarHBondContact O-N 2.87Å; T160-E203 VanDerWaalsContact CG2-CD 3.48Å; T160-E203 HydrophobicContact CG2-CG 3.91Å; T160-E203 VanDerWaalsContact CG2-OE1 3.28Å; T160-E203 WeakPolarHBondContact CG2-OE1 3.32Å; T160-L207 HydrophobicContact CG2-CD1 3.88Å
161	K	84.8	Confident	83.1	Confident	59 Å²	59	51.4 Å²	51.4	26%	0.257	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-43.6	173.1	-74.2	-171.5	-179.7	-176.7	0	111.6	D117 Y139 K157 T158 G163 K164 L165	D117-K161 IonicContact OD1-NZ 3.69Å; D117-K161 PolarHBondContact OD1-NZ 2.85Å; D117-K161 IonicContact OD2-NZ 3.03Å; Y139-K161 HydrophobicContact CE1-CB 3.8Å; Y139-K161 HydrophobicContact CE1-CD 4.25Å; Y139-K161 WeakPolarHBondContact OH-CD 3.38Å; K157-K161 WeakPolarHBondContact O-CG 3.38Å; K157-K161 PolarHBondContact O-N 3.37Å; T158-K161 PolarHBondContact O-N 2.73Å; K161-G163 VanDerWaalsContact C-N 3.29Å; K161-G163 PolarHBondContact O-N 3.45Å; K161-K164 WeakPolarHBondContact O-CB 3.5Å; K161-K164 PolarHBondContact O-N 3.45Å; K161-L165 PolarHBondContact O-N 3.23Å
162	L	85.4	Confident	84.1	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-37.1	174.4	-179.5	59.3	0	0	0	112.1	Q136 Y139 E140 L143 T158 N159 L165 Y166 I178	Q136-L162 HydrophobicContact CG-CD1 4.05Å; Y139-L162 HydrophobicContact CD2-CD1 4.46Å; Y139-L162 HydrophobicContact CG-CB 4.28Å; Y139-L162 HydrophobicContact CG-CD1 4.38Å; E140-L162 HydrophobicContact CG-CD2 4.37Å; L143-L162 HydrophobicContact CD1-CD2 3.55Å; T158-L162 WeakPolarHBondContact O-CB 3.5Å; T158-L162 PolarHBondContact O-N 2.97Å; N159-L162 PolarHBondContact O-N 3.11Å; L162-L165 HydrophobicContact CD1-CD2 4.19Å; L162-L165 WeakPolarHBondContact O-CB 3.22Å; L162-L165 PolarHBondContact O-N 3.42Å; L162-Y166 HydrophobicContact CD1-CD2 4.04Å; L162-Y166 HydrophobicContact CD1-CE2 3.6Å; L162-Y166 HydrophobicContact CD2-CE2 3.99Å; L162-Y166 HydrophobicContact CG-CD2 3.9Å; L162-Y166 HydrophobicContact CG-CE2 3.59Å; L162-Y166 WeakPolarHBondContact O-CD2 3.43Å; L162-Y166 PolarHBondContact O-N 3.44Å; L162-I178 HydrophobicContact CD2-CD1 3.68Å; L162-I178 HydrophobicContact CG-CD1 3.82Å
163	G	87.9	Confident	84.9	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-42.1	173.7	0	0	0	0	0	112.7	N159 T160 K161 Y166 L167 L175	N159-G163 PolarHBondContact O-N 3.28Å; T160-G163 PolarHBondContact O-N 2.95Å; K161-G163 VanDerWaalsContact C-N 3.29Å; K161-G163 PolarHBondContact O-N 3.45Å; G163-Y166 PolarHBondContact O-N 3.45Å; G163-L167 PolarHBondContact O-N 3.28Å; G163-L175 WeakPolarHBondContact O-CD1 3.5Å
164	K	86.6	Confident	85.5	Confident	88 Å²	88	46.4 Å²	46.4	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-41.6	173.6	-68.5	171.3	-173.2	168.9	0	111.4	T160 K161 Y166 L167 E168 E203 L207	T160-K164 WeakPolarHBondContact O-CG 3.39Å; T160-K164 PolarHBondContact O-N 2.87Å; K161-K164 WeakPolarHBondContact O-CB 3.5Å; K161-K164 PolarHBondContact O-N 3.45Å; K164-Y166 PolarHBondContact O-N 3.16Å; K164-L167 WeakPolarHBondContact O-CB 3.47Å; K164-L167 PolarHBondContact O-N 3.01Å; K164-E168 PolarHBondContact O-N 3.28Å; K164-E168 VanDerWaalsContact O-N 3.09Å; K164-E203 IonicContact NZ-OE1 2.83Å; K164-E203 PolarHBondContact NZ-OE1 3.2Å; K164-L207 HydrophobicContact CD-CD2 4.49Å; K164-L207 HydrophobicContact CG-CD2 3.57Å
165	L	84.9	Confident	86.1	Confident	13 Å²	13	46.3 Å²	46.3	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-44	174.2	-167.5	96.4	0	0	0	112.1	M132 L135 Q136 K161 L162 L167 E168 R169	M132-L165 HydrophobicContact CE-CD1 3.58Å; M132-L165 HydrophobicContact CE-CG 4.07Å; L135-L165 HydrophobicContact CD2-CD1 3.83Å; L135-L165 HydrophobicContact CG-CD1 4.34Å; Q136-L165 HydrophobicContact CB-CD2 3.8Å; Q136-L165 HydrophobicContact CG-CD2 4.18Å; K161-L165 PolarHBondContact O-N 3.23Å; L162-L165 HydrophobicContact CD1-CD2 4.19Å; L162-L165 WeakPolarHBondContact O-CB 3.22Å; L162-L165 PolarHBondContact O-N 3.42Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L165-L167 PolarHBondContact O-N 3.2Å; L165-E168 PolarHBondContact O-N 2.93Å; L165-R169 PolarHBondContact O-N 2.99Å
166	Y	86.8	Confident	86.4	Confident	6 Å²	6	48.1 Å²	48.1	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-30.2	177	-78.2	-49.8	0	0	0	113.5	Q136 E140 L162 G163 K164 R169 E170 E171 K174 I178	Q136-Y166 HydrophobicContact CG-CE1 4.21Å; Q136-Y166 PolarHBondContact NE2-OH 3.02Å; Q136-Y166 VanDerWaalsContact NE2-OH 3.11Å; E140-Y166 PolarHBondContact OE1-OH 3.32Å; L162-Y166 HydrophobicContact CD1-CD2 4.04Å; L162-Y166 HydrophobicContact CD1-CE2 3.6Å; L162-Y166 HydrophobicContact CD2-CE2 3.99Å; L162-Y166 HydrophobicContact CG-CD2 3.9Å; L162-Y166 HydrophobicContact CG-CE2 3.59Å; L162-Y166 WeakPolarHBondContact O-CD2 3.43Å; L162-Y166 PolarHBondContact O-N 3.44Å; G163-Y166 PolarHBondContact O-N 3.45Å; K164-Y166 PolarHBondContact O-N 3.16Å; Y166-R169 PolarHBondContact O-N 3.48Å; Y166-E170 PolarHBondContact O-N 3.3Å; Y166-E170 VanDerWaalsContact O-N 3.16Å; Y166-E171 HydrophobicContact CD1-CB 3.79Å; Y166-E171 HydrophobicContact CE1-CB 4.49Å; Y166-E171 PolarHBondContact O-N 3.46Å; Y166-K174 HydrophobicContact CD1-CB 4.37Å; Y166-K174 HydrophobicContact CD1-CD 4.46Å; Y166-K174 HydrophobicContact CD2-CB 4.37Å; Y166-K174 HydrophobicContact CE1-CB 4.11Å; Y166-K174 HydrophobicContact CE1-CD 3.57Å; Y166-K174 HydrophobicContact CE1-CG 4.5Å; Y166-K174 HydrophobicContact CE2-CB 4.1Å; Y166-K174 HydrophobicContact CE2-CD 4.46Å; Y166-K174 HydrophobicContact CG-CB 4.5Å; Y166-K174 VanDerWaalsContact OH-CD 3.27Å; Y166-K174 WeakPolarHBondContact OH-CD 3.17Å; Y166-I178 HydrophobicContact CD2-CD1 3.57Å; Y166-I178 HydrophobicContact CE2-CD1 3.46Å; Y166-I178 VanDerWaalsContact CE2-CD1 3.46Å
167	L	86.1	Confident	86.7	Confident	26 Å²	26	54 Å²	54	14%	0.136	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-45	170.7	-78.6	170.9	0	0	0	111.4	G163 K164 L165 R169 E170 L175 L207 Q210 M211	G163-L167 PolarHBondContact O-N 3.28Å; K164-L167 WeakPolarHBondContact O-CB 3.47Å; K164-L167 PolarHBondContact O-N 3.01Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L165-L167 PolarHBondContact O-N 3.2Å; L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.17Å; L167-E170 PolarHBondContact O-N 3.36Å; L167-E170 VanDerWaalsContact O-N 3.16Å; L167-L175 HydrophobicContact CD1-CD2 4.49Å; L167-L175 HydrophobicContact CD2-CD2 3.29Å; L167-L175 HydrophobicContact CG-CD2 3.51Å; L167-L207 HydrophobicContact CD1-CD2 3.57Å; L167-Q210 HydrophobicContact CD1-CB 4.02Å; L167-Q210 HydrophobicContact CD2-CB 4.37Å; L167-M211 HydrophobicContact CD2-CB 3.86Å
168	E	84.6	Confident	87	Confident	140 Å²	140	51.1 Å²	51.1	65%	0.654	24%	0.242	S	C	*	.	H	α-helix	trans	-64.2	-31.5	177.3	-70.4	178.6	179.5	0	0	112.5	M132 K164 L165 E170	M132-E168 HydrophobicContact CE-CB 4.32Å; K164-E168 PolarHBondContact O-N 3.28Å; K164-E168 VanDerWaalsContact O-N 3.09Å; L165-E168 PolarHBondContact O-N 2.93Å; E168-E170 VanDerWaalsContact C-N 3.33Å
169	R	83.1	Confident	87.3	Confident	98 Å²	98	51.1 Å²	51.1	37%	0.37	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.7	176.4	-159.4	178	179.2	152.3	16.2	114	D133 L165 Y166 L167 E171	D133-R169 IonicContact OD1-CZ 2.71Å; D133-R169 IonicContact OD1-NH1 3.05Å; D133-R169 PolarHBondContact OD1-NH1 3.04Å; D133-R169 IonicContact OD1-NH2 2.8Å; D133-R169 PolarHBondContact OD1-NH2 2.93Å; D133-R169 IonicContact OD2-NH2 2.66Å; L165-R169 PolarHBondContact O-N 2.99Å; Y166-R169 PolarHBondContact O-N 3.48Å; L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.17Å; R169-E171 HydrophobicContact CB-CB 4.48Å; R169-E171 HydrophobicContact CB-CG 4.32Å; R169-E171 HydrophobicContact CG-CG 3.99Å; R169-E171 PolarHBondContact O-N 3.39Å
170	E	85.4	Confident	87.3	Confident	139 Å²	139	57.5 Å²	57.5	65%	0.65	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	23.7	-173.8	-54	-173.4	159.2	0	0	114.3	Y166 L167 E168 Y172	Y166-E170 PolarHBondContact O-N 3.3Å; Y166-E170 VanDerWaalsContact O-N 3.16Å; L167-E170 PolarHBondContact O-N 3.36Å; L167-E170 VanDerWaalsContact O-N 3.16Å; E168-E170 VanDerWaalsContact C-N 3.33Å; E170-Y172 HydrophobicContact CB-CE2 4.26Å; E170-Y172 WeakPolarHBondContact O-CD2 3.4Å; E170-Y172 WeakPolarHBondContact O-CE2 3.36Å; E170-Y172 PolarHBondContact O-N 3.06Å; E170-Y172 VanDerWaalsContact O-N 3.11Å
171	E	88.5	Confident	87.3	Confident	84 Å²	84	61.1 Å²	61.1	39%	0.393	28%	0.282	S	S	.	.			trans	-89.3	71.3	-177.8	-83.6	-69.6	178.8	0	0	111.9	Y166 R169 G173 L175	Y166-E171 HydrophobicContact CD1-CB 3.79Å; Y166-E171 HydrophobicContact CE1-CB 4.49Å; Y166-E171 PolarHBondContact O-N 3.46Å; R169-E171 HydrophobicContact CB-CB 4.48Å; R169-E171 HydrophobicContact CB-CG 4.32Å; R169-E171 HydrophobicContact CG-CG 3.99Å; R169-E171 PolarHBondContact O-N 3.39Å; E171-G173 VanDerWaalsContact C-N 3.31Å; E171-G173 PolarHBondContact O-N 3.22Å; E171-L175 PolarHBondContact O-N 2.92Å
172	Y	89.6	Confident	87.4	Confident	56 Å²	56	58.3 Å²	58.3	22%	0.22	27%	0.27	C	S	.	.	H	α-helix	trans	-68.2	-26.2	-171.3	-50.5	-56.9	0	0	0	114.7	E170 Q176 M211 A214 Q215	E170-Y172 HydrophobicContact CB-CE2 4.26Å; E170-Y172 WeakPolarHBondContact O-CD2 3.4Å; E170-Y172 WeakPolarHBondContact O-CE2 3.36Å; E170-Y172 PolarHBondContact O-N 3.06Å; E170-Y172 VanDerWaalsContact O-N 3.11Å; Y172-Q176 WeakPolarHBondContact O-CB 3.49Å; Y172-Q176 PolarHBondContact O-N 2.68Å; Y172-M211 HydrophobicContact CD1-CG 3.77Å; Y172-M211 HydrophobicContact CG-CG 4.41Å; Y172-A214 HydrophobicContact CE1-CB 4.07Å; Y172-A214 WeakPolarHBondContact OH-CB 3.43Å; Y172-Q215 HydrophobicContact CD2-CG 4.16Å; Y172-Q215 HydrophobicContact CE2-CG 4.36Å; Y172-Q215 HydrophobicContact CG-CG 4.32Å
173	G	90	Very high	87.4	Confident	47 Å²	47	60 Å²	60	49%	0.485	28%	0.277	S	S	.	.	H	α-helix	trans	-67.5	-43.8	-178.1	0	0	0	0	0	112.8	E171	E171-G173 VanDerWaalsContact C-N 3.31Å; E171-G173 PolarHBondContact O-N 3.22Å
174	K	87.8	Confident	87.2	Confident	86 Å²	86	66.2 Å²	66.2	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-71.8	-41.2	175.4	-66.4	-172.7	-177.9	180	0	111.1	Y166 Q176 K177 I178	Y166-K174 HydrophobicContact CD1-CB 4.37Å; Y166-K174 HydrophobicContact CD1-CD 4.46Å; Y166-K174 HydrophobicContact CD2-CB 4.37Å; Y166-K174 HydrophobicContact CE1-CB 4.11Å; Y166-K174 HydrophobicContact CE1-CD 3.57Å; Y166-K174 HydrophobicContact CE1-CG 4.5Å; Y166-K174 HydrophobicContact CE2-CB 4.1Å; Y166-K174 HydrophobicContact CE2-CD 4.46Å; Y166-K174 HydrophobicContact CG-CB 4.5Å; Y166-K174 VanDerWaalsContact OH-CD 3.27Å; Y166-K174 WeakPolarHBondContact OH-CD 3.17Å; K174-Q176 VanDerWaalsContact C-N 3.31Å; K174-Q176 PolarHBondContact O-N 2.71Å; K174-K177 WeakPolarHBondContact O-CB 3.42Å; K174-K177 PolarHBondContact O-N 2.9Å; K174-I178 PolarHBondContact O-N 3Å
175	L	89.9	Confident	86.9	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-55.4	-44.5	175.8	-179.5	59.9	0	0	0	112.3	G163 L167 E171 K177 I178 L179 M211	G163-L175 WeakPolarHBondContact O-CD1 3.5Å; L167-L175 HydrophobicContact CD1-CD2 4.49Å; L167-L175 HydrophobicContact CD2-CD2 3.29Å; L167-L175 HydrophobicContact CG-CD2 3.51Å; E171-L175 PolarHBondContact O-N 2.92Å; L175-K177 PolarHBondContact O-N 3.34Å; L175-I178 PolarHBondContact O-N 3.48Å; L175-I178 VanDerWaalsContact O-N 3.12Å; L175-L179 HydrophobicContact CD1-CD1 4.03Å; L175-L179 HydrophobicContact CD1-CG 4.13Å; L175-L179 HydrophobicContact CD2-CD1 4.41Å; L175-L179 HydrophobicContact CG-CD1 3.73Å; L175-L179 HydrophobicContact CG-CG 4.31Å; L175-L179 WeakPolarHBondContact O-CG 3.33Å; L175-L179 PolarHBondContact O-N 3.16Å; L175-M211 HydrophobicContact CB-SD 4.44Å; L175-M211 HydrophobicContact CD2-CB 3.87Å; L175-M211 HydrophobicContact CD2-CG 3.8Å; L175-M211 HydrophobicContact CD2-SD 3.77Å; L175-M211 HydrophobicContact CG-SD 4.01Å
176	Q	89.6	Confident	86.5	Confident	75 Å²	75	63.2 Å²	63.2	35%	0.35	30%	0.298	S	S	.	.	H	α-helix	trans	-64.8	-25.5	178.1	-163.3	-177.1	19.2	0	0	113.5	Y172 K174 R180	Y172-Q176 WeakPolarHBondContact O-CB 3.49Å; Y172-Q176 PolarHBondContact O-N 2.68Å; K174-Q176 VanDerWaalsContact C-N 3.31Å; K174-Q176 PolarHBondContact O-N 2.71Å; Q176-R180 WeakPolarHBondContact O-CG 3.42Å; Q176-R180 PolarHBondContact O-N 3.01Å; Q176-R180 PolarHBondContact O-NE 3.06Å; Q176-R180 VanDerWaalsContact O-NE 3.08Å
177	K	90.1	Very high	86.1	Confident	130 Å²	130	66.1 Å²	66.1	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-72.4	-42.7	172.7	-67.4	178.8	-178.3	177.4	0	110.8	K174 L175 R180 Q181	K174-K177 WeakPolarHBondContact O-CB 3.42Å; K174-K177 PolarHBondContact O-N 2.9Å; L175-K177 PolarHBondContact O-N 3.34Å; K177-R180 PolarHBondContact O-N 3.33Å; K177-Q181 WeakPolarHBondContact O-CG 3.24Å; K177-Q181 PolarHBondContact O-N 3.4Å
178	I	88.3	Confident	85.3	Confident	15 Å²	15	67.3 Å²	67.3	8%	0.077	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-46.4	178.3	-68.2	170.3	0	0	0	110.7	N159 L162 Y166 K174 L175 R180 Q181 L182	N159-I178 HydrophobicContact CB-CG2 4.09Å; L162-I178 HydrophobicContact CD2-CD1 3.68Å; L162-I178 HydrophobicContact CG-CD1 3.82Å; Y166-I178 HydrophobicContact CD2-CD1 3.57Å; Y166-I178 HydrophobicContact CE2-CD1 3.46Å; Y166-I178 VanDerWaalsContact CE2-CD1 3.46Å; K174-I178 PolarHBondContact O-N 3Å; L175-I178 PolarHBondContact O-N 3.48Å; L175-I178 VanDerWaalsContact O-N 3.12Å; I178-R180 VanDerWaalsContact C-N 3.29Å; I178-R180 PolarHBondContact O-N 3.29Å; I178-Q181 WeakPolarHBondContact O-CB 3.48Å; I178-Q181 PolarHBondContact O-N 3.3Å; I178-L182 HydrophobicContact CG2-CD1 3.85Å; I178-L182 HydrophobicContact CG2-CG 4.17Å; I178-L182 WeakPolarHBondContact O-CG 3.27Å; I178-L182 PolarHBondContact O-N 2.88Å
179	L	89.3	Confident	84.1	Confident	1 Å²	1	69 Å²	69	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-38.8	178.8	-69.5	166.1	0	0	0	112.2	L175 Q181 L182 H183 I204 L207 E208 M211	L175-L179 HydrophobicContact CD1-CD1 4.03Å; L175-L179 HydrophobicContact CD1-CG 4.13Å; L175-L179 HydrophobicContact CD2-CD1 4.41Å; L175-L179 HydrophobicContact CG-CD1 3.73Å; L175-L179 HydrophobicContact CG-CG 4.31Å; L175-L179 WeakPolarHBondContact O-CG 3.33Å; L175-L179 PolarHBondContact O-N 3.16Å; L179-Q181 PolarHBondContact O-N 2.94Å; L179-L182 PolarHBondContact O-N 3.41Å; L179-H183 VanDerWaalsContact O-CB 3.27Å; L179-H183 WeakPolarHBondContact O-CB 3.25Å; L179-H183 PolarHBondContact O-N 3.16Å; L179-I204 HydrophobicContact CD2-CG2 4.02Å; L179-L207 HydrophobicContact CD2-CB 3.91Å; L179-L207 HydrophobicContact CD2-CD1 4.42Å; L179-E208 HydrophobicContact CB-CG 4.34Å; L179-E208 HydrophobicContact CD1-CG 3.64Å; L179-E208 HydrophobicContact CD2-CG 3.99Å; L179-E208 HydrophobicContact CG-CG 4.19Å; L179-M211 HydrophobicContact CD1-CE 4.02Å; L179-M211 HydrophobicContact CD1-SD 4.03Å
180	R	88.3	Confident	82.9	Confident	137 Å²	137	71.5 Å²	71.5	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-42.2	172.8	-81.4	-177.3	-77.5	175.2	-8.3	112.8	Q176 K177 I178 Q184	Q176-R180 WeakPolarHBondContact O-CG 3.42Å; Q176-R180 PolarHBondContact O-N 3.01Å; Q176-R180 PolarHBondContact O-NE 3.06Å; Q176-R180 VanDerWaalsContact O-NE 3.08Å; K177-R180 PolarHBondContact O-N 3.33Å; I178-R180 VanDerWaalsContact C-N 3.29Å; I178-R180 PolarHBondContact O-N 3.29Å; R180-Q184 WeakPolarHBondContact O-CB 3.33Å; R180-Q184 VanDerWaalsContact O-CG 3.27Å; R180-Q184 WeakPolarHBondContact O-CG 3.4Å; R180-Q184 PolarHBondContact O-N 3.02Å
181	Q	86.5	Confident	81.7	Confident	78 Å²	78	66.9 Å²	66.9	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-67.4	-42.7	177.3	-69.4	174.9	-2.4	0	0	111.6	W155 K177 I178 L179 Q184 S185	W155-Q181 HydrophobicContact CH2-CB 4.2Å; W155-Q181 HydrophobicContact CZ2-CB 4.35Å; K177-Q181 WeakPolarHBondContact O-CG 3.24Å; K177-Q181 PolarHBondContact O-N 3.4Å; I178-Q181 WeakPolarHBondContact O-CB 3.48Å; I178-Q181 PolarHBondContact O-N 3.3Å; L179-Q181 PolarHBondContact O-N 2.94Å; Q181-Q184 PolarHBondContact O-N 3.49Å; Q181-S185 PolarHBondContact O-N 3.44Å
182	L	86.6	Confident	80.7	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-45.9	176.5	-74.3	176.1	0	0	0	111.2	W155 F156 N159 I178 L179 S185 C186 I204	W155-L182 HydrophobicContact CH2-CD2 4.17Å; W155-L182 HydrophobicContact CZ3-CD2 3.81Å; F156-L182 HydrophobicContact CD2-CD2 3.66Å; F156-L182 HydrophobicContact CE2-CD2 3.9Å; F156-L182 HydrophobicContact CG-CD2 4.38Å; N159-L182 HydrophobicContact CB-CD1 4.23Å; N159-L182 HydrophobicContact CB-CD2 3.63Å; N159-L182 HydrophobicContact CB-CG 4.11Å; I178-L182 HydrophobicContact CG2-CD1 3.85Å; I178-L182 HydrophobicContact CG2-CG 4.17Å; I178-L182 WeakPolarHBondContact O-CG 3.27Å; I178-L182 PolarHBondContact O-N 2.88Å; L179-L182 PolarHBondContact O-N 3.41Å; L182-S185 WeakPolarHBondContact O-CB 3.44Å; L182-S185 PolarHBondContact O-N 3.39Å; L182-S185 VanDerWaalsContact O-N 3.17Å; L182-S185 PolarHBondContact O-OG 3.22Å; L182-C186 PolarHBondContact O-N 3Å; L182-I204 HydrophobicContact CB-CD1 3.8Å; L182-I204 HydrophobicContact CB-CG1 3.94Å; L182-I204 HydrophobicContact CD1-CG1 4.48Å
183	H	85.6	Confident	79.6	Confident	39 Å²	39	70.1 Å²	70.1	18%	0.181	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-44.3	178.7	-166.1	70.8	0	0	0	111.6	L179 S185 C186 Q187 D193 Y205	L179-H183 VanDerWaalsContact O-CB 3.27Å; L179-H183 WeakPolarHBondContact O-CB 3.25Å; L179-H183 PolarHBondContact O-N 3.16Å; H183-S185 VanDerWaalsContact C-N 3.25Å; H183-S185 PolarHBondContact O-N 2.8Å; H183-C186 CarbonylContact O-C 3.55Å; H183-C186 PolarHBondContact O-N 2.83Å; H183-Q187 PolarHBondContact CD2-NE2 3.42Å; H183-Q187 PolarHBondContact NE2-NE2 2.95Å; H183-Q187 WeakPolarHBondContact O-CG 3.4Å; H183-Q187 PolarHBondContact O-N 3.41Å; H183-Q187 VanDerWaalsContact O-N 3.12Å; H183-D193 IonicContact CE1-OD1 2.66Å; H183-D193 IonicContact NE2-OD1 3.87Å; H183-Y205 AromaticContact CE1-CE1 3.96Å; H183-Y205 PolarHBondContact CE1-OH 3.46Å
184	Q	83.9	Confident	78.5	Confident	133 Å²	133	69.7 Å²	69.7	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-58.3	-35.3	173.1	-76.5	176.3	-8.7	0	0	113.1	R180 Q181 C186 Q187	R180-Q184 WeakPolarHBondContact O-CB 3.33Å; R180-Q184 VanDerWaalsContact O-CG 3.27Å; R180-Q184 WeakPolarHBondContact O-CG 3.4Å; R180-Q184 PolarHBondContact O-N 3.02Å; Q181-Q184 PolarHBondContact O-N 3.49Å; Q184-C186 PolarHBondContact O-N 2.98Å; Q184-Q187 PolarHBondContact O-N 3.43Å
185	S	80.6	Confident	77.4	Confident	38 Å²	38	70.8 Å²	70.8	27%	0.266	36%	0.359	S	S	.	.	H	α-helix	trans	-70.6	-18.7	177.3	79.9	0	0	0	0	113.9	Q181 L182 H183 K197	Q181-S185 PolarHBondContact O-N 3.44Å; L182-S185 WeakPolarHBondContact O-CB 3.44Å; L182-S185 PolarHBondContact O-N 3.39Å; L182-S185 VanDerWaalsContact O-N 3.17Å; L182-S185 PolarHBondContact O-OG 3.22Å; H183-S185 VanDerWaalsContact C-N 3.25Å; H183-S185 PolarHBondContact O-N 2.8Å; S185-K197 PolarHBondContact O-NZ 3.5Å
186	C	75.9	Confident	76.3	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-101.6	-3.2	178.7	-66	0	0	0	0	113	L182 H183 Q184 D194 L201 I204	L182-C186 PolarHBondContact O-N 3Å; H183-C186 CarbonylContact O-C 3.55Å; H183-C186 PolarHBondContact O-N 2.83Å; Q184-C186 PolarHBondContact O-N 2.98Å; C186-D194 VanDerWaalsContact O-CB 3.28Å; C186-D194 WeakPolarHBondContact O-CB 3.48Å; C186-D194 PolarHBondContact O-N 2.9Å; C186-L201 HydrophobicContact CB-CD1 4.14Å; C186-I204 HydrophobicContact CB-CD1 4.29Å
187	Q	77.8	Confident	75.5	Confident	66 Å²	66	79.9 Å²	79.9	31%	0.308	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-86.4	145.4	171.9	-72.6	174.5	-19.4	0	0	110.3	H183 Q184 E192	H183-Q187 PolarHBondContact CD2-NE2 3.42Å; H183-Q187 PolarHBondContact NE2-NE2 2.95Å; H183-Q187 WeakPolarHBondContact O-CG 3.4Å; H183-Q187 PolarHBondContact O-N 3.41Å; H183-Q187 VanDerWaalsContact O-N 3.12Å; Q184-Q187 PolarHBondContact O-N 3.43Å; Q187-E192 CarbonylContact C-O 3.45Å; Q187-E192 WeakPolarHBondContact CA-O 3.09Å
188	T	69.6	Low	74.8	Confident	51 Å²	51	73.8 Å²	73.8	31%	0.313	37%	0.371	S	S	.	.			trans	-72.6	166.3	170.4	55.7	0	0	0	0	110.8	D190 G191 E192 D194	T188-D190 PolarHBondContact O-N 3.16Å; T188-D190 VanDerWaalsContact O-N 3.09Å; T188-G191 PolarHBondContact O-N 3.04Å; T188-E192 WeakPolarHBondContact CB-O 3.31Å; T188-E192 PolarHBondContact N-O 3.29Å; T188-E192 PolarHBondContact OG1-N 3.13Å; T188-E192 PolarHBondContact OG1-O 3.5Å; T188-D194 HydrophobicContact CG2-CB 3.8Å
189	D	59.6	Low	74.5	Confident	175 Å²	175	76.1 Å²	76.1	94%	0.936	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.5	177.6	-70.4	-28	0	0	0	112.9	G191	D189-G191 VanDerWaalsContact C-N 3.34Å
190	D	57.3	Low	74.3	Confident	151 Å²	151	78.8 Å²	78.8	81%	0.807	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.9	175.3	-63.8	-44.3	0	0	0	113.4	T188	T188-D190 PolarHBondContact O-N 3.16Å; T188-D190 VanDerWaalsContact O-N 3.09Å
191	G	62.3	Low	74.2	Confident	43 Å²	43	72.4 Å²	72.4	44%	0.443	38%	0.375	S	S	.	.	S	Bend	trans	83.4	4.6	179.4	0	0	0	0	0	115.1	T188 D189	T188-G191 PolarHBondContact O-N 3.04Å; D189-G191 VanDerWaalsContact C-N 3.34Å
192	E	65.9	Low	74.2	Confident	150 Å²	150	68.7 Å²	68.7	70%	0.701	36%	0.358	S	S	*	.	S	Bend	trans	-89.4	149.7	174.4	-65.2	-167.7	162.8	0	0	111.8	Q187 T188 D194	Q187-E192 CarbonylContact C-O 3.45Å; Q187-E192 WeakPolarHBondContact CA-O 3.09Å; T188-E192 WeakPolarHBondContact CB-O 3.31Å; T188-E192 PolarHBondContact N-O 3.29Å; T188-E192 PolarHBondContact OG1-N 3.13Å; T188-E192 PolarHBondContact OG1-O 3.5Å; E192-D194 PolarHBondContact O-N 3.08Å
193	D	67	Low	74.2	Confident	57 Å²	57	70.8 Å²	70.8	31%	0.305	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-61.3	123.7	179.3	-73.9	-16.1	0	0	0	111.8	H183 L195 L201 Y205	H183-D193 IonicContact CE1-OD1 2.66Å; H183-D193 IonicContact NE2-OD1 3.87Å; D193-L195 PolarHBondContact O-N 2.98Å; D193-L195 VanDerWaalsContact O-N 3.09Å; D193-L201 HydrophobicContact CB-CD2 3.62Å; D193-Y205 PolarHBondContact OD2-OH 3.47Å
194	D	67.5	Low	74.4	Confident	38 Å²	38	69 Å²	69	20%	0.203	36%	0.359	C	S	.	.			trans	-72.8	104.9	178.2	-174.3	-2.2	0	0	0	110.7	C186 T188 E192 K196 K197	C186-D194 VanDerWaalsContact O-CB 3.28Å; C186-D194 WeakPolarHBondContact O-CB 3.48Å; C186-D194 PolarHBondContact O-N 2.9Å; T188-D194 HydrophobicContact CG2-CB 3.8Å; E192-D194 PolarHBondContact O-N 3.08Å; D194-K196 PolarHBondContact O-N 3.39Å; D194-K196 VanDerWaalsContact O-N 3.11Å; D194-K196 VanDerWaalsContact OD1-CB 3.27Å; D194-K196 WeakPolarHBondContact OD1-CB 3.47Å; D194-K196 PolarHBondContact OD1-N 3.43Å; D194-K197 HydrophobicContact CB-CB 4.49Å; D194-K197 CarbonylContact O-C 3.59Å; D194-K197 PolarHBondContact O-N 3.47Å
195	L	64.1	Low	74.7	Confident	110 Å²	110	62.7 Å²	62.7	58%	0.576	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-57.5	-25.1	177.6	-65.8	170.4	0	0	0	113.1	D193 K197 G198	D193-L195 PolarHBondContact O-N 2.98Å; D193-L195 VanDerWaalsContact O-N 3.09Å; L195-K197 VanDerWaalsContact C-N 3.26Å; L195-K197 PolarHBondContact O-N 3.2Å; L195-G198 PolarHBondContact O-N 3.26Å
196	K	67.3	Low	75.2	Confident	197 Å²	197	61.1 Å²	61.1	86%	0.857	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-69.6	-24.9	175.5	-61.7	176.7	-178.6	171.3	0	112.3	D194	D194-K196 PolarHBondContact O-N 3.39Å; D194-K196 VanDerWaalsContact O-N 3.11Å; D194-K196 VanDerWaalsContact OD1-CB 3.27Å; D194-K196 WeakPolarHBondContact OD1-CB 3.47Å; D194-K196 PolarHBondContact OD1-N 3.43Å
197	K	72.6	Confident	75.9	Confident	68 Å²	68	61.2 Å²	61.2	30%	0.296	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-99	19.1	174.6	-62.8	-176.7	-173.3	-179.1	0	112.3	S185 D194 L195 T199 Q200 L201	S185-K197 PolarHBondContact O-NZ 3.5Å; D194-K197 HydrophobicContact CB-CB 4.49Å; D194-K197 CarbonylContact O-C 3.59Å; D194-K197 PolarHBondContact O-N 3.47Å; L195-K197 VanDerWaalsContact C-N 3.26Å; L195-K197 PolarHBondContact O-N 3.2Å; K197-T199 VanDerWaalsContact C-N 3.26Å; K197-T199 PolarHBondContact O-N 3.12Å; K197-T199 VanDerWaalsContact O-N 3.1Å; K197-Q200 HydrophobicContact CB-CB 4.49Å; K197-Q200 WeakPolarHBondContact O-CA 3.46Å; K197-Q200 WeakPolarHBondContact O-CB 3.3Å; K197-Q200 PolarHBondContact O-N 3.45Å; K197-L201 PolarHBondContact O-N 3.01Å
198	G	75.7	Confident	76.5	Confident	2 Å²	2	59.3 Å²	59.3	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-51.9	-37.7	-176.4	0	0	0	0	0	114.8	L195 L201 L202	L195-G198 PolarHBondContact O-N 3.26Å; G198-L201 PolarHBondContact O-N 3.34Å; G198-L202 WeakPolarHBondContact O-CG 3.43Å; G198-L202 PolarHBondContact O-N 3.2Å
199	T	82	Confident	77.5	Confident	64 Å²	64	57 Å²	57	39%	0.393	30%	0.296	S	S	.	.	H	α-helix	trans	-65	-40.8	176.3	-51.4	0	0	0	0	112.6	K197 E203	K197-T199 VanDerWaalsContact C-N 3.26Å; K197-T199 PolarHBondContact O-N 3.12Å; K197-T199 VanDerWaalsContact O-N 3.1Å; T199-E203 PolarHBondContact O-N 3.33Å
200	Q	83.4	Confident	78.9	Confident	58 Å²	58	51.6 Å²	51.6	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-67.8	-41.7	176.3	-72.1	178.6	-14.8	0	0	110.4	F156 K197 L202 E203 I204	F156-Q200 HydrophobicContact CD1-CG 4.07Å; F156-Q200 HydrophobicContact CD2-CB 4.36Å; F156-Q200 HydrophobicContact CD2-CG 4.43Å; F156-Q200 HydrophobicContact CE1-CB 3.93Å; F156-Q200 HydrophobicContact CE1-CG 3.78Å; F156-Q200 HydrophobicContact CE2-CB 3.69Å; F156-Q200 HydrophobicContact CE2-CG 4.16Å; F156-Q200 HydrophobicContact CG-CG 4.41Å; F156-Q200 HydrophobicContact CZ-CB 3.46Å; F156-Q200 VanDerWaalsContact CZ-CB 3.46Å; F156-Q200 HydrophobicContact CZ-CG 3.85Å; F156-Q200 WeakPolarHBondContact CZ-O 3.43Å; K197-Q200 HydrophobicContact CB-CB 4.49Å; K197-Q200 WeakPolarHBondContact O-CA 3.46Å; K197-Q200 WeakPolarHBondContact O-CB 3.3Å; K197-Q200 PolarHBondContact O-N 3.45Å; Q200-L202 PolarHBondContact O-N 3.33Å; Q200-E203 WeakPolarHBondContact O-CB 3.42Å; Q200-E203 PolarHBondContact O-N 2.99Å; Q200-E203 VanDerWaalsContact O-N 3.1Å; Q200-I204 WeakPolarHBondContact O-CG1 3.21Å; Q200-I204 PolarHBondContact O-N 2.7Å
201	L	86.4	Confident	80.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-40.7	178.7	-169.9	59.6	0	0	0	112.5	C186 D193 K197 G198 E203 I204 Y205 I231	C186-L201 HydrophobicContact CB-CD1 4.14Å; D193-L201 HydrophobicContact CB-CD2 3.62Å; K197-L201 PolarHBondContact O-N 3.01Å; G198-L201 PolarHBondContact O-N 3.34Å; L201-E203 VanDerWaalsContact C-N 3.3Å; L201-E203 PolarHBondContact O-N 2.9Å; L201-I204 HydrophobicContact CD1-CD1 4.28Å; L201-I204 WeakPolarHBondContact O-CB 3.47Å; L201-I204 PolarHBondContact O-N 2.87Å; L201-Y205 HydrophobicContact CD1-CE1 4.36Å; L201-Y205 HydrophobicContact CD1-CE2 4.33Å; L201-Y205 HydrophobicContact CD2-CE2 4.27Å; L201-Y205 HydrophobicContact CG-CD2 4.33Å; L201-Y205 HydrophobicContact CG-CE2 3.87Å; L201-Y205 PolarHBondContact O-N 3.29Å; L201-I231 HydrophobicContact CB-CD1 4.1Å; L201-I231 HydrophobicContact CD2-CD1 3.49Å; L201-I231 VanDerWaalsContact CD2-CD1 3.49Å; L201-I231 HydrophobicContact CD2-CG1 4.33Å; L201-I231 HydrophobicContact CG-CD1 3.68Å
202	L	86.9	Confident	81.9	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-34.2	172.7	-73.6	169.6	0	0	0	112.5	G198 Q200 Y205 A206 I231 A234 P236 I240 I244	G198-L202 WeakPolarHBondContact O-CG 3.43Å; G198-L202 PolarHBondContact O-N 3.2Å; Q200-L202 PolarHBondContact O-N 3.33Å; L202-Y205 PolarHBondContact O-N 2.97Å; L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.49Å; L202-I231 HydrophobicContact CD1-CG2 4.09Å; L202-I231 HydrophobicContact CD2-CB 4.25Å; L202-I231 HydrophobicContact CD2-CD1 4.06Å; L202-I231 HydrophobicContact CG-CB 4.32Å; L202-I231 HydrophobicContact CG-CD1 4.15Å; L202-I231 HydrophobicContact CG-CG2 4.08Å; L202-A234 HydrophobicContact CD1-CB 4.32Å; L202-P236 HydrophobicContact CD1-CB 3.78Å; L202-P236 HydrophobicContact CD1-CG 3.82Å; L202-I240 HydrophobicContact CB-CG2 4.14Å; L202-I240 WeakPolarHBondContact O-CG2 3.45Å; L202-I244 HydrophobicContact CB-CD1 4.19Å; L202-I244 HydrophobicContact CD2-CD1 3.6Å; L202-I244 HydrophobicContact CG-CD1 4.49Å
203	E	87.6	Confident	82.9	Confident	44 Å²	44	39 Å²	39	21%	0.206	19%	0.194	C	C	.	.	H	α-helix	trans	-67.3	-37.9	174.3	-162.9	168.8	-168.8	0	0	111.8	T160 K164 T199 Q200 L201 A206 L207 I240	T160-E203 VanDerWaalsContact CG2-CD 3.48Å; T160-E203 HydrophobicContact CG2-CG 3.91Å; T160-E203 VanDerWaalsContact CG2-OE1 3.28Å; T160-E203 WeakPolarHBondContact CG2-OE1 3.32Å; K164-E203 IonicContact NZ-OE1 2.83Å; K164-E203 PolarHBondContact NZ-OE1 3.2Å; T199-E203 PolarHBondContact O-N 3.33Å; Q200-E203 WeakPolarHBondContact O-CB 3.42Å; Q200-E203 PolarHBondContact O-N 2.99Å; Q200-E203 VanDerWaalsContact O-N 3.1Å; L201-E203 VanDerWaalsContact C-N 3.3Å; L201-E203 PolarHBondContact O-N 2.9Å; E203-A206 PolarHBondContact O-N 2.63Å; E203-L207 WeakPolarHBondContact O-CG 3.5Å; E203-L207 PolarHBondContact O-N 3.31Å; E203-L207 VanDerWaalsContact O-N 3.13Å; E203-I240 HydrophobicContact CB-CD1 3.93Å; E203-I240 HydrophobicContact CG-CD1 3.88Å
204	I	89.8	Confident	83.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-50.4	173	-61.2	165.3	0	0	0	110.1	F156 L179 L182 C186 Q200 L201 A206 L207 E208	F156-I204 HydrophobicContact CE2-CD1 3.89Å; F156-I204 HydrophobicContact CE2-CG1 3.97Å; F156-I204 HydrophobicContact CZ-CD1 4.42Å; F156-I204 HydrophobicContact CZ-CG1 4.07Å; L179-I204 HydrophobicContact CD2-CG2 4.02Å; L182-I204 HydrophobicContact CB-CD1 3.8Å; L182-I204 HydrophobicContact CB-CG1 3.94Å; L182-I204 HydrophobicContact CD1-CG1 4.48Å; C186-I204 HydrophobicContact CB-CD1 4.29Å; Q200-I204 WeakPolarHBondContact O-CG1 3.21Å; Q200-I204 PolarHBondContact O-N 2.7Å; L201-I204 HydrophobicContact CD1-CD1 4.28Å; L201-I204 WeakPolarHBondContact O-CB 3.47Å; L201-I204 PolarHBondContact O-N 2.87Å; I204-A206 VanDerWaalsContact C-N 3.3Å; I204-A206 PolarHBondContact O-N 3.05Å; I204-L207 WeakPolarHBondContact O-CB 3.5Å; I204-L207 PolarHBondContact O-N 2.75Å; I204-L207 VanDerWaalsContact O-N 3.1Å; I204-E208 PolarHBondContact O-N 3.11Å
205	Y	89.9	Confident	84.8	Confident	1 Å²	1	41 Å²	41	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-37.8	179	-70.6	-27.9	0	0	0	112.3	H183 D193 L201 L202 L207 E208 I209 L224 Q227 I231	H183-Y205 AromaticContact CE1-CE1 3.96Å; H183-Y205 PolarHBondContact CE1-OH 3.46Å; D193-Y205 PolarHBondContact OD2-OH 3.47Å; L201-Y205 HydrophobicContact CD1-CE1 4.36Å; L201-Y205 HydrophobicContact CD1-CE2 4.33Å; L201-Y205 HydrophobicContact CD2-CE2 4.27Å; L201-Y205 HydrophobicContact CG-CD2 4.33Å; L201-Y205 HydrophobicContact CG-CE2 3.87Å; L201-Y205 PolarHBondContact O-N 3.29Å; L202-Y205 PolarHBondContact O-N 2.97Å; Y205-L207 VanDerWaalsContact C-N 3.35Å; Y205-L207 PolarHBondContact O-N 3.33Å; Y205-E208 WeakPolarHBondContact CD1-OE2 3.35Å; Y205-E208 PolarHBondContact O-N 2.66Å; Y205-I209 WeakPolarHBondContact O-CB 3.43Å; Y205-I209 VanDerWaalsContact O-CG1 3.24Å; Y205-I209 WeakPolarHBondContact O-CG1 3.46Å; Y205-I209 PolarHBondContact O-N 3.24Å; Y205-L224 HydrophobicContact CD1-CD2 3.82Å; Y205-L224 HydrophobicContact CE1-CD2 4.07Å; Y205-Q227 HydrophobicContact CE2-CB 4.17Å; Y205-I231 HydrophobicContact CD2-CD1 3.81Å; Y205-I231 HydrophobicContact CE2-CD1 3.47Å; Y205-I231 VanDerWaalsContact CE2-CD1 3.47Å
206	A	90.4	Very high	85.8	Confident	5 Å²	5	43.9 Å²	43.9	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-39.1	174.5	0	0	0	0	0	112.5	L202 E203 I204 Q210 I240 V243 I244	L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.49Å; E203-A206 PolarHBondContact O-N 2.63Å; I204-A206 VanDerWaalsContact C-N 3.3Å; I204-A206 PolarHBondContact O-N 3.05Å; A206-Q210 VanDerWaalsContact O-CG 3.32Å; A206-Q210 WeakPolarHBondContact O-CG 3.37Å; A206-Q210 PolarHBondContact O-N 2.87Å; A206-I240 HydrophobicContact CB-CG2 3.85Å; A206-V243 HydrophobicContact CB-CG1 4.28Å; A206-I244 HydrophobicContact CB-CG1 4.21Å
207	L	90.3	Very high	86.9	Confident	3 Å²	3	37 Å²	37	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-41.1	174.3	-70	175.7	0	0	0	112.2	T160 K164 L167 L179 E203 I204 Y205 Q210 M211	T160-L207 HydrophobicContact CG2-CD1 3.88Å; K164-L207 HydrophobicContact CD-CD2 4.49Å; K164-L207 HydrophobicContact CG-CD2 3.57Å; L167-L207 HydrophobicContact CD1-CD2 3.57Å; L179-L207 HydrophobicContact CD2-CB 3.91Å; L179-L207 HydrophobicContact CD2-CD1 4.42Å; E203-L207 WeakPolarHBondContact O-CG 3.5Å; E203-L207 PolarHBondContact O-N 3.31Å; E203-L207 VanDerWaalsContact O-N 3.13Å; I204-L207 WeakPolarHBondContact O-CB 3.5Å; I204-L207 PolarHBondContact O-N 2.75Å; I204-L207 VanDerWaalsContact O-N 3.1Å; Y205-L207 VanDerWaalsContact C-N 3.35Å; Y205-L207 PolarHBondContact O-N 3.33Å; L207-Q210 PolarHBondContact O-N 3.05Å; L207-M211 PolarHBondContact O-N 3.43Å
208	E	91.1	Very high	87.5	Confident	25 Å²	25	37.5 Å²	37.5	12%	0.117	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-43.1	174.7	-81.1	178.9	158.7	0	0	112.2	L179 I204 Y205 Q210 M211 Y212 L224	L179-E208 HydrophobicContact CB-CG 4.34Å; L179-E208 HydrophobicContact CD1-CG 3.64Å; L179-E208 HydrophobicContact CD2-CG 3.99Å; L179-E208 HydrophobicContact CG-CG 4.19Å; I204-E208 PolarHBondContact O-N 3.11Å; Y205-E208 WeakPolarHBondContact CD1-OE2 3.35Å; Y205-E208 PolarHBondContact O-N 2.66Å; E208-Q210 VanDerWaalsContact C-N 3.35Å; E208-Q210 PolarHBondContact O-N 2.83Å; E208-M211 WeakPolarHBondContact O-CB 3.46Å; E208-M211 PolarHBondContact O-N 3.12Å; E208-Y212 HydrophobicContact CB-CD2 4.42Å; E208-Y212 HydrophobicContact CB-CE2 4.4Å; E208-Y212 WeakPolarHBondContact O-CD2 3.27Å; E208-Y212 PolarHBondContact O-N 3.45Å; E208-L224 HydrophobicContact CB-CD1 3.76Å; E208-L224 HydrophobicContact CB-CD2 4.42Å; E208-L224 WeakPolarHBondContact OE2-CD2 3.27Å
209	I	91.4	Very high	88.2	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.015	23%	0.233	C	C	.	.	H	α-helix	trans	-60	-45.8	175.3	-77	167	0	0	0	110.3	Y205 M211 Y212 T213 L221 L224 V243 I244 C247	Y205-I209 WeakPolarHBondContact O-CB 3.43Å; Y205-I209 VanDerWaalsContact O-CG1 3.24Å; Y205-I209 WeakPolarHBondContact O-CG1 3.46Å; Y205-I209 PolarHBondContact O-N 3.24Å; I209-M211 PolarHBondContact O-N 3.35Å; I209-Y212 PolarHBondContact O-N 3.37Å; I209-T213 VanDerWaalsContact O-CB 3.25Å; I209-T213 WeakPolarHBondContact O-CB 3.45Å; I209-T213 PolarHBondContact O-N 3.12Å; I209-T213 PolarHBondContact O-OG1 3.02Å; I209-L221 HydrophobicContact CB-CD2 4.3Å; I209-L221 HydrophobicContact CG1-CD2 4.31Å; I209-L221 HydrophobicContact CG2-CD2 4.19Å; I209-L221 WeakPolarHBondContact O-CD2 3.41Å; I209-L224 HydrophobicContact CG1-CB 4.2Å; I209-L224 HydrophobicContact CG1-CD1 4.32Å; I209-V243 HydrophobicContact CG2-CG1 4.43Å; I209-I244 HydrophobicContact CD1-CB 4.35Å; I209-I244 HydrophobicContact CD1-CG1 4.03Å; I209-I244 HydrophobicContact CD1-CG2 4.24Å; I209-C247 HydrophobicContact CD1-CB 4.41Å; I209-C247 HydrophobicContact CG2-CB 3.48Å; I209-C247 VanDerWaalsContact CG2-CB 3.48Å
210	Q	89	Confident	88.5	Confident	61 Å²	61	47.2 Å²	47.2	29%	0.285	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-43.3	177.3	-72.4	177.4	41.8	0	0	111.9	L167 A206 L207 E208 T213 A214 V243	L167-Q210 HydrophobicContact CD1-CB 4.02Å; L167-Q210 HydrophobicContact CD2-CB 4.37Å; A206-Q210 VanDerWaalsContact O-CG 3.32Å; A206-Q210 WeakPolarHBondContact O-CG 3.37Å; A206-Q210 PolarHBondContact O-N 2.87Å; L207-Q210 PolarHBondContact O-N 3.05Å; E208-Q210 VanDerWaalsContact C-N 3.35Å; E208-Q210 PolarHBondContact O-N 2.83Å; Q210-T213 PolarHBondContact O-N 3.35Å; Q210-A214 PolarHBondContact O-N 2.96Å; Q210-V243 HydrophobicContact CG-CG1 4.06Å
211	M	90.8	Very high	88.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-51.8	175.5	-177.8	-176	65.5	0	0	111.9	L167 Y172 L175 L179 L207 E208 I209 T213 A214 Q215	L167-M211 HydrophobicContact CD2-CB 3.86Å; Y172-M211 HydrophobicContact CD1-CG 3.77Å; Y172-M211 HydrophobicContact CG-CG 4.41Å; L175-M211 HydrophobicContact CB-SD 4.44Å; L175-M211 HydrophobicContact CD2-CB 3.87Å; L175-M211 HydrophobicContact CD2-CG 3.8Å; L175-M211 HydrophobicContact CD2-SD 3.77Å; L175-M211 HydrophobicContact CG-SD 4.01Å; L179-M211 HydrophobicContact CD1-CE 4.02Å; L179-M211 HydrophobicContact CD1-SD 4.03Å; L207-M211 PolarHBondContact O-N 3.43Å; E208-M211 WeakPolarHBondContact O-CB 3.46Å; E208-M211 PolarHBondContact O-N 3.12Å; I209-M211 PolarHBondContact O-N 3.35Å; M211-T213 VanDerWaalsContact C-N 3.3Å; M211-T213 PolarHBondContact O-N 2.74Å; M211-A214 PolarHBondContact O-N 2.95Å; M211-Q215 WeakPolarHBondContact O-CG 3.45Å; M211-Q215 PolarHBondContact O-N 3.4Å
212	Y	90.9	Very high	88.9	Confident	17 Å²	17	48.1 Å²	48.1	7%	0.067	24%	0.236	C	C	.	.	H	α-helix	trans	-73.2	-23.2	-177.3	-71.5	-57.4	0	0	0	113.2	E208 I209 Q215 K216 N217 K220 L224	E208-Y212 HydrophobicContact CB-CD2 4.42Å; E208-Y212 HydrophobicContact CB-CE2 4.4Å; E208-Y212 WeakPolarHBondContact O-CD2 3.27Å; E208-Y212 PolarHBondContact O-N 3.45Å; I209-Y212 PolarHBondContact O-N 3.37Å; Y212-Q215 CarbonylContact O-C 3.59Å; Y212-Q215 PolarHBondContact O-N 3.14Å; Y212-K216 PolarHBondContact O-N 2.71Å; Y212-N217 HydrophobicContact CD1-CB 3.98Å; Y212-N217 PolarHBondContact O-N 3.45Å; Y212-K220 HydrophobicContact CD1-CB 4.32Å; Y212-K220 HydrophobicContact CD1-CD 3.99Å; Y212-K220 HydrophobicContact CD2-CB 4.18Å; Y212-K220 HydrophobicContact CD2-CD 4.49Å; Y212-K220 HydrophobicContact CE1-CB 4.43Å; Y212-K220 HydrophobicContact CE1-CD 3.34Å; Y212-K220 HydrophobicContact CE2-CB 4.29Å; Y212-K220 HydrophobicContact CE2-CD 3.92Å; Y212-K220 HydrophobicContact CG-CB 4.2Å; Y212-K220 WeakPolarHBondContact OH-CD 3.15Å; Y212-K220 PolarHBondContact OH-NZ 3.4Å; Y212-L224 HydrophobicContact CD2-CD1 3.53Å; Y212-L224 HydrophobicContact CE2-CD1 3.84Å
213	T	87	Confident	89.1	Confident	63 Å²	63	50 Å²	50	39%	0.387	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-46.1	170.3	-61	0	0	0	0	110.1	I209 Q210 M211 Q215 K216	I209-T213 VanDerWaalsContact O-CB 3.25Å; I209-T213 WeakPolarHBondContact O-CB 3.45Å; I209-T213 PolarHBondContact O-N 3.12Å; I209-T213 PolarHBondContact O-OG1 3.02Å; Q210-T213 PolarHBondContact O-N 3.35Å; M211-T213 VanDerWaalsContact C-N 3.3Å; M211-T213 PolarHBondContact O-N 2.74Å; T213-Q215 PolarHBondContact O-N 3.29Å; T213-K216 PolarHBondContact O-N 2.97Å; T213-K216 VanDerWaalsContact O-N 3.14Å
214	A	86.2	Confident	89.2	Confident	54 Å²	54	48.5 Å²	48.5	45%	0.446	25%	0.245	S	C	.	.	H	α-helix	trans	-64.2	-38.8	175.4	0	0	0	0	0	112.3	Y172 Q210 M211 K216	Y172-A214 HydrophobicContact CE1-CB 4.07Å; Y172-A214 WeakPolarHBondContact OH-CB 3.43Å; Q210-A214 PolarHBondContact O-N 2.96Å; M211-A214 PolarHBondContact O-N 2.95Å; A214-K216 PolarHBondContact O-N 3.49Å
215	Q	87.8	Confident	89.2	Confident	82 Å²	82	48.9 Å²	48.9	38%	0.383	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.4	174.7	-66.1	177.9	13.3	0	0	114.6	Y172 M211 Y212 T213 N217	Y172-Q215 HydrophobicContact CD2-CG 4.16Å; Y172-Q215 HydrophobicContact CE2-CG 4.36Å; Y172-Q215 HydrophobicContact CG-CG 4.32Å; M211-Q215 WeakPolarHBondContact O-CG 3.45Å; M211-Q215 PolarHBondContact O-N 3.4Å; Y212-Q215 CarbonylContact O-C 3.59Å; Y212-Q215 PolarHBondContact O-N 3.14Å; T213-Q215 PolarHBondContact O-N 3.29Å; Q215-N217 VanDerWaalsContact C-N 3.26Å; Q215-N217 PolarHBondContact O-N 3.24Å
216	K	86.1	Confident	89.1	Confident	170 Å²	170	53.1 Å²	53.1	74%	0.739	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	34.3	-175.7	-56.5	-178.9	179.1	178.8	0	114.2	Y212 T213 A214 N218	Y212-K216 PolarHBondContact O-N 2.71Å; T213-K216 PolarHBondContact O-N 2.97Å; T213-K216 VanDerWaalsContact O-N 3.14Å; A214-K216 PolarHBondContact O-N 3.49Å; K216-N218 PolarHBondContact O-N 3.16Å
217	N	89.4	Confident	88.8	Confident	54 Å²	54	57 Å²	57	29%	0.289	28%	0.283	S	S	.	.			trans	-91.6	84.3	-179.5	-167.8	-21.2	0	0	0	112.4	Y212 Q215 K219 K220 L221	Y212-N217 HydrophobicContact CD1-CB 3.98Å; Y212-N217 PolarHBondContact O-N 3.45Å; Q215-N217 VanDerWaalsContact C-N 3.26Å; Q215-N217 PolarHBondContact O-N 3.24Å; N217-K219 VanDerWaalsContact C-N 3.34Å; N217-K219 PolarHBondContact O-N 2.92Å; N217-K220 PolarHBondContact O-N 2.95Å; N217-L221 WeakPolarHBondContact O-CG 3.5Å; N217-L221 PolarHBondContact O-N 3.26Å
218	N	86.1	Confident	88.6	Confident	78 Å²	78	57.2 Å²	57.2	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-34.3	-173	-58	-24.8	0	0	0	114.3	K216 K220 L221 K222 R254	K216-N218 PolarHBondContact O-N 3.16Å; N218-K220 VanDerWaalsContact C-N 3.34Å; N218-K220 PolarHBondContact O-N 3.5Å; N218-L221 PolarHBondContact O-N 3.45Å; N218-K222 PolarHBondContact O-N 3.23Å; N218-K222 VanDerWaalsContact O-N 3.11Å; N218-R254 PolarHBondContact ND2-NH1 2.89Å; N218-R254 PolarHBondContact OD1-NH1 3.49Å
219	K	89	Confident	88.1	Confident	185 Å²	185	59.5 Å²	59.5	80%	0.804	30%	0.298	S	S	*	.	H	α-helix	trans	-64.6	-40.8	-178.3	-67.7	-175	178.7	-177.8	0	111.7	N217 A223	N217-K219 VanDerWaalsContact C-N 3.34Å; N217-K219 PolarHBondContact O-N 2.92Å; K219-A223 PolarHBondContact O-N 3.35Å
220	K	88.9	Confident	87.6	Confident	85 Å²	85	66.6 Å²	66.6	37%	0.37	33%	0.331	S	S	.	.	H	α-helix	trans	-73.5	-38.5	177.7	-74	-166.3	173	-174.8	0	112.3	Y212 N217 N218 K222 A223 L224	Y212-K220 HydrophobicContact CD1-CB 4.32Å; Y212-K220 HydrophobicContact CD1-CD 3.99Å; Y212-K220 HydrophobicContact CD2-CB 4.18Å; Y212-K220 HydrophobicContact CD2-CD 4.49Å; Y212-K220 HydrophobicContact CE1-CB 4.43Å; Y212-K220 HydrophobicContact CE1-CD 3.34Å; Y212-K220 HydrophobicContact CE2-CB 4.29Å; Y212-K220 HydrophobicContact CE2-CD 3.92Å; Y212-K220 HydrophobicContact CG-CB 4.2Å; Y212-K220 WeakPolarHBondContact OH-CD 3.15Å; Y212-K220 PolarHBondContact OH-NZ 3.4Å; N217-K220 PolarHBondContact O-N 2.95Å; N218-K220 VanDerWaalsContact C-N 3.34Å; N218-K220 PolarHBondContact O-N 3.5Å; K220-K222 VanDerWaalsContact C-N 3.26Å; K220-K222 PolarHBondContact O-N 2.74Å; K220-A223 PolarHBondContact O-N 2.68Å; K220-L224 WeakPolarHBondContact O-CG 3.44Å; K220-L224 PolarHBondContact O-N 3.06Å
221	L	89.3	Confident	87	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-56.8	-41.6	175	-69.7	174.2	0	0	0	111.8	I209 N217 N218 L224 Y225	I209-L221 HydrophobicContact CB-CD2 4.3Å; I209-L221 HydrophobicContact CG1-CD2 4.31Å; I209-L221 HydrophobicContact CG2-CD2 4.19Å; I209-L221 WeakPolarHBondContact O-CD2 3.41Å; N217-L221 WeakPolarHBondContact O-CG 3.5Å; N217-L221 PolarHBondContact O-N 3.26Å; N218-L221 PolarHBondContact O-N 3.45Å; L221-L224 PolarHBondContact O-N 2.59Å; L221-Y225 WeakPolarHBondContact O-CB 3.4Å; L221-Y225 PolarHBondContact O-N 3.19Å
222	K	89.3	Confident	85.4	Confident	64 Å²	64	73.6 Å²	73.6	28%	0.278	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-51.3	175.4	177.5	161	-172.1	166.8	0	112.7	N218 K220 L224 Y225 E226 M251 E255	N218-K222 PolarHBondContact O-N 3.23Å; N218-K222 VanDerWaalsContact O-N 3.11Å; K220-K222 VanDerWaalsContact C-N 3.26Å; K220-K222 PolarHBondContact O-N 2.74Å; K222-L224 VanDerWaalsContact C-N 3.31Å; K222-L224 PolarHBondContact O-N 3.18Å; K222-Y225 PolarHBondContact O-N 3.45Å; K222-E226 WeakPolarHBondContact CE-OE1 3.32Å; K222-E226 WeakPolarHBondContact O-CG 3.39Å; K222-E226 PolarHBondContact O-N 2.89Å; K222-M251 VanDerWaalsContact CA-SD 3.58Å; K222-M251 HydrophobicContact CB-CG 4.3Å; K222-M251 HydrophobicContact CB-SD 3.65Å; K222-M251 HydrophobicContact CD-SD 4.06Å; K222-M251 HydrophobicContact CG-SD 3.57Å; K222-M251 VanDerWaalsContact CG-SD 3.57Å; K222-E255 VanDerWaalsContact CD-OE1 3.28Å; K222-E255 WeakPolarHBondContact CD-OE1 3.39Å; K222-E255 WeakPolarHBondContact CE-OE1 3.46Å; K222-E255 IonicContact NZ-OE1 2.88Å; K222-E255 PolarHBondContact NZ-OE1 2.99Å; K222-E255 IonicContact NZ-OE2 2.9Å; K222-E255 PolarHBondContact NZ-OE2 3.43Å
223	A	90.4	Very high	83.6	Confident	40 Å²	40	77.5 Å²	77.5	33%	0.331	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-42.4	179.1	0	0	0	0	0	112.2	K219 K220 E226 Q227	K219-A223 PolarHBondContact O-N 3.35Å; K220-A223 PolarHBondContact O-N 2.68Å; A223-E226 PolarHBondContact O-N 3.4Å; A223-Q227 WeakPolarHBondContact O-CB 3.36Å; A223-Q227 WeakPolarHBondContact O-CG 3.18Å; A223-Q227 PolarHBondContact O-N 3.23Å
224	L	89.9	Confident	82.3	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-40.4	178.3	-70.8	170.4	0	0	0	112.5	Y205 E208 I209 Y212 K220 L221 K222 Q227 S228	Y205-L224 HydrophobicContact CD1-CD2 3.82Å; Y205-L224 HydrophobicContact CE1-CD2 4.07Å; E208-L224 HydrophobicContact CB-CD1 3.76Å; E208-L224 HydrophobicContact CB-CD2 4.42Å; E208-L224 WeakPolarHBondContact OE2-CD2 3.27Å; I209-L224 HydrophobicContact CG1-CB 4.2Å; I209-L224 HydrophobicContact CG1-CD1 4.32Å; Y212-L224 HydrophobicContact CD2-CD1 3.53Å; Y212-L224 HydrophobicContact CE2-CD1 3.84Å; K220-L224 WeakPolarHBondContact O-CG 3.44Å; K220-L224 PolarHBondContact O-N 3.06Å; L221-L224 PolarHBondContact O-N 2.59Å; K222-L224 VanDerWaalsContact C-N 3.31Å; K222-L224 PolarHBondContact O-N 3.18Å; L224-Q227 PolarHBondContact O-N 3.13Å; L224-S228 WeakPolarHBondContact O-CB 3.32Å; L224-S228 PolarHBondContact O-N 2.89Å
225	Y	89.8	Confident	81.3	Confident	8 Å²	8	80.7 Å²	80.7	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-46.9	176.3	176.1	-102.9	0	0	0	111.1	L221 K222 Q227 S228 L229 I244 R245 G248 M251 H252 D264	L221-Y225 WeakPolarHBondContact O-CB 3.4Å; L221-Y225 PolarHBondContact O-N 3.19Å; K222-Y225 PolarHBondContact O-N 3.45Å; Y225-Q227 VanDerWaalsContact C-N 3.33Å; Y225-Q227 PolarHBondContact O-N 3.1Å; Y225-S228 WeakPolarHBondContact O-CB 3.38Å; Y225-S228 PolarHBondContact O-N 3.44Å; Y225-S228 VanDerWaalsContact O-N 3.12Å; Y225-S228 PolarHBondContact O-OG 3.07Å; Y225-L229 HydrophobicContact CD1-CD1 4.27Å; Y225-L229 HydrophobicContact CE1-CD1 3.71Å; Y225-L229 HydrophobicContact CE1-CG 4.27Å; Y225-L229 HydrophobicContact CE2-CD2 4.37Å; Y225-L229 WeakPolarHBondContact O-CG 3.45Å; Y225-L229 PolarHBondContact O-N 3.25Å; Y225-I244 HydrophobicContact CD2-CG2 4.1Å; Y225-R245 PolarHBondContact OH-NH1 3.2Å; Y225-G248 VanDerWaalsContact CD2-CA 3.48Å; Y225-G248 VanDerWaalsContact CE2-CA 3.4Å; Y225-M251 HydrophobicContact CD1-CE 3.62Å; Y225-M251 HydrophobicContact CD1-SD 4.13Å; Y225-M251 HydrophobicContact CE1-CE 3.91Å; Y225-H252 AromaticContact CE1-CE1 3.63Å; Y225-D264 PolarHBondContact OH-OD1 3.2Å; Y225-D264 PolarHBondContact OH-OD2 3.38Å
226	E	87.4	Confident	80.4	Confident	90 Å²	90	77.9 Å²	77.9	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-58.5	-43.6	175.5	-70.9	173.2	179.5	0	0	111.8	K222 A223 S228 L229 H230	K222-E226 WeakPolarHBondContact CE-OE1 3.32Å; K222-E226 WeakPolarHBondContact O-CG 3.39Å; K222-E226 PolarHBondContact O-N 2.89Å; A223-E226 PolarHBondContact O-N 3.4Å; E226-S228 VanDerWaalsContact C-N 3.34Å; E226-S228 PolarHBondContact O-N 2.9Å; E226-L229 PolarHBondContact O-N 3.47Å; E226-H230 PolarHBondContact O-CD2 3.46Å
227	Q	85.7	Confident	80.2	Confident	86 Å²	86	75.1 Å²	75.1	40%	0.402	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-41	174.7	-73.8	170.7	4.1	0	0	112.5	Y205 A223 L224 Y225 L229 H230	Y205-Q227 HydrophobicContact CE2-CB 4.17Å; A223-Q227 WeakPolarHBondContact O-CB 3.36Å; A223-Q227 WeakPolarHBondContact O-CG 3.18Å; A223-Q227 PolarHBondContact O-N 3.23Å; L224-Q227 PolarHBondContact O-N 3.13Å; Y225-Q227 VanDerWaalsContact C-N 3.33Å; Y225-Q227 PolarHBondContact O-N 3.1Å; Q227-L229 VanDerWaalsContact C-N 3.27Å; Q227-L229 PolarHBondContact O-N 3.39Å; Q227-H230 PolarHBondContact O-N 3.3Å
228	S	85.1	Confident	79.9	Confident	8 Å²	8	74.4 Å²	74.4	6%	0.056	38%	0.375	C	S	.	.	H	α-helix	trans	-63.6	-30.4	179.1	77.1	0	0	0	0	113.3	L224 Y225 E226 H230 I231 I244	L224-S228 WeakPolarHBondContact O-CB 3.32Å; L224-S228 PolarHBondContact O-N 2.89Å; Y225-S228 WeakPolarHBondContact O-CB 3.38Å; Y225-S228 PolarHBondContact O-N 3.44Å; Y225-S228 VanDerWaalsContact O-N 3.12Å; Y225-S228 PolarHBondContact O-OG 3.07Å; E226-S228 VanDerWaalsContact C-N 3.34Å; E226-S228 PolarHBondContact O-N 2.9Å; S228-H230 VanDerWaalsContact C-N 3.27Å; S228-H230 PolarHBondContact O-N 3.32Å; S228-I231 PolarHBondContact O-N 3.13Å; S228-I244 WeakPolarHBondContact OG-CG2 3.46Å
229	L	81.6	Confident	80	Confident	72 Å²	72	74 Å²	74	38%	0.377	37%	0.373	S	S	.	.	H	α-helix	trans	-69.2	-23.8	178.6	-67.3	174.4	0	0	0	113.3	Y225 E226 Q227 I231	Y225-L229 HydrophobicContact CD1-CD1 4.27Å; Y225-L229 HydrophobicContact CE1-CD1 3.71Å; Y225-L229 HydrophobicContact CE1-CG 4.27Å; Y225-L229 HydrophobicContact CE2-CD2 4.37Å; Y225-L229 WeakPolarHBondContact O-CG 3.45Å; Y225-L229 PolarHBondContact O-N 3.25Å; E226-L229 PolarHBondContact O-N 3.47Å; Q227-L229 VanDerWaalsContact C-N 3.27Å; Q227-L229 PolarHBondContact O-N 3.39Å; L229-I231 VanDerWaalsContact C-N 3.27Å
230	H	79.4	Confident	79.9	Confident	153 Å²	153	66.2 Å²	66.2	71%	0.708	34%	0.339	S	S	*	.	H	α-helix	trans	-73.8	-20.2	176.7	-68	-67.5	0	0	0	112.4	E226 Q227 S228 K232	E226-H230 PolarHBondContact O-CD2 3.46Å; Q227-H230 PolarHBondContact O-N 3.3Å; S228-H230 VanDerWaalsContact C-N 3.27Å; S228-H230 PolarHBondContact O-N 3.32Å; H230-K232 VanDerWaalsContact C-N 3.31Å; H230-K232 PolarHBondContact O-N 3.28Å
231	I	76.6	Confident	79.8	Confident	16 Å²	16	64.1 Å²	64.1	8%	0.082	33%	0.331	C	S	.	.			trans	-84.4	72.8	179.6	-50.8	172.6	0	0	0	109.7	L201 L202 Y205 S228 L229 A234	L201-I231 HydrophobicContact CB-CD1 4.1Å; L201-I231 HydrophobicContact CD2-CD1 3.49Å; L201-I231 VanDerWaalsContact CD2-CD1 3.49Å; L201-I231 HydrophobicContact CD2-CG1 4.33Å; L201-I231 HydrophobicContact CG-CD1 3.68Å; L202-I231 HydrophobicContact CD1-CG2 4.09Å; L202-I231 HydrophobicContact CD2-CB 4.25Å; L202-I231 HydrophobicContact CD2-CD1 4.06Å; L202-I231 HydrophobicContact CG-CB 4.32Å; L202-I231 HydrophobicContact CG-CD1 4.15Å; L202-I231 HydrophobicContact CG-CG2 4.08Å; Y205-I231 HydrophobicContact CD2-CD1 3.81Å; Y205-I231 HydrophobicContact CE2-CD1 3.47Å; Y205-I231 VanDerWaalsContact CE2-CD1 3.47Å; S228-I231 PolarHBondContact O-N 3.13Å; L229-I231 VanDerWaalsContact C-N 3.27Å; I231-A234 HydrophobicContact CG2-CB 4.45Å
232	K	57	Low	79.8	Confident	192 Å²	192	63.4 Å²	63.4	84%	0.835	33%	0.328	S	S	*	.			trans	-85.3	-14.4	179.4	-84.8	-175.5	176.5	179.8	0	115.4	H230	H230-K232 VanDerWaalsContact C-N 3.31Å; H230-K232 PolarHBondContact O-N 3.28Å
233	S	53.6	Low	79.9	Confident	100 Å²	100	60.9 Å²	60.9	70%	0.699	32%	0.318	S	S	*	.	S	Bend	trans	-88.8	-3	-168.7	-167	0	0	0	0	114.8
234	A	60.3	Low	79.9	Confident	19 Å²	19	59.1 Å²	59.1	16%	0.157	30%	0.303	C	S	.	.			trans	-104	142.2	-178.6	0	0	0	0	0	110.4	L202 I231 P236	L202-A234 HydrophobicContact CD1-CB 4.32Å; I231-A234 HydrophobicContact CG2-CB 4.45Å; A234-P236 WeakPolarHBondContact O-CD 3.4Å
235	I	65.3	Low	80	Confident	165 Å²	165	60.8 Å²	60.8	85%	0.846	31%	0.308	S	S	*	.			trans	-91.8	91.6	160.5	-58	172.2	0	0	0	105.8
236	P	69.4	Low	80.2	Confident	22 Å²	22	61.3 Å²	61.3	14%	0.143	31%	0.311	C	S	.	.			trans	-71.8	161.6	177.3	28.7	-34.5	0	0	0	111.1	L202 A234 M241	L202-P236 HydrophobicContact CD1-CB 3.78Å; L202-P236 HydrophobicContact CD1-CG 3.82Å; A234-P236 WeakPolarHBondContact O-CD 3.4Å; P236-M241 HydrophobicContact CG-CB 4.19Å; P236-M241 HydrophobicContact CG-CE 3.38Å
237	H	80	Confident	80.4	Confident	112 Å²	112	57.5 Å²	57.5	52%	0.519	29%	0.294	S	S	.	.			trans	-60.5	134.4	169.8	-170.5	-75.6	0	0	0	109.6	L239 I240 M241	H237-L239 VanDerWaalsContact ND1-CB 3.34Å; H237-L239 WeakPolarHBondContact ND1-CB 3.46Å; H237-L239 PolarHBondContact ND1-N 2.99Å; H237-L239 PolarHBondContact O-N 3.32Å; H237-L239 VanDerWaalsContact O-N 3.12Å; H237-I240 HydrophobicContact CB-CD1 3.99Å; H237-I240 HydrophobicContact CB-CG1 4.23Å; H237-I240 PolarHBondContact O-N 3.01Å; H237-M241 PolarHBondContact O-N 3.13Å
238	P	84.4	Confident	80.6	Confident	39 Å²	39	53.4 Å²	53.4	25%	0.253	28%	0.275	S	S	.	.	H	α-helix	trans	-49.6	-44.5	-176.5	-29.9	34.5	0	0	0	113	I240 M241 G242 N271 E274	P238-I240 VanDerWaalsContact C-N 3.32Å; P238-I240 PolarHBondContact O-N 3.47Å; P238-M241 PolarHBondContact O-N 2.78Å; P238-G242 PolarHBondContact O-N 3.04Å; P238-N271 HydrophobicContact CB-CB 4.39Å; P238-N271 WeakPolarHBondContact O-CB 3.42Å; P238-E274 HydrophobicContact CB-CB 4.46Å
239	L	86.9	Confident	81	Confident	70 Å²	70	53 Å²	53	37%	0.366	27%	0.272	S	S	.	.	H	α-helix	trans	-53.1	-42.2	176.1	-174.1	64.6	0	0	0	114.4	H237 G242 V243 Y272	H237-L239 VanDerWaalsContact ND1-CB 3.34Å; H237-L239 WeakPolarHBondContact ND1-CB 3.46Å; H237-L239 PolarHBondContact ND1-N 2.99Å; H237-L239 PolarHBondContact O-N 3.32Å; H237-L239 VanDerWaalsContact O-N 3.12Å; L239-G242 PolarHBondContact O-N 3.1Å; L239-V243 WeakPolarHBondContact O-CG2 3.42Å; L239-V243 PolarHBondContact O-N 3.48Å; L239-Y272 HydrophobicContact CD1-CD1 4.07Å; L239-Y272 HydrophobicContact CD1-CE1 3.94Å
240	I	87.4	Confident	81.5	Confident	21 Å²	21	51.7 Å²	51.7	11%	0.108	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-45.2	-178.2	-62.6	171.8	0	0	0	109.4	L202 E203 A206 H237 P238 G242 V243 I244	L202-I240 HydrophobicContact CB-CG2 4.14Å; L202-I240 WeakPolarHBondContact O-CG2 3.45Å; E203-I240 HydrophobicContact CB-CD1 3.93Å; E203-I240 HydrophobicContact CG-CD1 3.88Å; A206-I240 HydrophobicContact CB-CG2 3.85Å; H237-I240 HydrophobicContact CB-CD1 3.99Å; H237-I240 HydrophobicContact CB-CG1 4.23Å; H237-I240 PolarHBondContact O-N 3.01Å; P238-I240 VanDerWaalsContact C-N 3.32Å; P238-I240 PolarHBondContact O-N 3.47Å; I240-G242 VanDerWaalsContact C-N 3.31Å; I240-G242 PolarHBondContact O-N 3.29Å; I240-V243 PolarHBondContact O-N 2.99Å; I240-I244 HydrophobicContact CG2-CD1 4.08Å; I240-I244 WeakPolarHBondContact O-CG1 3.45Å; I240-I244 PolarHBondContact O-N 3.02Å
241	M	87.4	Confident	82	Confident	41 Å²	41	45.3 Å²	45.3	20%	0.202	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-41.5	176.3	-176	55.5	61.2	0	0	111.3	P236 H237 P238 V243 I244 R245	P236-M241 HydrophobicContact CG-CB 4.19Å; P236-M241 HydrophobicContact CG-CE 3.38Å; H237-M241 PolarHBondContact O-N 3.13Å; P238-M241 PolarHBondContact O-N 2.78Å; M241-V243 PolarHBondContact O-N 3.25Å; M241-I244 PolarHBondContact O-N 2.84Å; M241-R245 HydrophobicContact CG-CG 4.22Å; M241-R245 WeakPolarHBondContact O-CB 3.5Å; M241-R245 VanDerWaalsContact O-CG 3.32Å; M241-R245 WeakPolarHBondContact O-CG 3.39Å; M241-R245 PolarHBondContact O-N 3.05Å; M241-R245 HydrophobicContact SD-CG 3.89Å
242	G	89.8	Confident	82.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-44.9	175.6	0	0	0	0	0	113.1	P238 L239 I240 E246	P238-G242 PolarHBondContact O-N 3.04Å; L239-G242 PolarHBondContact O-N 3.1Å; I240-G242 VanDerWaalsContact C-N 3.31Å; I240-G242 PolarHBondContact O-N 3.29Å; G242-E246 VanDerWaalsContact O-CB 3.31Å; G242-E246 WeakPolarHBondContact O-CB 3.18Å; G242-E246 PolarHBondContact O-N 3Å
243	V	90.8	Very high	84.3	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-43.6	178	172.1	0	0	0	0	112	A206 I209 Q210 L239 I240 M241 C247 Y272	A206-V243 HydrophobicContact CB-CG1 4.28Å; I209-V243 HydrophobicContact CG2-CG1 4.43Å; Q210-V243 HydrophobicContact CG-CG1 4.06Å; L239-V243 WeakPolarHBondContact O-CG2 3.42Å; L239-V243 PolarHBondContact O-N 3.48Å; I240-V243 PolarHBondContact O-N 2.99Å; M241-V243 PolarHBondContact O-N 3.25Å; V243-C247 PolarHBondContact O-N 2.99Å; V243-Y272 WeakPolarHBondContact CA-OH 3.5Å; V243-Y272 HydrophobicContact CG2-CE1 4.32Å; V243-Y272 WeakPolarHBondContact CG2-OH 3.28Å
244	I	91.2	Very high	85.9	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-66.5	-46.8	-179.3	-64.3	169.9	0	0	0	110.2	L202 A206 I209 Y225 S228 I240 M241 C247 G248	L202-I244 HydrophobicContact CB-CD1 4.19Å; L202-I244 HydrophobicContact CD2-CD1 3.6Å; L202-I244 HydrophobicContact CG-CD1 4.49Å; A206-I244 HydrophobicContact CB-CG1 4.21Å; I209-I244 HydrophobicContact CD1-CB 4.35Å; I209-I244 HydrophobicContact CD1-CG1 4.03Å; I209-I244 HydrophobicContact CD1-CG2 4.24Å; Y225-I244 HydrophobicContact CD2-CG2 4.1Å; S228-I244 WeakPolarHBondContact OG-CG2 3.46Å; I240-I244 HydrophobicContact CG2-CD1 4.08Å; I240-I244 WeakPolarHBondContact O-CG1 3.45Å; I240-I244 PolarHBondContact O-N 3.02Å; M241-I244 PolarHBondContact O-N 2.84Å; I244-C247 WeakPolarHBondContact O-CB 3.29Å; I244-C247 PolarHBondContact O-N 3.37Å; I244-G248 PolarHBondContact O-N 2.86Å
245	R	92.1	Very high	87.2	Confident	48 Å²	48	40.3 Å²	40.3	18%	0.181	19%	0.194	C	C	.	.	H	α-helix	trans	-63.4	-41	177.9	-73	-65.7	-164.8	-164.6	1.1	112.6	Y225 M241 C247 G248 G249 D264 E267 A268	Y225-R245 PolarHBondContact OH-NH1 3.2Å; M241-R245 HydrophobicContact CG-CG 4.22Å; M241-R245 WeakPolarHBondContact O-CB 3.5Å; M241-R245 VanDerWaalsContact O-CG 3.32Å; M241-R245 WeakPolarHBondContact O-CG 3.39Å; M241-R245 PolarHBondContact O-N 3.05Å; M241-R245 HydrophobicContact SD-CG 3.89Å; R245-C247 VanDerWaalsContact C-N 3.27Å; R245-C247 PolarHBondContact O-N 3.47Å; R245-G248 PolarHBondContact O-N 3.12Å; R245-G248 VanDerWaalsContact O-N 3.12Å; R245-G249 PolarHBondContact O-N 3.21Å; R245-D264 WeakPolarHBondContact CD-OD1 3.39Å; R245-D264 IonicContact CZ-OD1 3.99Å; R245-D264 IonicContact NE-OD1 2.68Å; R245-D264 IonicContact NH1-OD1 3.12Å; R245-D264 PolarHBondContact NH1-OD1 3.21Å; R245-E267 HydrophobicContact CG-CB 4.36Å; R245-E267 IonicContact CZ-OE2 2.74Å; R245-E267 IonicContact NE-OE2 2.74Å; R245-E267 PolarHBondContact NE-OE2 3.05Å; R245-E267 IonicContact NH2-OE1 3.53Å; R245-E267 IonicContact NH2-OE2 3.83Å; R245-E267 PolarHBondContact NH2-OE2 3.49Å; R245-A268 HydrophobicContact CB-CB 3.72Å
246	E	93	Very high	88.2	Confident	20 Å²	20	34.2 Å²	34.2	9%	0.093	17%	0.172	C	C	.	.	H	α-helix	trans	-58.5	-41	175	-172.4	-163.4	146.4	0	0	111.5	G242 G249 K250 F265 A268 Y272	G242-E246 VanDerWaalsContact O-CB 3.31Å; G242-E246 WeakPolarHBondContact O-CB 3.18Å; G242-E246 PolarHBondContact O-N 3Å; E246-G249 PolarHBondContact O-N 3.28Å; E246-K250 WeakPolarHBondContact O-CG 3.23Å; E246-K250 PolarHBondContact O-N 3.38Å; E246-K250 WeakPolarHBondContact OE1-CE 3.42Å; E246-K250 IonicContact OE1-NZ 2.97Å; E246-K250 PolarHBondContact OE1-NZ 3.1Å; E246-F265 HydrophobicContact CG-CE1 4.38Å; E246-A268 HydrophobicContact CB-CB 4.29Å; E246-Y272 HydrophobicContact CB-CE2 4.29Å; E246-Y272 WeakPolarHBondContact OE2-CE2 3.39Å; E246-Y272 PolarHBondContact OE2-OH 3.27Å
247	C	91.4	Very high	89.3	Confident	10 Å²	10	36.5 Å²	36.5	7%	0.068	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-43.4	174.5	-179	0	0	0	0	112.1	I209 V243 I244 R245 G249 K250 M251	I209-C247 HydrophobicContact CD1-CB 4.41Å; I209-C247 HydrophobicContact CG2-CB 3.48Å; I209-C247 VanDerWaalsContact CG2-CB 3.48Å; V243-C247 PolarHBondContact O-N 2.99Å; I244-C247 WeakPolarHBondContact O-CB 3.29Å; I244-C247 PolarHBondContact O-N 3.37Å; R245-C247 VanDerWaalsContact C-N 3.27Å; R245-C247 PolarHBondContact O-N 3.47Å; C247-G249 VanDerWaalsContact C-N 3.34Å; C247-G249 PolarHBondContact O-N 3.15Å; C247-K250 PolarHBondContact O-N 3.45Å; C247-M251 WeakPolarHBondContact O-CB 3.34Å; C247-M251 PolarHBondContact O-N 2.92Å
248	G	90.8	Very high	89.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.5	-46.5	173.5	0	0	0	0	0	112.5	Y225 I244 R245 K250 M251 H252	Y225-G248 VanDerWaalsContact CD2-CA 3.48Å; Y225-G248 VanDerWaalsContact CE2-CA 3.4Å; I244-G248 PolarHBondContact O-N 2.86Å; R245-G248 PolarHBondContact O-N 3.12Å; R245-G248 VanDerWaalsContact O-N 3.12Å; G248-K250 PolarHBondContact O-N 2.91Å; G248-M251 WeakPolarHBondContact O-CB 3.28Å; G248-M251 PolarHBondContact O-N 3.37Å; G248-H252 PolarHBondContact O-N 2.84Å; G248-H252 PolarHBondContact O-ND1 3.31Å; G248-H252 VanDerWaalsContact O-ND1 3.16Å
249	G	93.1	Very high	90.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-45.9	176.4	0	0	0	0	0	112.7	R245 E246 C247 M251 H252 L253	R245-G249 PolarHBondContact O-N 3.21Å; E246-G249 PolarHBondContact O-N 3.28Å; C247-G249 VanDerWaalsContact C-N 3.34Å; C247-G249 PolarHBondContact O-N 3.15Å; G249-M251 VanDerWaalsContact C-N 3.32Å; G249-M251 PolarHBondContact O-N 2.93Å; G249-H252 PolarHBondContact O-N 3.32Å; G249-L253 WeakPolarHBondContact O-CB 3.34Å; G249-L253 PolarHBondContact O-N 3.28Å
250	K	91.6	Very high	90.4	Very high	43 Å²	43	39.6 Å²	39.6	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-37.9	176.8	-74.6	174.8	169.8	168.2	0	112.6	E246 C247 G248 R254 F265 F349	E246-K250 WeakPolarHBondContact O-CG 3.23Å; E246-K250 PolarHBondContact O-N 3.38Å; E246-K250 WeakPolarHBondContact OE1-CE 3.42Å; E246-K250 IonicContact OE1-NZ 2.97Å; E246-K250 PolarHBondContact OE1-NZ 3.1Å; C247-K250 PolarHBondContact O-N 3.45Å; G248-K250 PolarHBondContact O-N 2.91Å; K250-R254 WeakPolarHBondContact O-CG 3.25Å; K250-R254 PolarHBondContact O-N 3.41Å; K250-F265 HydrophobicContact CG-CE1 4.07Å; K250-F265 HydrophobicContact CG-CZ 3.9Å; K250-F265 VanDerWaalsContact N-CZ 3.29Å; K250-F349 HydrophobicContact CB-CE2 3.87Å; K250-F349 HydrophobicContact CB-CZ 4Å; K250-F349 HydrophobicContact CG-CD2 4.3Å; K250-F349 HydrophobicContact CG-CE1 4.1Å; K250-F349 HydrophobicContact CG-CE2 3.79Å; K250-F349 HydrophobicContact CG-CZ 3.68Å
251	M	90.1	Very high	90.7	Very high	20 Å²	20	38.6 Å²	38.6	10%	0.099	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-54.2	175.7	177.1	-157.6	73.8	0	0	111	K222 Y225 C247 G248 G249 L253 R254 E255	K222-M251 VanDerWaalsContact CA-SD 3.58Å; K222-M251 HydrophobicContact CB-CG 4.3Å; K222-M251 HydrophobicContact CB-SD 3.65Å; K222-M251 HydrophobicContact CD-SD 4.06Å; K222-M251 HydrophobicContact CG-SD 3.57Å; K222-M251 VanDerWaalsContact CG-SD 3.57Å; Y225-M251 HydrophobicContact CD1-CE 3.62Å; Y225-M251 HydrophobicContact CD1-SD 4.13Å; Y225-M251 HydrophobicContact CE1-CE 3.91Å; C247-M251 WeakPolarHBondContact O-CB 3.34Å; C247-M251 PolarHBondContact O-N 2.92Å; G248-M251 WeakPolarHBondContact O-CB 3.28Å; G248-M251 PolarHBondContact O-N 3.37Å; G249-M251 VanDerWaalsContact C-N 3.32Å; G249-M251 PolarHBondContact O-N 2.93Å; M251-L253 VanDerWaalsContact C-N 3.26Å; M251-L253 PolarHBondContact O-N 3.46Å; M251-R254 WeakPolarHBondContact O-CB 3.48Å; M251-R254 PolarHBondContact O-N 3.13Å; M251-E255 PolarHBondContact O-N 3.45Å
252	H	91.4	Very high	90.9	Very high	16 Å²	16	38.6 Å²	38.6	7%	0.074	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-37.8	-179.6	-72.6	134.4	0	0	0	112.2	Y225 G248 G249 R254 E255 G256 E257 K260 A261 D264	Y225-H252 AromaticContact CE1-CE1 3.63Å; G248-H252 PolarHBondContact O-N 2.84Å; G248-H252 PolarHBondContact O-ND1 3.31Å; G248-H252 VanDerWaalsContact O-ND1 3.16Å; G249-H252 PolarHBondContact O-N 3.32Å; H252-R254 VanDerWaalsContact C-N 3.3Å; H252-R254 PolarHBondContact O-N 3.46Å; H252-E255 PolarHBondContact O-N 2.91Å; H252-E255 VanDerWaalsContact O-N 3.15Å; H252-G256 PolarHBondContact O-N 2.92Å; H252-G256 VanDerWaalsContact O-N 3.17Å; H252-E257 HydrophobicContact CB-CB 4.26Å; H252-E257 IonicContact CD2-OE2 2.89Å; H252-E257 PolarHBondContact CD2-OE2 2.75Å; H252-E257 IonicContact NE2-OE2 3.58Å; H252-E257 PolarHBondContact O-N 3.41Å; H252-K260 HydrophobicContact CB-CB 4.34Å; H252-A261 HydrophobicContact CB-CB 3.75Å; H252-D264 IonicContact CE1-OD2 3.75Å; H252-D264 PolarHBondContact CE1-OD2 2.79Å; H252-D264 IonicContact ND1-OD2 3.82Å; H252-D264 PolarHBondContact ND1-OD2 3Å
253	L	90.2	Very high	91	Very high	3 Å²	3	42 Å²	42	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-37.4	177.3	-149.7	76.9	0	0	0	112.5	G249 M251 E255 G256 F258 A261 L289 A290 L293 F349	G249-L253 WeakPolarHBondContact O-CB 3.34Å; G249-L253 PolarHBondContact O-N 3.28Å; M251-L253 VanDerWaalsContact C-N 3.26Å; M251-L253 PolarHBondContact O-N 3.46Å; L253-E255 VanDerWaalsContact C-N 3.32Å; L253-G256 PolarHBondContact O-N 3.28Å; L253-F258 HydrophobicContact CD1-CD1 3.82Å; L253-F258 HydrophobicContact CD1-CE1 4.39Å; L253-F258 HydrophobicContact CG-CD1 4.49Å; L253-A261 HydrophobicContact CB-CB 4.27Å; L253-A261 HydrophobicContact CD1-CB 3.75Å; L253-L289 HydrophobicContact CD2-CD2 4.03Å; L253-L289 HydrophobicContact CD2-CG 4.48Å; L253-A290 HydrophobicContact CD1-CB 3.96Å; L253-L293 HydrophobicContact CD1-CD1 3.8Å; L253-L293 HydrophobicContact CD2-CD1 4.07Å; L253-L293 HydrophobicContact CG-CD1 4.07Å; L253-F349 HydrophobicContact CB-CZ 3.98Å; L253-F349 HydrophobicContact CD2-CE1 3.61Å; L253-F349 HydrophobicContact CD2-CE2 4.41Å; L253-F349 HydrophobicContact CD2-CZ 3.39Å; L253-F349 HydrophobicContact CG-CZ 4.31Å
254	R	87.6	Confident	91.1	Very high	112 Å²	112	41.7 Å²	41.7	42%	0.423	20%	0.201	S	C	.	.	H	α-helix	trans	-72.7	-25	176	-72.5	178.7	169.7	170.5	-1.6	113.5	N218 K250 M251 H252 G256	N218-R254 PolarHBondContact ND2-NH1 2.89Å; N218-R254 PolarHBondContact OD1-NH1 3.49Å; K250-R254 WeakPolarHBondContact O-CG 3.25Å; K250-R254 PolarHBondContact O-N 3.41Å; M251-R254 WeakPolarHBondContact O-CB 3.48Å; M251-R254 PolarHBondContact O-N 3.13Å; H252-R254 VanDerWaalsContact C-N 3.3Å; H252-R254 PolarHBondContact O-N 3.46Å; R254-G256 VanDerWaalsContact C-N 3.29Å
255	E	87.4	Confident	91.2	Very high	91 Å²	91	41.5 Å²	41.5	43%	0.425	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.8	174.8	-61.5	-164.7	161.5	0	0	112.8	K222 M251 H252 L253 E257	K222-E255 VanDerWaalsContact CD-OE1 3.28Å; K222-E255 WeakPolarHBondContact CD-OE1 3.39Å; K222-E255 WeakPolarHBondContact CE-OE1 3.46Å; K222-E255 IonicContact NZ-OE1 2.88Å; K222-E255 PolarHBondContact NZ-OE1 2.99Å; K222-E255 IonicContact NZ-OE2 2.9Å; K222-E255 PolarHBondContact NZ-OE2 3.43Å; M251-E255 PolarHBondContact O-N 3.45Å; H252-E255 PolarHBondContact O-N 2.91Å; H252-E255 VanDerWaalsContact O-N 3.15Å; L253-E255 VanDerWaalsContact C-N 3.32Å; E255-E257 VanDerWaalsContact C-N 3.27Å; E255-E257 HydrophobicContact CB-CG 4.42Å
256	G	87.3	Confident	91.2	Very high	37 Å²	37	42 Å²	42	38%	0.381	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	9.2	-176.7	0	0	0	0	0	113.8	H252 L253 R254 F258	H252-G256 PolarHBondContact O-N 2.92Å; H252-G256 VanDerWaalsContact O-N 3.17Å; L253-G256 PolarHBondContact O-N 3.28Å; R254-G256 VanDerWaalsContact C-N 3.29Å; G256-F258 VanDerWaalsContact C-N 3.29Å; G256-F258 WeakPolarHBondContact O-CD2 3.46Å; G256-F258 PolarHBondContact O-N 3.18Å
257	E	91.6	Very high	91.1	Very high	70 Å²	70	44.9 Å²	44.9	33%	0.327	22%	0.218	S	C	.	.			trans	-85	68.1	177.5	-62.8	-167.4	148.5	0	0	110.8	H252 E255 E259 K260 A261	H252-E257 HydrophobicContact CB-CB 4.26Å; H252-E257 IonicContact CD2-OE2 2.89Å; H252-E257 PolarHBondContact CD2-OE2 2.75Å; H252-E257 IonicContact NE2-OE2 3.58Å; H252-E257 PolarHBondContact O-N 3.41Å; E255-E257 VanDerWaalsContact C-N 3.27Å; E255-E257 HydrophobicContact CB-CG 4.42Å; E257-E259 VanDerWaalsContact C-N 3.32Å; E257-E259 PolarHBondContact O-N 3.44Å; E257-K260 HydrophobicContact CB-CB 4.46Å; E257-K260 PolarHBondContact O-N 3.28Å; E257-K260 IonicContact OE1-NZ 2.73Å; E257-K260 PolarHBondContact OE1-NZ 3.02Å; E257-K260 VanDerWaalsContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CE 3.48Å; E257-K260 IonicContact OE2-NZ 2.65Å; E257-K260 PolarHBondContact OE2-NZ 3.09Å; E257-A261 PolarHBondContact O-N 2.94Å
258	F	91.2	Very high	91.2	Very high	42 Å²	42	44.4 Å²	44.4	18%	0.184	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-34.5	-171.4	-54	-57.7	0	0	0	114.3	L253 G256 A261 H262 L293 M294 E356	L253-F258 HydrophobicContact CD1-CD1 3.82Å; L253-F258 HydrophobicContact CD1-CE1 4.39Å; L253-F258 HydrophobicContact CG-CD1 4.49Å; G256-F258 VanDerWaalsContact C-N 3.29Å; G256-F258 WeakPolarHBondContact O-CD2 3.46Å; G256-F258 PolarHBondContact O-N 3.18Å; F258-A261 PolarHBondContact O-N 3.2Å; F258-H262 WeakPolarHBondContact O-CB 3.45Å; F258-H262 PolarHBondContact O-N 2.77Å; F258-L293 HydrophobicContact CB-CB 4.46Å; F258-L293 HydrophobicContact CD1-CB 3.62Å; F258-L293 HydrophobicContact CD1-CD1 4.06Å; F258-L293 HydrophobicContact CD1-CG 4.35Å; F258-L293 HydrophobicContact CD2-CB 4.49Å; F258-L293 HydrophobicContact CE1-CB 3.91Å; F258-L293 HydrophobicContact CE1-CD1 3.92Å; F258-L293 HydrophobicContact CE1-CD2 4.24Å; F258-L293 HydrophobicContact CE1-CG 4.24Å; F258-L293 HydrophobicContact CG-CB 3.94Å; F258-L293 HydrophobicContact CZ-CB 4.45Å; F258-L293 HydrophobicContact CZ-CD2 4.45Å; F258-M294 HydrophobicContact CB-CB 4.25Å; F258-E356 WeakPolarHBondContact CZ-OE1 3.41Å
259	E	90.8	Very high	91.3	Very high	144 Å²	144	44.4 Å²	44.4	67%	0.673	22%	0.215	S	C	*	.	H	α-helix	trans	-67.7	-44.5	179.8	-172.5	173.6	-170.4	0	0	111.8	E257 H262 T263 M294	E257-E259 VanDerWaalsContact C-N 3.32Å; E257-E259 PolarHBondContact O-N 3.44Å; E259-H262 WeakPolarHBondContact O-CB 3.49Å; E259-H262 PolarHBondContact O-N 3.05Å; E259-T263 PolarHBondContact O-N 3.07Å; E259-T263 VanDerWaalsContact O-N 3.12Å; E259-M294 HydrophobicContact CB-SD 4.16Å; E259-M294 HydrophobicContact CG-SD 4.16Å
260	K	91.8	Very high	91.1	Very high	100 Å²	100	47.9 Å²	47.9	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-66.4	-41.4	174.7	-63.5	-168	-157.6	151.3	0	111.3	H252 E257 H262 T263 D264	H252-K260 HydrophobicContact CB-CB 4.34Å; E257-K260 HydrophobicContact CB-CB 4.46Å; E257-K260 PolarHBondContact O-N 3.28Å; E257-K260 IonicContact OE1-NZ 2.73Å; E257-K260 PolarHBondContact OE1-NZ 3.02Å; E257-K260 VanDerWaalsContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CE 3.48Å; E257-K260 IonicContact OE2-NZ 2.65Å; E257-K260 PolarHBondContact OE2-NZ 3.09Å; K260-H262 VanDerWaalsContact C-N 3.29Å; K260-H262 PolarHBondContact O-N 3.21Å; K260-T263 WeakPolarHBondContact CA-OG1 3.39Å; K260-T263 PolarHBondContact O-N 3.43Å; K260-T263 VanDerWaalsContact O-N 3.14Å; K260-T263 PolarHBondContact O-OG1 3.3Å; K260-D264 PolarHBondContact O-N 3.49Å
261	A	93.6	Very high	91.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-43.8	175.5	0	0	0	0	0	111.7	H252 L253 E257 F258 T263 D264 F265 A290	H252-A261 HydrophobicContact CB-CB 3.75Å; L253-A261 HydrophobicContact CB-CB 4.27Å; L253-A261 HydrophobicContact CD1-CB 3.75Å; E257-A261 PolarHBondContact O-N 2.94Å; F258-A261 PolarHBondContact O-N 3.2Å; A261-T263 PolarHBondContact O-N 3.03Å; A261-D264 PolarHBondContact O-N 3.48Å; A261-F265 HydrophobicContact CB-CD2 4.42Å; A261-F265 HydrophobicContact CB-CE2 4.3Å; A261-F265 WeakPolarHBondContact O-CB 3.49Å; A261-F265 WeakPolarHBondContact O-CD2 3.28Å; A261-F265 WeakPolarHBondContact O-CG 3.46Å; A261-F265 PolarHBondContact O-N 3.09Å; A261-A290 HydrophobicContact CB-CB 4.47Å
262	H	92.3	Very high	91.2	Very high	40 Å²	40	46.1 Å²	46.1	19%	0.185	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-46.5	175.3	177.1	-84.2	0	0	0	111.8	F258 E259 K260 F265 F266 A290 N291 M294	F258-H262 WeakPolarHBondContact O-CB 3.45Å; F258-H262 PolarHBondContact O-N 2.77Å; E259-H262 WeakPolarHBondContact O-CB 3.49Å; E259-H262 PolarHBondContact O-N 3.05Å; K260-H262 VanDerWaalsContact C-N 3.29Å; K260-H262 PolarHBondContact O-N 3.21Å; H262-F265 PolarHBondContact O-N 3.32Å; H262-F266 VanDerWaalsContact O-CB 3.3Å; H262-F266 WeakPolarHBondContact O-CB 3.28Å; H262-F266 PolarHBondContact O-N 3.17Å; H262-A290 HydrophobicContact CB-CB 4.32Å; H262-N291 PolarHBondContact NE2-ND2 2.83Å; H262-M294 HydrophobicContact CB-SD 4.3Å
263	T	91.4	Very high	91.1	Very high	72 Å²	72	47.8 Å²	47.8	44%	0.442	23%	0.232	S	C	.	.	H	α-helix	trans	-62.4	-43.9	178.1	56	0	0	0	0	112.8	E259 K260 A261 F266 E267	E259-T263 PolarHBondContact O-N 3.07Å; E259-T263 VanDerWaalsContact O-N 3.12Å; K260-T263 WeakPolarHBondContact CA-OG1 3.39Å; K260-T263 PolarHBondContact O-N 3.43Å; K260-T263 VanDerWaalsContact O-N 3.14Å; K260-T263 PolarHBondContact O-OG1 3.3Å; A261-T263 PolarHBondContact O-N 3.03Å; T263-F266 PolarHBondContact O-N 3.36Å; T263-E267 PolarHBondContact O-N 2.99Å
264	D	93.6	Very high	91.1	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-44.6	178.5	-84.7	-38.8	0	0	0	112.1	Y225 R245 H252 K260 A261 F266 E267 A268	Y225-D264 PolarHBondContact OH-OD1 3.2Å; Y225-D264 PolarHBondContact OH-OD2 3.38Å; R245-D264 WeakPolarHBondContact CD-OD1 3.39Å; R245-D264 IonicContact CZ-OD1 3.99Å; R245-D264 IonicContact NE-OD1 2.68Å; R245-D264 IonicContact NH1-OD1 3.12Å; R245-D264 PolarHBondContact NH1-OD1 3.21Å; H252-D264 IonicContact CE1-OD2 3.75Å; H252-D264 PolarHBondContact CE1-OD2 2.79Å; H252-D264 IonicContact ND1-OD2 3.82Å; H252-D264 PolarHBondContact ND1-OD2 3Å; K260-D264 PolarHBondContact O-N 3.49Å; A261-D264 PolarHBondContact O-N 3.48Å; D264-F266 VanDerWaalsContact C-N 3.29Å; D264-F266 PolarHBondContact O-N 3.41Å; D264-E267 PolarHBondContact O-N 3.43Å; D264-A268 VanDerWaalsContact O-CB 3.28Å; D264-A268 WeakPolarHBondContact O-CB 3.28Å; D264-A268 PolarHBondContact O-N 3.11Å
265	F	94.1	Very high	91	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-33.5	177.1	-73.9	-51.1	0	0	0	112.3	E246 K250 A261 H262 A268 F269 Y286 L287 A290 F349	E246-F265 HydrophobicContact CG-CE1 4.38Å; K250-F265 HydrophobicContact CG-CE1 4.07Å; K250-F265 HydrophobicContact CG-CZ 3.9Å; K250-F265 VanDerWaalsContact N-CZ 3.29Å; A261-F265 HydrophobicContact CB-CD2 4.42Å; A261-F265 HydrophobicContact CB-CE2 4.3Å; A261-F265 WeakPolarHBondContact O-CB 3.49Å; A261-F265 WeakPolarHBondContact O-CD2 3.28Å; A261-F265 WeakPolarHBondContact O-CG 3.46Å; A261-F265 PolarHBondContact O-N 3.09Å; H262-F265 PolarHBondContact O-N 3.32Å; F265-A268 PolarHBondContact O-N 3.41Å; F265-F269 VanDerWaalsContact O-CB 3.29Å; F265-F269 WeakPolarHBondContact O-CB 3.38Å; F265-F269 PolarHBondContact O-N 3.18Å; F265-Y286 HydrophobicContact CD1-CD2 4.45Å; F265-Y286 AromaticContact CE1-CD2 3.9Å; F265-Y286 HydrophobicContact CE1-CD2 3.9Å; F265-Y286 HydrophobicContact CE1-CG 4.09Å; F265-Y286 HydrophobicContact CZ-CD2 4.44Å; F265-Y286 HydrophobicContact CZ-CG 4.27Å; F265-L287 HydrophobicContact CB-CB 4.06Å; F265-L287 HydrophobicContact CB-CD1 4.17Å; F265-A290 HydrophobicContact CD2-CB 3.92Å; F265-A290 HydrophobicContact CE2-CB 4.35Å; F265-F349 HydrophobicContact CZ-CE1 4.21Å; F265-F349 HydrophobicContact CZ-CZ 4.28Å
266	F	91.6	Very high	91	Very high	57 Å²	57	48.7 Å²	48.7	25%	0.25	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-47	176.1	-171.8	-104.9	0	0	0	111.1	H262 T263 D264 A268 F269 K270 L287	H262-F266 VanDerWaalsContact O-CB 3.3Å; H262-F266 WeakPolarHBondContact O-CB 3.28Å; H262-F266 PolarHBondContact O-N 3.17Å; T263-F266 PolarHBondContact O-N 3.36Å; D264-F266 VanDerWaalsContact C-N 3.29Å; D264-F266 PolarHBondContact O-N 3.41Å; F266-A268 VanDerWaalsContact C-N 3.35Å; F266-A268 PolarHBondContact O-N 2.89Å; F266-F269 PolarHBondContact O-N 2.95Å; F266-K270 HydrophobicContact CD1-CD 4.17Å; F266-K270 HydrophobicContact CE1-CD 3.69Å; F266-K270 HydrophobicContact CE1-CG 4.41Å; F266-K270 HydrophobicContact CZ-CD 4.14Å; F266-K270 WeakPolarHBondContact O-CG 3.24Å; F266-K270 PolarHBondContact O-N 3.3Å; F266-K270 VanDerWaalsContact O-N 3.09Å; F266-L287 HydrophobicContact CB-CD1 3.91Å; F266-L287 HydrophobicContact CD2-CD1 4.33Å; F266-L287 HydrophobicContact CD2-CD2 3.83Å
267	E	90.6	Very high	90.9	Very high	82 Å²	82	47.7 Å²	47.7	38%	0.383	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-41	173.8	-73.3	-170.1	-170.2	0	0	111.9	R245 T263 D264 F269 K270 N271	R245-E267 HydrophobicContact CG-CB 4.36Å; R245-E267 IonicContact CZ-OE2 2.74Å; R245-E267 IonicContact NE-OE2 2.74Å; R245-E267 PolarHBondContact NE-OE2 3.05Å; R245-E267 IonicContact NH2-OE1 3.53Å; R245-E267 IonicContact NH2-OE2 3.83Å; R245-E267 PolarHBondContact NH2-OE2 3.49Å; T263-E267 PolarHBondContact O-N 2.99Å; D264-E267 PolarHBondContact O-N 3.43Å; E267-F269 PolarHBondContact O-N 3.3Å; E267-K270 PolarHBondContact O-N 3.44Å; E267-N271 PolarHBondContact O-N 2.91Å; E267-N271 VanDerWaalsContact O-N 3.11Å; E267-N271 PolarHBondContact O-ND2 3.34Å
268	A	92.8	Very high	90.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-44.2	176	0	0	0	0	0	111.8	R245 E246 D264 F265 F266 N271 Y272	R245-A268 HydrophobicContact CB-CB 3.72Å; E246-A268 HydrophobicContact CB-CB 4.29Å; D264-A268 VanDerWaalsContact O-CB 3.28Å; D264-A268 WeakPolarHBondContact O-CB 3.28Å; D264-A268 PolarHBondContact O-N 3.11Å; F265-A268 PolarHBondContact O-N 3.41Å; F266-A268 VanDerWaalsContact C-N 3.35Å; F266-A268 PolarHBondContact O-N 2.89Å; A268-N271 PolarHBondContact O-N 2.91Å; A268-Y272 HydrophobicContact CB-CE2 4.43Å; A268-Y272 WeakPolarHBondContact O-CD2 3.43Å; A268-Y272 PolarHBondContact O-N 3.34Å
269	F	92.6	Very high	90.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-46.7	178.1	173.1	-106.7	0	0	0	111.8	F265 F266 E267 N271 Y272 D273 R280 L284 E305 A306 Y309	F265-F269 VanDerWaalsContact O-CB 3.29Å; F265-F269 WeakPolarHBondContact O-CB 3.38Å; F265-F269 PolarHBondContact O-N 3.18Å; F266-F269 PolarHBondContact O-N 2.95Å; E267-F269 PolarHBondContact O-N 3.3Å; F269-N271 VanDerWaalsContact C-N 3.34Å; F269-N271 PolarHBondContact O-N 3.17Å; F269-Y272 PolarHBondContact O-N 3.16Å; F269-D273 WeakPolarHBondContact O-CB 3.42Å; F269-D273 PolarHBondContact O-N 3.45Å; F269-R280 HydrophobicContact CD2-CB 4.4Å; F269-R280 HydrophobicContact CE2-CB 4.29Å; F269-L284 HydrophobicContact CD2-CB 3.97Å; F269-L284 HydrophobicContact CD2-CD1 4.31Å; F269-L284 HydrophobicContact CE2-CB 3.91Å; F269-L284 HydrophobicContact CE2-CD1 4.1Å; F269-L284 HydrophobicContact CE2-CD2 4.06Å; F269-L284 HydrophobicContact CE2-CG 4.25Å; F269-L284 HydrophobicContact CZ-CD1 4.22Å; F269-L284 HydrophobicContact CZ-CD2 4.31Å; F269-E305 HydrophobicContact CD1-CB 4.45Å; F269-E305 HydrophobicContact CE1-CB 3.79Å; F269-A306 HydrophobicContact CE1-CB 4.3Å; F269-Y309 HydrophobicContact CE2-CD2 4.49Å; F269-Y309 HydrophobicContact CE2-CE2 4.43Å; F269-Y309 AromaticContact CZ-CD2 3.85Å; F269-Y309 HydrophobicContact CZ-CD2 3.85Å; F269-Y309 AromaticContact CZ-CE2 3.83Å; F269-Y309 HydrophobicContact CZ-CE2 3.83Å
270	K	90.3	Very high	90.4	Very high	72 Å²	72	49 Å²	49	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-58.6	-45.8	176.8	-69.5	-174.2	63.1	145.5	0	112.3	F266 E267 Y272 D273 E274 E305	F266-K270 HydrophobicContact CD1-CD 4.17Å; F266-K270 HydrophobicContact CE1-CD 3.69Å; F266-K270 HydrophobicContact CE1-CG 4.41Å; F266-K270 HydrophobicContact CZ-CD 4.14Å; F266-K270 WeakPolarHBondContact O-CG 3.24Å; F266-K270 PolarHBondContact O-N 3.3Å; F266-K270 VanDerWaalsContact O-N 3.09Å; E267-K270 PolarHBondContact O-N 3.44Å; K270-Y272 VanDerWaalsContact C-N 3.33Å; K270-Y272 PolarHBondContact O-N 3.17Å; K270-D273 PolarHBondContact O-N 3.42Å; K270-E274 WeakPolarHBondContact O-CG 3.41Å; K270-E274 PolarHBondContact O-N 3.14Å; K270-E305 WeakPolarHBondContact CE-OE1 3.45Å; K270-E305 HydrophobicContact CG-CG 4.34Å; K270-E305 IonicContact NZ-OE1 2.94Å; K270-E305 PolarHBondContact NZ-OE1 3.11Å
271	N	91	Very high	90.3	Very high	27 Å²	27	45.1 Å²	45.1	14%	0.144	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-39	176.9	-79.9	-62.9	0	0	0	112.5	P238 E267 A268 F269 S275	P238-N271 HydrophobicContact CB-CB 4.39Å; P238-N271 WeakPolarHBondContact O-CB 3.42Å; E267-N271 PolarHBondContact O-N 2.91Å; E267-N271 VanDerWaalsContact O-N 3.11Å; E267-N271 PolarHBondContact O-ND2 3.34Å; A268-N271 PolarHBondContact O-N 2.91Å; F269-N271 VanDerWaalsContact C-N 3.34Å; F269-N271 PolarHBondContact O-N 3.17Å; N271-S275 WeakPolarHBondContact O-CB 3.39Å; N271-S275 PolarHBondContact O-N 3.31Å; N271-S275 VanDerWaalsContact O-N 3.13Å; N271-S275 PolarHBondContact O-OG 3.48Å
272	Y	92.3	Very high	90.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-70.1	-37.1	176.3	-75	-47.5	0	0	0	112.8	L239 V243 E246 A268 F269 K270 S275 G276 S277 R279 C283	L239-Y272 HydrophobicContact CD1-CD1 4.07Å; L239-Y272 HydrophobicContact CD1-CE1 3.94Å; V243-Y272 WeakPolarHBondContact CA-OH 3.5Å; V243-Y272 HydrophobicContact CG2-CE1 4.32Å; V243-Y272 WeakPolarHBondContact CG2-OH 3.28Å; E246-Y272 HydrophobicContact CB-CE2 4.29Å; E246-Y272 WeakPolarHBondContact OE2-CE2 3.39Å; E246-Y272 PolarHBondContact OE2-OH 3.27Å; A268-Y272 HydrophobicContact CB-CE2 4.43Å; A268-Y272 WeakPolarHBondContact O-CD2 3.43Å; A268-Y272 PolarHBondContact O-N 3.34Å; F269-Y272 PolarHBondContact O-N 3.16Å; K270-Y272 VanDerWaalsContact C-N 3.33Å; K270-Y272 PolarHBondContact O-N 3.17Å; Y272-S275 WeakPolarHBondContact CA-OG 3.43Å; Y272-S275 PolarHBondContact O-N 3.43Å; Y272-S275 PolarHBondContact O-OG 3Å; Y272-G276 PolarHBondContact O-N 3.12Å; Y272-S277 PolarHBondContact O-N 2.75Å; Y272-S277 VanDerWaalsContact O-N 3.1Å; Y272-R279 HydrophobicContact CD1-CB 4.32Å; Y272-R279 HydrophobicContact CD2-CB 4.48Å; Y272-R279 HydrophobicContact CE1-CB 4.15Å; Y272-R279 HydrophobicContact CE2-CB 4.3Å; Y272-R279 HydrophobicContact CG-CB 4.48Å; Y272-C283 HydrophobicContact CD2-CB 3.84Å; Y272-C283 HydrophobicContact CE2-CB 4.14Å
273	D	89.9	Confident	90.1	Very high	51 Å²	51	45.4 Å²	45.4	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-63.4	-48.8	175.8	-167.4	55	0	0	0	111.4	F269 K270 S275 G276 Y309	F269-D273 WeakPolarHBondContact O-CB 3.42Å; F269-D273 PolarHBondContact O-N 3.45Å; K270-D273 PolarHBondContact O-N 3.42Å; D273-S275 VanDerWaalsContact C-N 3.25Å; D273-S275 PolarHBondContact O-N 3.05Å; D273-G276 PolarHBondContact O-N 3.07Å; D273-Y309 PolarHBondContact OD1-OH 2.57Å
274	E	88.8	Confident	90.1	Very high	137 Å²	137	42 Å²	42	64%	0.64	22%	0.221	S	C	*	.	H	α-helix	trans	-59.7	-34.8	174.7	-72.8	177.9	-170	0	0	112.6	P238 K270	P238-E274 HydrophobicContact CB-CB 4.46Å; K270-E274 WeakPolarHBondContact O-CG 3.41Å; K270-E274 PolarHBondContact O-N 3.14Å
275	S	87.3	Confident	90	Very high	40 Å²	40	42.6 Å²	42.6	28%	0.28	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.7	177.8	73.2	0	0	0	0	114.7	N271 Y272 D273 S277	N271-S275 WeakPolarHBondContact O-CB 3.39Å; N271-S275 PolarHBondContact O-N 3.31Å; N271-S275 VanDerWaalsContact O-N 3.13Å; N271-S275 PolarHBondContact O-OG 3.48Å; Y272-S275 WeakPolarHBondContact CA-OG 3.43Å; Y272-S275 PolarHBondContact O-N 3.43Å; Y272-S275 PolarHBondContact O-OG 3Å; D273-S275 VanDerWaalsContact C-N 3.25Å; D273-S275 PolarHBondContact O-N 3.05Å; S275-S277 PolarHBondContact O-N 3.09Å; S275-S277 WeakPolarHBondContact OG-CB 3.47Å; S275-S277 PolarHBondContact OG-N 3.46Å
276	G	86.1	Confident	90	Very high	47 Å²	47	43.2 Å²	43.2	49%	0.485	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	20.6	-174.4	0	0	0	0	0	114.8	Y272 D273	Y272-G276 PolarHBondContact O-N 3.12Å; D273-G276 PolarHBondContact O-N 3.07Å
277	S	84.6	Confident	90	Very high	16 Å²	16	40.5 Å²	40.5	11%	0.112	22%	0.215	C	C	.	.			trans	-70.9	140.4	-176.2	-177.1	0	0	0	0	112.1	Y272 S275 R279 R280	Y272-S277 PolarHBondContact O-N 2.75Å; Y272-S277 VanDerWaalsContact O-N 3.1Å; S275-S277 PolarHBondContact O-N 3.09Å; S275-S277 WeakPolarHBondContact OG-CB 3.47Å; S275-S277 PolarHBondContact OG-N 3.46Å; S277-R279 PolarHBondContact O-N 3.09Å; S277-R279 VanDerWaalsContact O-N 3.16Å; S277-R279 PolarHBondContact OG-N 2.75Å; S277-R280 WeakPolarHBondContact O-CB 3.2Å; S277-R280 WeakPolarHBondContact O-CG 3.28Å; S277-R280 PolarHBondContact O-N 3.36Å
278	P	85.9	Confident	90	Very high	104 Å²	104	36.6 Å²	36.6	68%	0.675	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21	173.4	26.8	-35.1	0	0	0	112.6	R280 T281	P278-R280 PolarHBondContact O-N 2.77Å; P278-R280 VanDerWaalsContact O-N 3.11Å; P278-T281 PolarHBondContact O-N 3.04Å; P278-T281 PolarHBondContact O-OG1 2.86Å
279	R	87.8	Confident	89.9	Confident	105 Å²	105	36.7 Å²	36.7	40%	0.396	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-13.4	176.6	-70.2	-169.6	172.8	-171.5	0.4	114	Y272 S277 T281 T282 C283	Y272-R279 HydrophobicContact CD1-CB 4.32Å; Y272-R279 HydrophobicContact CD2-CB 4.48Å; Y272-R279 HydrophobicContact CE1-CB 4.15Å; Y272-R279 HydrophobicContact CE2-CB 4.3Å; Y272-R279 HydrophobicContact CG-CB 4.48Å; S277-R279 PolarHBondContact O-N 3.09Å; S277-R279 VanDerWaalsContact O-N 3.16Å; S277-R279 PolarHBondContact OG-N 2.75Å; R279-T281 VanDerWaalsContact C-N 3.25Å; R279-T281 PolarHBondContact O-N 3.35Å; R279-T282 PolarHBondContact O-N 3.34Å; R279-C283 WeakPolarHBondContact O-CB 3.46Å; R279-C283 PolarHBondContact O-N 3.12Å
280	R	90.4	Very high	89.8	Confident	76 Å²	76	36.7 Å²	36.7	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-57.6	-37.5	177.3	74.3	-174	174.9	-149.7	-5.8	112.4	F269 S277 P278 C283 L284 Y309	F269-R280 HydrophobicContact CD2-CB 4.4Å; F269-R280 HydrophobicContact CE2-CB 4.29Å; S277-R280 WeakPolarHBondContact O-CB 3.2Å; S277-R280 WeakPolarHBondContact O-CG 3.28Å; S277-R280 PolarHBondContact O-N 3.36Å; P278-R280 PolarHBondContact O-N 2.77Å; P278-R280 VanDerWaalsContact O-N 3.11Å; R280-C283 PolarHBondContact O-N 2.9Å; R280-L284 VanDerWaalsContact O-CB 3.28Å; R280-L284 WeakPolarHBondContact O-CB 3.43Å; R280-L284 PolarHBondContact O-N 3.29Å; R280-Y309 WeakPolarHBondContact CD-OH 3.29Å; R280-Y309 PolarHBondContact NE-OH 3.23Å
281	T	88.9	Confident	89.8	Confident	18 Å²	18	33.5 Å²	33.5	11%	0.11	18%	0.183	C	C	.	.	H	α-helix	trans	-68.7	-45.2	-178.5	56.5	0	0	0	0	110.3	P278 R279 L284 K285	P278-T281 PolarHBondContact O-N 3.04Å; P278-T281 PolarHBondContact O-OG1 2.86Å; R279-T281 VanDerWaalsContact C-N 3.25Å; R279-T281 PolarHBondContact O-N 3.35Å; T281-L284 WeakPolarHBondContact O-CB 3.4Å; T281-L284 PolarHBondContact O-N 2.64Å; T281-K285 WeakPolarHBondContact O-CG 3.46Å; T281-K285 PolarHBondContact O-N 3.17Å; T281-K285 VanDerWaalsContact O-N 3.1Å
282	T	90.9	Very high	89.6	Confident	45 Å²	45	32.3 Å²	32.3	28%	0.276	18%	0.177	S	C	.	.	H	α-helix	trans	-61.7	-45.3	174.4	-40	0	0	0	0	111.7	R279 L284 K285 Y286	R279-T282 PolarHBondContact O-N 3.34Å; T282-L284 VanDerWaalsContact C-N 3.29Å; T282-L284 PolarHBondContact O-N 2.79Å; T282-K285 WeakPolarHBondContact O-CB 3.28Å; T282-K285 PolarHBondContact O-N 3.24Å; T282-K285 VanDerWaalsContact O-N 3.13Å; T282-Y286 HydrophobicContact CG2-CE1 4.39Å; T282-Y286 HydrophobicContact CG2-CE2 3.82Å; T282-Y286 PolarHBondContact O-N 3.46Å
283	C	92.4	Very high	89.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-36.9	178.2	-166	0	0	0	0	112	Y272 R279 R280 K285 Y286 L287	Y272-C283 HydrophobicContact CD2-CB 3.84Å; Y272-C283 HydrophobicContact CE2-CB 4.14Å; R279-C283 WeakPolarHBondContact O-CB 3.46Å; R279-C283 PolarHBondContact O-N 3.12Å; R280-C283 PolarHBondContact O-N 2.9Å; C283-K285 VanDerWaalsContact C-N 3.34Å; C283-Y286 PolarHBondContact O-N 2.95Å; C283-L287 PolarHBondContact O-N 3.09Å
284	L	91.1	Very high	89.2	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-37.8	174.6	-174	57	0	0	0	111.8	F269 R280 T281 T282 Y286 L287 V288 F301 A306 Y309 I315	F269-L284 HydrophobicContact CD2-CB 3.97Å; F269-L284 HydrophobicContact CD2-CD1 4.31Å; F269-L284 HydrophobicContact CE2-CB 3.91Å; F269-L284 HydrophobicContact CE2-CD1 4.1Å; F269-L284 HydrophobicContact CE2-CD2 4.06Å; F269-L284 HydrophobicContact CE2-CG 4.25Å; F269-L284 HydrophobicContact CZ-CD1 4.22Å; F269-L284 HydrophobicContact CZ-CD2 4.31Å; R280-L284 VanDerWaalsContact O-CB 3.28Å; R280-L284 WeakPolarHBondContact O-CB 3.43Å; R280-L284 PolarHBondContact O-N 3.29Å; T281-L284 WeakPolarHBondContact O-CB 3.4Å; T281-L284 PolarHBondContact O-N 2.64Å; T282-L284 VanDerWaalsContact C-N 3.29Å; T282-L284 PolarHBondContact O-N 2.79Å; L284-Y286 VanDerWaalsContact C-N 3.32Å; L284-Y286 PolarHBondContact O-N 3.45Å; L284-L287 HydrophobicContact CD1-CD2 4.06Å; L284-L287 PolarHBondContact O-N 3.25Å; L284-V288 WeakPolarHBondContact O-CG2 3.34Å; L284-V288 PolarHBondContact O-N 2.95Å; L284-F301 HydrophobicContact CD1-CE1 4.31Å; L284-F301 HydrophobicContact CD2-CE1 4.01Å; L284-F301 HydrophobicContact CG-CE1 4.23Å; L284-A306 HydrophobicContact CD1-CB 3.97Å; L284-Y309 HydrophobicContact CD2-CG 4.18Å; L284-I315 HydrophobicContact CB-CD1 4.36Å; L284-I315 HydrophobicContact CD2-CD1 4.09Å; L284-I315 HydrophobicContact CD2-CG1 4.19Å; L284-I315 HydrophobicContact CD2-CG2 3.93Å; L284-I315 HydrophobicContact CG-CD1 4.41Å
285	K	91.8	Very high	88.8	Confident	17 Å²	17	32.2 Å²	32.2	7%	0.074	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-43.3	171.6	-61.7	179.2	-174.9	174.9	0	111.3	T281 T282 C283 V288 L289 E314 I315 M318 N343 I350	T281-K285 WeakPolarHBondContact O-CG 3.46Å; T281-K285 PolarHBondContact O-N 3.17Å; T281-K285 VanDerWaalsContact O-N 3.1Å; T282-K285 WeakPolarHBondContact O-CB 3.28Å; T282-K285 PolarHBondContact O-N 3.24Å; T282-K285 VanDerWaalsContact O-N 3.13Å; C283-K285 VanDerWaalsContact C-N 3.34Å; K285-V288 PolarHBondContact O-N 3.01Å; K285-L289 WeakPolarHBondContact O-CB 3.37Å; K285-L289 PolarHBondContact O-N 3.04Å; K285-E314 IonicContact NZ-OE1 3.18Å; K285-E314 PolarHBondContact NZ-OE1 3Å; K285-I315 HydrophobicContact CG-CD1 4.23Å; K285-M318 HydrophobicContact CB-CE 4.37Å; K285-M318 HydrophobicContact CB-CG 4.27Å; K285-M318 HydrophobicContact CB-SD 4.39Å; K285-M318 HydrophobicContact CG-CG 3.84Å; K285-M318 HydrophobicContact CG-SD 4.37Å; K285-M318 WeakPolarHBondContact O-CE 3.34Å; K285-N343 PolarHBondContact NZ-O 3.33Å; K285-N343 VanDerWaalsContact NZ-O 3.16Å; K285-I350 HydrophobicContact CB-CD1 3.89Å; K285-I350 HydrophobicContact CD-CD1 4.23Å
286	Y	92.8	Very high	88.1	Confident	12 Å²	12	31.4 Å²	31.4	5%	0.047	17%	0.167	C	C	.	.	H	α-helix	trans	-67.8	-39.5	177.6	-57.1	-32.1	0	0	0	113.3	F265 T282 C283 L284 V288 L289 A290 D347 F349 I350	F265-Y286 HydrophobicContact CD1-CD2 4.45Å; F265-Y286 AromaticContact CE1-CD2 3.9Å; F265-Y286 HydrophobicContact CE1-CD2 3.9Å; F265-Y286 HydrophobicContact CE1-CG 4.09Å; F265-Y286 HydrophobicContact CZ-CD2 4.44Å; F265-Y286 HydrophobicContact CZ-CG 4.27Å; T282-Y286 HydrophobicContact CG2-CE1 4.39Å; T282-Y286 HydrophobicContact CG2-CE2 3.82Å; T282-Y286 PolarHBondContact O-N 3.46Å; C283-Y286 PolarHBondContact O-N 2.95Å; L284-Y286 VanDerWaalsContact C-N 3.32Å; L284-Y286 PolarHBondContact O-N 3.45Å; Y286-V288 VanDerWaalsContact C-N 3.33Å; Y286-V288 PolarHBondContact O-N 3.03Å; Y286-L289 PolarHBondContact O-N 3.19Å; Y286-A290 WeakPolarHBondContact O-CB 3.39Å; Y286-A290 PolarHBondContact O-N 3.36Å; Y286-D347 VanDerWaalsContact CE1-OD2 3.25Å; Y286-D347 WeakPolarHBondContact CE1-OD2 3.09Å; Y286-D347 PolarHBondContact OH-OD2 3.37Å; Y286-F349 AromaticContact CD1-CD1 3.61Å; Y286-F349 HydrophobicContact CD1-CD1 3.61Å; Y286-F349 AromaticContact CD1-CE1 3.91Å; Y286-F349 HydrophobicContact CD1-CE1 3.91Å; Y286-F349 HydrophobicContact CE1-CB 4.41Å; Y286-F349 AromaticContact CE1-CD1 3.53Å; Y286-F349 HydrophobicContact CE1-CD1 3.53Å; Y286-F349 HydrophobicContact CE1-CE1 4.27Å; Y286-F349 HydrophobicContact CE1-CG 4.37Å; Y286-F349 HydrophobicContact CG-CD1 4.35Å; Y286-F349 HydrophobicContact CG-CE1 4.29Å; Y286-I350 HydrophobicContact CD1-CD1 4.36Å; Y286-I350 HydrophobicContact CD1-CG1 4.03Å; Y286-I350 HydrophobicContact CE1-CD1 4.19Å; Y286-I350 HydrophobicContact CE1-CG1 3.85Å
287	L	91.9	Very high	87.1	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-58.8	-46.8	174.2	174.3	61.6	0	0	0	111.1	F265 F266 C283 L284 A290 N291	F265-L287 HydrophobicContact CB-CB 4.06Å; F265-L287 HydrophobicContact CB-CD1 4.17Å; F266-L287 HydrophobicContact CB-CD1 3.91Å; F266-L287 HydrophobicContact CD2-CD1 4.33Å; F266-L287 HydrophobicContact CD2-CD2 3.83Å; C283-L287 PolarHBondContact O-N 3.09Å; L284-L287 HydrophobicContact CD1-CD2 4.06Å; L284-L287 PolarHBondContact O-N 3.25Å; L287-A290 PolarHBondContact O-N 3.1Å; L287-N291 WeakPolarHBondContact O-CB 3.07Å; L287-N291 PolarHBondContact O-N 2.95Å
288	V	90.3	Very high	86.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-43.2	178.9	173.3	0	0	0	0	111.2	L284 K285 Y286 N291 M292 P300 F301 M318 V322	L284-V288 WeakPolarHBondContact O-CG2 3.34Å; L284-V288 PolarHBondContact O-N 2.95Å; K285-V288 PolarHBondContact O-N 3.01Å; Y286-V288 VanDerWaalsContact C-N 3.33Å; Y286-V288 PolarHBondContact O-N 3.03Å; V288-N291 PolarHBondContact O-N 3.42Å; V288-M292 HydrophobicContact CG1-CE 3.85Å; V288-M292 WeakPolarHBondContact O-CG 3.35Å; V288-M292 PolarHBondContact O-N 3.48Å; V288-P300 HydrophobicContact CB-CG 4.39Å; V288-P300 HydrophobicContact CG1-CG 4.43Å; V288-P300 HydrophobicContact CG2-CB 4.35Å; V288-P300 HydrophobicContact CG2-CG 3.79Å; V288-F301 HydrophobicContact CG2-CE1 4.43Å; V288-F301 HydrophobicContact CG2-CE2 3.72Å; V288-F301 HydrophobicContact CG2-CZ 3.57Å; V288-M318 HydrophobicContact CB-CE 3.85Å; V288-M318 HydrophobicContact CG1-CB 4.17Å; V288-M318 HydrophobicContact CG1-CE 3.66Å; V288-V322 HydrophobicContact CB-CG2 4.49Å; V288-V322 HydrophobicContact CG1-CG2 3.14Å
289	L	90.8	Very high	86	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-48.6	174.7	177.8	65	0	0	0	111.9	L253 K285 Y286 N291 M292 L293 F349 I350 H353 L357	L253-L289 HydrophobicContact CD2-CD2 4.03Å; L253-L289 HydrophobicContact CD2-CG 4.48Å; K285-L289 WeakPolarHBondContact O-CB 3.37Å; K285-L289 PolarHBondContact O-N 3.04Å; Y286-L289 PolarHBondContact O-N 3.19Å; L289-N291 VanDerWaalsContact C-N 3.3Å; L289-N291 PolarHBondContact O-N 3.25Å; L289-M292 PolarHBondContact O-N 2.91Å; L289-L293 HydrophobicContact CD1-CD1 4.2Å; L289-L293 HydrophobicContact CG-CD1 4.03Å; L289-L293 WeakPolarHBondContact O-CG 3.08Å; L289-L293 PolarHBondContact O-N 3.44Å; L289-F349 HydrophobicContact CD2-CE1 4.41Å; L289-I350 HydrophobicContact CD2-CB 4.46Å; L289-I350 HydrophobicContact CD2-CG1 4.33Å; L289-I350 HydrophobicContact CD2-CG2 4.36Å; L289-H353 HydrophobicContact CD1-CB 4.2Å; L289-H353 HydrophobicContact CD2-CB 4.13Å; L289-L357 HydrophobicContact CD1-CD2 4.21Å
290	A	91.7	Very high	85.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-38.2	178.1	0	0	0	0	0	112	L253 A261 H262 F265 Y286 L287 L293 M294	L253-A290 HydrophobicContact CD1-CB 3.96Å; A261-A290 HydrophobicContact CB-CB 4.47Å; H262-A290 HydrophobicContact CB-CB 4.32Å; F265-A290 HydrophobicContact CD2-CB 3.92Å; F265-A290 HydrophobicContact CE2-CB 4.35Å; Y286-A290 WeakPolarHBondContact O-CB 3.39Å; Y286-A290 PolarHBondContact O-N 3.36Å; L287-A290 PolarHBondContact O-N 3.1Å; A290-L293 PolarHBondContact O-N 3.47Å; A290-M294 WeakPolarHBondContact O-CB 3.41Å; A290-M294 PolarHBondContact O-N 3.49Å
291	N	89.6	Confident	85.1	Confident	5 Å²	5	26 Å²	26	3%	0.027	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-44.7	176.6	-174.4	-80.6	0	0	0	112.3	H262 L287 V288 L289 M294 I298 P300	H262-N291 PolarHBondContact NE2-ND2 2.83Å; L287-N291 WeakPolarHBondContact O-CB 3.07Å; L287-N291 PolarHBondContact O-N 2.95Å; V288-N291 PolarHBondContact O-N 3.42Å; L289-N291 VanDerWaalsContact C-N 3.3Å; L289-N291 PolarHBondContact O-N 3.25Å; N291-M294 PolarHBondContact O-N 3.2Å; N291-I298 PolarHBondContact ND2-O 3.26Å; N291-I298 PolarHBondContact OD1-O 2.96Å; N291-I298 VanDerWaalsContact OD1-O 3.07Å; N291-P300 HydrophobicContact CB-CG 4.33Å
292	M	87.1	Confident	84.7	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-41.5	176.2	-67.5	-176.7	-68.4	0	0	111.4	V288 L289 M294 K295 M318 L321 V322 Y325 L357	V288-M292 HydrophobicContact CG1-CE 3.85Å; V288-M292 WeakPolarHBondContact O-CG 3.35Å; V288-M292 PolarHBondContact O-N 3.48Å; L289-M292 PolarHBondContact O-N 2.91Å; M292-M294 VanDerWaalsContact C-N 3.35Å; M292-M294 PolarHBondContact O-N 2.95Å; M292-K295 PolarHBondContact O-N 2.87Å; M292-M318 HydrophobicContact CE-CE 4.22Å; M292-L321 HydrophobicContact SD-CB 4.47Å; M292-V322 HydrophobicContact CG-CG2 4.21Å; M292-V322 HydrophobicContact SD-CG2 3.96Å; M292-Y325 HydrophobicContact CB-CD1 4.35Å; M292-Y325 HydrophobicContact CB-CD2 4.3Å; M292-Y325 HydrophobicContact CB-CE1 4.39Å; M292-Y325 HydrophobicContact CB-CE2 4.38Å; M292-Y325 HydrophobicContact CB-CG 4.32Å; M292-Y325 HydrophobicContact CG-CD1 4.23Å; M292-Y325 HydrophobicContact CG-CD2 4.46Å; M292-Y325 HydrophobicContact CG-CG 4.11Å; M292-Y325 VanDerWaalsContact O-CZ 3.3Å; M292-Y325 PolarHBondContact O-OH 3.03Å; M292-Y325 HydrophobicContact SD-CD2 4.44Å; M292-Y325 HydrophobicContact SD-CG 4.25Å; M292-L357 HydrophobicContact CB-CD1 3.75Å; M292-L357 HydrophobicContact CB-CD2 3.82Å; M292-L357 HydrophobicContact CB-CG 4.2Å; M292-L357 HydrophobicContact CE-CD2 3.55Å; M292-L357 HydrophobicContact CG-CD2 4.43Å; M292-L357 HydrophobicContact SD-CD2 3.81Å
293	L	88.1	Confident	84.3	Confident	2 Å²	2	30 Å²	30	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-33.8	176.9	-73.3	165.2	0	0	0	113.3	L253 F258 L289 A290 K295 H353 E356 L357	L253-L293 HydrophobicContact CD1-CD1 3.8Å; L253-L293 HydrophobicContact CD2-CD1 4.07Å; L253-L293 HydrophobicContact CG-CD1 4.07Å; F258-L293 HydrophobicContact CB-CB 4.46Å; F258-L293 HydrophobicContact CD1-CB 3.62Å; F258-L293 HydrophobicContact CD1-CD1 4.06Å; F258-L293 HydrophobicContact CD1-CG 4.35Å; F258-L293 HydrophobicContact CD2-CB 4.49Å; F258-L293 HydrophobicContact CE1-CB 3.91Å; F258-L293 HydrophobicContact CE1-CD1 3.92Å; F258-L293 HydrophobicContact CE1-CD2 4.24Å; F258-L293 HydrophobicContact CE1-CG 4.24Å; F258-L293 HydrophobicContact CG-CB 3.94Å; F258-L293 HydrophobicContact CZ-CB 4.45Å; F258-L293 HydrophobicContact CZ-CD2 4.45Å; L289-L293 HydrophobicContact CD1-CD1 4.2Å; L289-L293 HydrophobicContact CG-CD1 4.03Å; L289-L293 WeakPolarHBondContact O-CG 3.08Å; L289-L293 PolarHBondContact O-N 3.44Å; A290-L293 PolarHBondContact O-N 3.47Å; L293-K295 PolarHBondContact O-N 2.94Å; L293-K295 VanDerWaalsContact O-N 3.1Å; L293-H353 HydrophobicContact CD1-CB 4.15Å; L293-E356 HydrophobicContact CD2-CB 4.39Å; L293-E356 HydrophobicContact CD2-CG 4.15Å; L293-L357 HydrophobicContact CB-CD1 4.39Å; L293-L357 HydrophobicContact CD2-CD1 3.47Å; L293-L357 VanDerWaalsContact CD2-CD1 3.47Å; L293-L357 HydrophobicContact CG-CD1 3.59Å
294	M	85.4	Confident	83.8	Confident	58 Å²	58	38.3 Å²	38.3	29%	0.286	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-7.4	173.2	-171.6	172.1	72.3	0	0	112.9	F258 E259 H262 A290 N291 M292 S296	F258-M294 HydrophobicContact CB-CB 4.25Å; E259-M294 HydrophobicContact CB-SD 4.16Å; E259-M294 HydrophobicContact CG-SD 4.16Å; H262-M294 HydrophobicContact CB-SD 4.3Å; A290-M294 WeakPolarHBondContact O-CB 3.41Å; A290-M294 PolarHBondContact O-N 3.49Å; N291-M294 PolarHBondContact O-N 3.2Å; M292-M294 VanDerWaalsContact C-N 3.35Å; M292-M294 PolarHBondContact O-N 2.95Å; M294-S296 PolarHBondContact O-N 3.46Å
295	K	80.7	Confident	83.3	Confident	127 Å²	127	40.6 Å²	40.6	55%	0.552	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	29	-176	-55.3	179.7	179.9	-178.5	0	112.4	M292 L293 N360	M292-K295 PolarHBondContact O-N 2.87Å; L293-K295 PolarHBondContact O-N 2.94Å; L293-K295 VanDerWaalsContact O-N 3.1Å; K295-N360 WeakPolarHBondContact CE-OD1 3.49Å; K295-N360 PolarHBondContact NZ-OD1 3.11Å; K295-N360 VanDerWaalsContact NZ-OD1 3.13Å
296	S	71.3	Confident	82.9	Confident	22 Å²	22	39.8 Å²	39.8	15%	0.154	22%	0.216	C	C	.	.			trans	-76.8	140.3	176.3	-173.7	0	0	0	0	110.6	M294 I298	M294-S296 PolarHBondContact O-N 3.46Å; S296-I298 VanDerWaalsContact C-N 3.26Å; S296-I298 PolarHBondContact OG-N 3.43Å
297	G	65.1	Low	82.5	Confident	66 Å²	66	45.1 Å²	45.1	68%	0.68	24%	0.239	S	C	*	.			trans	-83.1	-1.9	169.8	0	0	0	0	0	113.6	Q326	G297-Q326 PolarHBondContact O-NE2 3.11Å
298	I	74.7	Confident	82.3	Confident	120 Å²	120	49.4 Å²	49.4	62%	0.615	27%	0.267	S	S	*	.	S	Bend	trans	-85.5	124	-175.1	-56.3	171.7	0	0	0	109.2	N291 S296 P300	N291-I298 PolarHBondContact ND2-O 3.26Å; N291-I298 PolarHBondContact OD1-O 2.96Å; N291-I298 VanDerWaalsContact OD1-O 3.07Å; S296-I298 VanDerWaalsContact C-N 3.26Å; S296-I298 PolarHBondContact OG-N 3.43Å; I298-P300 WeakPolarHBondContact O-CD 3.27Å
299	N	74.2	Confident	82	Confident	30 Å²	30	50.9 Å²	50.9	16%	0.16	27%	0.273	C	S	.	.			trans	-74.5	121.1	-179.9	-153.9	-35.2	0	0	0	110.2	F301 D302	N299-F301 PolarHBondContact O-N 2.93Å; N299-F301 VanDerWaalsContact O-N 3.12Å; N299-F301 WeakPolarHBondContact OD1-CD2 3.49Å; N299-F301 PolarHBondContact OD1-N 3.46Å; N299-D302 WeakPolarHBondContact CB-OD2 3.4Å; N299-D302 WeakPolarHBondContact O-CB 3.42Å; N299-D302 PolarHBondContact O-N 3.34Å
300	P	77.7	Confident	81.6	Confident	10 Å²	10	54.9 Å²	54.9	7%	0.065	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-59.3	-25.7	179.3	21.7	-32.7	0	0	0	112.8	V288 N291 I298 D302 S303 V322	V288-P300 HydrophobicContact CB-CG 4.39Å; V288-P300 HydrophobicContact CG1-CG 4.43Å; V288-P300 HydrophobicContact CG2-CB 4.35Å; V288-P300 HydrophobicContact CG2-CG 3.79Å; N291-P300 HydrophobicContact CB-CG 4.33Å; I298-P300 WeakPolarHBondContact O-CD 3.27Å; P300-D302 VanDerWaalsContact C-N 3.29Å; P300-D302 PolarHBondContact O-N 2.97Å; P300-S303 PolarHBondContact O-N 3.38Å; P300-S303 PolarHBondContact O-OG 2.87Å; P300-V322 HydrophobicContact CG-CG2 4.41Å
301	F	81.1	Confident	81.2	Confident	9 Å²	9	60.7 Å²	60.7	4%	0.039	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-78.7	-4.9	178.4	-62	-72.3	0	0	0	114.9	L284 V288 N299 S303 A306 K307 K310 I315 M318 T319 V322	L284-F301 HydrophobicContact CD1-CE1 4.31Å; L284-F301 HydrophobicContact CD2-CE1 4.01Å; L284-F301 HydrophobicContact CG-CE1 4.23Å; V288-F301 HydrophobicContact CG2-CE1 4.43Å; V288-F301 HydrophobicContact CG2-CE2 3.72Å; V288-F301 HydrophobicContact CG2-CZ 3.57Å; N299-F301 PolarHBondContact O-N 2.93Å; N299-F301 VanDerWaalsContact O-N 3.12Å; N299-F301 WeakPolarHBondContact OD1-CD2 3.49Å; N299-F301 PolarHBondContact OD1-N 3.46Å; F301-S303 VanDerWaalsContact C-N 3.26Å; F301-A306 HydrophobicContact CD1-CB 4.08Å; F301-K307 WeakPolarHBondContact O-CA 3.4Å; F301-K310 HydrophobicContact CD1-CB 4.38Å; F301-I315 HydrophobicContact CE1-CG2 3.42Å; F301-I315 VanDerWaalsContact CE1-CG2 3.42Å; F301-I315 HydrophobicContact CZ-CG2 3.54Å; F301-M318 HydrophobicContact CZ-CB 4.43Å; F301-T319 HydrophobicContact CD2-CG2 4.31Å; F301-T319 HydrophobicContact CE2-CG2 4.47Å; F301-V322 HydrophobicContact CE2-CG2 4.4Å
302	D	80.4	Confident	81	Confident	120 Å²	120	63 Å²	63	64%	0.642	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-78.1	-15.3	172.1	-69.6	-27.5	0	0	0	112.3	N299 P300	N299-D302 WeakPolarHBondContact CB-OD2 3.4Å; N299-D302 WeakPolarHBondContact O-CB 3.42Å; N299-D302 PolarHBondContact O-N 3.34Å; P300-D302 VanDerWaalsContact C-N 3.29Å; P300-D302 PolarHBondContact O-N 2.97Å
303	S	82.1	Confident	80.8	Confident	26 Å²	26	67.8 Å²	67.8	18%	0.182	37%	0.365	C	S	.	.	S	Bend	trans	-63.3	146.1	172.3	63.6	0	0	0	0	111.3	P300 F301 E305 A306 K307	P300-S303 PolarHBondContact O-N 3.38Å; P300-S303 PolarHBondContact O-OG 2.87Å; F301-S303 VanDerWaalsContact C-N 3.26Å; S303-E305 PolarHBondContact O-N 2.89Å; S303-A306 PolarHBondContact O-N 3.19Å; S303-A306 VanDerWaalsContact OG-CB 3.25Å; S303-A306 WeakPolarHBondContact OG-CB 3.36Å; S303-A306 PolarHBondContact OG-N 3.29Å; S303-K307 VanDerWaalsContact O-CB 3.27Å; S303-K307 WeakPolarHBondContact O-CB 3.42Å; S303-K307 PolarHBondContact O-N 3.14Å
304	Q	82.4	Confident	80.5	Confident	176 Å²	176	71.2 Å²	71.2	82%	0.822	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.7	-178.4	-67.7	-176.1	-5.3	0	0	111.3	P308	Q304-P308 WeakPolarHBondContact O-CD 3.34Å
305	E	79.9	Confident	80.5	Confident	49 Å²	49	68.5 Å²	68.5	23%	0.229	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-37.9	-177.4	-57.2	94	148.5	0	0	112.7	F269 K270 S303 P308 Y309	F269-E305 HydrophobicContact CD1-CB 4.45Å; F269-E305 HydrophobicContact CE1-CB 3.79Å; K270-E305 WeakPolarHBondContact CE-OE1 3.45Å; K270-E305 HydrophobicContact CG-CG 4.34Å; K270-E305 IonicContact NZ-OE1 2.94Å; K270-E305 PolarHBondContact NZ-OE1 3.11Å; S303-E305 PolarHBondContact O-N 2.89Å; E305-P308 WeakPolarHBondContact O-CD 3.39Å; E305-Y309 VanDerWaalsContact O-CD2 3.3Å; E305-Y309 WeakPolarHBondContact O-CD2 3.42Å; E305-Y309 WeakPolarHBondContact O-CE2 3.44Å
306	A	82.8	Confident	80.9	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-20.2	-178	0	0	0	0	0	114.2	F269 L284 F301 S303 P308 Y309	F269-A306 HydrophobicContact CE1-CB 4.3Å; L284-A306 HydrophobicContact CD1-CB 3.97Å; F301-A306 HydrophobicContact CD1-CB 4.08Å; S303-A306 PolarHBondContact O-N 3.19Å; S303-A306 VanDerWaalsContact OG-CB 3.25Å; S303-A306 WeakPolarHBondContact OG-CB 3.36Å; S303-A306 PolarHBondContact OG-N 3.29Å; A306-P308 VanDerWaalsContact C-CD 3.41Å; A306-Y309 WeakPolarHBondContact O-CB 3.45Å; A306-Y309 PolarHBondContact O-N 2.82Å
307	K	85.2	Confident	81.7	Confident	124 Å²	124	65 Å²	65	54%	0.539	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-52.4	-40.4	179.4	-169.9	171	-174.7	172.9	0	115.8	F301 S303 Y309 K310	F301-K307 WeakPolarHBondContact O-CA 3.4Å; S303-K307 VanDerWaalsContact O-CB 3.27Å; S303-K307 WeakPolarHBondContact O-CB 3.42Å; S303-K307 PolarHBondContact O-N 3.14Å; K307-Y309 VanDerWaalsContact C-N 3.26Å; K307-Y309 PolarHBondContact O-N 2.9Å; K307-K310 WeakPolarHBondContact O-CD 3.49Å; K307-K310 VanDerWaalsContact O-CG 3.29Å; K307-K310 WeakPolarHBondContact O-CG 3.3Å
308	P	87.3	Confident	82.8	Confident	91 Å²	91	62 Å²	62	59%	0.591	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-67.8	-27.1	177.9	24.9	-32.9	0	0	0	112.8	Q304 E305 A306 K310	Q304-P308 WeakPolarHBondContact O-CD 3.34Å; E305-P308 WeakPolarHBondContact O-CD 3.39Å; A306-P308 VanDerWaalsContact C-CD 3.41Å; P308-K310 VanDerWaalsContact C-N 3.34Å; P308-K310 PolarHBondContact O-N 2.9Å
309	Y	85.1	Confident	83.5	Confident	31 Å²	31	57.6 Å²	57.6	12%	0.122	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-81.4	-9.9	-175.6	-64	-76.2	0	0	0	114.2	F269 D273 R280 L284 E305 A306 K307 N311 D312	F269-Y309 HydrophobicContact CE2-CD2 4.49Å; F269-Y309 HydrophobicContact CE2-CE2 4.43Å; F269-Y309 AromaticContact CZ-CD2 3.85Å; F269-Y309 HydrophobicContact CZ-CD2 3.85Å; F269-Y309 AromaticContact CZ-CE2 3.83Å; F269-Y309 HydrophobicContact CZ-CE2 3.83Å; D273-Y309 PolarHBondContact OD1-OH 2.57Å; R280-Y309 WeakPolarHBondContact CD-OH 3.29Å; R280-Y309 PolarHBondContact NE-OH 3.23Å; L284-Y309 HydrophobicContact CD2-CG 4.18Å; E305-Y309 VanDerWaalsContact O-CD2 3.3Å; E305-Y309 WeakPolarHBondContact O-CD2 3.42Å; E305-Y309 WeakPolarHBondContact O-CE2 3.44Å; A306-Y309 WeakPolarHBondContact O-CB 3.45Å; A306-Y309 PolarHBondContact O-N 2.82Å; K307-Y309 VanDerWaalsContact C-N 3.26Å; K307-Y309 PolarHBondContact O-N 2.9Å; Y309-N311 PolarHBondContact O-N 3.39Å; Y309-N311 VanDerWaalsContact O-N 3.09Å; Y309-D312 VanDerWaalsContact O-CB 3.3Å; Y309-D312 WeakPolarHBondContact O-CB 3.27Å; Y309-D312 PolarHBondContact O-N 2.97Å
310	K	81.7	Confident	84.2	Confident	84 Å²	84	59.1 Å²	59.1	37%	0.365	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-58.3	-28.1	-175.5	75.1	-176.2	-177.1	170	0	114.5	F301 K307 P308 T319	F301-K310 HydrophobicContact CD1-CB 4.38Å; K307-K310 WeakPolarHBondContact O-CD 3.49Å; K307-K310 VanDerWaalsContact O-CG 3.29Å; K307-K310 WeakPolarHBondContact O-CG 3.3Å; P308-K310 VanDerWaalsContact C-N 3.34Å; P308-K310 PolarHBondContact O-N 2.9Å; K310-T319 PolarHBondContact O-OG1 3.36Å
311	N	83.3	Confident	84.7	Confident	123 Å²	123	58.7 Å²	58.7	66%	0.658	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-97.1	-2.5	-176.3	-66.5	-26	0	0	0	112.7	Y309	Y309-N311 PolarHBondContact O-N 3.39Å; Y309-N311 VanDerWaalsContact O-N 3.09Å
312	D	85.7	Confident	85.1	Confident	53 Å²	53	58.3 Å²	58.3	28%	0.283	30%	0.304	S	S	.	.			trans	-66.5	127.8	176.6	-172.7	-37.9	0	0	0	108.9	Y309 E314 I315 L316	Y309-D312 VanDerWaalsContact O-CB 3.3Å; Y309-D312 WeakPolarHBondContact O-CB 3.27Å; Y309-D312 PolarHBondContact O-N 2.97Å; D312-E314 PolarHBondContact O-N 3.46Å; D312-E314 VanDerWaalsContact O-N 3.13Å; D312-E314 PolarHBondContact OD1-N 2.84Å; D312-I315 HydrophobicContact CB-CB 4.18Å; D312-I315 HydrophobicContact CB-CG1 4.18Å; D312-I315 CarbonylContact O-C 3.6Å; D312-I315 PolarHBondContact O-N 3.12Å; D312-L316 WeakPolarHBondContact O-CB 3.27Å; D312-L316 PolarHBondContact O-N 3.41Å
313	P	82.3	Confident	85.5	Confident	103 Å²	103	54.8 Å²	54.8	67%	0.669	29%	0.289	S	S	*	.	H	α-helix	trans	-55.9	-29.7	-178.6	22.9	-35	0	0	0	113.6
314	E	81.3	Confident	85.8	Confident	73 Å²	73	53.7 Å²	53.7	34%	0.341	28%	0.281	S	S	.	.	H	α-helix	trans	-75.2	-30.5	178.8	-160.6	-175.9	165.3	0	0	112.4	K285 D312	K285-E314 IonicContact NZ-OE1 3.18Å; K285-E314 PolarHBondContact NZ-OE1 3Å; D312-E314 PolarHBondContact O-N 3.46Å; D312-E314 VanDerWaalsContact O-N 3.13Å; D312-E314 PolarHBondContact OD1-N 2.84Å
315	I	86.8	Confident	86	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-95.4	-23	-177.5	-58.6	-59.6	0	0	0	112.1	L284 K285 F301 D312 A317 M318 T319	L284-I315 HydrophobicContact CB-CD1 4.36Å; L284-I315 HydrophobicContact CD2-CD1 4.09Å; L284-I315 HydrophobicContact CD2-CG1 4.19Å; L284-I315 HydrophobicContact CD2-CG2 3.93Å; L284-I315 HydrophobicContact CG-CD1 4.41Å; K285-I315 HydrophobicContact CG-CD1 4.23Å; F301-I315 HydrophobicContact CE1-CG2 3.42Å; F301-I315 VanDerWaalsContact CE1-CG2 3.42Å; F301-I315 HydrophobicContact CZ-CG2 3.54Å; D312-I315 HydrophobicContact CB-CB 4.18Å; D312-I315 HydrophobicContact CB-CG1 4.18Å; D312-I315 CarbonylContact O-C 3.6Å; D312-I315 PolarHBondContact O-N 3.12Å; I315-A317 PolarHBondContact O-N 3.22Å; I315-A317 VanDerWaalsContact O-N 3.13Å; I315-M318 WeakPolarHBondContact O-CA 3.39Å; I315-M318 WeakPolarHBondContact O-CB 3.5Å; I315-M318 PolarHBondContact O-N 3.39Å; I315-T319 PolarHBondContact O-N 2.78Å; I315-T319 PolarHBondContact O-OG1 3.11Å
316	L	88.7	Confident	86.3	Confident	74 Å²	74	46.8 Å²	46.8	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-54.9	-35.6	-179.4	-172.8	66.3	0	0	0	112.1	D312 M318 T319 N320	D312-L316 WeakPolarHBondContact O-CB 3.27Å; D312-L316 PolarHBondContact O-N 3.41Å; L316-M318 VanDerWaalsContact C-N 3.33Å; L316-M318 PolarHBondContact O-N 3.43Å; L316-T319 WeakPolarHBondContact O-CB 3.24Å; L316-T319 PolarHBondContact O-N 3.11Å; L316-N320 WeakPolarHBondContact O-CB 3.31Å; L316-N320 VanDerWaalsContact O-CG 3.23Å; L316-N320 PolarHBondContact O-N 2.98Å; L316-N320 PolarHBondContact O-ND2 3.34Å
317	A	88.7	Confident	86.5	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-43.1	173.5	0	0	0	0	0	112	I315 N320 L321 N340 I344	I315-A317 PolarHBondContact O-N 3.22Å; I315-A317 VanDerWaalsContact O-N 3.13Å; A317-N320 PolarHBondContact O-N 3.48Å; A317-L321 WeakPolarHBondContact O-CG 3.43Å; A317-L321 PolarHBondContact O-N 3.46Å; A317-N340 HydrophobicContact CB-CB 3.75Å; A317-I344 HydrophobicContact CB-CD1 4.08Å; A317-I344 HydrophobicContact CB-CG1 4.5Å
318	M	88.5	Confident	86.6	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-69.9	-39	176	-61.6	-57.5	-65.6	0	0	112	K285 V288 M292 F301 I315 L316 N320 L321 V322 I344	K285-M318 HydrophobicContact CB-CE 4.37Å; K285-M318 HydrophobicContact CB-CG 4.27Å; K285-M318 HydrophobicContact CB-SD 4.39Å; K285-M318 HydrophobicContact CG-CG 3.84Å; K285-M318 HydrophobicContact CG-SD 4.37Å; K285-M318 WeakPolarHBondContact O-CE 3.34Å; V288-M318 HydrophobicContact CB-CE 3.85Å; V288-M318 HydrophobicContact CG1-CB 4.17Å; V288-M318 HydrophobicContact CG1-CE 3.66Å; M292-M318 HydrophobicContact CE-CE 4.22Å; F301-M318 HydrophobicContact CZ-CB 4.43Å; I315-M318 WeakPolarHBondContact O-CA 3.39Å; I315-M318 WeakPolarHBondContact O-CB 3.5Å; I315-M318 PolarHBondContact O-N 3.39Å; L316-M318 VanDerWaalsContact C-N 3.33Å; L316-M318 PolarHBondContact O-N 3.43Å; M318-N320 VanDerWaalsContact C-N 3.3Å; M318-N320 PolarHBondContact O-N 3.25Å; M318-L321 PolarHBondContact O-N 3.04Å; M318-L321 HydrophobicContact SD-CD1 4.04Å; M318-V322 WeakPolarHBondContact O-CG2 3.39Å; M318-V322 PolarHBondContact O-N 3.29Å; M318-I344 HydrophobicContact SD-CG1 4.37Å
319	T	89	Confident	86.6	Confident	28 Å²	28	47.1 Å²	47.1	17%	0.172	25%	0.251	C	S	.	.	H	α-helix	trans	-57.9	-44.8	174.6	-51.5	0	0	0	0	111.3	F301 K310 I315 L316 V322 S323	F301-T319 HydrophobicContact CD2-CG2 4.31Å; F301-T319 HydrophobicContact CE2-CG2 4.47Å; K310-T319 PolarHBondContact O-OG1 3.36Å; I315-T319 PolarHBondContact O-N 2.78Å; I315-T319 PolarHBondContact O-OG1 3.11Å; L316-T319 WeakPolarHBondContact O-CB 3.24Å; L316-T319 PolarHBondContact O-N 3.11Å; T319-V322 PolarHBondContact O-N 2.85Å; T319-S323 PolarHBondContact O-N 3.44Å; T319-S323 VanDerWaalsContact O-N 3.13Å; T319-S323 PolarHBondContact O-OG 2.98Å
320	N	88.8	Confident	86.6	Confident	61 Å²	61	46.1 Å²	46.1	33%	0.326	25%	0.248	S	C	.	.	H	α-helix	trans	-68.5	-37	177.8	-66.4	-23	0	0	0	111.9	L316 A317 M318 S323 A324 I336	L316-N320 WeakPolarHBondContact O-CB 3.31Å; L316-N320 VanDerWaalsContact O-CG 3.23Å; L316-N320 PolarHBondContact O-N 2.98Å; L316-N320 PolarHBondContact O-ND2 3.34Å; A317-N320 PolarHBondContact O-N 3.48Å; M318-N320 VanDerWaalsContact C-N 3.3Å; M318-N320 PolarHBondContact O-N 3.25Å; N320-S323 WeakPolarHBondContact CA-OG 3.16Å; N320-S323 PolarHBondContact O-N 2.86Å; N320-S323 PolarHBondContact O-OG 3.24Å; N320-A324 WeakPolarHBondContact O-CB 3.29Å; N320-A324 PolarHBondContact O-N 3.49Å; N320-I336 HydrophobicContact CB-CD1 3.72Å; N320-I336 HydrophobicContact CB-CG1 4.2Å; N320-I336 HydrophobicContact CB-CG2 4.31Å; N320-I336 VanDerWaalsContact O-CD1 3.32Å; N320-I336 WeakPolarHBondContact O-CD1 2.94Å
321	L	88.4	Confident	86.9	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-43	174.6	-77.4	176.6	0	0	0	112	M292 A317 M318 S323 A324 Y325 F333 I336 L337 I344	M292-L321 HydrophobicContact SD-CB 4.47Å; A317-L321 WeakPolarHBondContact O-CG 3.43Å; A317-L321 PolarHBondContact O-N 3.46Å; M318-L321 PolarHBondContact O-N 3.04Å; M318-L321 HydrophobicContact SD-CD1 4.04Å; L321-S323 PolarHBondContact O-N 3.1Å; L321-A324 PolarHBondContact O-N 3.13Å; L321-Y325 WeakPolarHBondContact O-CB 3.3Å; L321-Y325 PolarHBondContact O-N 3.16Å; L321-F333 HydrophobicContact CB-CE2 4.18Å; L321-F333 HydrophobicContact CD2-CD1 4.34Å; L321-F333 HydrophobicContact CD2-CD2 3.78Å; L321-F333 HydrophobicContact CD2-CE1 4.23Å; L321-F333 HydrophobicContact CD2-CE2 3.63Å; L321-F333 HydrophobicContact CD2-CG 4.13Å; L321-F333 HydrophobicContact CD2-CZ 3.86Å; L321-F333 HydrophobicContact CG-CE2 4.44Å; L321-I336 HydrophobicContact CD2-CB 3.97Å; L321-I336 HydrophobicContact CD2-CG2 3.68Å; L321-I336 HydrophobicContact CG-CG2 3.75Å; L321-L337 HydrophobicContact CD1-CD2 4.27Å; L321-L337 HydrophobicContact CD2-CD2 4.09Å; L321-L337 HydrophobicContact CD2-CG 4.11Å; L321-I344 HydrophobicContact CD1-CD1 3.65Å; L321-I344 HydrophobicContact CD1-CG1 4.41Å; L321-I344 HydrophobicContact CG-CD1 4.41Å
322	V	89.1	Confident	87.2	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-43.8	177.4	173.1	0	0	0	0	111.2	V288 M292 P300 F301 M318 T319 Y325 Q326	V288-V322 HydrophobicContact CB-CG2 4.49Å; V288-V322 HydrophobicContact CG1-CG2 3.14Å; M292-V322 HydrophobicContact CG-CG2 4.21Å; M292-V322 HydrophobicContact SD-CG2 3.96Å; P300-V322 HydrophobicContact CG-CG2 4.41Å; F301-V322 HydrophobicContact CE2-CG2 4.4Å; M318-V322 WeakPolarHBondContact O-CG2 3.39Å; M318-V322 PolarHBondContact O-N 3.29Å; T319-V322 PolarHBondContact O-N 2.85Å; V322-Y325 WeakPolarHBondContact O-CB 3.41Å; V322-Y325 PolarHBondContact O-N 3.33Å; V322-Q326 HydrophobicContact CG1-CG 4.33Å; V322-Q326 WeakPolarHBondContact O-CG 3.38Å; V322-Q326 PolarHBondContact O-N 3.33Å
323	S	88.2	Confident	87.4	Confident	46 Å²	46	41.3 Å²	41.3	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-39.8	179.6	64.7	0	0	0	0	111.9	T319 N320 L321 Q326 N327	T319-S323 PolarHBondContact O-N 3.44Å; T319-S323 VanDerWaalsContact O-N 3.13Å; T319-S323 PolarHBondContact O-OG 2.98Å; N320-S323 WeakPolarHBondContact CA-OG 3.16Å; N320-S323 PolarHBondContact O-N 2.86Å; N320-S323 PolarHBondContact O-OG 3.24Å; L321-S323 PolarHBondContact O-N 3.1Å; S323-Q326 PolarHBondContact O-N 3.36Å; S323-N327 WeakPolarHBondContact O-CB 3.45Å; S323-N327 VanDerWaalsContact O-CG 3.31Å; S323-N327 PolarHBondContact O-N 3.17Å; S323-N327 PolarHBondContact O-ND2 3.43Å; S323-N327 VanDerWaalsContact O-ND2 3.16Å
324	A	89.1	Confident	87.7	Confident	3 Å²	3	37.8 Å²	37.8	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-41	172.4	0	0	0	0	0	112	N320 L321 N327 N328 D329 E332 F333 I336	N320-A324 WeakPolarHBondContact O-CB 3.29Å; N320-A324 PolarHBondContact O-N 3.49Å; L321-A324 PolarHBondContact O-N 3.13Å; A324-N327 PolarHBondContact O-N 3.17Å; A324-N328 PolarHBondContact O-N 2.98Å; A324-N328 VanDerWaalsContact O-N 3.1Å; A324-D329 PolarHBondContact O-N 2.77Å; A324-E332 HydrophobicContact CB-CB 4.37Å; A324-E332 HydrophobicContact CB-CG 4.47Å; A324-F333 HydrophobicContact CB-CB 4.1Å; A324-F333 HydrophobicContact CB-CD2 4.11Å; A324-I336 HydrophobicContact CB-CD1 3.95Å
325	Y	87.2	Confident	88.2	Confident	11 Å²	11	39.7 Å²	39.7	4%	0.043	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-48.2	175.6	-171	-90.5	0	0	0	111.8	M292 L321 V322 N327 N328 F333 L357 I361	M292-Y325 HydrophobicContact CB-CD1 4.35Å; M292-Y325 HydrophobicContact CB-CD2 4.3Å; M292-Y325 HydrophobicContact CB-CE1 4.39Å; M292-Y325 HydrophobicContact CB-CE2 4.38Å; M292-Y325 HydrophobicContact CB-CG 4.32Å; M292-Y325 HydrophobicContact CG-CD1 4.23Å; M292-Y325 HydrophobicContact CG-CD2 4.46Å; M292-Y325 HydrophobicContact CG-CG 4.11Å; M292-Y325 VanDerWaalsContact O-CZ 3.3Å; M292-Y325 PolarHBondContact O-OH 3.03Å; M292-Y325 HydrophobicContact SD-CD2 4.44Å; M292-Y325 HydrophobicContact SD-CG 4.25Å; L321-Y325 WeakPolarHBondContact O-CB 3.3Å; L321-Y325 PolarHBondContact O-N 3.16Å; V322-Y325 WeakPolarHBondContact O-CB 3.41Å; V322-Y325 PolarHBondContact O-N 3.33Å; Y325-N327 VanDerWaalsContact C-N 3.31Å; Y325-N327 PolarHBondContact O-N 2.52Å; Y325-N328 PolarHBondContact O-N 3.38Å; Y325-F333 HydrophobicContact CD2-CE2 4.49Å; Y325-L357 HydrophobicContact CD2-CG 4.27Å; Y325-L357 HydrophobicContact CE2-CD1 4.28Å; Y325-L357 HydrophobicContact CE2-CG 4.04Å; Y325-I361 HydrophobicContact CD2-CD1 3.56Å; Y325-I361 HydrophobicContact CD2-CG1 3.3Å; Y325-I361 HydrophobicContact CE2-CD1 4.11Å; Y325-I361 HydrophobicContact CE2-CG1 3.4Å; Y325-I361 HydrophobicContact CG-CG1 4.33Å
326	Q	86.1	Confident	88.4	Confident	69 Å²	69	40 Å²	40	32%	0.322	21%	0.21	S	C	.	.	H	α-helix	trans	-62	-37.7	178.6	-73.8	179.7	-10.9	0	0	112.6	G297 V322 S323 N328	G297-Q326 PolarHBondContact O-NE2 3.11Å; V322-Q326 HydrophobicContact CG1-CG 4.33Å; V322-Q326 WeakPolarHBondContact O-CG 3.38Å; V322-Q326 PolarHBondContact O-N 3.33Å; S323-Q326 PolarHBondContact O-N 3.36Å; Q326-N328 PolarHBondContact O-N 3.26Å; Q326-N328 PolarHBondContact O-ND2 3.05Å
327	N	87.1	Confident	88.3	Confident	121 Å²	121	37 Å²	37	65%	0.647	20%	0.195	S	C	*	.	H	α-helix	trans	-76.7	-9.3	176.3	-68.8	-30	0	0	0	113.2	S323 A324 Y325 D329	S323-N327 WeakPolarHBondContact O-CB 3.45Å; S323-N327 VanDerWaalsContact O-CG 3.31Å; S323-N327 PolarHBondContact O-N 3.17Å; S323-N327 PolarHBondContact O-ND2 3.43Å; S323-N327 VanDerWaalsContact O-ND2 3.16Å; A324-N327 PolarHBondContact O-N 3.17Å; Y325-N327 VanDerWaalsContact C-N 3.31Å; Y325-N327 PolarHBondContact O-N 2.52Å; N327-D329 VanDerWaalsContact C-N 3.27Å
328	N	85.9	Confident	88.3	Confident	38 Å²	38	44.6 Å²	44.6	20%	0.203	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	39.5	-172.2	-50.2	-86.9	0	0	0	112.2	A324 Y325 Q326 Q364 V365	A324-N328 PolarHBondContact O-N 2.98Å; A324-N328 VanDerWaalsContact O-N 3.1Å; Y325-N328 PolarHBondContact O-N 3.38Å; Q326-N328 PolarHBondContact O-N 3.26Å; Q326-N328 PolarHBondContact O-ND2 3.05Å; N328-Q364 WeakPolarHBondContact OD1-CG 3.45Å; N328-Q364 PolarHBondContact OD1-NE2 2.87Å; N328-Q364 PolarHBondContact OD1-OE1 3.04Å; N328-V365 HydrophobicContact CB-CG2 3.8Å; N328-V365 WeakPolarHBondContact O-CG2 3.24Å
329	D	87	Confident	88.3	Confident	62 Å²	62	49.3 Å²	49.3	33%	0.332	26%	0.257	S	S	.	.			trans	-99.4	103.8	179.5	-170.5	-20.4	0	0	0	110.9	A324 N327 T331 E332 F333	A324-D329 PolarHBondContact O-N 2.77Å; N327-D329 VanDerWaalsContact C-N 3.27Å; D329-T331 VanDerWaalsContact C-N 3.35Å; D329-T331 PolarHBondContact OD1-N 3.42Å; D329-T331 PolarHBondContact OD1-OG1 2.92Å; D329-E332 HydrophobicContact CB-CB 4.28Å; D329-E332 PolarHBondContact OD1-N 3.11Å; D329-E332 VanDerWaalsContact OD1-N 3.09Å; D329-F333 VanDerWaalsContact O-CB 3.26Å; D329-F333 WeakPolarHBondContact O-CB 3.3Å; D329-F333 PolarHBondContact O-N 2.93Å
330	I	86	Confident	88.3	Confident	11 Å²	11	49.9 Å²	49.9	6%	0.056	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-37	-179.3	-56.5	160	0	0	0	110.6	F333 E334 I361 R362 V365 L385	I330-F333 PolarHBondContact O-N 2.82Å; I330-E334 HydrophobicContact CG2-CG 4.35Å; I330-E334 WeakPolarHBondContact O-CG 3.37Å; I330-E334 PolarHBondContact O-N 2.93Å; I330-I361 HydrophobicContact CG1-CG2 3.72Å; I330-R362 HydrophobicContact CD1-CG 3.96Å; I330-R362 HydrophobicContact CG1-CG 4.37Å; I330-V365 HydrophobicContact CD1-CB 3.97Å; I330-V365 HydrophobicContact CD1-CG1 4.04Å; I330-V365 HydrophobicContact CD1-CG2 3.88Å; I330-V365 HydrophobicContact CG1-CG2 4.04Å; I330-L385 HydrophobicContact CD1-CD2 3.53Å
331	T	87.6	Confident	88	Confident	88 Å²	88	52 Å²	52	54%	0.54	27%	0.266	S	S	.	.	H	α-helix	trans	-69.7	-44.6	-174.1	62.3	0	0	0	0	111.5	D329 F333 K335	D329-T331 VanDerWaalsContact C-N 3.35Å; D329-T331 PolarHBondContact OD1-N 3.42Å; D329-T331 PolarHBondContact OD1-OG1 2.92Å; T331-F333 VanDerWaalsContact C-N 3.35Å; T331-K335 VanDerWaalsContact O-CB 3.25Å; T331-K335 WeakPolarHBondContact O-CB 3.25Å; T331-K335 PolarHBondContact O-N 3.43Å
332	E	90.6	Very high	87.7	Confident	70 Å²	70	55 Å²	55	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-68.3	-38.3	175.5	-166.8	62.7	-153.2	0	0	110.5	A324 D329 K335 I336	A324-E332 HydrophobicContact CB-CB 4.37Å; A324-E332 HydrophobicContact CB-CG 4.47Å; D329-E332 HydrophobicContact CB-CB 4.28Å; D329-E332 PolarHBondContact OD1-N 3.11Å; D329-E332 VanDerWaalsContact OD1-N 3.09Å; E332-K335 VanDerWaalsContact CD-NZ 3.3Å; E332-K335 PolarHBondContact O-N 2.92Å; E332-K335 IonicContact OE1-NZ 2.82Å; E332-K335 PolarHBondContact OE1-NZ 2.89Å; E332-K335 WeakPolarHBondContact OE2-CD 3.36Å; E332-K335 IonicContact OE2-NZ 3.92Å; E332-K335 PolarHBondContact OE2-NZ 3.08Å; E332-I336 HydrophobicContact CG-CD1 3.93Å; E332-I336 HydrophobicContact CG-CG1 4.41Å; E332-I336 WeakPolarHBondContact O-CD1 3.49Å; E332-I336 WeakPolarHBondContact O-CG1 3.4Å; E332-I336 PolarHBondContact O-N 3.27Å
333	F	88.9	Confident	87.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-49.1	176.6	-165.4	-86.9	0	0	0	112.3	L321 A324 Y325 D329 I330 T331 K335 I336 L337 I354 L357 L358 I361	L321-F333 HydrophobicContact CB-CE2 4.18Å; L321-F333 HydrophobicContact CD2-CD1 4.34Å; L321-F333 HydrophobicContact CD2-CD2 3.78Å; L321-F333 HydrophobicContact CD2-CE1 4.23Å; L321-F333 HydrophobicContact CD2-CE2 3.63Å; L321-F333 HydrophobicContact CD2-CG 4.13Å; L321-F333 HydrophobicContact CD2-CZ 3.86Å; L321-F333 HydrophobicContact CG-CE2 4.44Å; A324-F333 HydrophobicContact CB-CB 4.1Å; A324-F333 HydrophobicContact CB-CD2 4.11Å; Y325-F333 HydrophobicContact CD2-CE2 4.49Å; D329-F333 VanDerWaalsContact O-CB 3.26Å; D329-F333 WeakPolarHBondContact O-CB 3.3Å; D329-F333 PolarHBondContact O-N 2.93Å; I330-F333 PolarHBondContact O-N 2.82Å; T331-F333 VanDerWaalsContact C-N 3.35Å; F333-K335 VanDerWaalsContact C-N 3.34Å; F333-K335 PolarHBondContact O-N 2.66Å; F333-I336 PolarHBondContact O-N 3.22Å; F333-L337 HydrophobicContact CD1-CD1 3.87Å; F333-L337 HydrophobicContact CD1-CG 4.38Å; F333-L337 HydrophobicContact CE1-CD1 3.66Å; F333-L337 HydrophobicContact CE1-CG 4.27Å; F333-L337 WeakPolarHBondContact O-CG 3.32Å; F333-L337 PolarHBondContact O-N 3.22Å; F333-L337 VanDerWaalsContact O-N 3.11Å; F333-I354 HydrophobicContact CE1-CD1 4.18Å; F333-I354 HydrophobicContact CZ-CD1 4.09Å; F333-L357 HydrophobicContact CE2-CD2 4.39Å; F333-L357 HydrophobicContact CZ-CD2 3.86Å; F333-L357 HydrophobicContact CZ-CG 4.45Å; F333-L358 HydrophobicContact CD1-CD2 3.56Å; F333-L358 HydrophobicContact CD1-CG 4.36Å; F333-L358 HydrophobicContact CE1-CD2 3.8Å; F333-L358 HydrophobicContact CE1-CG 4.09Å; F333-I361 HydrophobicContact CB-CD1 4.29Å; F333-I361 HydrophobicContact CD1-CD1 3.93Å; F333-I361 HydrophobicContact CD2-CD1 3.49Å; F333-I361 VanDerWaalsContact CD2-CD1 3.49Å; F333-I361 HydrophobicContact CE1-CD1 4.06Å; F333-I361 HydrophobicContact CE2-CD1 3.66Å; F333-I361 HydrophobicContact CG-CD1 3.63Å; F333-I361 HydrophobicContact CZ-CD1 3.95Å
334	E	88.3	Confident	87.1	Confident	30 Å²	30	55.7 Å²	55.7	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-37.3	176.9	-73.6	-178.3	172.6	0	0	112.4	I330 L337 K338 L358 R362 N386	I330-E334 HydrophobicContact CG2-CG 4.35Å; I330-E334 WeakPolarHBondContact O-CG 3.37Å; I330-E334 PolarHBondContact O-N 2.93Å; E334-L337 PolarHBondContact O-N 3.1Å; E334-K338 WeakPolarHBondContact O-CG 3.19Å; E334-K338 PolarHBondContact O-N 3.47Å; E334-L358 HydrophobicContact CG-CD2 4.18Å; E334-R362 IonicContact OE1-CZ 4Å; E334-R362 IonicContact OE1-NH2 2.91Å; E334-R362 PolarHBondContact OE1-NH2 3.31Å; E334-N386 PolarHBondContact OE2-ND2 2.96Å
335	K	91.6	Very high	86.8	Confident	112 Å²	112	57.3 Å²	57.3	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-41.3	176.1	176.4	-172.8	159.8	-144.9	0	111.9	T331 E332 F333 K338 T339	T331-K335 VanDerWaalsContact O-CB 3.25Å; T331-K335 WeakPolarHBondContact O-CB 3.25Å; T331-K335 PolarHBondContact O-N 3.43Å; E332-K335 VanDerWaalsContact CD-NZ 3.3Å; E332-K335 PolarHBondContact O-N 2.92Å; E332-K335 IonicContact OE1-NZ 2.82Å; E332-K335 PolarHBondContact OE1-NZ 2.89Å; E332-K335 WeakPolarHBondContact OE2-CD 3.36Å; E332-K335 IonicContact OE2-NZ 3.92Å; E332-K335 PolarHBondContact OE2-NZ 3.08Å; F333-K335 VanDerWaalsContact C-N 3.34Å; F333-K335 PolarHBondContact O-N 2.66Å; K335-K338 PolarHBondContact O-N 2.94Å; K335-T339 WeakPolarHBondContact O-CB 3.49Å; K335-T339 PolarHBondContact O-N 3.42Å; K335-T339 PolarHBondContact O-OG1 3.46Å
336	I	90.9	Very high	86.8	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-43	176.3	-66.7	158	0	0	0	110.4	N320 L321 A324 E332 F333 K338 T339 N340	N320-I336 HydrophobicContact CB-CD1 3.72Å; N320-I336 HydrophobicContact CB-CG1 4.2Å; N320-I336 HydrophobicContact CB-CG2 4.31Å; N320-I336 VanDerWaalsContact O-CD1 3.32Å; N320-I336 WeakPolarHBondContact O-CD1 2.94Å; L321-I336 HydrophobicContact CD2-CB 3.97Å; L321-I336 HydrophobicContact CD2-CG2 3.68Å; L321-I336 HydrophobicContact CG-CG2 3.75Å; A324-I336 HydrophobicContact CB-CD1 3.95Å; E332-I336 HydrophobicContact CG-CD1 3.93Å; E332-I336 HydrophobicContact CG-CG1 4.41Å; E332-I336 WeakPolarHBondContact O-CD1 3.49Å; E332-I336 WeakPolarHBondContact O-CG1 3.4Å; E332-I336 PolarHBondContact O-N 3.27Å; F333-I336 PolarHBondContact O-N 3.22Å; I336-K338 PolarHBondContact O-N 2.96Å; I336-T339 PolarHBondContact O-N 2.88Å; I336-N340 PolarHBondContact O-N 2.88Å; I336-N340 PolarHBondContact O-ND2 3.24Å
337	L	87.4	Confident	86.9	Confident	12 Å²	12	60.5 Å²	60.5	6%	0.063	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-41.3	175.4	-71.9	177.1	0	0	0	112.7	L321 F333 E334 H341 I344 I354 L358	L321-L337 HydrophobicContact CD1-CD2 4.27Å; L321-L337 HydrophobicContact CD2-CD2 4.09Å; L321-L337 HydrophobicContact CD2-CG 4.11Å; F333-L337 HydrophobicContact CD1-CD1 3.87Å; F333-L337 HydrophobicContact CD1-CG 4.38Å; F333-L337 HydrophobicContact CE1-CD1 3.66Å; F333-L337 HydrophobicContact CE1-CG 4.27Å; F333-L337 WeakPolarHBondContact O-CG 3.32Å; F333-L337 PolarHBondContact O-N 3.22Å; F333-L337 VanDerWaalsContact O-N 3.11Å; E334-L337 PolarHBondContact O-N 3.1Å; L337-H341 WeakPolarHBondContact O-CA 3.22Å; L337-H341 PolarHBondContact O-N 3.32Å; L337-I344 HydrophobicContact CD2-CD1 4.16Å; L337-I344 HydrophobicContact CD2-CG2 3.91Å; L337-I354 HydrophobicContact CD1-CD1 4.31Å; L337-I354 HydrophobicContact CD1-CG1 3.92Å; L337-I354 HydrophobicContact CD2-CD1 3.93Å; L337-I354 HydrophobicContact CD2-CG1 4.03Å; L337-L358 HydrophobicContact CD1-CD1 4.47Å
338	K	88.2	Confident	86.8	Confident	162 Å²	162	58.7 Å²	58.7	70%	0.704	31%	0.31	S	S	*	.	H	α-helix	trans	-67.5	-40.8	176	-74.6	176.6	-178	172.5	0	112.5	E334 K335 I336	E334-K338 WeakPolarHBondContact O-CG 3.19Å; E334-K338 PolarHBondContact O-N 3.47Å; K335-K338 PolarHBondContact O-N 2.94Å; I336-K338 PolarHBondContact O-N 2.96Å
339	T	89.8	Confident	86.8	Confident	102 Å²	102	57.5 Å²	57.5	63%	0.626	30%	0.303	S	S	*	.	H	α-helix	trans	-72.4	-40.7	-176.5	-53.7	0	0	0	0	111.8	K335 I336	K335-T339 WeakPolarHBondContact O-CB 3.49Å; K335-T339 PolarHBondContact O-N 3.42Å; K335-T339 PolarHBondContact O-OG1 3.46Å; I336-T339 PolarHBondContact O-N 2.88Å
340	N	87.3	Confident	86.9	Confident	40 Å²	40	54.7 Å²	54.7	21%	0.214	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	35.8	-175.7	-58.4	-79.6	0	0	0	112	A317 I336 S342 N343 I344	A317-N340 HydrophobicContact CB-CB 3.75Å; I336-N340 PolarHBondContact O-N 2.88Å; I336-N340 PolarHBondContact O-ND2 3.24Å; N340-S342 VanDerWaalsContact C-N 3.33Å; N340-S342 PolarHBondContact O-N 3.4Å; N340-N343 PolarHBondContact O-N 3.08Å; N340-N343 VanDerWaalsContact O-N 3.12Å; N340-I344 HydrophobicContact CB-CD1 4.02Å; N340-I344 PolarHBondContact O-N 3.31Å
341	H	82.9	Confident	87	Confident	104 Å²	104	61 Å²	61	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-55.4	-45.5	-172.3	-174.6	-74.2	0	0	0	112.5	L337 N343 I344 M345	L337-H341 WeakPolarHBondContact O-CA 3.22Å; L337-H341 PolarHBondContact O-N 3.32Å; H341-N343 VanDerWaalsContact C-N 3.33Å; H341-N343 PolarHBondContact O-N 3.09Å; H341-I344 PolarHBondContact O-N 2.84Å; H341-M345 VanDerWaalsContact O-CB 3.29Å; H341-M345 WeakPolarHBondContact O-CB 3.35Å; H341-M345 PolarHBondContact O-N 3.08Å
342	S	83.3	Confident	87.1	Confident	67 Å²	67	62.2 Å²	62.2	47%	0.469	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-39.8	179.2	56.6	0	0	0	0	112.8	N340 I344 D346	N340-S342 VanDerWaalsContact C-N 3.33Å; N340-S342 PolarHBondContact O-N 3.4Å; S342-I344 VanDerWaalsContact C-N 3.3Å; S342-I344 PolarHBondContact O-N 2.9Å; S342-D346 VanDerWaalsContact O-CB 3.22Å; S342-D346 WeakPolarHBondContact O-CB 3.24Å
343	N	81.3	Confident	87	Confident	58 Å²	58	59.3 Å²	59.3	31%	0.31	30%	0.297	S	S	.	.	H	α-helix	trans	-77	-19	-172.2	-64.7	-11.9	0	0	0	113.4	K285 N340 H341	K285-N343 PolarHBondContact NZ-O 3.33Å; K285-N343 VanDerWaalsContact NZ-O 3.16Å; N340-N343 PolarHBondContact O-N 3.08Å; N340-N343 VanDerWaalsContact O-N 3.12Å; H341-N343 VanDerWaalsContact C-N 3.33Å; H341-N343 PolarHBondContact O-N 3.09Å
344	I	82.7	Confident	86.9	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-115.4	-48.4	-172.2	-62.7	160.9	0	0	0	111.5	A317 M318 L321 L337 N340 H341 S342 I350	A317-I344 HydrophobicContact CB-CD1 4.08Å; A317-I344 HydrophobicContact CB-CG1 4.5Å; M318-I344 HydrophobicContact SD-CG1 4.37Å; L321-I344 HydrophobicContact CD1-CD1 3.65Å; L321-I344 HydrophobicContact CD1-CG1 4.41Å; L321-I344 HydrophobicContact CG-CD1 4.41Å; L337-I344 HydrophobicContact CD2-CD1 4.16Å; L337-I344 HydrophobicContact CD2-CG2 3.91Å; N340-I344 HydrophobicContact CB-CD1 4.02Å; N340-I344 PolarHBondContact O-N 3.31Å; H341-I344 PolarHBondContact O-N 2.84Å; S342-I344 VanDerWaalsContact C-N 3.3Å; S342-I344 PolarHBondContact O-N 2.9Å; I344-I350 HydrophobicContact CG2-CG2 3.97Å
345	M	83.2	Confident	86.8	Confident	38 Å²	38	62.5 Å²	62.5	19%	0.187	31%	0.312	C	S	.	.	H	α-helix	trans	-84.5	-16.5	-171.8	-63.9	-63.8	-154.3	0	0	113.9	H341 D347 R351 I354	H341-M345 VanDerWaalsContact O-CB 3.29Å; H341-M345 WeakPolarHBondContact O-CB 3.35Å; H341-M345 PolarHBondContact O-N 3.08Å; M345-D347 PolarHBondContact O-N 2.84Å; M345-R351 HydrophobicContact SD-CG 4.25Å; M345-I354 HydrophobicContact CE-CG2 4.29Å; M345-I354 HydrophobicContact SD-CG2 4.39Å
346	D	87.1	Confident	86.6	Confident	118 Å²	118	60.2 Å²	60.2	63%	0.631	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.8	175.3	-67.6	-6.2	0	0	0	111.2	S342 P348	S342-D346 VanDerWaalsContact O-CB 3.22Å; S342-D346 WeakPolarHBondContact O-CB 3.24Å; D346-P348 WeakPolarHBondContact O-CD 3.32Å
347	D	86.9	Confident	86.4	Confident	28 Å²	28	59.9 Å²	59.9	15%	0.15	30%	0.302	C	S	.	.	S	Bend	trans	-79.8	113.3	172.1	-170.4	-46.5	0	0	0	110.3	Y286 M345 F349 I350 R351	Y286-D347 VanDerWaalsContact CE1-OD2 3.25Å; Y286-D347 WeakPolarHBondContact CE1-OD2 3.09Å; Y286-D347 PolarHBondContact OH-OD2 3.37Å; M345-D347 PolarHBondContact O-N 2.84Å; D347-F349 VanDerWaalsContact C-N 3.26Å; D347-F349 PolarHBondContact O-N 2.83Å; D347-F349 WeakPolarHBondContact OD1-CA 3.32Å; D347-F349 WeakPolarHBondContact OD1-CB 3.48Å; D347-F349 PolarHBondContact OD1-N 2.83Å; D347-I350 HydrophobicContact CB-CB 4.23Å; D347-I350 HydrophobicContact CB-CD1 3.91Å; D347-I350 HydrophobicContact CB-CG1 3.96Å; D347-I350 PolarHBondContact O-N 2.87Å; D347-I350 PolarHBondContact OD1-N 3.31Å; D347-R351 WeakPolarHBondContact O-CB 2.88Å; D347-R351 PolarHBondContact O-N 2.66Å; D347-R351 VanDerWaalsContact O-N 3.13Å
348	P	85.9	Confident	86.4	Confident	83 Å²	83	60.1 Å²	60.1	54%	0.539	30%	0.303	S	S	.	.	H	α-helix	trans	-66.6	-27.3	-177.6	28.2	-35.1	0	0	0	113.1	D346 E352	D346-P348 WeakPolarHBondContact O-CD 3.32Å; P348-E352 PolarHBondContact O-N 3.2Å
349	F	86.4	Confident	86.3	Confident	14 Å²	14	57.7 Å²	57.7	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-73	-43.4	179.2	179.6	-97.9	0	0	0	110.8	K250 L253 F265 Y286 L289 D347 E352 H353	K250-F349 HydrophobicContact CB-CE2 3.87Å; K250-F349 HydrophobicContact CB-CZ 4Å; K250-F349 HydrophobicContact CG-CD2 4.3Å; K250-F349 HydrophobicContact CG-CE1 4.1Å; K250-F349 HydrophobicContact CG-CE2 3.79Å; K250-F349 HydrophobicContact CG-CZ 3.68Å; L253-F349 HydrophobicContact CB-CZ 3.98Å; L253-F349 HydrophobicContact CD2-CE1 3.61Å; L253-F349 HydrophobicContact CD2-CE2 4.41Å; L253-F349 HydrophobicContact CD2-CZ 3.39Å; L253-F349 HydrophobicContact CG-CZ 4.31Å; F265-F349 HydrophobicContact CZ-CE1 4.21Å; F265-F349 HydrophobicContact CZ-CZ 4.28Å; Y286-F349 AromaticContact CD1-CD1 3.61Å; Y286-F349 HydrophobicContact CD1-CD1 3.61Å; Y286-F349 AromaticContact CD1-CE1 3.91Å; Y286-F349 HydrophobicContact CD1-CE1 3.91Å; Y286-F349 HydrophobicContact CE1-CB 4.41Å; Y286-F349 AromaticContact CE1-CD1 3.53Å; Y286-F349 HydrophobicContact CE1-CD1 3.53Å; Y286-F349 HydrophobicContact CE1-CE1 4.27Å; Y286-F349 HydrophobicContact CE1-CG 4.37Å; Y286-F349 HydrophobicContact CG-CD1 4.35Å; Y286-F349 HydrophobicContact CG-CE1 4.29Å; L289-F349 HydrophobicContact CD2-CE1 4.41Å; D347-F349 VanDerWaalsContact C-N 3.26Å; D347-F349 PolarHBondContact O-N 2.83Å; D347-F349 WeakPolarHBondContact OD1-CA 3.32Å; D347-F349 WeakPolarHBondContact OD1-CB 3.48Å; D347-F349 PolarHBondContact OD1-N 2.83Å; F349-E352 PolarHBondContact O-N 3.38Å; F349-H353 PolarHBondContact O-CD2 3.49Å
350	I	88.3	Confident	86.2	Confident	2 Å²	2	54 Å²	54	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-65.3	-42.9	176.5	-58	178.5	0	0	0	110.6	K285 Y286 L289 I344 D347 E352 H353 I354	K285-I350 HydrophobicContact CB-CD1 3.89Å; K285-I350 HydrophobicContact CD-CD1 4.23Å; Y286-I350 HydrophobicContact CD1-CD1 4.36Å; Y286-I350 HydrophobicContact CD1-CG1 4.03Å; Y286-I350 HydrophobicContact CE1-CD1 4.19Å; Y286-I350 HydrophobicContact CE1-CG1 3.85Å; L289-I350 HydrophobicContact CD2-CB 4.46Å; L289-I350 HydrophobicContact CD2-CG1 4.33Å; L289-I350 HydrophobicContact CD2-CG2 4.36Å; I344-I350 HydrophobicContact CG2-CG2 3.97Å; D347-I350 HydrophobicContact CB-CB 4.23Å; D347-I350 HydrophobicContact CB-CD1 3.91Å; D347-I350 HydrophobicContact CB-CG1 3.96Å; D347-I350 PolarHBondContact O-N 2.87Å; D347-I350 PolarHBondContact OD1-N 3.31Å; I350-E352 VanDerWaalsContact C-N 3.26Å; I350-E352 PolarHBondContact O-N 3.07Å; I350-H353 PolarHBondContact O-N 3.23Å; I350-H353 VanDerWaalsContact O-N 3.12Å; I350-I354 PolarHBondContact O-N 2.8Å; I350-I354 VanDerWaalsContact O-N 3.1Å
351	R	88.9	Confident	86.2	Confident	143 Å²	143	52.1 Å²	52.1	54%	0.54	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-32.3	179.7	-175.8	178.3	59.7	-169.2	-6.5	113.4	M345 D347 H353 I354	M345-R351 HydrophobicContact SD-CG 4.25Å; D347-R351 WeakPolarHBondContact O-CB 2.88Å; D347-R351 PolarHBondContact O-N 2.66Å; D347-R351 VanDerWaalsContact O-N 3.13Å; R351-H353 VanDerWaalsContact C-N 3.28Å; R351-H353 PolarHBondContact O-N 3.01Å; R351-I354 WeakPolarHBondContact O-CG2 2.99Å
352	E	88.5	Confident	86.5	Confident	114 Å²	114	48.7 Å²	48.7	53%	0.533	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-35.2	177.5	-170.7	174.7	172.2	0	0	111.9	P348 F349 I350	P348-E352 PolarHBondContact O-N 3.2Å; F349-E352 PolarHBondContact O-N 3.38Å; I350-E352 VanDerWaalsContact C-N 3.26Å; I350-E352 PolarHBondContact O-N 3.07Å
353	H	88.9	Confident	86.7	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-99.4	-10.1	-174.6	-65.4	-72.7	0	0	0	114.3	L289 L293 F349 I350 R351 E355 E356 L357	L289-H353 HydrophobicContact CD1-CB 4.2Å; L289-H353 HydrophobicContact CD2-CB 4.13Å; L293-H353 HydrophobicContact CD1-CB 4.15Å; F349-H353 PolarHBondContact O-CD2 3.49Å; I350-H353 PolarHBondContact O-N 3.23Å; I350-H353 VanDerWaalsContact O-N 3.12Å; R351-H353 VanDerWaalsContact C-N 3.28Å; R351-H353 PolarHBondContact O-N 3.01Å; H353-E355 VanDerWaalsContact C-N 3.3Å; H353-E355 PolarHBondContact O-N 2.86Å; H353-E356 IonicContact ND1-OE2 3.93Å; H353-E356 WeakPolarHBondContact O-CB 3.28Å; H353-E356 PolarHBondContact O-N 2.91Å; H353-L357 PolarHBondContact O-N 3.28Å; H353-L357 VanDerWaalsContact O-N 3.12Å
354	I	87.6	Confident	87	Confident	11 Å²	11	48.1 Å²	48.1	6%	0.056	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-33.9	-177	-158.7	64	0	0	0	112.8	F333 L337 M345 I350 R351 L357 L358	F333-I354 HydrophobicContact CE1-CD1 4.18Å; F333-I354 HydrophobicContact CZ-CD1 4.09Å; L337-I354 HydrophobicContact CD1-CD1 4.31Å; L337-I354 HydrophobicContact CD1-CG1 3.92Å; L337-I354 HydrophobicContact CD2-CD1 3.93Å; L337-I354 HydrophobicContact CD2-CG1 4.03Å; M345-I354 HydrophobicContact CE-CG2 4.29Å; M345-I354 HydrophobicContact SD-CG2 4.39Å; I350-I354 PolarHBondContact O-N 2.8Å; I350-I354 VanDerWaalsContact O-N 3.1Å; R351-I354 WeakPolarHBondContact O-CG2 2.99Å; I354-L357 HydrophobicContact CD1-CD2 4.34Å; I354-L357 WeakPolarHBondContact O-CB 3.25Å; I354-L357 PolarHBondContact O-N 3.23Å; I354-L358 PolarHBondContact O-N 3.32Å
355	E	85.6	Confident	87.3	Confident	87 Å²	87	49.3 Å²	49.3	41%	0.407	24%	0.235	S	C	.	.	H	α-helix	trans	-68.8	-36.4	178.5	-171.8	57.9	-135.3	0	0	111.6	H353 L357 R359	H353-E355 VanDerWaalsContact C-N 3.3Å; H353-E355 PolarHBondContact O-N 2.86Å; E355-L357 VanDerWaalsContact C-N 3.31Å; E355-R359 WeakPolarHBondContact O-CG 3.24Å; E355-R359 PolarHBondContact O-N 2.65Å; E355-R359 VanDerWaalsContact O-N 3.08Å; E355-R359 PolarHBondContact O-NE 3.39Å
356	E	87.4	Confident	87.6	Confident	64 Å²	64	47.5 Å²	47.5	30%	0.299	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-39.2	171.9	-171.1	175.3	-178.1	0	0	111.2	F258 L293 H353 R359 N360	F258-E356 WeakPolarHBondContact CZ-OE1 3.41Å; L293-E356 HydrophobicContact CD2-CB 4.39Å; L293-E356 HydrophobicContact CD2-CG 4.15Å; H353-E356 IonicContact ND1-OE2 3.93Å; H353-E356 WeakPolarHBondContact O-CB 3.28Å; H353-E356 PolarHBondContact O-N 2.91Å; E356-R359 PolarHBondContact O-N 3.16Å; E356-N360 PolarHBondContact O-N 3.43Å; E356-N360 PolarHBondContact O-ND2 3.29Å
357	L	87	Confident	87.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-46.1	176.8	-138.1	67	0	0	0	112.5	L289 M292 L293 Y325 F333 H353 I354 E355 R359 N360 I361	L289-L357 HydrophobicContact CD1-CD2 4.21Å; M292-L357 HydrophobicContact CB-CD1 3.75Å; M292-L357 HydrophobicContact CB-CD2 3.82Å; M292-L357 HydrophobicContact CB-CG 4.2Å; M292-L357 HydrophobicContact CE-CD2 3.55Å; M292-L357 HydrophobicContact CG-CD2 4.43Å; M292-L357 HydrophobicContact SD-CD2 3.81Å; L293-L357 HydrophobicContact CB-CD1 4.39Å; L293-L357 HydrophobicContact CD2-CD1 3.47Å; L293-L357 VanDerWaalsContact CD2-CD1 3.47Å; L293-L357 HydrophobicContact CG-CD1 3.59Å; Y325-L357 HydrophobicContact CD2-CG 4.27Å; Y325-L357 HydrophobicContact CE2-CD1 4.28Å; Y325-L357 HydrophobicContact CE2-CG 4.04Å; F333-L357 HydrophobicContact CE2-CD2 4.39Å; F333-L357 HydrophobicContact CZ-CD2 3.86Å; F333-L357 HydrophobicContact CZ-CG 4.45Å; H353-L357 PolarHBondContact O-N 3.28Å; H353-L357 VanDerWaalsContact O-N 3.12Å; I354-L357 HydrophobicContact CD1-CD2 4.34Å; I354-L357 WeakPolarHBondContact O-CB 3.25Å; I354-L357 PolarHBondContact O-N 3.23Å; E355-L357 VanDerWaalsContact C-N 3.31Å; L357-R359 VanDerWaalsContact C-N 3.32Å; L357-R359 PolarHBondContact O-N 2.71Å; L357-N360 WeakPolarHBondContact O-CB 3.49Å; L357-N360 PolarHBondContact O-N 3.07Å; L357-N360 VanDerWaalsContact O-N 3.17Å; L357-I361 WeakPolarHBondContact O-CG1 3.48Å; L357-I361 PolarHBondContact O-N 2.94Å
358	L	87.3	Confident	87.7	Confident	16 Å²	16	51.3 Å²	51.3	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-58.9	-43.9	174.9	-80.8	170.4	0	0	0	111.6	F333 E334 L337 I354 N360 I361 R362	F333-L358 HydrophobicContact CD1-CD2 3.56Å; F333-L358 HydrophobicContact CD1-CG 4.36Å; F333-L358 HydrophobicContact CE1-CD2 3.8Å; F333-L358 HydrophobicContact CE1-CG 4.09Å; E334-L358 HydrophobicContact CG-CD2 4.18Å; L337-L358 HydrophobicContact CD1-CD1 4.47Å; I354-L358 PolarHBondContact O-N 3.32Å; L358-N360 VanDerWaalsContact C-N 3.33Å; L358-N360 PolarHBondContact O-N 3.23Å; L358-I361 PolarHBondContact O-N 3.42Å; L358-R362 WeakPolarHBondContact O-CB 3.45Å; L358-R362 VanDerWaalsContact O-CG 3.23Å; L358-R362 WeakPolarHBondContact O-CG 3.41Å; L358-R362 PolarHBondContact O-N 2.9Å
359	R	86.9	Confident	88	Confident	112 Å²	112	48.7 Å²	48.7	42%	0.423	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-40	175.4	-75.2	-178.4	-73.7	-159.4	2.2	112.3	E355 E356 L357 R362 T363	E355-R359 WeakPolarHBondContact O-CG 3.24Å; E355-R359 PolarHBondContact O-N 2.65Å; E355-R359 VanDerWaalsContact O-N 3.08Å; E355-R359 PolarHBondContact O-NE 3.39Å; E356-R359 PolarHBondContact O-N 3.16Å; L357-R359 VanDerWaalsContact C-N 3.32Å; L357-R359 PolarHBondContact O-N 2.71Å; R359-R362 PolarHBondContact O-N 2.89Å; R359-T363 WeakPolarHBondContact O-CB 3.42Å; R359-T363 PolarHBondContact O-N 3.11Å; R359-T363 PolarHBondContact O-OG1 3.44Å
360	N	87	Confident	88.2	Confident	23 Å²	23	48.6 Å²	48.6	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-47.6	176.6	-78.7	-37.7	0	0	0	112.3	K295 E356 L357 L358 T363 Q364	K295-N360 WeakPolarHBondContact CE-OD1 3.49Å; K295-N360 PolarHBondContact NZ-OD1 3.11Å; K295-N360 VanDerWaalsContact NZ-OD1 3.13Å; E356-N360 PolarHBondContact O-N 3.43Å; E356-N360 PolarHBondContact O-ND2 3.29Å; L357-N360 WeakPolarHBondContact O-CB 3.49Å; L357-N360 PolarHBondContact O-N 3.07Å; L357-N360 VanDerWaalsContact O-N 3.17Å; L358-N360 VanDerWaalsContact C-N 3.33Å; L358-N360 PolarHBondContact O-N 3.23Å; N360-T363 WeakPolarHBondContact O-CB 3.36Å; N360-T363 PolarHBondContact O-N 3.14Å; N360-Q364 PolarHBondContact O-N 3.46Å
361	I	87.3	Confident	88.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-48.4	176.8	-57.8	169.2	0	0	0	110.1	Y325 I330 F333 L357 L358 T363 Q364 V365	Y325-I361 HydrophobicContact CD2-CD1 3.56Å; Y325-I361 HydrophobicContact CD2-CG1 3.3Å; Y325-I361 HydrophobicContact CE2-CD1 4.11Å; Y325-I361 HydrophobicContact CE2-CG1 3.4Å; Y325-I361 HydrophobicContact CG-CG1 4.33Å; I330-I361 HydrophobicContact CG1-CG2 3.72Å; F333-I361 HydrophobicContact CB-CD1 4.29Å; F333-I361 HydrophobicContact CD1-CD1 3.93Å; F333-I361 HydrophobicContact CD2-CD1 3.49Å; F333-I361 VanDerWaalsContact CD2-CD1 3.49Å; F333-I361 HydrophobicContact CE1-CD1 4.06Å; F333-I361 HydrophobicContact CE2-CD1 3.66Å; F333-I361 HydrophobicContact CG-CD1 3.63Å; F333-I361 HydrophobicContact CZ-CD1 3.95Å; L357-I361 WeakPolarHBondContact O-CG1 3.48Å; L357-I361 PolarHBondContact O-N 2.94Å; L358-I361 PolarHBondContact O-N 3.42Å; I361-T363 VanDerWaalsContact C-N 3.27Å; I361-T363 PolarHBondContact O-N 3.05Å; I361-Q364 PolarHBondContact O-N 3.29Å; I361-V365 HydrophobicContact CG2-CG2 4.18Å; I361-V365 WeakPolarHBondContact O-CG2 3.42Å; I361-V365 PolarHBondContact O-N 3.11Å
362	R	88.4	Confident	88.3	Confident	32 Å²	32	54.8 Å²	54.8	12%	0.121	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-41.3	179.5	-73.3	169.5	-179.7	164.4	2	111.5	I330 E334 L358 R359 Q364 L366 L395	I330-R362 HydrophobicContact CD1-CG 3.96Å; I330-R362 HydrophobicContact CG1-CG 4.37Å; E334-R362 IonicContact OE1-CZ 4Å; E334-R362 IonicContact OE1-NH2 2.91Å; E334-R362 PolarHBondContact OE1-NH2 3.31Å; L358-R362 WeakPolarHBondContact O-CB 3.45Å; L358-R362 VanDerWaalsContact O-CG 3.23Å; L358-R362 WeakPolarHBondContact O-CG 3.41Å; L358-R362 PolarHBondContact O-N 2.9Å; R359-R362 PolarHBondContact O-N 2.89Å; R362-Q364 PolarHBondContact O-N 2.69Å; R362-L366 WeakPolarHBondContact O-CB 3.42Å; R362-L366 PolarHBondContact O-N 3.5Å; R362-L395 HydrophobicContact CB-CD2 3.98Å
363	T	88.6	Confident	88.5	Confident	23 Å²	23	53.7 Å²	53.7	14%	0.141	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-44.8	174.9	-57.8	0	0	0	0	111.4	R359 N360 I361 L366 I367	R359-T363 WeakPolarHBondContact O-CB 3.42Å; R359-T363 PolarHBondContact O-N 3.11Å; R359-T363 PolarHBondContact O-OG1 3.44Å; N360-T363 WeakPolarHBondContact O-CB 3.36Å; N360-T363 PolarHBondContact O-N 3.14Å; I361-T363 VanDerWaalsContact C-N 3.27Å; I361-T363 PolarHBondContact O-N 3.05Å; T363-L366 PolarHBondContact O-N 3.28Å; T363-I367 HydrophobicContact CG2-CD1 3.97Å; T363-I367 VanDerWaalsContact O-CG1 3.28Å; T363-I367 WeakPolarHBondContact O-CG1 3.41Å; T363-I367 PolarHBondContact O-N 2.93Å
364	Q	86.3	Confident	88.5	Confident	91 Å²	91	57.2 Å²	57.2	43%	0.425	28%	0.275	S	S	.	.	H	α-helix	trans	-69	-41.7	-178.4	-167.9	160	-2.9	0	0	112.6	N328 N360 I361 R362 I367 K368	N328-Q364 WeakPolarHBondContact OD1-CG 3.45Å; N328-Q364 PolarHBondContact OD1-NE2 2.87Å; N328-Q364 PolarHBondContact OD1-OE1 3.04Å; N360-Q364 PolarHBondContact O-N 3.46Å; I361-Q364 PolarHBondContact O-N 3.29Å; R362-Q364 PolarHBondContact O-N 2.69Å; Q364-I367 PolarHBondContact O-N 3.01Å; Q364-K368 PolarHBondContact O-N 2.93Å
365	V	88.9	Confident	88.8	Confident	26 Å²	26	63.9 Å²	63.9	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-44.1	173.2	176.7	0	0	0	0	110.6	N328 I330 I361 I367 K368 L369 L385	N328-V365 HydrophobicContact CB-CG2 3.8Å; N328-V365 WeakPolarHBondContact O-CG2 3.24Å; I330-V365 HydrophobicContact CD1-CB 3.97Å; I330-V365 HydrophobicContact CD1-CG1 4.04Å; I330-V365 HydrophobicContact CD1-CG2 3.88Å; I330-V365 HydrophobicContact CG1-CG2 4.04Å; I361-V365 HydrophobicContact CG2-CG2 4.18Å; I361-V365 WeakPolarHBondContact O-CG2 3.42Å; I361-V365 PolarHBondContact O-N 3.11Å; V365-I367 PolarHBondContact O-N 3.41Å; V365-K368 PolarHBondContact O-N 3.36Å; V365-L369 VanDerWaalsContact O-CB 3.3Å; V365-L369 WeakPolarHBondContact O-CB 3.36Å; V365-L369 PolarHBondContact O-N 3.31Å; V365-L385 HydrophobicContact CB-CD2 3.96Å; V365-L385 HydrophobicContact CG1-CD2 3.63Å
366	L	90.5	Very high	89.2	Confident	0 Å²	0	60 Å²	60	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.1	-48.7	177.7	177.6	62.6	0	0	0	111.7	R362 T363 K368 L369 I370 I381 L385 L395 L396 I405	R362-L366 WeakPolarHBondContact O-CB 3.42Å; R362-L366 PolarHBondContact O-N 3.5Å; T363-L366 PolarHBondContact O-N 3.28Å; L366-K368 VanDerWaalsContact C-N 3.26Å; L366-K368 PolarHBondContact O-N 3.45Å; L366-L369 PolarHBondContact O-N 3.32Å; L366-L369 VanDerWaalsContact O-N 3.12Å; L366-I370 HydrophobicContact CD1-CG2 3.76Å; L366-I370 HydrophobicContact CG-CG2 4.4Å; L366-I370 WeakPolarHBondContact O-CG1 3.24Å; L366-I370 WeakPolarHBondContact O-CG2 3.2Å; L366-I370 PolarHBondContact O-N 2.9Å; L366-I381 HydrophobicContact CD1-CD1 4.15Å; L366-I381 HydrophobicContact CD1-CG1 4.46Å; L366-I381 HydrophobicContact CD1-CG2 3.56Å; L366-L385 HydrophobicContact CB-CD1 4.3Å; L366-L385 HydrophobicContact CD1-CD1 4.3Å; L366-L395 HydrophobicContact CD2-CD2 4.1Å; L366-L395 HydrophobicContact CD2-CG 4.32Å; L366-L396 HydrophobicContact CD1-CD2 4.36Å; L366-L396 HydrophobicContact CD2-CD2 3.83Å; L366-L396 HydrophobicContact CD2-CG 4.42Å; L366-I405 HydrophobicContact CD2-CD1 3.63Å; L366-I405 HydrophobicContact CG-CD1 3.91Å
367	I	88.6	Confident	89.5	Confident	71 Å²	71	62.6 Å²	62.6	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-58.7	-40.2	178.1	-69.6	164	0	0	0	111.2	T363 Q364 V365 I370 I405	T363-I367 HydrophobicContact CG2-CD1 3.97Å; T363-I367 VanDerWaalsContact O-CG1 3.28Å; T363-I367 WeakPolarHBondContact O-CG1 3.41Å; T363-I367 PolarHBondContact O-N 2.93Å; Q364-I367 PolarHBondContact O-N 3.01Å; V365-I367 PolarHBondContact O-N 3.41Å; I367-I370 WeakPolarHBondContact O-CG1 3.47Å; I367-I405 HydrophobicContact CG1-CG1 4.17Å
368	K	88.4	Confident	89.9	Confident	156 Å²	156	62.6 Å²	62.6	68%	0.678	29%	0.293	S	S	*	.	H	α-helix	trans	-69.6	-38.8	177.1	-169.6	177.9	178.3	-176	0	111.7	Q364 V365 L366	Q364-K368 PolarHBondContact O-N 2.93Å; V365-K368 PolarHBondContact O-N 3.36Å; L366-K368 VanDerWaalsContact C-N 3.26Å; L366-K368 PolarHBondContact O-N 3.45Å
369	L	90.7	Very high	90.2	Very high	28 Å²	28	64.4 Å²	64.4	15%	0.147	31%	0.306	C	S	.	.	H	α-helix	trans	-68.5	-41	-178.1	-176.9	65.5	0	0	0	112.5	V365 L366 P372 Y373 F380 I381 E384	V365-L369 VanDerWaalsContact O-CB 3.3Å; V365-L369 WeakPolarHBondContact O-CB 3.36Å; V365-L369 PolarHBondContact O-N 3.31Å; L366-L369 PolarHBondContact O-N 3.32Å; L366-L369 VanDerWaalsContact O-N 3.12Å; L369-P372 VanDerWaalsContact O-CD 3.31Å; L369-P372 WeakPolarHBondContact O-CD 3.36Å; L369-Y373 WeakPolarHBondContact O-CD2 3.3Å; L369-Y373 WeakPolarHBondContact O-CE2 3.27Å; L369-F380 HydrophobicContact CD1-CE1 4.39Å; L369-I381 HydrophobicContact CD2-CG1 4.43Å; L369-E384 HydrophobicContact CD1-CG 3.94Å; L369-E384 HydrophobicContact CD2-CB 3.83Å; L369-E384 HydrophobicContact CD2-CG 3.78Å
370	I	90.6	Very high	90.6	Very high	11 Å²	11	63.1 Å²	63.1	6%	0.056	30%	0.304	C	S	.	.	H	α-helix	trans	-78.3	-22	-175.6	66.2	-175.8	0	0	0	113.2	L366 I367 P372 Y373 I376 I381 I405 L416 L418	L366-I370 HydrophobicContact CD1-CG2 3.76Å; L366-I370 HydrophobicContact CG-CG2 4.4Å; L366-I370 WeakPolarHBondContact O-CG1 3.24Å; L366-I370 WeakPolarHBondContact O-CG2 3.2Å; L366-I370 PolarHBondContact O-N 2.9Å; I367-I370 WeakPolarHBondContact O-CG1 3.47Å; I370-P372 VanDerWaalsContact C-CD 3.47Å; I370-Y373 PolarHBondContact O-N 2.9Å; I370-I376 HydrophobicContact CG2-CD1 4.4Å; I370-I376 HydrophobicContact CG2-CG2 4.41Å; I370-I381 HydrophobicContact CG2-CD1 4.45Å; I370-I405 HydrophobicContact CD1-CB 4.39Å; I370-I405 HydrophobicContact CD1-CD1 3.73Å; I370-I405 HydrophobicContact CD1-CG1 3.77Å; I370-I405 HydrophobicContact CD1-CG2 3.8Å; I370-L416 HydrophobicContact CG2-CD2 4.08Å; I370-L418 HydrophobicContact CB-CD1 4.14Å; I370-L418 HydrophobicContact CD1-CD2 4.18Å; I370-L418 WeakPolarHBondContact O-CD1 3.34Å
371	K	88.8	Confident	90.8	Very high	174 Å²	174	62 Å²	62	76%	0.757	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-40.6	-174	-166.6	175.4	-176.3	177.2	0	116	Y373	K371-Y373 VanDerWaalsContact C-N 3.34Å
372	P	92.1	Very high	91.1	Very high	102 Å²	102	62.9 Å²	62.9	66%	0.662	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.8	178	30.9	-34.5	0	0	0	114.2	L369 I370	L369-P372 VanDerWaalsContact O-CD 3.31Å; L369-P372 WeakPolarHBondContact O-CD 3.36Å; I370-P372 VanDerWaalsContact C-CD 3.47Å
373	Y	91.8	Very high	91.2	Very high	90 Å²	90	69.6 Å²	69.6	35%	0.353	33%	0.334	S	S	.	.			trans	-98.8	156	-175.5	-60.5	-81.7	0	0	0	111.6	L369 I370 K371 I376 L418	L369-Y373 WeakPolarHBondContact O-CD2 3.3Å; L369-Y373 WeakPolarHBondContact O-CE2 3.27Å; I370-Y373 PolarHBondContact O-N 2.9Å; K371-Y373 VanDerWaalsContact C-N 3.34Å; Y373-I376 HydrophobicContact CD2-CD1 3.75Å; Y373-I376 HydrophobicContact CD2-CG1 4.49Å; Y373-I376 HydrophobicContact CE2-CD1 4.07Å; Y373-I376 HydrophobicContact CG-CB 4.29Å; Y373-I376 HydrophobicContact CG-CD1 4.16Å; Y373-I376 HydrophobicContact CG-CG1 4.44Å; Y373-L418 WeakPolarHBondContact O-CD1 3.44Å
374	T	89.9	Confident	91.2	Very high	83 Å²	83	73.9 Å²	73.9	51%	0.509	35%	0.352	S	S	.	.	S	Bend	trans	-105.6	-38.7	167.4	34.9	0	0	0	0	111.1	L418 H420	T374-L418 PolarHBondContact O-N 2.93Å; T374-H420 HydrophobicContact CG2-CB 4.23Å
375	R	92.2	Very high	91.3	Very high	151 Å²	151	69.6 Å²	69.6	57%	0.57	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	129.2	172.4	-64.7	173.6	67.3	-167.5	2.8	107.5	L416 E417	R375-L416 WeakPolarHBondContact CA-O 3.46Å; R375-E417 HydrophobicContact CG-CG 4.25Å
376	I	94.6	Very high	91.1	Very high	7 Å²	7	73.2 Å²	73.2	4%	0.036	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.8	-178	-174	172.8	0	0	0	109.5	I370 Y373 F380 I381 L415 L416	I370-I376 HydrophobicContact CG2-CD1 4.4Å; I370-I376 HydrophobicContact CG2-CG2 4.41Å; Y373-I376 HydrophobicContact CD2-CD1 3.75Å; Y373-I376 HydrophobicContact CD2-CG1 4.49Å; Y373-I376 HydrophobicContact CE2-CD1 4.07Å; Y373-I376 HydrophobicContact CG-CB 4.29Å; Y373-I376 HydrophobicContact CG-CD1 4.16Å; Y373-I376 HydrophobicContact CG-CG1 4.44Å; I376-F380 HydrophobicContact CD1-CD1 3.94Å; I376-F380 HydrophobicContact CD1-CE1 4.3Å; I376-F380 HydrophobicContact CG1-CD1 4.04Å; I376-I381 HydrophobicContact CD1-CD1 4.1Å; I376-I381 HydrophobicContact CD1-CG1 3.69Å; I376-I381 HydrophobicContact CG1-CD1 4.24Å; I376-I381 HydrophobicContact CG1-CG1 4.02Å; I376-I381 HydrophobicContact CG2-CD1 3.9Å; I376-L415 WeakPolarHBondContact O-CA 3.43Å; I376-L416 HydrophobicContact CG2-CB 3.74Å; I376-L416 HydrophobicContact CG2-CD2 3.9Å; I376-L416 HydrophobicContact CG2-CG 4.25Å; I376-L416 PolarHBondContact N-O 3.36Å; I376-L416 PolarHBondContact O-N 2.7Å
377	H	94.8	Very high	91.1	Very high	117 Å²	117	74.2 Å²	74.2	54%	0.542	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.5	178.3	-77.7	-72.2	0	0	0	110.8	F380 I381	H377-F380 HydrophobicContact CB-CB 4.1Å; H377-F380 WeakPolarHBondContact O-CB 3.47Å; H377-F380 PolarHBondContact O-N 3.48Å; H377-I381 PolarHBondContact O-N 3.37Å
378	I	93.8	Very high	91.3	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-41.4	176.2	-56.6	173.5	0	0	0	111.1	F380 I381 S382 V389 V392 L396 I409 Q414	I378-F380 PolarHBondContact O-N 3Å; I378-I381 WeakPolarHBondContact O-CB 3.47Å; I378-I381 PolarHBondContact O-N 2.97Å; I378-I381 VanDerWaalsContact O-N 3.1Å; I378-S382 PolarHBondContact O-N 3.47Å; I378-V389 HydrophobicContact CG2-CG1 3.84Å; I378-V392 HydrophobicContact CG2-CB 4.15Å; I378-V392 HydrophobicContact CG2-CG1 3.78Å; I378-L396 HydrophobicContact CG1-CD1 4.42Å; I378-I409 HydrophobicContact CD1-CG2 3.9Å; I378-Q414 PolarHBondContact N-O 3.37Å
379	P	94.7	Very high	91.5	Very high	55 Å²	55	70.1 Å²	70.1	36%	0.357	34%	0.344	S	S	.	.	H	α-helix	trans	-60.8	-26.1	173.8	-26.9	35.4	0	0	0	114.6	K383 Q414	P379-K383 WeakPolarHBondContact O-CG 3.33Å; P379-K383 PolarHBondContact O-N 3.44Å; P379-Q414 HydrophobicContact CG-CB 4.5Å
380	F	93.9	Very high	91.6	Very high	85 Å²	85	71.4 Å²	71.4	37%	0.373	36%	0.358	S	S	.	.	H	α-helix	trans	-72.2	-43.6	174.8	177.2	-94.8	0	0	0	110.6	L369 I376 H377 I378 S382 K383 E384	L369-F380 HydrophobicContact CD1-CE1 4.39Å; I376-F380 HydrophobicContact CD1-CD1 3.94Å; I376-F380 HydrophobicContact CD1-CE1 4.3Å; I376-F380 HydrophobicContact CG1-CD1 4.04Å; H377-F380 HydrophobicContact CB-CB 4.1Å; H377-F380 WeakPolarHBondContact O-CB 3.47Å; H377-F380 PolarHBondContact O-N 3.48Å; I378-F380 PolarHBondContact O-N 3Å; F380-S382 VanDerWaalsContact C-N 3.33Å; F380-S382 PolarHBondContact O-N 2.94Å; F380-K383 PolarHBondContact O-N 2.93Å; F380-E384 PolarHBondContact O-N 3.45Å; F380-E384 VanDerWaalsContact O-N 3.11Å
381	I	92.8	Very high	91.6	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.8	-42.8	174.4	-61.4	169	0	0	0	110.9	L366 L369 I370 I376 H377 I378 K383 E384 L385 V392 L396 L416	L366-I381 HydrophobicContact CD1-CD1 4.15Å; L366-I381 HydrophobicContact CD1-CG1 4.46Å; L366-I381 HydrophobicContact CD1-CG2 3.56Å; L369-I381 HydrophobicContact CD2-CG1 4.43Å; I370-I381 HydrophobicContact CG2-CD1 4.45Å; I376-I381 HydrophobicContact CD1-CD1 4.1Å; I376-I381 HydrophobicContact CD1-CG1 3.69Å; I376-I381 HydrophobicContact CG1-CD1 4.24Å; I376-I381 HydrophobicContact CG1-CG1 4.02Å; I376-I381 HydrophobicContact CG2-CD1 3.9Å; H377-I381 PolarHBondContact O-N 3.37Å; I378-I381 WeakPolarHBondContact O-CB 3.47Å; I378-I381 PolarHBondContact O-N 2.97Å; I378-I381 VanDerWaalsContact O-N 3.1Å; I381-K383 VanDerWaalsContact C-N 3.34Å; I381-K383 PolarHBondContact O-N 3.39Å; I381-E384 PolarHBondContact O-N 2.91Å; I381-L385 HydrophobicContact CG2-CD1 3.57Å; I381-L385 HydrophobicContact CG2-CG 4.05Å; I381-L385 WeakPolarHBondContact O-CB 3.4Å; I381-L385 WeakPolarHBondContact O-CG 3.49Å; I381-L385 PolarHBondContact O-N 3.27Å; I381-V392 HydrophobicContact CB-CG1 4.02Å; I381-V392 HydrophobicContact CG2-CG1 3.55Å; I381-V392 HydrophobicContact CG2-CG2 4.36Å; I381-L396 HydrophobicContact CD1-CD1 4.49Å; I381-L416 HydrophobicContact CD1-CD2 4.37Å
382	S	93.3	Very high	91.8	Very high	18 Å²	18	67 Å²	67	13%	0.126	34%	0.343	C	S	.	.	H	α-helix	trans	-57	-44.4	177	161.6	0	0	0	0	112.5	I378 F380 N386 I387	I378-S382 PolarHBondContact O-N 3.47Å; F380-S382 VanDerWaalsContact C-N 3.33Å; F380-S382 PolarHBondContact O-N 2.94Å; S382-N386 WeakPolarHBondContact O-CA 3.32Å; S382-N386 PolarHBondContact O-N 2.85Å; S382-I387 WeakPolarHBondContact CB-O 3.48Å; S382-I387 PolarHBondContact O-N 3.42Å; S382-I387 PolarHBondContact OG-O 3.39Å
383	K	90.6	Very high	91.8	Very high	173 Å²	173	64 Å²	64	75%	0.752	32%	0.32	S	S	*	.	H	α-helix	trans	-66.1	-39.3	176.7	-72.7	179.2	-178.8	-177	0	112.8	P379 F380 I381	P379-K383 WeakPolarHBondContact O-CG 3.33Å; P379-K383 PolarHBondContact O-N 3.44Å; F380-K383 PolarHBondContact O-N 2.93Å; I381-K383 VanDerWaalsContact C-N 3.34Å; I381-K383 PolarHBondContact O-N 3.39Å
384	E	88.1	Confident	91.9	Very high	113 Å²	113	63.3 Å²	63.3	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-73.4	-37.2	-178.7	-161.4	68.5	-165.8	0	0	112.4	L369 F380 I381	L369-E384 HydrophobicContact CD1-CG 3.94Å; L369-E384 HydrophobicContact CD2-CB 3.83Å; L369-E384 HydrophobicContact CD2-CG 3.78Å; F380-E384 PolarHBondContact O-N 3.45Å; F380-E384 VanDerWaalsContact O-N 3.11Å; I381-E384 PolarHBondContact O-N 2.91Å
385	L	87.6	Confident	92	Very high	1 Å²	1	60 Å²	60	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-87	-6.6	178.3	-64.4	-178.2	0	0	0	113.7	I330 V365 L366 I381 I387 L395	I330-L385 HydrophobicContact CD1-CD2 3.53Å; V365-L385 HydrophobicContact CB-CD2 3.96Å; V365-L385 HydrophobicContact CG1-CD2 3.63Å; L366-L385 HydrophobicContact CB-CD1 4.3Å; L366-L385 HydrophobicContact CD1-CD1 4.3Å; I381-L385 HydrophobicContact CG2-CD1 3.57Å; I381-L385 HydrophobicContact CG2-CG 4.05Å; I381-L385 WeakPolarHBondContact O-CB 3.4Å; I381-L385 WeakPolarHBondContact O-CG 3.49Å; I381-L385 PolarHBondContact O-N 3.27Å; L385-I387 HydrophobicContact CB-CD1 4.25Å; L385-I387 HydrophobicContact CB-CG1 3.8Å; L385-I387 HydrophobicContact CD1-CD1 4.28Å; L385-I387 PolarHBondContact O-N 3.34Å; L385-L395 HydrophobicContact CD1-CD2 4.47Å
386	N	86.4	Confident	92	Very high	103 Å²	103	52.8 Å²	52.8	55%	0.551	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	43.1	-177.3	-167.4	45.7	0	0	0	113.9	E334 S382	E334-N386 PolarHBondContact OE2-ND2 2.96Å; S382-N386 WeakPolarHBondContact O-CA 3.32Å; S382-N386 PolarHBondContact O-N 2.85Å
387	I	89.2	Confident	91.9	Very high	20 Å²	20	55.6 Å²	55.6	10%	0.103	30%	0.297	C	S	.	.	S	Bend	trans	-133.9	162.1	178.8	53.5	164.9	0	0	0	111.8	S382 L385 D391 V392	S382-I387 WeakPolarHBondContact CB-O 3.48Å; S382-I387 PolarHBondContact O-N 3.42Å; S382-I387 PolarHBondContact OG-O 3.39Å; L385-I387 HydrophobicContact CB-CD1 4.25Å; L385-I387 HydrophobicContact CB-CG1 3.8Å; L385-I387 HydrophobicContact CD1-CD1 4.28Å; L385-I387 PolarHBondContact O-N 3.34Å; I387-D391 HydrophobicContact CB-CB 4.5Å; I387-D391 HydrophobicContact CD1-CB 4.23Å; I387-V392 HydrophobicContact CD1-CB 4.41Å; I387-V392 HydrophobicContact CD1-CG2 3.55Å; I387-V392 HydrophobicContact CG1-CG2 3.58Å
388	D	92.9	Very high	91.8	Very high	99 Å²	99	54.6 Å²	54.6	53%	0.529	29%	0.293	S	S	.	.			trans	-63.9	150.6	179	-166.9	-90.3	0	0	0	111.8	A390 D391 V392	D388-A390 PolarHBondContact O-N 3.16Å; D388-A390 WeakPolarHBondContact OD1-CB 3.41Å; D388-A390 PolarHBondContact OD1-N 3.4Å; D388-D391 PolarHBondContact O-N 3.23Å; D388-D391 VanDerWaalsContact O-N 3.11Å; D388-V392 WeakPolarHBondContact O-CG2 3.27Å; D388-V392 PolarHBondContact O-N 3.4Å
389	V	92.7	Very high	91.6	Very high	43 Å²	43	54.8 Å²	54.8	26%	0.261	29%	0.294	S	S	.	.	H	α-helix	trans	-59.2	-36.6	-179.8	-176.3	0	0	0	0	111.2	I378 D391 V392 E393	I378-V389 HydrophobicContact CG2-CG1 3.84Å; V389-D391 VanDerWaalsContact C-N 3.35Å; V389-V392 PolarHBondContact O-N 2.92Å; V389-E393 PolarHBondContact O-N 3.48Å
390	A	92.6	Very high	91.5	Very high	54 Å²	54	54.2 Å²	54.2	45%	0.446	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-36.7	177.4	0	0	0	0	0	112.5	D388 E393 S394	D388-A390 PolarHBondContact O-N 3.16Å; D388-A390 WeakPolarHBondContact OD1-CB 3.41Å; D388-A390 PolarHBondContact OD1-N 3.4Å; A390-E393 PolarHBondContact O-N 3.13Å; A390-S394 WeakPolarHBondContact O-CB 3.19Å; A390-S394 PolarHBondContact O-N 3.47Å; A390-S394 PolarHBondContact O-OG 2.94Å
391	D	91.1	Very high	91.5	Very high	93 Å²	93	56.2 Å²	56.2	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-71.8	-36.9	176.9	-66.3	-32.2	0	0	0	111.2	I387 D388 V389 E393 S394 L395	I387-D391 HydrophobicContact CB-CB 4.5Å; I387-D391 HydrophobicContact CD1-CB 4.23Å; D388-D391 PolarHBondContact O-N 3.23Å; D388-D391 VanDerWaalsContact O-N 3.11Å; V389-D391 VanDerWaalsContact C-N 3.35Å; D391-E393 VanDerWaalsContact C-N 3.35Å; D391-S394 PolarHBondContact O-N 3.2Å; D391-L395 VanDerWaalsContact O-CB 3.3Å; D391-L395 WeakPolarHBondContact O-CB 3.36Å; D391-L395 PolarHBondContact O-N 3.36Å
392	V	93.1	Very high	91.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-46	172.2	178.2	0	0	0	0	110.6	I378 I381 I387 D388 V389 L395 L396	I378-V392 HydrophobicContact CG2-CB 4.15Å; I378-V392 HydrophobicContact CG2-CG1 3.78Å; I381-V392 HydrophobicContact CB-CG1 4.02Å; I381-V392 HydrophobicContact CG2-CG1 3.55Å; I381-V392 HydrophobicContact CG2-CG2 4.36Å; I387-V392 HydrophobicContact CD1-CB 4.41Å; I387-V392 HydrophobicContact CD1-CG2 3.55Å; I387-V392 HydrophobicContact CG1-CG2 3.58Å; D388-V392 WeakPolarHBondContact O-CG2 3.27Å; D388-V392 PolarHBondContact O-N 3.4Å; V389-V392 PolarHBondContact O-N 2.92Å; V392-L395 PolarHBondContact O-N 2.76Å; V392-L396 HydrophobicContact CG1-CD1 3.86Å; V392-L396 HydrophobicContact CG1-CG 4.29Å; V392-L396 WeakPolarHBondContact O-CB 3.35Å; V392-L396 VanDerWaalsContact O-CG 3.29Å; V392-L396 WeakPolarHBondContact O-CG 3.48Å; V392-L396 PolarHBondContact O-N 3.04Å
393	E	92.7	Very high	91.1	Very high	39 Å²	39	65.5 Å²	65.5	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-61.9	-45.7	179.1	-170.7	174.9	174.6	0	0	110.9	V389 A390 D391 L395 L396 V397 I409 Q411	V389-E393 PolarHBondContact O-N 3.48Å; A390-E393 PolarHBondContact O-N 3.13Å; D391-E393 VanDerWaalsContact C-N 3.35Å; E393-L395 VanDerWaalsContact C-N 3.34Å; E393-L395 PolarHBondContact O-N 3.21Å; E393-L396 PolarHBondContact O-N 3.44Å; E393-V397 WeakPolarHBondContact O-CG2 3.11Å; E393-V397 PolarHBondContact O-N 3.15Å; E393-I409 HydrophobicContact CG-CG2 4.46Å; E393-Q411 VanDerWaalsContact OE1-CD 3.27Å; E393-Q411 WeakPolarHBondContact OE1-CG 3.43Å; E393-Q411 PolarHBondContact OE1-NE2 2.96Å
394	S	92.5	Very high	90.9	Very high	76 Å²	76	60.5 Å²	60.5	53%	0.531	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-43.1	175.9	-59.4	0	0	0	0	112.2	A390 D391 V397 Q398	A390-S394 WeakPolarHBondContact O-CB 3.19Å; A390-S394 PolarHBondContact O-N 3.47Å; A390-S394 PolarHBondContact O-OG 2.94Å; D391-S394 PolarHBondContact O-N 3.2Å; S394-V397 PolarHBondContact O-N 3.49Å; S394-Q398 PolarHBondContact O-N 3.21Å; S394-Q398 VanDerWaalsContact O-N 3.08Å
395	L	91.8	Very high	91	Very high	12 Å²	12	55.3 Å²	55.3	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.2	-175.5	65.4	0	0	0	111.7	R362 L366 L385 D391 V392 E393 Q398 C399	R362-L395 HydrophobicContact CB-CD2 3.98Å; L366-L395 HydrophobicContact CD2-CD2 4.1Å; L366-L395 HydrophobicContact CD2-CG 4.32Å; L385-L395 HydrophobicContact CD1-CD2 4.47Å; D391-L395 VanDerWaalsContact O-CB 3.3Å; D391-L395 WeakPolarHBondContact O-CB 3.36Å; D391-L395 PolarHBondContact O-N 3.36Å; V392-L395 PolarHBondContact O-N 2.76Å; E393-L395 VanDerWaalsContact C-N 3.34Å; E393-L395 PolarHBondContact O-N 3.21Å; L395-Q398 PolarHBondContact O-N 2.99Å; L395-C399 WeakPolarHBondContact O-CB 3.31Å; L395-C399 PolarHBondContact O-N 3.47Å; L395-C399 PolarHBondContact O-SG 3.45Å
396	L	92.3	Very high	91.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-42.5	176.5	-76.2	169.1	0	0	0	111.7	L366 I378 I381 V392 E393 C399 I400 I405 I409 L416	L366-L396 HydrophobicContact CD1-CD2 4.36Å; L366-L396 HydrophobicContact CD2-CD2 3.83Å; L366-L396 HydrophobicContact CD2-CG 4.42Å; I378-L396 HydrophobicContact CG1-CD1 4.42Å; I381-L396 HydrophobicContact CD1-CD1 4.49Å; V392-L396 HydrophobicContact CG1-CD1 3.86Å; V392-L396 HydrophobicContact CG1-CG 4.29Å; V392-L396 WeakPolarHBondContact O-CB 3.35Å; V392-L396 VanDerWaalsContact O-CG 3.29Å; V392-L396 WeakPolarHBondContact O-CG 3.48Å; V392-L396 PolarHBondContact O-N 3.04Å; E393-L396 PolarHBondContact O-N 3.44Å; L396-C399 PolarHBondContact O-N 2.91Å; L396-I400 WeakPolarHBondContact O-CB 3.17Å; L396-I400 WeakPolarHBondContact O-CD1 3.08Å; L396-I400 VanDerWaalsContact O-CG1 3.23Å; L396-I400 WeakPolarHBondContact O-CG1 3.44Å; L396-I400 PolarHBondContact O-N 2.87Å; L396-I405 HydrophobicContact CD2-CD1 4.07Å; L396-I409 HydrophobicContact CB-CD1 3.66Å; L396-I409 HydrophobicContact CB-CG1 4.31Å; L396-L416 HydrophobicContact CD1-CD1 4.43Å; L396-L416 HydrophobicContact CD2-CD1 4.08Å; L396-L416 HydrophobicContact CD2-CD2 3.66Å; L396-L416 HydrophobicContact CD2-CG 4.46Å
397	V	93.8	Very high	91.2	Very high	66 Å²	66	55.7 Å²	55.7	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-58	-50.3	175.3	170	0	0	0	0	110.2	E393 S394 C399 I400 L401 I409	E393-V397 WeakPolarHBondContact O-CG2 3.11Å; E393-V397 PolarHBondContact O-N 3.15Å; S394-V397 PolarHBondContact O-N 3.49Å; V397-C399 PolarHBondContact O-N 2.87Å; V397-I400 PolarHBondContact O-N 3.16Å; V397-L401 HydrophobicContact CG1-CD1 3.96Å; V397-L401 WeakPolarHBondContact O-CG 3.09Å; V397-L401 PolarHBondContact O-N 3.41Å; V397-I409 HydrophobicContact CG2-CD1 3.66Å
398	Q	91.1	Very high	91.3	Very high	97 Å²	97	62.8 Å²	62.8	45%	0.453	34%	0.336	S	S	.	.	H	α-helix	trans	-59	-47.7	177.9	-174.1	-176	-17.6	0	0	111.4	S394 L395 I400 L401 D402	S394-Q398 PolarHBondContact O-N 3.21Å; S394-Q398 VanDerWaalsContact O-N 3.08Å; L395-Q398 PolarHBondContact O-N 2.99Å; Q398-I400 VanDerWaalsContact C-N 3.31Å; Q398-I400 PolarHBondContact O-N 3.23Å; Q398-L401 PolarHBondContact O-N 3.1Å; Q398-D402 WeakPolarHBondContact O-CB 3.14Å; Q398-D402 PolarHBondContact O-N 3.17Å
399	C	90.9	Very high	91.4	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-63.7	-33.7	-178.7	-68.6	0	0	0	0	113.5	L395 L396 V397 N403 T404 I405	L395-C399 WeakPolarHBondContact O-CB 3.31Å; L395-C399 PolarHBondContact O-N 3.47Å; L395-C399 PolarHBondContact O-SG 3.45Å; L396-C399 PolarHBondContact O-N 2.91Å; V397-C399 PolarHBondContact O-N 2.87Å; C399-N403 PolarHBondContact O-N 3.28Å; C399-T404 VanDerWaalsContact CA-OG1 3.32Å; C399-T404 WeakPolarHBondContact CA-OG1 3.36Å; C399-T404 VanDerWaalsContact CB-OG1 3.31Å; C399-T404 WeakPolarHBondContact CB-OG1 3.16Å; C399-T404 PolarHBondContact O-N 3.15Å; C399-T404 PolarHBondContact O-OG1 3.4Å; C399-I405 HydrophobicContact CB-CB 4.13Å; C399-I405 HydrophobicContact CB-CD1 3.54Å; C399-I405 HydrophobicContact CB-CG1 3.78Å; C399-I405 PolarHBondContact O-N 3.01Å; C399-I405 VanDerWaalsContact O-N 3.15Å
400	I	92	Very high	91.4	Very high	43 Å²	43	60.3 Å²	60.3	22%	0.221	32%	0.321	C	S	.	.	H	α-helix	trans	-71.6	-42.5	175.9	-68.6	165	0	0	0	110.5	L396 V397 Q398 D402 N403 I405 I409 L416	L396-I400 WeakPolarHBondContact O-CB 3.17Å; L396-I400 WeakPolarHBondContact O-CD1 3.08Å; L396-I400 VanDerWaalsContact O-CG1 3.23Å; L396-I400 WeakPolarHBondContact O-CG1 3.44Å; L396-I400 PolarHBondContact O-N 2.87Å; V397-I400 PolarHBondContact O-N 3.16Å; Q398-I400 VanDerWaalsContact C-N 3.31Å; Q398-I400 PolarHBondContact O-N 3.23Å; I400-D402 VanDerWaalsContact C-N 3.35Å; I400-N403 PolarHBondContact O-N 3.2Å; I400-N403 VanDerWaalsContact O-N 3.09Å; I400-I405 HydrophobicContact CG1-CB 4.33Å; I400-I405 HydrophobicContact CG1-CG2 4.28Å; I400-I409 HydrophobicContact CD1-CD1 3.95Å; I400-I409 HydrophobicContact CD1-CG1 3.69Å; I400-L416 HydrophobicContact CD1-CD1 4.39Å
401	L	93.3	Very high	91.4	Very high	127 Å²	127	63.6 Å²	63.6	67%	0.665	33%	0.327	S	S	*	.	H	α-helix	trans	-63.6	-40.5	176.3	-70.2	172.8	0	0	0	112	V397 Q398 N403	V397-L401 HydrophobicContact CG1-CD1 3.96Å; V397-L401 WeakPolarHBondContact O-CG 3.09Å; V397-L401 PolarHBondContact O-N 3.41Å; Q398-L401 PolarHBondContact O-N 3.1Å; L401-N403 PolarHBondContact O-N 3.15Å; L401-N403 PolarHBondContact O-ND2 2.89Å
402	D	90.1	Very high	91.4	Very high	95 Å²	95	65.4 Å²	65.4	51%	0.508	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	0.9	175.8	-68.2	-17.8	0	0	0	112.8	Q398 I400 T404	Q398-D402 WeakPolarHBondContact O-CB 3.14Å; Q398-D402 PolarHBondContact O-N 3.17Å; I400-D402 VanDerWaalsContact C-N 3.35Å; D402-T404 HydrophobicContact CB-CG2 4.07Å; D402-T404 PolarHBondContact O-N 3.45Å; D402-T404 VanDerWaalsContact O-N 3.14Å
403	N	87.6	Confident	91.3	Very high	119 Å²	119	70 Å²	70	64%	0.636	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	20.3	-176.6	-61	-76.9	0	0	0	114.5	C399 I400 L401 H406	C399-N403 PolarHBondContact O-N 3.28Å; I400-N403 PolarHBondContact O-N 3.2Å; I400-N403 VanDerWaalsContact O-N 3.09Å; L401-N403 PolarHBondContact O-N 3.15Å; L401-N403 PolarHBondContact O-ND2 2.89Å; N403-H406 PolarHBondContact O-CE1 3.37Å
404	T	88	Confident	91.3	Very high	67 Å²	67	70.8 Å²	70.8	41%	0.411	37%	0.369	S	S	.	.	S	Bend	trans	-79.2	-31.2	176.1	62.3	0	0	0	0	111.6	C399 D402	C399-T404 VanDerWaalsContact CA-OG1 3.32Å; C399-T404 WeakPolarHBondContact CA-OG1 3.36Å; C399-T404 VanDerWaalsContact CB-OG1 3.31Å; C399-T404 WeakPolarHBondContact CB-OG1 3.16Å; C399-T404 PolarHBondContact O-N 3.15Å; C399-T404 PolarHBondContact O-OG1 3.4Å; D402-T404 HydrophobicContact CB-CG2 4.07Å; D402-T404 PolarHBondContact O-N 3.45Å; D402-T404 VanDerWaalsContact O-N 3.14Å
405	I	89.6	Confident	91.4	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.026	35%	0.346	C	S	.	.	S	Bend	trans	-115.8	131.8	174.2	-64.2	178	0	0	0	109.6	L366 I367 I370 L396 C399 I400 L418	L366-I405 HydrophobicContact CD2-CD1 3.63Å; L366-I405 HydrophobicContact CG-CD1 3.91Å; I367-I405 HydrophobicContact CG1-CG1 4.17Å; I370-I405 HydrophobicContact CD1-CB 4.39Å; I370-I405 HydrophobicContact CD1-CD1 3.73Å; I370-I405 HydrophobicContact CD1-CG1 3.77Å; I370-I405 HydrophobicContact CD1-CG2 3.8Å; L396-I405 HydrophobicContact CD2-CD1 4.07Å; C399-I405 HydrophobicContact CB-CB 4.13Å; C399-I405 HydrophobicContact CB-CD1 3.54Å; C399-I405 HydrophobicContact CB-CG1 3.78Å; C399-I405 PolarHBondContact O-N 3.01Å; C399-I405 VanDerWaalsContact O-N 3.15Å; I400-I405 HydrophobicContact CG1-CB 4.33Å; I400-I405 HydrophobicContact CG1-CG2 4.28Å; I405-L418 HydrophobicContact CG2-CD2 4.19Å
406	H	88.7	Confident	91.5	Very high	103 Å²	103	67.1 Å²	67.1	48%	0.477	34%	0.343	S	S	.	.			trans	-103.7	98.1	175.2	-59.8	-45.3	0	0	0	110.4	N403 D419	N403-H406 PolarHBondContact O-CE1 3.37Å; H406-D419 PolarHBondContact O-N 3.26Å; H406-D419 VanDerWaalsContact O-N 3.09Å
407	G	89.8	Confident	91.5	Very high	8 Å²	8	71.7 Å²	71.7	8%	0.082	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	-175.3	179.2	0	0	0	0	0	112.5	E417	G407-E417 CarbonylContact C-O 3.55Å; G407-E417 WeakPolarHBondContact CA-O 3.35Å
408	R	91.6	Very high	91.3	Very high	169 Å²	169	69.8 Å²	69.8	64%	0.638	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.9	180	-58.2	177.1	-167.4	-174.7	0.1	109.5	E417	R408-E417 PolarHBondContact N-O 3.36Å; R408-E417 PolarHBondContact O-N 2.96Å
409	I	94.3	Very high	90.8	Very high	45 Å²	45	68.8 Å²	68.8	23%	0.231	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.5	177.2	-53.8	174.2	0	0	0	107.8	I378 E393 L396 V397 I400 L416	I378-I409 HydrophobicContact CD1-CG2 3.9Å; E393-I409 HydrophobicContact CG-CG2 4.46Å; L396-I409 HydrophobicContact CB-CD1 3.66Å; L396-I409 HydrophobicContact CB-CG1 4.31Å; V397-I409 HydrophobicContact CG2-CD1 3.66Å; I400-I409 HydrophobicContact CD1-CD1 3.95Å; I400-I409 HydrophobicContact CD1-CG1 3.69Å; I409-L416 HydrophobicContact CG1-CD1 4.09Å
410	D	93.4	Very high	89.9	Confident	46 Å²	46	75.3 Å²	75.3	25%	0.246	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	97	166.9	-179.7	-12.4	0	0	0	108.2	V412 N413 Q414 L415	D410-V412 VanDerWaalsContact C-N 3.29Å; D410-V412 PolarHBondContact O-N 3.47Å; D410-V412 PolarHBondContact OD1-N 2.86Å; D410-V412 VanDerWaalsContact OD1-N 3.07Å; D410-N413 PolarHBondContact OD1-N 3.15Å; D410-N413 PolarHBondContact OD2-ND2 3.01Å; D410-Q414 WeakPolarHBondContact O-CA 3.36Å; D410-Q414 PolarHBondContact O-N 3.15Å; D410-L415 HydrophobicContact CB-CD1 3.4Å; D410-L415 HydrophobicContact CB-CG 3.8Å; D410-L415 WeakPolarHBondContact CB-O 3.27Å; D410-L415 PolarHBondContact N-O 3.43Å; D410-L415 PolarHBondContact O-N 3.38Å
411	Q	91.3	Very high	88.3	Confident	123 Å²	123	81.7 Å²	81.7	58%	0.575	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.9	-177.9	-163.3	178.3	34.6	0	0	112.5	E393 Q414	E393-Q411 VanDerWaalsContact OE1-CD 3.27Å; E393-Q411 WeakPolarHBondContact OE1-CG 3.43Å; E393-Q411 PolarHBondContact OE1-NE2 2.96Å; Q411-Q414 PolarHBondContact O-NE2 3.49Å
412	V	92.4	Very high	86.8	Confident	131 Å²	131	83.4 Å²	83.4	79%	0.794	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-46.2	-178.3	179.6	0	0	0	0	110.2	D410	D410-V412 VanDerWaalsContact C-N 3.29Å; D410-V412 PolarHBondContact O-N 3.47Å; D410-V412 PolarHBondContact OD1-N 2.86Å; D410-V412 VanDerWaalsContact OD1-N 3.07Å
413	N	90.7	Very high	85.8	Confident	96 Å²	96	89.5 Å²	89.5	51%	0.513	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	3	-178.9	-60.2	-60.4	0	0	0	113.4	D410 L415	D410-N413 PolarHBondContact OD1-N 3.15Å; D410-N413 PolarHBondContact OD2-ND2 3.01Å; N413-L415 VanDerWaalsContact C-N 3.34Å; N413-L415 HydrophobicContact CB-CD2 3.29Å; N413-L415 HydrophobicContact CB-CG 3.74Å; N413-L415 PolarHBondContact O-N 3.09Å
414	Q	92.7	Very high	84.9	Confident	55 Å²	55	86.1 Å²	86.1	26%	0.257	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	49.7	179.8	-68.6	-70.4	-52.1	0	0	112.3	I378 P379 D410 Q411	I378-Q414 PolarHBondContact N-O 3.37Å; P379-Q414 HydrophobicContact CG-CB 4.5Å; D410-Q414 WeakPolarHBondContact O-CA 3.36Å; D410-Q414 PolarHBondContact O-N 3.15Å; Q411-Q414 PolarHBondContact O-NE2 3.49Å
415	L	94.1	Very high	84.4	Confident	11 Å²	11	84.9 Å²	84.9	6%	0.058	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.9	-177.4	54	91.9	0	0	0	112.2	I376 D410 N413	I376-L415 WeakPolarHBondContact O-CA 3.43Å; D410-L415 HydrophobicContact CB-CD1 3.4Å; D410-L415 HydrophobicContact CB-CG 3.8Å; D410-L415 WeakPolarHBondContact CB-O 3.27Å; D410-L415 PolarHBondContact N-O 3.43Å; D410-L415 PolarHBondContact O-N 3.38Å; N413-L415 VanDerWaalsContact C-N 3.34Å; N413-L415 HydrophobicContact CB-CD2 3.29Å; N413-L415 HydrophobicContact CB-CG 3.74Å; N413-L415 PolarHBondContact O-N 3.09Å
416	L	93.4	Very high	84.1	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.8	170.7	178.1	73.4	0	0	0	108	I370 R375 I376 I381 L396 I400 I409 L418	I370-L416 HydrophobicContact CG2-CD2 4.08Å; R375-L416 WeakPolarHBondContact CA-O 3.46Å; I376-L416 HydrophobicContact CG2-CB 3.74Å; I376-L416 HydrophobicContact CG2-CD2 3.9Å; I376-L416 HydrophobicContact CG2-CG 4.25Å; I376-L416 PolarHBondContact N-O 3.36Å; I376-L416 PolarHBondContact O-N 2.7Å; I381-L416 HydrophobicContact CD1-CD2 4.37Å; L396-L416 HydrophobicContact CD1-CD1 4.43Å; L396-L416 HydrophobicContact CD2-CD1 4.08Å; L396-L416 HydrophobicContact CD2-CD2 3.66Å; L396-L416 HydrophobicContact CD2-CG 4.46Å; I400-L416 HydrophobicContact CD1-CD1 4.39Å; I409-L416 HydrophobicContact CG1-CD1 4.09Å; L416-L418 HydrophobicContact CD2-CD2 4.18Å; L416-L418 HydrophobicContact CG-CD2 4.44Å
417	E	92.6	Very high	84.1	Confident	96 Å²	96	91.6 Å²	91.6	45%	0.449	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.6	176.6	-171.6	166	-142.3	0	0	109.3	R375 G407 R408	R375-E417 HydrophobicContact CG-CG 4.25Å; G407-E417 CarbonylContact C-O 3.55Å; G407-E417 WeakPolarHBondContact CA-O 3.35Å; R408-E417 PolarHBondContact N-O 3.36Å; R408-E417 PolarHBondContact O-N 2.96Å
418	L	89.3	Confident	84.1	Confident	27 Å²	27	97 Å²	97	14%	0.141	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	138.5	-176.7	-66.5	162.8	0	0	0	110.6	I370 Y373 T374 I405 L416 H420	I370-L418 HydrophobicContact CB-CD1 4.14Å; I370-L418 HydrophobicContact CD1-CD2 4.18Å; I370-L418 WeakPolarHBondContact O-CD1 3.34Å; Y373-L418 WeakPolarHBondContact O-CD1 3.44Å; T374-L418 PolarHBondContact O-N 2.93Å; I405-L418 HydrophobicContact CG2-CD2 4.19Å; L416-L418 HydrophobicContact CD2-CD2 4.18Å; L416-L418 HydrophobicContact CG-CD2 4.44Å; L418-H420 VanDerWaalsContact C-N 3.26Å; L418-H420 PolarHBondContact O-N 3.04Å
419	D	81.3	Confident	84.1	Confident	76 Å²	76	93 Å²	93	41%	0.406	47%	0.473	S	S	.	.			trans	-75.8	75.8	-177.7	-86.9	-27.8	0	0	0	111	H406	H406-D419 PolarHBondContact O-N 3.26Å; H406-D419 VanDerWaalsContact O-N 3.09Å
420	H	71.1	Confident	84	Confident	139 Å²	139	93.8 Å²	93.8	64%	0.644	49%	0.486	S	S	*	.			trans	-83.7	-18.7	178.1	-131.9	-43.8	0	0	0	112.9	T374 L418	T374-H420 HydrophobicContact CG2-CB 4.23Å; L418-H420 VanDerWaalsContact C-N 3.26Å; L418-H420 PolarHBondContact O-N 3.04Å
421	Q	59.9	Low	84.1	Confident	177 Å²	177	95.5 Å²	95.5	83%	0.827	49%	0.494	S	S	*	.			trans	-107.5	71.6	-175.8	-74.5	-93.7	-31.2	0	0	111.1	R423	Q421-R423 PolarHBondContact O-N 3.01Å
422	K	61	Low	84.3	Confident	163 Å²	163	94.5 Å²	94.5	71%	0.709	49%	0.493	S	S	*	.			trans	-74.4	95.6	168.5	-86.1	-176.6	178.4	173.6	0	109.7	G424	K422-G424 PolarHBondContact O-N 2.97Å
423	R	69.4	Low	84.4	Confident	223 Å²	223	95.8 Å²	95.8	84%	0.842	49%	0.488	S	S	*	.			trans	-55	128.5	151.3	-67.9	-177.6	-178.4	-179.6	1.4	106.3	Q421 G425	Q421-R423 PolarHBondContact O-N 3.01Å; R423-G425 VanDerWaalsContact C-N 3.32Å; R423-G425 PolarHBondContact O-N 3.1Å
424	G	69.3	Low	84.7	Confident	48 Å²	48	99 Å²	99	50%	0.495	49%	0.493	S	S	.	.			trans	-61	84.1	-168.6	0	0	0	0	0	113.9	K422 A426 R427 Y428	K422-G424 PolarHBondContact O-N 2.97Å; G424-A426 VanDerWaalsContact C-N 3.28Å; G424-A426 PolarHBondContact O-N 3.08Å; G424-R427 PolarHBondContact O-N 3.04Å; G424-Y428 VanDerWaalsContact O-CD2 3.24Å; G424-Y428 WeakPolarHBondContact O-CD2 3.45Å
425	G	77.2	Confident	84.9	Confident	41 Å²	41	100.1 Å²	100.1	42%	0.423	50%	0.504	S	S	.	.	H	α-helix	trans	-59.4	-38.2	-175.5	0	0	0	0	0	112.6	R423 R427 Y428 T429	R423-G425 VanDerWaalsContact C-N 3.32Å; R423-G425 PolarHBondContact O-N 3.1Å; G425-R427 VanDerWaalsContact C-N 3.25Å; G425-R427 PolarHBondContact O-N 3.18Å; G425-R427 VanDerWaalsContact O-N 3.16Å; G425-Y428 PolarHBondContact O-N 3.25Å; G425-T429 PolarHBondContact O-N 3.18Å; G425-T429 PolarHBondContact O-OG1 3.41Å
426	A	82.4	Confident	85	Confident	84 Å²	84	104.7 Å²	104.7	69%	0.694	53%	0.528	S	S	*	.	H	α-helix	trans	-54.8	-37.5	-177.3	0	0	0	0	0	113.6	G424 A430	G424-A426 VanDerWaalsContact C-N 3.28Å; G424-A426 PolarHBondContact O-N 3.08Å; A426-A430 WeakPolarHBondContact O-CB 3.12Å; A426-A430 PolarHBondContact O-N 2.99Å; A426-A430 VanDerWaalsContact O-N 3.11Å
427	R	89.2	Confident	85.2	Confident	166 Å²	166	111.1 Å²	111.1	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-68.6	-42.7	178.4	-174	175.9	66.5	-169.4	1.8	111.5	G424 G425 A430 L431	G424-R427 PolarHBondContact O-N 3.04Å; G425-R427 VanDerWaalsContact C-N 3.25Å; G425-R427 PolarHBondContact O-N 3.18Å; G425-R427 VanDerWaalsContact O-N 3.16Å; R427-A430 PolarHBondContact O-N 3.28Å; R427-L431 HydrophobicContact CG-CD1 4.39Å; R427-L431 WeakPolarHBondContact O-CG 3.45Å; R427-L431 PolarHBondContact O-N 3.46Å; R427-L431 VanDerWaalsContact O-N 3.11Å
428	Y	90.4	Very high	85.4	Confident	122 Å²	122	110.8 Å²	110.8	48%	0.478	56%	0.559	S	S	.	*	H	α-helix	trans	-68.8	-39.4	178.7	-59.7	-70.1	0	0	0	111.2	G424 G425 A430 L431 D432	G424-Y428 VanDerWaalsContact O-CD2 3.24Å; G424-Y428 WeakPolarHBondContact O-CD2 3.45Å; G425-Y428 PolarHBondContact O-N 3.25Å; Y428-A430 VanDerWaalsContact C-N 3.3Å; Y428-A430 PolarHBondContact O-N 3.11Å; Y428-L431 PolarHBondContact O-N 3.21Å; Y428-D432 PolarHBondContact O-N 3.32Å
429	T	91.4	Very high	85.7	Confident	85 Å²	85	113.5 Å²	113.5	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-63	-36.9	175.8	-8	0	0	0	0	112.3	G425 K433	G425-T429 PolarHBondContact O-N 3.18Å; G425-T429 PolarHBondContact O-OG1 3.41Å; T429-K433 PolarHBondContact O-N 2.86Å
430	A	92.4	Very high	86.4	Confident	61 Å²	61	112.5 Å²	112.5	50%	0.504	57%	0.573	S	S	.	*	H	α-helix	trans	-66.8	-43.3	175.2	0	0	0	0	0	112.1	A426 R427 Y428 K433 W434	A426-A430 WeakPolarHBondContact O-CB 3.12Å; A426-A430 PolarHBondContact O-N 2.99Å; A426-A430 VanDerWaalsContact O-N 3.11Å; R427-A430 PolarHBondContact O-N 3.28Å; Y428-A430 VanDerWaalsContact C-N 3.3Å; Y428-A430 PolarHBondContact O-N 3.11Å; A430-K433 PolarHBondContact O-N 3.49Å; A430-W434 WeakPolarHBondContact O-CB 3.36Å; A430-W434 PolarHBondContact O-N 2.95Å
431	L	94.9	Very high	87.6	Confident	81 Å²	81	110.9 Å²	110.9	42%	0.424	57%	0.568	S	S	.	*	H	α-helix	trans	-63.7	-41.6	176.3	-72.3	169	0	0	0	112.1	R427 Y428 W434 T435	R427-L431 HydrophobicContact CG-CD1 4.39Å; R427-L431 WeakPolarHBondContact O-CG 3.45Å; R427-L431 PolarHBondContact O-N 3.46Å; R427-L431 VanDerWaalsContact O-N 3.11Å; Y428-L431 PolarHBondContact O-N 3.21Å; L431-W434 HydrophobicContact CD2-CE3 4.34Å; L431-W434 PolarHBondContact O-N 3.22Å; L431-T435 WeakPolarHBondContact O-CB 3.44Å; L431-T435 PolarHBondContact O-N 3.31Å; L431-T435 PolarHBondContact O-OG1 2.9Å
432	D	94.8	Very high	89.3	Confident	102 Å²	102	107 Å²	107	55%	0.545	55%	0.553	S	S	.	*	H	α-helix	trans	-63.7	-45.2	176.1	-81	-13.5	0	0	0	111.6	Y428 W434 T435 N436	Y428-D432 PolarHBondContact O-N 3.32Å; D432-W434 VanDerWaalsContact C-N 3.31Å; D432-W434 PolarHBondContact O-N 3.44Å; D432-T435 PolarHBondContact O-N 2.86Å; D432-N436 WeakPolarHBondContact O-CB 3.49Å; D432-N436 PolarHBondContact O-N 3.19Å; D432-N436 PolarHBondContact O-ND2 3.49Å
433	K	95.6	Very high	90.9	Very high	158 Å²	158	105.2 Å²	105.2	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-57.5	-46.2	174.6	-94.5	-173.2	176.1	-178.3	0	111.3	T429 A430 N436 Q437	T429-K433 PolarHBondContact O-N 2.86Å; A430-K433 PolarHBondContact O-N 3.49Å; K433-N436 PolarHBondContact O-N 2.7Å; K433-Q437 VanDerWaalsContact O-CG 3.28Å; K433-Q437 WeakPolarHBondContact O-CG 3.02Å; K433-Q437 PolarHBondContact O-N 2.98Å; K433-Q437 VanDerWaalsContact O-N 3.08Å
434	W	96.5	Very high	92.1	Very high	163 Å²	163	97 Å²	97	62%	0.617	53%	0.527	S	S	*	.	H	α-helix	trans	-64.7	-43.5	-179.8	-172.6	23.3	0	0	0	111.9	A430 L431 D432 N436 Q437 L438	A430-W434 WeakPolarHBondContact O-CB 3.36Å; A430-W434 PolarHBondContact O-N 2.95Å; L431-W434 HydrophobicContact CD2-CE3 4.34Å; L431-W434 PolarHBondContact O-N 3.22Å; D432-W434 VanDerWaalsContact C-N 3.31Å; D432-W434 PolarHBondContact O-N 3.44Å; W434-N436 PolarHBondContact O-N 3.18Å; W434-Q437 PolarHBondContact O-N 3.45Å; W434-L438 HydrophobicContact CD2-CD1 4.32Å; W434-L438 HydrophobicContact CG-CD1 4.33Å; W434-L438 HydrophobicContact CZ2-CD1 4.38Å; W434-L438 WeakPolarHBondContact O-CG 3.38Å; W434-L438 PolarHBondContact O-N 3.17Å
435	T	97.3	Very high	93.2	Very high	80 Å²	80	98.7 Å²	98.7	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-60.8	-44.8	178.2	-55.7	0	0	0	0	111.4	L431 D432 Q437 L438 N439	L431-T435 WeakPolarHBondContact O-CB 3.44Å; L431-T435 PolarHBondContact O-N 3.31Å; L431-T435 PolarHBondContact O-OG1 2.9Å; D432-T435 PolarHBondContact O-N 2.86Å; T435-Q437 PolarHBondContact O-N 3.33Å; T435-L438 PolarHBondContact O-N 2.68Å; T435-N439 WeakPolarHBondContact O-CB 3.48Å; T435-N439 PolarHBondContact O-N 3.4Å
436	N	96.4	Very high	94.1	Very high	107 Å²	107	101.1 Å²	101.1	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-63.8	-42	177.8	-74.2	-25.1	0	0	0	112.3	D432 K433 W434 N439 S440	D432-N436 WeakPolarHBondContact O-CB 3.49Å; D432-N436 PolarHBondContact O-N 3.19Å; D432-N436 PolarHBondContact O-ND2 3.49Å; K433-N436 PolarHBondContact O-N 2.7Å; W434-N436 PolarHBondContact O-N 3.18Å; N436-N439 PolarHBondContact O-N 3.29Å; N436-S440 PolarHBondContact O-N 3.49Å
437	Q	96.6	Very high	94.6	Very high	135 Å²	135	100.9 Å²	100.9	63%	0.631	53%	0.528	S	S	*	.	H	α-helix	trans	-64.5	-45.2	176.7	-70.3	-64.7	-30.9	0	0	111.6	K433 W434 T435 N439 S440 L441	K433-Q437 VanDerWaalsContact O-CG 3.28Å; K433-Q437 WeakPolarHBondContact O-CG 3.02Å; K433-Q437 PolarHBondContact O-N 2.98Å; K433-Q437 VanDerWaalsContact O-N 3.08Å; W434-Q437 PolarHBondContact O-N 3.45Å; T435-Q437 PolarHBondContact O-N 3.33Å; Q437-N439 VanDerWaalsContact C-N 3.32Å; Q437-N439 PolarHBondContact O-N 2.94Å; Q437-S440 PolarHBondContact O-N 2.95Å; Q437-S440 PolarHBondContact O-OG 2.9Å; Q437-L441 WeakPolarHBondContact O-CB 3.27Å; Q437-L441 PolarHBondContact O-N 3.11Å
438	L	96.7	Very high	94.5	Very high	88 Å²	88	101.6 Å²	101.6	46%	0.461	54%	0.535	S	S	.	.	H	α-helix	trans	-61.2	-39.3	175.5	-75.1	174.5	0	0	0	112.5	W434 T435 L441 N442	W434-L438 HydrophobicContact CD2-CD1 4.32Å; W434-L438 HydrophobicContact CG-CD1 4.33Å; W434-L438 HydrophobicContact CZ2-CD1 4.38Å; W434-L438 WeakPolarHBondContact O-CG 3.38Å; W434-L438 PolarHBondContact O-N 3.17Å; T435-L438 PolarHBondContact O-N 2.68Å; L438-L441 PolarHBondContact O-N 3.16Å; L438-N442 WeakPolarHBondContact O-CB 3.4Å; L438-N442 PolarHBondContact O-N 3.45Å
439	N	96.7	Very high	93.9	Very high	85 Å²	85	103.5 Å²	103.5	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-64.5	-44.7	177.2	-166.2	16.2	0	0	0	111.5	T435 N436 Q437 L441 N442 Q443	T435-N439 WeakPolarHBondContact O-CB 3.48Å; T435-N439 PolarHBondContact O-N 3.4Å; N436-N439 PolarHBondContact O-N 3.29Å; Q437-N439 VanDerWaalsContact C-N 3.32Å; Q437-N439 PolarHBondContact O-N 2.94Å; N439-L441 PolarHBondContact O-N 2.7Å; N439-N442 PolarHBondContact O-N 3.02Å; N439-Q443 WeakPolarHBondContact O-CG 3.38Å; N439-Q443 PolarHBondContact O-N 3.31Å
440	S	95.6	Very high	92.3	Very high	55 Å²	55	106.3 Å²	106.3	39%	0.385	58%	0.584	S	S	.	*	H	α-helix	trans	-63.5	-39.2	175.8	70.7	0	0	0	0	112.7	N436 Q437 Q443 A444	N436-S440 PolarHBondContact O-N 3.49Å; Q437-S440 PolarHBondContact O-N 2.95Å; Q437-S440 PolarHBondContact O-OG 2.9Å; S440-Q443 PolarHBondContact O-N 3.08Å; S440-A444 PolarHBondContact O-N 3.04Å
441	L	95.4	Very high	92.3	Very high	105 Å²	105	108.6 Å²	108.6	55%	0.55	59%	0.588	S	S	.	*	H	α-helix	trans	-64.1	-44.5	176.2	-178.2	66.7	0	0	0	111.1	Q437 L438 N439 Q443 A444 V445	Q437-L441 WeakPolarHBondContact O-CB 3.27Å; Q437-L441 PolarHBondContact O-N 3.11Å; L438-L441 PolarHBondContact O-N 3.16Å; N439-L441 PolarHBondContact O-N 2.7Å; L441-Q443 PolarHBondContact O-N 3.05Å; L441-A444 PolarHBondContact O-N 3.18Å; L441-V445 WeakPolarHBondContact O-CG2 3.48Å; L441-V445 PolarHBondContact O-N 2.88Å
442	N	95.5	Very high	92.1	Very high	94 Å²	94	110 Å²	110	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-58.9	-48	176.6	-179	34.9	0	0	0	111.4	L438 N439 A444 V445 V446	L438-N442 WeakPolarHBondContact O-CB 3.4Å; L438-N442 PolarHBondContact O-N 3.45Å; N439-N442 PolarHBondContact O-N 3.02Å; N442-A444 VanDerWaalsContact C-N 3.31Å; N442-A444 PolarHBondContact O-N 3.2Å; N442-V445 PolarHBondContact O-N 2.99Å; N442-V446 WeakPolarHBondContact O-CG2 3.42Å; N442-V446 PolarHBondContact O-N 3.15Å
443	Q	94.7	Very high	92	Very high	126 Å²	126	110.4 Å²	110.4	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-58.6	-42.3	176.2	-72	178.2	-4.1	0	0	112.3	N439 S440 L441 V446 S447	N439-Q443 WeakPolarHBondContact O-CG 3.38Å; N439-Q443 PolarHBondContact O-N 3.31Å; S440-Q443 PolarHBondContact O-N 3.08Å; L441-Q443 PolarHBondContact O-N 3.05Å; Q443-V446 PolarHBondContact O-N 3.05Å; Q443-S447 WeakPolarHBondContact O-CB 3.43Å; Q443-S447 PolarHBondContact O-N 2.86Å
444	A	94	Very high	91.8	Very high	50 Å²	50	107.6 Å²	107.6	41%	0.413	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-41.1	177.4	0	0	0	0	0	112.6	S440 L441 N442 S447 K448	S440-A444 PolarHBondContact O-N 3.04Å; L441-A444 PolarHBondContact O-N 3.18Å; N442-A444 VanDerWaalsContact C-N 3.31Å; N442-A444 PolarHBondContact O-N 3.2Å; A444-S447 PolarHBondContact O-N 2.96Å; A444-S447 PolarHBondContact O-OG 2.85Å; A444-K448 WeakPolarHBondContact O-CG 3.18Å; A444-K448 PolarHBondContact O-N 2.91Å
445	V	94	Very high	91.5	Very high	84 Å²	84	104.2 Å²	104.2	51%	0.509	59%	0.593	S	S	.	*	H	α-helix	trans	-65.8	-44.5	176.6	172.4	0	0	0	0	111.2	L441 N442 S447 K448	L441-V445 WeakPolarHBondContact O-CG2 3.48Å; L441-V445 PolarHBondContact O-N 2.88Å; N442-V445 PolarHBondContact O-N 2.99Å; V445-S447 VanDerWaalsContact C-N 3.3Å; V445-S447 PolarHBondContact O-N 2.75Å; V445-K448 WeakPolarHBondContact O-CB 3.37Å; V445-K448 PolarHBondContact O-N 2.82Å
446	V	94.7	Very high	91.1	Very high	92 Å²	92	105.8 Å²	105.8	56%	0.558	60%	0.6	S	S	*	*	H	α-helix	trans	-62	-39.1	177.6	172.5	0	0	0	0	111.3	N442 Q443 K448 L449	N442-V446 WeakPolarHBondContact O-CG2 3.42Å; N442-V446 PolarHBondContact O-N 3.15Å; Q443-V446 PolarHBondContact O-N 3.05Å; V446-K448 PolarHBondContact O-N 2.77Å; V446-K448 VanDerWaalsContact O-N 3.16Å; V446-L449 PolarHBondContact O-N 2.89Å; V446-L449 VanDerWaalsContact O-N 3.14Å
447	S	92.6	Very high	90.7	Very high	80 Å²	80	105.7 Å²	105.7	56%	0.559	60%	0.602	S	S	*	*	H	α-helix	trans	-64.7	-16.9	178.4	74.7	0	0	0	0	114.8	Q443 A444 V445	Q443-S447 WeakPolarHBondContact O-CB 3.43Å; Q443-S447 PolarHBondContact O-N 2.86Å; A444-S447 PolarHBondContact O-N 2.96Å; A444-S447 PolarHBondContact O-OG 2.85Å; V445-S447 VanDerWaalsContact C-N 3.3Å; V445-S447 PolarHBondContact O-N 2.75Å
448	K	88.9	Confident	90.3	Very high	181 Å²	181	103.5 Å²	103.5	79%	0.787	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-12	178.2	-69.1	-93.6	-177.6	175.5	0	113.2	A444 V445 V446	A444-K448 WeakPolarHBondContact O-CG 3.18Å; A444-K448 PolarHBondContact O-N 2.91Å; V445-K448 WeakPolarHBondContact O-CB 3.37Å; V445-K448 PolarHBondContact O-N 2.82Å; V446-K448 PolarHBondContact O-N 2.77Å; V446-K448 VanDerWaalsContact O-N 3.16Å
449	L	76.9	Confident	89.7	Confident	161 Å²	161	104.8 Å²	104.8	84%	0.843	61%	0.612	S	S	*	*			trans	-98.6	-5.5	-174.6	-132.8	98.3	0	0	0	113.4	V446	V446-L449 PolarHBondContact O-N 2.89Å; V446-L449 VanDerWaalsContact O-N 3.14Å
450	A	57.6	Low	89.1	Confident	144 Å²	144	106.5 Å²	106.5	100%	1.19	63%	0.626	S	S	*	*			trans	-101.2	0	166.2	0	0	0	0	0	108.8

Retrieved 450 of 450 residues in 1630.9 ms (Link to these results)

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