A0A3Q0KBA3_SCHMA Loading...

Similar to potassium channel-interacting protein 4 isoform 4-related

AlphaFold DB , UniProt , Accession A0A3Q0KBA3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 208 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	33.2	Very low	212 Å²	212	140.4 Å²	140.4	100%	1.044	84%	0.837	S	S	*	*				0	114.9	0	-69.2	-108.9	-84.7	0	0	105.9
2	Y	36.2	Very low	33.4	Very low	215 Å²	215	145.3 Å²	145.3	84%	0.843	84%	0.84	S	S	*	*			cis	-143.3	149.3	17.1	-80.2	-100.6	0	0	0	106.3
3	G	34.3	Very low	33	Very low	66 Å²	66	144.1 Å²	144.1	68%	0.68	83%	0.828	S	S	*	*				136.9	134.1	64.8	0	0	0	0	0	106.6
4	A	32.1	Very low	32.9	Very low	93 Å²	93	143.1 Å²	143.1	77%	0.769	82%	0.818	S	S	*	*				66.8	132.3	110.5	0	0	0	0	0	113.9
5	T	32.3	Very low	32.9	Very low	123 Å²	123	141.8 Å²	141.8	76%	0.755	81%	0.814	S	S	*	*			cis	-178.1	144.9	25	14.2	0	0	0	0	108
6	T	29.3	Very low	32.8	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	81%	0.808	S	S	*	*			trans	24.8	120.7	143.6	62.6	0	0	0	0	120.7
7	G	35.7	Very low	32.7	Very low	75 Å²	75	142.5 Å²	142.5	77%	0.773	81%	0.805	S	S	*	*			trans	-154.4	93	160.6	0	0	0	0	0	111.8	K9	G7-K9 PolarHBondContact O-N 3.28Å
8	S	30.7	Very low	32.7	Very low	128 Å²	128	139.1 Å²	139.1	90%	0.895	80%	0.797	S	S	*	*			trans	-55	120.8	168	-85.4	0	0	0	0	111.6
9	K	38.2	Very low	32.9	Very low	208 Å²	208	138.7 Å²	138.7	90%	0.904	80%	0.797	S	S	*	*			trans	-106.5	108.1	158.7	-86.6	-174.2	177.4	176.4	0	109.7	G7	G7-K9 PolarHBondContact O-N 3.28Å
10	K	32.8	Very low	33	Very low	211 Å²	211	141 Å²	141	92%	0.917	80%	0.798	S	S	*	*			trans	-55.2	133.3	167.4	-81.9	176.7	170	177.6	0	111.2
11	G	29.2	Very low	33.1	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	79%	0.791	S	S	*	*			trans	54.5	91.7	134.3	0	0	0	0	0	118.2
12	K	35.3	Very low	33.4	Very low	200 Å²	200	135.4 Å²	135.4	87%	0.87	78%	0.776	S	S	*	*			trans	-93.7	113	144.2	-78.6	-173.7	177.1	-178.9	0	107.8	L14	K12-L14 PolarHBondContact O-N 2.98Å
13	N	29	Very low	33.5	Very low	129 Å²	129	131.8 Å²	131.8	69%	0.69	77%	0.772	S	S	*	*			trans	-58.5	110.5	176.4	-156.6	-46.7	0	0	0	108.7	T15	N13-T15 PolarHBondContact O-N 3.06Å; N13-T15 WeakPolarHBondContact OD1-CG2 3.34Å; N13-T15 PolarHBondContact OD1-OG1 3.34Å
14	L	31.4	Very low	34.1	Very low	130 Å²	130	135.2 Å²	135.2	68%	0.681	77%	0.768	S	S	*	*			trans	-84.8	14.8	-174.3	-81.1	161.6	0	0	0	113.4	K12 S16 Y17	K12-L14 PolarHBondContact O-N 2.98Å; L14-S16 PolarHBondContact O-N 2.97Å; L14-S16 VanDerWaalsContact O-N 3.14Å; L14-Y17 HydrophobicContact CD2-CD2 4.39Å; L14-Y17 HydrophobicContact CD2-CE2 3.81Å
15	T	32.6	Very low	34.6	Very low	124 Å²	124	138.8 Å²	138.8	76%	0.761	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	5	-179.1	52	0	0	0	0	114.2	N13	N13-T15 PolarHBondContact O-N 3.06Å; N13-T15 WeakPolarHBondContact OD1-CG2 3.34Å; N13-T15 PolarHBondContact OD1-OG1 3.34Å
16	S	31	Very low	35.3	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	15.1	176.4	85.9	0	0	0	0	115.1	L14 A18	L14-S16 PolarHBondContact O-N 2.97Å; L14-S16 VanDerWaalsContact O-N 3.14Å; S16-A18 PolarHBondContact O-N 3.2Å
17	Y	30.6	Very low	36.5	Very low	193 Å²	193	141.1 Å²	141.1	76%	0.757	77%	0.768	S	S	*	*			trans	-75.1	58.2	156.8	-73.5	-81.9	0	0	0	109.4	L14 V19	L14-Y17 HydrophobicContact CD2-CD2 4.39Å; L14-Y17 HydrophobicContact CD2-CE2 3.81Å; Y17-V19 PolarHBondContact O-N 3.12Å
18	A	34.3	Very low	37.8	Very low	81 Å²	81	143 Å²	143	67%	0.669	77%	0.767	S	S	*	*			trans	-50.1	115.3	148.3	0	0	0	0	0	105.3	S16 K20	S16-A18 PolarHBondContact O-N 3.2Å; A18-K20 VanDerWaalsContact C-N 3.33Å; A18-K20 PolarHBondContact O-N 2.95Å
19	V	36.5	Very low	40.2	Very low	132 Å²	132	138.6 Å²	138.6	80%	0.8	73%	0.733	S	S	*	*			trans	-37.8	99.1	176.3	178.5	0	0	0	0	107.6	Y17 S21	Y17-V19 PolarHBondContact O-N 3.12Å; V19-S21 VanDerWaalsContact C-N 3.29Å; V19-S21 PolarHBondContact O-N 3.32Å
20	K	34.5	Very low	42.6	Very low	184 Å²	184	132 Å²	132	80%	0.8	71%	0.713	S	S	*	*			trans	-55.6	108.9	162.5	-90.5	179.1	173.6	179.2	0	103.2	A18 L22	A18-K20 VanDerWaalsContact C-N 3.33Å; A18-K20 PolarHBondContact O-N 2.95Å; K20-L22 PolarHBondContact O-N 3.09Å
21	S	34.9	Very low	45.4	Very low	94 Å²	94	124.4 Å²	124.4	66%	0.657	68%	0.682	S	S	*	*			trans	-30.8	113.4	156.6	45.8	0	0	0	0	106.4	V19 D23	V19-S21 VanDerWaalsContact C-N 3.29Å; V19-S21 PolarHBondContact O-N 3.32Å; S21-D23 PolarHBondContact O-N 2.87Å
22	L	40.4	Very low	48.3	Very low	141 Å²	141	126.1 Å²	126.1	74%	0.738	67%	0.669	S	S	*	*			trans	-56.8	97.5	171.6	-87.4	84.1	0	0	0	104.5	K20 F24	K20-L22 PolarHBondContact O-N 3.09Å; L22-F24 PolarHBondContact O-N 2.82Å
23	D	39.3	Very low	51.1	Low	140 Å²	140	121.1 Å²	121.1	75%	0.749	65%	0.648	S	S	*	*			trans	-49.7	113.4	163.5	-94.4	-26.5	0	0	0	103.7	S21 Q25	S21-D23 PolarHBondContact O-N 2.87Å; D23-Q25 VanDerWaalsContact C-N 3.3Å; D23-Q25 PolarHBondContact O-N 3.16Å
24	F	45.8	Very low	54.2	Low	138 Å²	138	115.5 Å²	115.5	61%	0.605	62%	0.617	S	S	*	*			trans	-43.2	106.7	167.7	-81.4	-97.5	0	0	0	105	L22 T26 T95	L22-F24 PolarHBondContact O-N 2.82Å; F24-T26 HydrophobicContact CB-CG2 4.46Å; F24-T26 WeakPolarHBondContact O-CG2 3.49Å; F24-T26 PolarHBondContact O-N 3.27Å; F24-T95 HydrophobicContact CZ-CG2 4.37Å
25	Q	43	Very low	57.3	Low	167 Å²	167	112.1 Å²	112.1	78%	0.78	60%	0.598	S	S	*	*			trans	-66.2	91.6	172.7	-80.7	-176.9	-2.6	0	0	104.3	D23 K27	D23-Q25 VanDerWaalsContact C-N 3.3Å; D23-Q25 PolarHBondContact O-N 3.16Å; Q25-K27 PolarHBondContact O-N 3.24Å
26	T	47	Very low	60.3	Low	134 Å²	134	113.1 Å²	113.1	82%	0.822	60%	0.596	S	S	*	*			trans	-65	4.6	-178.8	41.1	0	0	0	0	112.3	F24	F24-T26 HydrophobicContact CB-CG2 4.46Å; F24-T26 WeakPolarHBondContact O-CG2 3.49Å; F24-T26 PolarHBondContact O-N 3.27Å
27	K	53.6	Low	63.2	Low	175 Å²	175	112.3 Å²	112.3	76%	0.761	58%	0.582	S	S	*	*	S	Bend	trans	-99.8	113.5	167.4	-74.8	-173.3	177.8	179.9	0	108.8	Q25 I29	Q25-K27 PolarHBondContact O-N 3.24Å; K27-I29 PolarHBondContact O-N 3.12Å
28	P	64.6	Low	66.2	Low	116 Å²	116	103.5 Å²	103.5	75%	0.753	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-48.2	133.7	168.5	-24	32.2	0	0	0	109.6	S30	P28-S30 PolarHBondContact O-N 3.44Å
29	I	79.4	Confident	69.1	Low	35 Å²	35	104.2 Å²	104.2	18%	0.179	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-55.8	141.6	172.4	-67.6	-159.7	0	0	0	109.4	K27 K33 L34 E101	K27-I29 PolarHBondContact O-N 3.12Å; I29-K33 HydrophobicContact CD1-CD 4.08Å; I29-K33 HydrophobicContact CG2-CB 3.46Å; I29-K33 VanDerWaalsContact CG2-CB 3.46Å; I29-K33 HydrophobicContact CG2-CD 3.57Å; I29-K33 HydrophobicContact CG2-CG 3.5Å; I29-K33 VanDerWaalsContact CG2-CG 3.5Å; I29-L34 HydrophobicContact CG2-CG 4.31Å; I29-E101 HydrophobicContact CD1-CG 4.33Å; I29-E101 WeakPolarHBondContact CD1-OE1 3.24Å; I29-E101 WeakPolarHBondContact CD1-OE2 3.29Å; I29-E101 WeakPolarHBondContact CG1-OE2 3.33Å
30	S	88.6	Confident	71.9	Confident	68 Å²	68	98.7 Å²	98.7	48%	0.476	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-61.7	146.2	178.6	70.9	0	0	0	0	110.6	P28 H32 K33 L34	P28-S30 PolarHBondContact O-N 3.44Å; S30-H32 PolarHBondContact O-N 2.76Å; S30-H32 VanDerWaalsContact O-N 3.11Å; S30-K33 PolarHBondContact O-N 2.94Å; S30-K33 PolarHBondContact OG-N 3.27Å; S30-L34 PolarHBondContact O-N 3.49Å; S30-L34 VanDerWaalsContact O-N 3.17Å
31	I	91.5	Very high	74.7	Confident	53 Å²	53	93.7 Å²	93.7	27%	0.272	49%	0.491	S	S	.	.	H	α-helix	trans	-53.7	-35.1	175.2	-168.8	162.6	0	0	0	111.8	K33 L34 E35 R42 L45 Q46	I31-K33 PolarHBondContact O-N 2.75Å; I31-L34 WeakPolarHBondContact O-CB 3.43Å; I31-L34 PolarHBondContact O-N 2.84Å; I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 2.99Å; I31-R42 HydrophobicContact CD1-CG 3.75Å; I31-R42 HydrophobicContact CG1-CG 4.45Å; I31-L45 HydrophobicContact CD1-CB 4.45Å; I31-L45 HydrophobicContact CG1-CB 4.46Å; I31-L45 HydrophobicContact CG1-CD1 4.29Å; I31-Q46 HydrophobicContact CD1-CG 3.8Å
32	H	92.1	Very high	77.6	Confident	112 Å²	112	94.7 Å²	94.7	52%	0.519	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-40	177.4	-174.9	58.1	0	0	0	112.9	S30 L34 E35 M36	S30-H32 PolarHBondContact O-N 2.76Å; S30-H32 VanDerWaalsContact O-N 3.11Å; H32-L34 VanDerWaalsContact C-N 3.35Å; H32-E35 WeakPolarHBondContact CA-OE2 3.44Å; H32-E35 WeakPolarHBondContact O-CB 3.19Å; H32-E35 PolarHBondContact O-N 3.36Å; H32-M36 WeakPolarHBondContact O-CG 3.42Å; H32-M36 PolarHBondContact O-N 3.16Å
33	K	93.9	Very high	80.2	Confident	95 Å²	95	95.1 Å²	95.1	41%	0.413	48%	0.476	S	S	.	.	H	α-helix	trans	-70.4	-33.7	175.8	174.7	170.4	171.5	-168.2	0	111.3	I29 S30 I31 M36 M37	I29-K33 HydrophobicContact CD1-CD 4.08Å; I29-K33 HydrophobicContact CG2-CB 3.46Å; I29-K33 VanDerWaalsContact CG2-CB 3.46Å; I29-K33 HydrophobicContact CG2-CD 3.57Å; I29-K33 HydrophobicContact CG2-CG 3.5Å; I29-K33 VanDerWaalsContact CG2-CG 3.5Å; S30-K33 PolarHBondContact O-N 2.94Å; S30-K33 PolarHBondContact OG-N 3.27Å; I31-K33 PolarHBondContact O-N 2.75Å; K33-M36 PolarHBondContact O-N 3.41Å; K33-M36 VanDerWaalsContact O-N 3.16Å; K33-M37 HydrophobicContact CD-SD 4.21Å; K33-M37 WeakPolarHBondContact CE-SD 3.31Å; K33-M37 HydrophobicContact CG-CG 4.34Å; K33-M37 HydrophobicContact CG-SD 3.67Å; K33-M37 VanDerWaalsContact O-CG 3.27Å; K33-M37 WeakPolarHBondContact O-CG 3.41Å; K33-M37 PolarHBondContact O-N 3.41Å
34	L	94.2	Very high	82.8	Confident	10 Å²	10	91.2 Å²	91.2	5%	0.052	45%	0.454	C	S	.	.	H	α-helix	trans	-65.3	-37.9	171.2	-68	174.1	0	0	0	112.4	I29 S30 I31 H32 M36 M37 T38 L45 F100 E101	I29-L34 HydrophobicContact CG2-CG 4.31Å; S30-L34 PolarHBondContact O-N 3.49Å; S30-L34 VanDerWaalsContact O-N 3.17Å; I31-L34 WeakPolarHBondContact O-CB 3.43Å; I31-L34 PolarHBondContact O-N 2.84Å; H32-L34 VanDerWaalsContact C-N 3.35Å; L34-M36 PolarHBondContact O-N 3.16Å; L34-M37 PolarHBondContact O-N 2.86Å; L34-T38 WeakPolarHBondContact O-CB 3.38Å; L34-T38 WeakPolarHBondContact O-CG2 3.21Å; L34-T38 PolarHBondContact O-N 3.26Å; L34-T38 PolarHBondContact O-OG1 3.15Å; L34-L45 HydrophobicContact CB-CD1 3.79Å; L34-L45 HydrophobicContact CB-CD2 4.23Å; L34-F100 HydrophobicContact CD1-CD1 3.91Å; L34-F100 HydrophobicContact CD1-CE1 3.72Å; L34-E101 HydrophobicContact CD2-CB 4.12Å; L34-E101 HydrophobicContact CD2-CG 3.99Å
35	E	95.6	Very high	85.2	Confident	59 Å²	59	84.8 Å²	84.8	28%	0.276	43%	0.425	S	S	.	.	H	α-helix	trans	-60.7	-29.2	172.1	-68.4	176	102.2	0	0	112	I31 H32 R42 L45	I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 2.99Å; H32-E35 WeakPolarHBondContact CA-OE2 3.44Å; H32-E35 WeakPolarHBondContact O-CB 3.19Å; H32-E35 PolarHBondContact O-N 3.36Å; E35-R42 WeakPolarHBondContact OE1-CB 3.38Å; E35-R42 IonicContact OE1-NE 3.24Å; E35-R42 IonicContact OE2-CZ 2.59Å; E35-R42 IonicContact OE2-NE 2.92Å; E35-R42 PolarHBondContact OE2-NE 2.81Å; E35-R42 IonicContact OE2-NH2 3.85Å; E35-R42 PolarHBondContact OE2-NH2 3.08Å; E35-L45 HydrophobicContact CB-CD1 4.48Å; E35-L45 HydrophobicContact CG-CD1 3.74Å
36	M	94.5	Very high	87.6	Confident	146 Å²	146	81.3 Å²	81.3	72%	0.719	41%	0.409	S	S	*	.	H	α-helix	trans	-83.8	-26.4	176.4	-66.8	-179.3	67.2	0	0	113.8	H32 K33 L34	H32-M36 WeakPolarHBondContact O-CG 3.42Å; H32-M36 PolarHBondContact O-N 3.16Å; K33-M36 PolarHBondContact O-N 3.41Å; K33-M36 VanDerWaalsContact O-N 3.16Å; L34-M36 PolarHBondContact O-N 3.16Å
37	M	93.1	Very high	89.8	Confident	86 Å²	86	79.8 Å²	79.8	42%	0.424	40%	0.396	S	S	.	.	H	α-helix	trans	-94.7	-13.8	-175.7	-69.7	175.6	64.1	0	0	113.1	K33 L34 E101	K33-M37 HydrophobicContact CD-SD 4.21Å; K33-M37 WeakPolarHBondContact CE-SD 3.31Å; K33-M37 HydrophobicContact CG-CG 4.34Å; K33-M37 HydrophobicContact CG-SD 3.67Å; K33-M37 VanDerWaalsContact O-CG 3.27Å; K33-M37 WeakPolarHBondContact O-CG 3.41Å; K33-M37 PolarHBondContact O-N 3.41Å; L34-M37 PolarHBondContact O-N 2.86Å; M37-E101 WeakPolarHBondContact CE-OE1 3.11Å
38	T	94.4	Very high	91.7	Very high	8 Å²	8	73.4 Å²	73.4	5%	0.049	37%	0.369	C	S	.	.	S	Bend	trans	-129.7	160.6	-175.3	70.4	0	0	0	0	110.7	L34 F40 A104	L34-T38 WeakPolarHBondContact O-CB 3.38Å; L34-T38 WeakPolarHBondContact O-CG2 3.21Å; L34-T38 PolarHBondContact O-N 3.26Å; L34-T38 PolarHBondContact O-OG1 3.15Å; T38-F40 PolarHBondContact O-N 2.86Å; T38-F40 PolarHBondContact OG1-N 2.65Å; T38-A104 HydrophobicContact CG2-CB 4.43Å
39	N	94.1	Very high	93	Very high	96 Å²	96	72.6 Å²	72.6	51%	0.513	35%	0.352	S	S	.	.	S	Bend	trans	-86.7	18.1	173.3	-62.6	-27.6	0	0	0	111.6	S108 K112	N39-S108 PolarHBondContact N-OG 3.03Å; N39-K112 HydrophobicContact CB-CB 3.65Å; N39-K112 HydrophobicContact CB-CD 4.23Å; N39-K112 PolarHBondContact ND2-O 3.11Å; N39-K112 WeakPolarHBondContact O-CD 3.44Å
40	F	94.5	Very high	93.5	Very high	15 Å²	15	77 Å²	77	7%	0.066	37%	0.372	C	S	.	.			trans	-94.7	139.9	177.6	-68.6	-61	0	0	0	111.7	T38 E44 L45 L48 A104 L107 K112	T38-F40 PolarHBondContact O-N 2.86Å; T38-F40 PolarHBondContact OG1-N 2.65Å; F40-E44 HydrophobicContact CB-CB 4.13Å; F40-E44 HydrophobicContact CD1-CB 3.93Å; F40-E44 HydrophobicContact CG-CB 4.39Å; F40-L45 HydrophobicContact CB-CD1 4.44Å; F40-L45 HydrophobicContact CB-CD2 3.83Å; F40-L45 HydrophobicContact CB-CG 3.71Å; F40-L45 HydrophobicContact CD2-CD2 4.11Å; F40-L45 HydrophobicContact CG-CD2 4.34Å; F40-L48 HydrophobicContact CD1-CD1 4.12Å; F40-L48 HydrophobicContact CD2-CD1 3.81Å; F40-L48 HydrophobicContact CE1-CD1 4Å; F40-L48 HydrophobicContact CE2-CD1 3.64Å; F40-L48 HydrophobicContact CG-CD1 4.07Å; F40-L48 HydrophobicContact CZ-CD1 3.78Å; F40-A104 WeakPolarHBondContact CE2-O 3.46Å; F40-L107 HydrophobicContact CE2-CB 4.34Å; F40-L107 HydrophobicContact CE2-CG 4.47Å; F40-L107 HydrophobicContact CZ-CB 4.37Å; F40-L107 HydrophobicContact CZ-CD2 4.11Å; F40-L107 HydrophobicContact CZ-CG 4.03Å; F40-K112 HydrophobicContact CD1-CD 3.67Å; F40-K112 HydrophobicContact CE1-CD 3.67Å; F40-K112 HydrophobicContact CE1-CG 4.29Å; F40-K112 HydrophobicContact CG-CD 4.49Å
41	T	94.9	Very high	93.6	Very high	79 Å²	79	75.4 Å²	75.4	49%	0.485	37%	0.367	S	S	.	.			trans	-69.4	160.1	167.5	63.3	0	0	0	0	111.2	K43 E44 L45	T41-K43 PolarHBondContact O-N 3.06Å; T41-K43 VanDerWaalsContact O-N 3.15Å; T41-E44 WeakPolarHBondContact CB-OE2 3.43Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.42Å; T41-E44 PolarHBondContact N-OE2 2.68Å; T41-E44 PolarHBondContact O-N 2.91Å; T41-E44 VanDerWaalsContact O-N 3.12Å; T41-E44 WeakPolarHBondContact OG1-CG 3.48Å; T41-E44 PolarHBondContact OG1-N 3.23Å; T41-E44 PolarHBondContact OG1-OE2 2.87Å; T41-L45 PolarHBondContact O-N 2.98Å
42	R	95.6	Very high	93.6	Very high	115 Å²	115	73.5 Å²	73.5	43%	0.434	36%	0.356	S	S	.	.	H	α-helix	trans	-45.4	-45.9	170.7	-174.6	163.6	-72.7	-140.3	-4.5	113.7	I31 E35 L45 Q46	I31-R42 HydrophobicContact CD1-CG 3.75Å; I31-R42 HydrophobicContact CG1-CG 4.45Å; E35-R42 WeakPolarHBondContact OE1-CB 3.38Å; E35-R42 IonicContact OE1-NE 3.24Å; E35-R42 IonicContact OE2-CZ 2.59Å; E35-R42 IonicContact OE2-NE 2.92Å; E35-R42 PolarHBondContact OE2-NE 2.81Å; E35-R42 IonicContact OE2-NH2 3.85Å; E35-R42 PolarHBondContact OE2-NH2 3.08Å; R42-L45 PolarHBondContact O-N 3.28Å; R42-Q46 VanDerWaalsContact O-CG 3.29Å; R42-Q46 WeakPolarHBondContact O-CG 3.49Å; R42-Q46 PolarHBondContact O-N 3.11Å
43	K	94.9	Very high	93.5	Very high	151 Å²	151	71.6 Å²	71.6	66%	0.657	35%	0.346	S	S	*	.	H	α-helix	trans	-68.6	-42.2	-175.9	-174.7	176	179.2	-177.1	0	111.1	T41 Q46 L47	T41-K43 PolarHBondContact O-N 3.06Å; T41-K43 VanDerWaalsContact O-N 3.15Å; K43-Q46 PolarHBondContact O-N 3.49Å; K43-L47 WeakPolarHBondContact O-CG 3.01Å; K43-L47 PolarHBondContact O-N 2.82Å; K43-L47 VanDerWaalsContact O-N 3.09Å
44	E	94.2	Very high	93.4	Very high	58 Å²	58	74.8 Å²	74.8	27%	0.271	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-45.3	174.5	-71.3	165.5	131.7	0	0	111	F40 T41 Q46 L47 L48 K112	F40-E44 HydrophobicContact CB-CB 4.13Å; F40-E44 HydrophobicContact CD1-CB 3.93Å; F40-E44 HydrophobicContact CG-CB 4.39Å; T41-E44 WeakPolarHBondContact CB-OE2 3.43Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.42Å; T41-E44 PolarHBondContact N-OE2 2.68Å; T41-E44 PolarHBondContact O-N 2.91Å; T41-E44 VanDerWaalsContact O-N 3.12Å; T41-E44 WeakPolarHBondContact OG1-CG 3.48Å; T41-E44 PolarHBondContact OG1-N 3.23Å; T41-E44 PolarHBondContact OG1-OE2 2.87Å; E44-Q46 VanDerWaalsContact C-N 3.31Å; E44-Q46 PolarHBondContact O-N 3.38Å; E44-L47 PolarHBondContact O-N 3.11Å; E44-L48 WeakPolarHBondContact O-CB 3.33Å; E44-L48 WeakPolarHBondContact O-CG 3.44Å; E44-L48 PolarHBondContact O-N 2.97Å; E44-K112 WeakPolarHBondContact OE1-CE 3.22Å; E44-K112 IonicContact OE1-NZ 2.8Å; E44-K112 PolarHBondContact OE1-NZ 3.34Å; E44-K112 IonicContact OE2-NZ 2.68Å
45	L	94.9	Very high	93.1	Very high	2 Å²	2	78.3 Å²	78.3	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-59.5	-40.2	176.1	-72	169.8	0	0	0	112.5	I31 L34 E35 F40 T41 R42 Y49 A104	I31-L45 HydrophobicContact CD1-CB 4.45Å; I31-L45 HydrophobicContact CG1-CB 4.46Å; I31-L45 HydrophobicContact CG1-CD1 4.29Å; L34-L45 HydrophobicContact CB-CD1 3.79Å; L34-L45 HydrophobicContact CB-CD2 4.23Å; E35-L45 HydrophobicContact CB-CD1 4.48Å; E35-L45 HydrophobicContact CG-CD1 3.74Å; F40-L45 HydrophobicContact CB-CD1 4.44Å; F40-L45 HydrophobicContact CB-CD2 3.83Å; F40-L45 HydrophobicContact CB-CG 3.71Å; F40-L45 HydrophobicContact CD2-CD2 4.11Å; F40-L45 HydrophobicContact CG-CD2 4.34Å; T41-L45 PolarHBondContact O-N 2.98Å; R42-L45 PolarHBondContact O-N 3.28Å; L45-Y49 VanDerWaalsContact O-CB 3.31Å; L45-Y49 WeakPolarHBondContact O-CB 3.45Å; L45-Y49 PolarHBondContact O-N 3.44Å; L45-A104 HydrophobicContact CD2-CB 4.23Å
46	Q	94.1	Very high	92.9	Very high	95 Å²	95	75.9 Å²	75.9	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-43.7	176	-75.3	171.6	-25.8	0	0	112.1	I31 R42 K43 E44 Y49 Q50	I31-Q46 HydrophobicContact CD1-CG 3.8Å; R42-Q46 VanDerWaalsContact O-CG 3.29Å; R42-Q46 WeakPolarHBondContact O-CG 3.49Å; R42-Q46 PolarHBondContact O-N 3.11Å; K43-Q46 PolarHBondContact O-N 3.49Å; E44-Q46 VanDerWaalsContact C-N 3.31Å; E44-Q46 PolarHBondContact O-N 3.38Å; Q46-Y49 PolarHBondContact O-N 3.15Å; Q46-Q50 VanDerWaalsContact O-CG 3.29Å; Q46-Q50 WeakPolarHBondContact O-CG 3.33Å; Q46-Q50 PolarHBondContact O-N 3.38Å
47	L	93.2	Very high	92.7	Very high	102 Å²	102	73.5 Å²	73.5	53%	0.534	37%	0.365	S	S	.	.	H	α-helix	trans	-66.8	-43.4	177.5	-69.9	171.9	0	0	0	111.7	K43 E44 Y49 Q50 G51	K43-L47 WeakPolarHBondContact O-CG 3.01Å; K43-L47 PolarHBondContact O-N 2.82Å; K43-L47 VanDerWaalsContact O-N 3.09Å; E44-L47 PolarHBondContact O-N 3.11Å; L47-Y49 VanDerWaalsContact C-N 3.31Å; L47-Y49 PolarHBondContact O-N 2.94Å; L47-Q50 PolarHBondContact O-N 3.22Å; L47-G51 PolarHBondContact O-N 3.25Å
48	L	92.5	Very high	92.5	Very high	40 Å²	40	73.8 Å²	73.8	21%	0.209	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-43.7	174	-73	174.2	0	0	0	111.1	F40 E44 G51 F52 F100 F103 L107	F40-L48 HydrophobicContact CD1-CD1 4.12Å; F40-L48 HydrophobicContact CD2-CD1 3.81Å; F40-L48 HydrophobicContact CE1-CD1 4Å; F40-L48 HydrophobicContact CE2-CD1 3.64Å; F40-L48 HydrophobicContact CG-CD1 4.07Å; F40-L48 HydrophobicContact CZ-CD1 3.78Å; E44-L48 WeakPolarHBondContact O-CB 3.33Å; E44-L48 WeakPolarHBondContact O-CG 3.44Å; E44-L48 PolarHBondContact O-N 2.97Å; L48-G51 PolarHBondContact O-N 3.14Å; L48-F52 VanDerWaalsContact O-CB 3.31Å; L48-F52 WeakPolarHBondContact O-CB 3.38Å; L48-F52 PolarHBondContact O-N 3.41Å; L48-F100 HydrophobicContact CB-CE2 3.98Å; L48-F100 HydrophobicContact CB-CZ 4.01Å; L48-F103 HydrophobicContact CD2-CE1 4.44Å; L48-L107 HydrophobicContact CD1-CD2 4.2Å; L48-L107 HydrophobicContact CD2-CD2 3.6Å
49	Y	92	Very high	92.3	Very high	99 Å²	99	74.4 Å²	74.4	39%	0.388	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-41.2	178.3	-174.7	-105.8	0	0	0	112.4	L45 Q46 L47 F52 K53 F100	L45-Y49 VanDerWaalsContact O-CB 3.31Å; L45-Y49 WeakPolarHBondContact O-CB 3.45Å; L45-Y49 PolarHBondContact O-N 3.44Å; Q46-Y49 PolarHBondContact O-N 3.15Å; L47-Y49 VanDerWaalsContact C-N 3.31Å; L47-Y49 PolarHBondContact O-N 2.94Å; Y49-F52 PolarHBondContact O-N 3.04Å; Y49-K53 HydrophobicContact CD1-CG 4.17Å; Y49-K53 HydrophobicContact CD2-CG 4.31Å; Y49-K53 HydrophobicContact CE1-CD 4.46Å; Y49-K53 HydrophobicContact CE1-CG 3.64Å; Y49-K53 HydrophobicContact CE2-CD 4.24Å; Y49-K53 HydrophobicContact CE2-CG 3.81Å; Y49-K53 HydrophobicContact CG-CG 4.48Å; Y49-K53 VanDerWaalsContact CZ-CG 3.44Å; Y49-K53 WeakPolarHBondContact O-CB 3.35Å; Y49-K53 PolarHBondContact O-N 3.42Å; Y49-F100 HydrophobicContact CD2-CB 4.26Å; Y49-F100 AromaticContact CD2-CD1 3.64Å; Y49-F100 HydrophobicContact CD2-CD1 3.64Å; Y49-F100 AromaticContact CD2-CD2 3.9Å; Y49-F100 HydrophobicContact CD2-CD2 3.9Å; Y49-F100 AromaticContact CD2-CE1 3.88Å; Y49-F100 HydrophobicContact CD2-CE1 3.88Å; Y49-F100 HydrophobicContact CD2-CE2 4.15Å; Y49-F100 AromaticContact CD2-CG 3.64Å; Y49-F100 HydrophobicContact CD2-CG 3.64Å; Y49-F100 HydrophobicContact CD2-CZ 4.14Å; Y49-F100 HydrophobicContact CE2-CB 4.43Å; Y49-F100 HydrophobicContact CE2-CD1 4.37Å; Y49-F100 HydrophobicContact CE2-CG 4.27Å; Y49-F100 HydrophobicContact CG-CE1 4.37Å; Y49-F100 HydrophobicContact CG-CZ 4.39Å
50	Q	91.7	Very high	92.2	Very high	127 Å²	127	71.9 Å²	71.9	59%	0.593	37%	0.372	S	S	*	.	H	α-helix	trans	-60.2	-47.1	175.1	-74.7	173	-0.8	0	0	111.4	Q46 L47 K53 H54	Q46-Q50 VanDerWaalsContact O-CG 3.29Å; Q46-Q50 WeakPolarHBondContact O-CG 3.33Å; Q46-Q50 PolarHBondContact O-N 3.38Å; L47-Q50 PolarHBondContact O-N 3.22Å; Q50-K53 PolarHBondContact O-N 3.48Å; Q50-H54 WeakPolarHBondContact O-CB 3.34Å; Q50-H54 PolarHBondContact O-N 2.96Å
51	G	90.3	Very high	92	Very high	36 Å²	36	71.4 Å²	71.4	37%	0.371	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-45.2	175.3	0	0	0	0	0	112.4	L47 L48 H54 I55	L47-G51 PolarHBondContact O-N 3.25Å; L48-G51 PolarHBondContact O-N 3.14Å; G51-H54 PolarHBondContact O-N 3.48Å; G51-I55 WeakPolarHBondContact O-CG1 3.45Å; G51-I55 PolarHBondContact O-N 3.01Å
52	F	90.6	Very high	91.9	Very high	13 Å²	13	69.5 Å²	69.5	6%	0.057	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-47.9	178	-173.4	-85.6	0	0	0	112	L48 Y49 H54 I55 C56 G59 A61 F100 F103	L48-F52 VanDerWaalsContact O-CB 3.31Å; L48-F52 WeakPolarHBondContact O-CB 3.38Å; L48-F52 PolarHBondContact O-N 3.41Å; Y49-F52 PolarHBondContact O-N 3.04Å; F52-H54 VanDerWaalsContact C-N 3.33Å; F52-H54 PolarHBondContact O-N 3.46Å; F52-I55 PolarHBondContact O-N 3.2Å; F52-C56 HydrophobicContact CD1-CB 4.4Å; F52-C56 HydrophobicContact CE1-CB 4.1Å; F52-C56 HydrophobicContact CZ-CB 4.47Å; F52-C56 WeakPolarHBondContact O-CA 3.33Å; F52-C56 WeakPolarHBondContact O-CB 3.44Å; F52-C56 PolarHBondContact O-N 2.99Å; F52-G59 WeakPolarHBondContact CE1-O 3.47Å; F52-A61 HydrophobicContact CE2-CB 3.85Å; F52-A61 HydrophobicContact CZ-CB 3.83Å; F52-F100 HydrophobicContact CB-CD2 3.8Å; F52-F100 HydrophobicContact CB-CE2 4.14Å; F52-F100 HydrophobicContact CD1-CB 4.27Å; F52-F100 HydrophobicContact CD1-CD2 4.16Å; F52-F100 HydrophobicContact CD2-CD2 4.14Å; F52-F100 HydrophobicContact CE1-CB 4.27Å; F52-F100 AromaticContact CG-CD2 3.78Å; F52-F100 HydrophobicContact CG-CD2 3.78Å; F52-F103 HydrophobicContact CD2-CB 4.21Å; F52-F103 AromaticContact CD2-CD1 3.8Å; F52-F103 HydrophobicContact CD2-CD1 3.8Å; F52-F103 HydrophobicContact CD2-CE1 4.33Å; F52-F103 AromaticContact CD2-CG 3.92Å; F52-F103 HydrophobicContact CD2-CG 3.92Å; F52-F103 HydrophobicContact CE2-CB 3.95Å; F52-F103 HydrophobicContact CE2-CD1 4.39Å; F52-F103 HydrophobicContact CE2-CG 4.07Å
53	K	90.9	Very high	91.6	Very high	71 Å²	71	67.4 Å²	67.4	31%	0.309	36%	0.355	S	S	.	.	H	α-helix	trans	-69	-29.9	178.8	-76	-71.8	-81.9	177	0	113.3	Y49 Q50 I55 C56 P57	Y49-K53 HydrophobicContact CD1-CG 4.17Å; Y49-K53 HydrophobicContact CD2-CG 4.31Å; Y49-K53 HydrophobicContact CE1-CD 4.46Å; Y49-K53 HydrophobicContact CE1-CG 3.64Å; Y49-K53 HydrophobicContact CE2-CD 4.24Å; Y49-K53 HydrophobicContact CE2-CG 3.81Å; Y49-K53 HydrophobicContact CG-CG 4.48Å; Y49-K53 VanDerWaalsContact CZ-CG 3.44Å; Y49-K53 WeakPolarHBondContact O-CB 3.35Å; Y49-K53 PolarHBondContact O-N 3.42Å; Q50-K53 PolarHBondContact O-N 3.48Å; K53-I55 VanDerWaalsContact C-N 3.32Å; K53-C56 CarbonylContact O-C 3.6Å; K53-P57 PolarHBondContact NZ-O 3.26Å; K53-P57 WeakPolarHBondContact O-CA 3.24Å
54	H	91.2	Very high	91.4	Very high	162 Å²	162	66.6 Å²	66.6	75%	0.75	35%	0.353	S	S	*	.	H	α-helix	trans	-63.1	-41.4	173.7	-178.8	73.3	0	0	0	111.3	Q50 G51 F52	Q50-H54 WeakPolarHBondContact O-CB 3.34Å; Q50-H54 PolarHBondContact O-N 2.96Å; G51-H54 PolarHBondContact O-N 3.48Å; F52-H54 VanDerWaalsContact C-N 3.33Å; F52-H54 PolarHBondContact O-N 3.46Å
55	I	88.3	Confident	91.2	Very high	84 Å²	84	65.3 Å²	65.3	43%	0.431	35%	0.35	S	S	.	.	H	α-helix	trans	-80.7	-37.6	179.5	-61.8	165.8	0	0	0	111.3	G51 F52 K53 P57 V69	G51-I55 WeakPolarHBondContact O-CG1 3.45Å; G51-I55 PolarHBondContact O-N 3.01Å; F52-I55 PolarHBondContact O-N 3.2Å; K53-I55 VanDerWaalsContact C-N 3.32Å; I55-P57 WeakPolarHBondContact O-CD 3.27Å; I55-V69 HydrophobicContact CD1-CG2 3.83Å; I55-V69 HydrophobicContact CG2-CG2 3.58Å
56	C	90.8	Very high	90.9	Very high	8 Å²	8	66.5 Å²	66.5	5%	0.054	36%	0.356	C	S	.	.			trans	-124.1	77.4	-175	-57.8	0	0	0	0	110.7	F52 K53 S58 G59 V60 A61	F52-C56 HydrophobicContact CD1-CB 4.4Å; F52-C56 HydrophobicContact CE1-CB 4.1Å; F52-C56 HydrophobicContact CZ-CB 4.47Å; F52-C56 WeakPolarHBondContact O-CA 3.33Å; F52-C56 WeakPolarHBondContact O-CB 3.44Å; F52-C56 PolarHBondContact O-N 2.99Å; K53-C56 CarbonylContact O-C 3.6Å; C56-S58 PolarHBondContact O-N 2.9Å; C56-S58 VanDerWaalsContact O-N 3.12Å; C56-G59 PolarHBondContact O-N 3.44Å; C56-V60 WeakPolarHBondContact CB-O 3.25Å; C56-A61 VanDerWaalsContact SG-CB 3.51Å
57	P	90	Very high	90.6	Very high	96 Å²	96	62.8 Å²	62.8	62%	0.623	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.2	-177.5	-27.8	35.8	0	0	0	114.1	K53 I55 G59	K53-P57 PolarHBondContact NZ-O 3.26Å; K53-P57 WeakPolarHBondContact O-CA 3.24Å; I55-P57 WeakPolarHBondContact O-CD 3.27Å; P57-G59 PolarHBondContact O-N 2.99Å
58	S	90.5	Very high	90.2	Very high	92 Å²	92	59.8 Å²	59.8	64%	0.643	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.4	174.1	57.5	0	0	0	0	113.5	C56 V60	C56-S58 PolarHBondContact O-N 2.9Å; C56-S58 VanDerWaalsContact O-N 3.12Å; S58-V60 PolarHBondContact OG-N 3.17Å; S58-V60 PolarHBondContact OG-O 2.98Å
59	G	88.5	Confident	89.8	Confident	21 Å²	21	60.1 Å²	60.1	22%	0.216	34%	0.336	C	S	.	.	S	Bend	trans	87.2	4.4	-174	0	0	0	0	0	114.6	F52 C56 P57	F52-G59 WeakPolarHBondContact CE1-O 3.47Å; C56-G59 PolarHBondContact O-N 3.44Å; P57-G59 PolarHBondContact O-N 2.99Å
60	V	92.1	Very high	89.3	Confident	43 Å²	43	56.8 Å²	56.8	26%	0.261	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.1	173.4	-68	0	0	0	0	109.8	C56 S58 Q97 L98	C56-V60 WeakPolarHBondContact CB-O 3.25Å; S58-V60 PolarHBondContact OG-N 3.17Å; S58-V60 PolarHBondContact OG-O 2.98Å; V60-Q97 HydrophobicContact CB-CB 4.45Å; V60-L98 CarbonylContact C-O 3.58Å; V60-L98 WeakPolarHBondContact CA-O 3.4Å
61	A	91.8	Very high	88.9	Confident	6 Å²	6	56 Å²	56	5%	0.05	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.3	175.4	0	0	0	0	0	109.6	F52 C56 S65 Q97 L98	F52-A61 HydrophobicContact CE2-CB 3.85Å; F52-A61 HydrophobicContact CZ-CB 3.83Å; C56-A61 VanDerWaalsContact SG-CB 3.51Å; A61-S65 VanDerWaalsContact CA-OG 3.27Å; A61-S65 WeakPolarHBondContact CA-OG 3.34Å; A61-S65 WeakPolarHBondContact CB-OG 3.34Å; A61-Q97 CarbonylContact O-C 3.54Å; A61-Q97 WeakPolarHBondContact O-CA 3.47Å; A61-L98 HydrophobicContact CB-CB 4.22Å; A61-L98 PolarHBondContact N-O 3.5Å; A61-L98 PolarHBondContact O-N 3.38Å
62	S	91.7	Very high	88.4	Confident	38 Å²	38	64.7 Å²	64.7	27%	0.266	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	164.3	168.5	81.8	0	0	0	0	110.8	E64 S65 F66	S62-E64 VanDerWaalsContact CB-OE2 3.25Å; S62-E64 WeakPolarHBondContact CB-OE2 3.43Å; S62-E64 PolarHBondContact O-N 3.42Å; S62-E64 PolarHBondContact OG-N 3.47Å; S62-E64 PolarHBondContact OG-OE2 3.03Å; S62-S65 PolarHBondContact N-OG 3.1Å; S62-S65 PolarHBondContact O-N 3.16Å; S62-S65 VanDerWaalsContact O-N 3.09Å; S62-S65 PolarHBondContact O-OG 3.36Å; S62-S65 PolarHBondContact OG-N 2.96Å; S62-F66 PolarHBondContact O-N 3.08Å
63	K	90.6	Very high	87.5	Confident	71 Å²	71	71.3 Å²	71.3	31%	0.309	37%	0.365	S	S	.	.	H	α-helix	trans	-50.6	-42	171.9	-174.2	175.8	179.5	178.6	0	112.1	F66 I67 F87	K63-F66 PolarHBondContact O-N 2.74Å; K63-I67 HydrophobicContact CG-CD1 3.79Å; K63-I67 HydrophobicContact CG-CG1 4.49Å; K63-I67 WeakPolarHBondContact O-CB 3.05Å; K63-I67 VanDerWaalsContact O-CG1 3.24Å; K63-I67 WeakPolarHBondContact O-CG1 3.34Å; K63-I67 PolarHBondContact O-N 3.36Å; K63-F87 VanDerWaalsContact CA-CE2 3.47Å; K63-F87 HydrophobicContact CB-CD1 4.28Å; K63-F87 HydrophobicContact CB-CD2 4.46Å; K63-F87 HydrophobicContact CB-CE1 4.02Å; K63-F87 HydrophobicContact CB-CE2 4.18Å; K63-F87 HydrophobicContact CB-CG 4.49Å; K63-F87 HydrophobicContact CB-CZ 3.96Å; K63-F87 HydrophobicContact CG-CD1 4.2Å; K63-F87 HydrophobicContact CG-CE1 4.43Å; K63-F87 HydrophobicContact CG-CG 4.3Å
64	E	89.3	Confident	86.7	Confident	135 Å²	135	72.4 Å²	72.4	63%	0.631	37%	0.37	S	S	*	.	H	α-helix	trans	-64.9	-44.1	179.3	-60.1	66.4	-140.8	0	0	111.4	S62 I67 G68	S62-E64 VanDerWaalsContact CB-OE2 3.25Å; S62-E64 WeakPolarHBondContact CB-OE2 3.43Å; S62-E64 PolarHBondContact O-N 3.42Å; S62-E64 PolarHBondContact OG-N 3.47Å; S62-E64 PolarHBondContact OG-OE2 3.03Å; E64-I67 PolarHBondContact O-N 3.08Å; E64-G68 PolarHBondContact O-N 3.47Å
65	S	89.8	Confident	85.8	Confident	30 Å²	30	69 Å²	69	21%	0.21	36%	0.363	C	S	.	.	H	α-helix	trans	-65.6	-41.8	178	69.4	0	0	0	0	112	A61 S62 G68 V69	A61-S65 VanDerWaalsContact CA-OG 3.27Å; A61-S65 WeakPolarHBondContact CA-OG 3.34Å; A61-S65 WeakPolarHBondContact CB-OG 3.34Å; S62-S65 PolarHBondContact N-OG 3.1Å; S62-S65 PolarHBondContact O-N 3.16Å; S62-S65 VanDerWaalsContact O-N 3.09Å; S62-S65 PolarHBondContact O-OG 3.36Å; S62-S65 PolarHBondContact OG-N 2.96Å; S65-G68 PolarHBondContact O-N 2.83Å; S65-V69 WeakPolarHBondContact O-CG2 3.45Å; S65-V69 PolarHBondContact O-N 3.04Å
66	F	89.3	Confident	85	Confident	27 Å²	27	72 Å²	72	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-49.6	175.8	-179.9	-86.9	0	0	0	111.4	S62 K63 G68 V69 Y70 A83 C86 F87 F90 L98	S62-F66 PolarHBondContact O-N 3.08Å; K63-F66 PolarHBondContact O-N 2.74Å; F66-G68 PolarHBondContact O-N 2.62Å; F66-V69 PolarHBondContact O-N 3.34Å; F66-V69 VanDerWaalsContact O-N 3.17Å; F66-Y70 WeakPolarHBondContact O-CB 3.33Å; F66-Y70 PolarHBondContact O-N 3.21Å; F66-A83 WeakPolarHBondContact CE1-O 3.28Å; F66-C86 HydrophobicContact CE1-CB 4.18Å; F66-C86 HydrophobicContact CZ-CB 4.12Å; F66-F87 HydrophobicContact CB-CD2 3.54Å; F66-F87 HydrophobicContact CB-CE2 3.97Å; F66-F87 HydrophobicContact CD1-CB 3.89Å; F66-F87 AromaticContact CD1-CD2 3.92Å; F66-F87 HydrophobicContact CD1-CD2 3.92Å; F66-F87 HydrophobicContact CD1-CG 4.41Å; F66-F87 HydrophobicContact CD2-CD2 4.11Å; F66-F87 HydrophobicContact CE1-CB 4.03Å; F66-F87 HydrophobicContact CG-CB 4.41Å; F66-F87 AromaticContact CG-CD2 3.6Å; F66-F87 HydrophobicContact CG-CD2 3.6Å; F66-F87 HydrophobicContact CG-CE2 4.43Å; F66-F87 HydrophobicContact CG-CG 4.5Å; F66-F90 HydrophobicContact CE2-CD2 4.08Å; F66-F90 HydrophobicContact CE2-CE2 4.3Å; F66-F90 HydrophobicContact CZ-CD2 4.17Å; F66-F90 HydrophobicContact CZ-CE2 4.32Å; F66-L98 HydrophobicContact CD2-CD1 3.69Å; F66-L98 HydrophobicContact CE2-CD1 4.14Å; F66-L98 HydrophobicContact CG-CD1 4.45Å
67	I	87.3	Confident	84	Confident	18 Å²	18	75 Å²	75	9%	0.092	39%	0.39	C	S	.	.	H	α-helix	trans	-61.6	-35.8	176.4	-68.5	170.7	0	0	0	110.6	K63 E64 Y70 R71 A78 A83 Q84	K63-I67 HydrophobicContact CG-CD1 3.79Å; K63-I67 HydrophobicContact CG-CG1 4.49Å; K63-I67 WeakPolarHBondContact O-CB 3.05Å; K63-I67 VanDerWaalsContact O-CG1 3.24Å; K63-I67 WeakPolarHBondContact O-CG1 3.34Å; K63-I67 PolarHBondContact O-N 3.36Å; E64-I67 PolarHBondContact O-N 3.08Å; I67-Y70 PolarHBondContact O-N 3.09Å; I67-R71 HydrophobicContact CG2-CG 4.44Å; I67-R71 WeakPolarHBondContact O-CB 3.47Å; I67-R71 VanDerWaalsContact O-CG 3.24Å; I67-R71 WeakPolarHBondContact O-CG 3.34Å; I67-R71 PolarHBondContact O-N 3.32Å; I67-A78 WeakPolarHBondContact CG2-O 3.43Å; I67-A83 HydrophobicContact CG1-CB 4.22Å; I67-Q84 HydrophobicContact CD1-CG 4.09Å
68	G	85.8	Confident	82.3	Confident	38 Å²	38	72.6 Å²	72.6	39%	0.392	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-42.3	174.3	0	0	0	0	0	113.3	E64 S65 F66 R71 R72	E64-G68 PolarHBondContact O-N 3.47Å; S65-G68 PolarHBondContact O-N 2.83Å; F66-G68 PolarHBondContact O-N 2.62Å; G68-R71 WeakPolarHBondContact O-CB 3.29Å; G68-R72 PolarHBondContact O-N 3.4Å
69	V	83.9	Confident	81.2	Confident	48 Å²	48	72.5 Å²	72.5	29%	0.291	38%	0.377	S	S	.	.	H	α-helix	trans	-67.5	-47.1	173.2	177	0	0	0	0	110.7	I55 S65 F66 R71 R72 F73	I55-V69 HydrophobicContact CD1-CG2 3.83Å; I55-V69 HydrophobicContact CG2-CG2 3.58Å; S65-V69 WeakPolarHBondContact O-CG2 3.45Å; S65-V69 PolarHBondContact O-N 3.04Å; F66-V69 PolarHBondContact O-N 3.34Å; F66-V69 VanDerWaalsContact O-N 3.17Å; V69-R71 VanDerWaalsContact C-N 3.26Å; V69-R71 PolarHBondContact O-N 2.64Å; V69-R72 VanDerWaalsContact O-CB 3.31Å; V69-R72 WeakPolarHBondContact O-CB 3.43Å; V69-R72 PolarHBondContact O-N 2.94Å; V69-F73 HydrophobicContact CG1-CD2 4.28Å; V69-F73 HydrophobicContact CG1-CE2 3.84Å; V69-F73 WeakPolarHBondContact O-CD2 3.49Å
70	Y	81.6	Confident	80.6	Confident	29 Å²	29	71.9 Å²	71.9	11%	0.114	37%	0.369	C	S	.	.	H	α-helix	trans	-55.6	-43.1	178.2	-169.8	-84.9	0	0	0	111.6	F66 I67 R72 F73 F74 Y82 A83 L149	F66-Y70 WeakPolarHBondContact O-CB 3.33Å; F66-Y70 PolarHBondContact O-N 3.21Å; I67-Y70 PolarHBondContact O-N 3.09Å; Y70-R72 VanDerWaalsContact C-N 3.25Å; Y70-R72 PolarHBondContact O-N 3.2Å; Y70-F73 PolarHBondContact O-N 2.84Å; Y70-F73 VanDerWaalsContact O-N 3.14Å; Y70-F74 HydrophobicContact CD1-CB 4.36Å; Y70-F74 AromaticContact CD1-CD2 3.78Å; Y70-F74 HydrophobicContact CD1-CD2 3.78Å; Y70-F74 HydrophobicContact CD1-CG 4.49Å; Y70-F74 HydrophobicContact CD2-CD2 4.22Å; Y70-F74 HydrophobicContact CD2-CE2 4.34Å; Y70-F74 HydrophobicContact CE1-CB 4.05Å; Y70-F74 AromaticContact CE1-CD2 3.39Å; Y70-F74 HydrophobicContact CE1-CD2 3.39Å; Y70-F74 HydrophobicContact CE1-CE2 4.12Å; Y70-F74 AromaticContact CE1-CG 3.96Å; Y70-F74 HydrophobicContact CE1-CG 3.96Å; Y70-F74 AromaticContact CE2-CD2 3.87Å; Y70-F74 HydrophobicContact CE2-CD2 3.87Å; Y70-F74 AromaticContact CE2-CE2 3.8Å; Y70-F74 HydrophobicContact CE2-CE2 3.8Å; Y70-F74 HydrophobicContact CG-CD2 4.17Å; Y70-F74 AromaticContact CZ-CD2 3.42Å; Y70-F74 VanDerWaalsContact CZ-CD2 3.42Å; Y70-F74 AromaticContact CZ-CE2 3.66Å; Y70-F74 WeakPolarHBondContact O-CD2 3.41Å; Y70-F74 PolarHBondContact O-N 3.34Å; Y70-Y82 WeakPolarHBondContact OH-CD1 3.38Å; Y70-A83 HydrophobicContact CD1-CB 3.65Å; Y70-A83 HydrophobicContact CD2-CB 4.2Å; Y70-A83 HydrophobicContact CE1-CB 3.94Å; Y70-A83 HydrophobicContact CE2-CB 4.45Å; Y70-A83 HydrophobicContact CG-CB 3.8Å; Y70-L149 HydrophobicContact CE1-CD1 4.15Å
71	R	82.7	Confident	80.3	Confident	110 Å²	110	71.6 Å²	71.6	42%	0.415	37%	0.371	S	S	.	.	H	α-helix	trans	-55.2	-36	172.9	-83.7	172.6	-167.3	-176.3	-1	113.3	I67 G68 V69 F73 F74 P75 A78	I67-R71 HydrophobicContact CG2-CG 4.44Å; I67-R71 WeakPolarHBondContact O-CB 3.47Å; I67-R71 VanDerWaalsContact O-CG 3.24Å; I67-R71 WeakPolarHBondContact O-CG 3.34Å; I67-R71 PolarHBondContact O-N 3.32Å; G68-R71 WeakPolarHBondContact O-CB 3.29Å; V69-R71 VanDerWaalsContact C-N 3.26Å; V69-R71 PolarHBondContact O-N 2.64Å; R71-F73 VanDerWaalsContact C-N 3.28Å; R71-F73 PolarHBondContact O-N 3.08Å; R71-F74 CarbonylContact O-C 3.36Å; R71-F74 PolarHBondContact O-N 2.95Å; R71-P75 WeakPolarHBondContact O-CA 3.29Å; R71-A78 HydrophobicContact CG-CB 4.12Å; R71-A78 PolarHBondContact NE-O 2.9Å; R71-A78 PolarHBondContact NH2-O 2.59Å
72	R	80	Confident	80.2	Confident	219 Å²	219	73.1 Å²	73.1	83%	0.826	38%	0.376	S	S	*	.	H	α-helix	trans	-66.5	-34.7	-179.6	-172.4	174.9	176.7	169.7	-1.3	111.9	G68 V69 Y70	G68-R72 PolarHBondContact O-N 3.4Å; V69-R72 VanDerWaalsContact O-CB 3.31Å; V69-R72 WeakPolarHBondContact O-CB 3.43Å; V69-R72 PolarHBondContact O-N 2.94Å; Y70-R72 VanDerWaalsContact C-N 3.25Å; Y70-R72 PolarHBondContact O-N 3.2Å
73	F	72.7	Confident	80.1	Confident	151 Å²	151	71.4 Å²	71.4	66%	0.662	36%	0.364	S	S	*	.	H	α-helix	trans	-79.5	-31.8	173.8	-65.8	-78.4	0	0	0	112.1	V69 Y70 R71 P75	V69-F73 HydrophobicContact CG1-CD2 4.28Å; V69-F73 HydrophobicContact CG1-CE2 3.84Å; V69-F73 WeakPolarHBondContact O-CD2 3.49Å; Y70-F73 PolarHBondContact O-N 2.84Å; Y70-F73 VanDerWaalsContact O-N 3.14Å; R71-F73 VanDerWaalsContact C-N 3.28Å; R71-F73 PolarHBondContact O-N 3.08Å; F73-P75 WeakPolarHBondContact O-CD 3.31Å
74	F	73.8	Confident	80.1	Confident	94 Å²	94	71.7 Å²	71.7	41%	0.412	37%	0.366	S	S	.	.	S	Bend	trans	-125.8	68.9	-179.3	-54.5	-76.5	0	0	0	111.6	Y70 R71 N76 R77	Y70-F74 HydrophobicContact CD1-CB 4.36Å; Y70-F74 AromaticContact CD1-CD2 3.78Å; Y70-F74 HydrophobicContact CD1-CD2 3.78Å; Y70-F74 HydrophobicContact CD1-CG 4.49Å; Y70-F74 HydrophobicContact CD2-CD2 4.22Å; Y70-F74 HydrophobicContact CD2-CE2 4.34Å; Y70-F74 HydrophobicContact CE1-CB 4.05Å; Y70-F74 AromaticContact CE1-CD2 3.39Å; Y70-F74 HydrophobicContact CE1-CD2 3.39Å; Y70-F74 HydrophobicContact CE1-CE2 4.12Å; Y70-F74 AromaticContact CE1-CG 3.96Å; Y70-F74 HydrophobicContact CE1-CG 3.96Å; Y70-F74 AromaticContact CE2-CD2 3.87Å; Y70-F74 HydrophobicContact CE2-CD2 3.87Å; Y70-F74 AromaticContact CE2-CE2 3.8Å; Y70-F74 HydrophobicContact CE2-CE2 3.8Å; Y70-F74 HydrophobicContact CG-CD2 4.17Å; Y70-F74 AromaticContact CZ-CD2 3.42Å; Y70-F74 VanDerWaalsContact CZ-CD2 3.42Å; Y70-F74 AromaticContact CZ-CE2 3.66Å; Y70-F74 WeakPolarHBondContact O-CD2 3.41Å; Y70-F74 PolarHBondContact O-N 3.34Å; R71-F74 CarbonylContact O-C 3.36Å; R71-F74 PolarHBondContact O-N 2.95Å; F74-N76 PolarHBondContact O-N 3.29Å; F74-R77 HydrophobicContact CB-CB 4.04Å; F74-R77 HydrophobicContact CB-CG 4.07Å; F74-R77 PolarHBondContact O-N 2.9Å
75	P	72.5	Confident	80.2	Confident	92 Å²	92	65.5 Å²	65.5	60%	0.597	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.3	-168	20	-32.6	0	0	0	114.4	R71 F73 R77	R71-P75 WeakPolarHBondContact O-CA 3.29Å; F73-P75 WeakPolarHBondContact O-CD 3.31Å; P75-R77 VanDerWaalsContact C-N 3.33Å; P75-R77 PolarHBondContact O-N 3.12Å
76	N	70.9	Confident	80.3	Confident	146 Å²	146	64.5 Å²	64.5	78%	0.781	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	9.1	-178.7	-61.4	-33.7	0	0	0	113.8	F74	F74-N76 PolarHBondContact O-N 3.29Å
77	R	69.5	Low	80.5	Confident	72 Å²	72	63.8 Å²	63.8	27%	0.272	33%	0.327	S	S	.	.			trans	-126	36.5	-168.2	-53	-60.7	173.2	168.5	8.8	113.5	F74 P75 S79 S80 D148 L149 L150	F74-R77 HydrophobicContact CB-CB 4.04Å; F74-R77 HydrophobicContact CB-CG 4.07Å; F74-R77 PolarHBondContact O-N 2.9Å; P75-R77 VanDerWaalsContact C-N 3.33Å; P75-R77 PolarHBondContact O-N 3.12Å; R77-S79 VanDerWaalsContact C-N 3.34Å; R77-S79 PolarHBondContact O-N 3.01Å; R77-S79 VanDerWaalsContact O-N 3.1Å; R77-S80 WeakPolarHBondContact O-CB 3.36Å; R77-S80 PolarHBondContact O-N 3.44Å; R77-S80 PolarHBondContact O-OG 3.14Å; R77-D148 PolarHBondContact NH1-O 3.5Å; R77-D148 VanDerWaalsContact NH1-O 3.08Å; R77-L149 HydrophobicContact CB-CD1 3.87Å; R77-L149 WeakPolarHBondContact CD-O 3.5Å; R77-L149 HydrophobicContact CG-CD1 3.82Å; R77-L149 PolarHBondContact NE-O 3.39Å; R77-L149 PolarHBondContact NH1-O 2.71Å; R77-L149 VanDerWaalsContact NH1-O 3.11Å; R77-L149 PolarHBondContact NH2-O 3.01Å; R77-L150 PolarHBondContact NH2-O 2.81Å
78	A	55.2	Low	80.8	Confident	44 Å²	44	65.5 Å²	65.5	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.9	-157.4	0	0	0	0	0	116.2	I67 R71	I67-A78 WeakPolarHBondContact CG2-O 3.43Å; R71-A78 HydrophobicContact CG-CB 4.12Å; R71-A78 PolarHBondContact NE-O 2.9Å; R71-A78 PolarHBondContact NH2-O 2.59Å
79	S	66	Low	81.1	Confident	90 Å²	90	64.2 Å²	64.2	63%	0.629	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	17	177	56.1	0	0	0	0	113.1	R77 A81	R77-S79 VanDerWaalsContact C-N 3.34Å; R77-S79 PolarHBondContact O-N 3.01Å; R77-S79 VanDerWaalsContact O-N 3.1Å; S79-A81 PolarHBondContact O-N 2.91Å; S79-A81 VanDerWaalsContact O-N 3.08Å
80	S	76	Confident	81.5	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.063	31%	0.306	C	S	.	.			trans	-50.6	121.9	-167.7	59.7	0	0	0	0	110	R77 Y82 A83	R77-S80 WeakPolarHBondContact O-CB 3.36Å; R77-S80 PolarHBondContact O-N 3.44Å; R77-S80 PolarHBondContact O-OG 3.14Å; S80-Y82 PolarHBondContact O-N 3.28Å; S80-A83 WeakPolarHBondContact O-CB 3.43Å; S80-A83 PolarHBondContact O-N 3.28Å
81	A	86.5	Confident	82.1	Confident	36 Å²	36	61.8 Å²	61.8	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-49.2	-31.3	178.1	0	0	0	0	0	110.6	S79 A83 Q84 L85 A145	S79-A81 PolarHBondContact O-N 2.91Å; S79-A81 VanDerWaalsContact O-N 3.08Å; A81-A83 PolarHBondContact O-N 3.01Å; A81-Q84 WeakPolarHBondContact O-CA 3.44Å; A81-Q84 VanDerWaalsContact O-CB 3.3Å; A81-Q84 WeakPolarHBondContact O-CB 3.47Å; A81-Q84 PolarHBondContact O-N 3.02Å; A81-L85 WeakPolarHBondContact O-CG 3.46Å; A81-L85 PolarHBondContact O-N 3.35Å; A81-A145 HydrophobicContact CB-CB 3.64Å
82	Y	88.8	Confident	82.3	Confident	39 Å²	39	62.9 Å²	62.9	15%	0.153	31%	0.314	C	S	.	.	H	α-helix	trans	-56.3	-43.5	174.8	-165.1	-95.5	0	0	0	114	Y70 S80 Q84 L85 C86 L125 I146 L149	Y70-Y82 WeakPolarHBondContact OH-CD1 3.38Å; S80-Y82 PolarHBondContact O-N 3.28Å; Y82-Q84 PolarHBondContact O-N 3.27Å; Y82-L85 WeakPolarHBondContact O-CB 3.46Å; Y82-L85 PolarHBondContact O-N 3.29Å; Y82-C86 WeakPolarHBondContact CE1-SG 3.3Å; Y82-C86 PolarHBondContact O-N 2.86Å; Y82-C86 PolarHBondContact O-SG 3.19Å; Y82-L125 HydrophobicContact CE2-CD2 3.94Å; Y82-I146 HydrophobicContact CD2-CG1 3.73Å; Y82-I146 HydrophobicContact CE2-CD1 4.34Å; Y82-I146 HydrophobicContact CE2-CG1 3.72Å; Y82-L149 HydrophobicContact CD1-CD2 3.72Å; Y82-L149 HydrophobicContact CD2-CD2 4.5Å; Y82-L149 HydrophobicContact CE1-CD2 4.19Å; Y82-L149 HydrophobicContact CG-CD2 3.88Å
83	A	90	Very high	82.6	Confident	2 Å²	2	56 Å²	56	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-62.7	-31.8	175.9	0	0	0	0	0	112	F66 I67 Y70 S80 A81 F87	F66-A83 WeakPolarHBondContact CE1-O 3.28Å; I67-A83 HydrophobicContact CG1-CB 4.22Å; Y70-A83 HydrophobicContact CD1-CB 3.65Å; Y70-A83 HydrophobicContact CD2-CB 4.2Å; Y70-A83 HydrophobicContact CE1-CB 3.94Å; Y70-A83 HydrophobicContact CE2-CB 4.45Å; Y70-A83 HydrophobicContact CG-CB 3.8Å; S80-A83 WeakPolarHBondContact O-CB 3.43Å; S80-A83 PolarHBondContact O-N 3.28Å; A81-A83 PolarHBondContact O-N 3.01Å; A83-F87 WeakPolarHBondContact O-CB 3.24Å; A83-F87 PolarHBondContact O-N 3.3Å
84	Q	90.8	Very high	83.3	Confident	77 Å²	77	56.7 Å²	56.7	36%	0.36	30%	0.296	S	S	.	.	H	α-helix	trans	-73.3	-40.3	176.2	-49.3	-173.3	41.4	0	0	111.4	I67 A81 Y82 F87 R88	I67-Q84 HydrophobicContact CD1-CG 4.09Å; A81-Q84 WeakPolarHBondContact O-CA 3.44Å; A81-Q84 VanDerWaalsContact O-CB 3.3Å; A81-Q84 WeakPolarHBondContact O-CB 3.47Å; A81-Q84 PolarHBondContact O-N 3.02Å; Y82-Q84 PolarHBondContact O-N 3.27Å; Q84-F87 PolarHBondContact O-N 2.83Å; Q84-R88 PolarHBondContact O-N 2.88Å
85	L	92.3	Very high	84.2	Confident	5 Å²	5	55 Å²	55	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-48.3	171.9	-60.1	173.5	0	0	0	110	A81 Y82 F87 R88 V89 L125 I128 V142 A145	A81-L85 WeakPolarHBondContact O-CG 3.46Å; A81-L85 PolarHBondContact O-N 3.35Å; Y82-L85 WeakPolarHBondContact O-CB 3.46Å; Y82-L85 PolarHBondContact O-N 3.29Å; L85-F87 PolarHBondContact O-N 3.36Å; L85-R88 WeakPolarHBondContact O-CB 3.15Å; L85-R88 PolarHBondContact O-N 2.96Å; L85-V89 WeakPolarHBondContact O-CG2 3.42Å; L85-V89 PolarHBondContact O-N 3.28Å; L85-L125 HydrophobicContact CB-CD1 3.69Å; L85-I128 HydrophobicContact CD2-CD1 4.12Å; L85-V142 HydrophobicContact CD1-CB 4.18Å; L85-V142 HydrophobicContact CD1-CG1 4.23Å; L85-V142 HydrophobicContact CD1-CG2 3.92Å; L85-V142 HydrophobicContact CD2-CG2 4.47Å; L85-A145 HydrophobicContact CD1-CB 3.47Å; L85-A145 VanDerWaalsContact CD1-CB 3.47Å; L85-A145 HydrophobicContact CG-CB 4.49Å
86	C	91.6	Very high	85.1	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-57.9	-48.7	175.9	-65.1	0	0	0	0	111.8	F66 Y82 R88 V89 F90	F66-C86 HydrophobicContact CE1-CB 4.18Å; F66-C86 HydrophobicContact CZ-CB 4.12Å; Y82-C86 WeakPolarHBondContact CE1-SG 3.3Å; Y82-C86 PolarHBondContact O-N 2.86Å; Y82-C86 PolarHBondContact O-SG 3.19Å; C86-R88 VanDerWaalsContact C-N 3.25Å; C86-R88 PolarHBondContact O-N 2.98Å; C86-V89 PolarHBondContact O-N 3.42Å; C86-F90 WeakPolarHBondContact O-CD2 3.47Å; C86-F90 PolarHBondContact O-N 2.93Å; C86-F90 VanDerWaalsContact O-N 3.15Å
87	F	92.8	Very high	86.2	Confident	11 Å²	11	49.4 Å²	49.4	5%	0.048	27%	0.266	C	S	.	.	H	α-helix	trans	-54.8	-42.9	177.9	-178.8	-90.6	0	0	0	112	K63 F66 A83 Q84 L85 V89 F90 D91 G96 L98	K63-F87 VanDerWaalsContact CA-CE2 3.47Å; K63-F87 HydrophobicContact CB-CD1 4.28Å; K63-F87 HydrophobicContact CB-CD2 4.46Å; K63-F87 HydrophobicContact CB-CE1 4.02Å; K63-F87 HydrophobicContact CB-CE2 4.18Å; K63-F87 HydrophobicContact CB-CG 4.49Å; K63-F87 HydrophobicContact CB-CZ 3.96Å; K63-F87 HydrophobicContact CG-CD1 4.2Å; K63-F87 HydrophobicContact CG-CE1 4.43Å; K63-F87 HydrophobicContact CG-CG 4.3Å; F66-F87 HydrophobicContact CB-CD2 3.54Å; F66-F87 HydrophobicContact CB-CE2 3.97Å; F66-F87 HydrophobicContact CD1-CB 3.89Å; F66-F87 AromaticContact CD1-CD2 3.92Å; F66-F87 HydrophobicContact CD1-CD2 3.92Å; F66-F87 HydrophobicContact CD1-CG 4.41Å; F66-F87 HydrophobicContact CD2-CD2 4.11Å; F66-F87 HydrophobicContact CE1-CB 4.03Å; F66-F87 HydrophobicContact CG-CB 4.41Å; F66-F87 AromaticContact CG-CD2 3.6Å; F66-F87 HydrophobicContact CG-CD2 3.6Å; F66-F87 HydrophobicContact CG-CE2 4.43Å; F66-F87 HydrophobicContact CG-CG 4.5Å; A83-F87 WeakPolarHBondContact O-CB 3.24Å; A83-F87 PolarHBondContact O-N 3.3Å; Q84-F87 PolarHBondContact O-N 2.83Å; L85-F87 PolarHBondContact O-N 3.36Å; F87-V89 VanDerWaalsContact C-N 3.31Å; F87-V89 PolarHBondContact O-N 3.37Å; F87-F90 PolarHBondContact O-N 2.88Å; F87-D91 HydrophobicContact CD1-CB 4.44Å; F87-D91 HydrophobicContact CE1-CB 4.06Å; F87-D91 PolarHBondContact O-N 3.28Å; F87-G96 WeakPolarHBondContact CZ-O 3.41Å; F87-L98 HydrophobicContact CD2-CD1 3.78Å; F87-L98 HydrophobicContact CD2-CG 4.04Å; F87-L98 HydrophobicContact CE2-CD1 3.71Å; F87-L98 HydrophobicContact CE2-CD2 4.22Å; F87-L98 HydrophobicContact CE2-CG 3.51Å; F87-L98 HydrophobicContact CZ-CD2 4.36Å; F87-L98 HydrophobicContact CZ-CG 4Å
88	R	92.8	Very high	87.3	Confident	55 Å²	55	46 Å²	46	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-58.3	-42.6	177.2	-174.1	-166.3	69.9	-122.8	-1.6	112	Q84 L85 C86 F90 D91 S124 L125 I128	Q84-R88 PolarHBondContact O-N 2.88Å; L85-R88 WeakPolarHBondContact O-CB 3.15Å; L85-R88 PolarHBondContact O-N 2.96Å; C86-R88 VanDerWaalsContact C-N 3.25Å; C86-R88 PolarHBondContact O-N 2.98Å; R88-F90 VanDerWaalsContact C-N 3.31Å; R88-F90 PolarHBondContact O-N 2.97Å; R88-D91 CarbonylContact O-C 3.52Å; R88-D91 PolarHBondContact O-N 2.95Å; R88-S124 PolarHBondContact NH2-O 2.96Å; R88-S124 VanDerWaalsContact NH2-O 3.14Å; R88-L125 PolarHBondContact NH2-O 2.92Å; R88-I128 WeakPolarHBondContact CD-O 3.37Å
89	V	93.4	Very high	89.1	Confident	10 Å²	10	46 Å²	46	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-37.3	179.2	-176.2	0	0	0	0	111.5	L85 C86 F87 Q92 W121 S124 L125	L85-V89 WeakPolarHBondContact O-CG2 3.42Å; L85-V89 PolarHBondContact O-N 3.28Å; C86-V89 PolarHBondContact O-N 3.42Å; F87-V89 VanDerWaalsContact C-N 3.31Å; F87-V89 PolarHBondContact O-N 3.37Å; V89-Q92 WeakPolarHBondContact O-CG 3.32Å; V89-W121 HydrophobicContact CB-CZ2 4.18Å; V89-W121 HydrophobicContact CG1-CD2 4.08Å; V89-W121 HydrophobicContact CG1-CG 4.15Å; V89-W121 HydrophobicContact CG1-CZ2 4.07Å; V89-W121 VanDerWaalsContact CG1-NE1 3.3Å; V89-S124 WeakPolarHBondContact CG2-O 3.43Å; V89-L125 HydrophobicContact CG2-CB 4.01Å; V89-L125 HydrophobicContact CG2-CD1 3.8Å
90	F	92.7	Very high	90.3	Very high	15 Å²	15	42.8 Å²	42.8	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-38.5	173.6	-81.5	-89.1	0	0	0	112.2	F66 C86 F87 R88 Q92 L98 F103 L110 W121	F66-F90 HydrophobicContact CE2-CD2 4.08Å; F66-F90 HydrophobicContact CE2-CE2 4.3Å; F66-F90 HydrophobicContact CZ-CD2 4.17Å; F66-F90 HydrophobicContact CZ-CE2 4.32Å; C86-F90 WeakPolarHBondContact O-CD2 3.47Å; C86-F90 PolarHBondContact O-N 2.93Å; C86-F90 VanDerWaalsContact O-N 3.15Å; F87-F90 PolarHBondContact O-N 2.88Å; R88-F90 VanDerWaalsContact C-N 3.31Å; R88-F90 PolarHBondContact O-N 2.97Å; F90-Q92 PolarHBondContact O-N 3.33Å; F90-L98 HydrophobicContact CB-CD1 3.69Å; F90-L98 HydrophobicContact CB-CD2 3.56Å; F90-L98 HydrophobicContact CB-CG 4.28Å; F90-L98 HydrophobicContact CG-CD1 4.32Å; F90-F103 HydrophobicContact CE1-CD2 4.4Å; F90-L110 HydrophobicContact CE2-CD1 4.24Å; F90-L110 HydrophobicContact CZ-CD1 3.97Å; F90-W121 HydrophobicContact CE2-CZ2 4.23Å
91	D	93.1	Very high	91.1	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.059	23%	0.234	C	C	.	.			trans	-81.7	60.1	-178.9	-172.7	20.3	0	0	0	112	F87 R88 C93 R94 T95 G96 L98 Q102	F87-D91 HydrophobicContact CD1-CB 4.44Å; F87-D91 HydrophobicContact CE1-CB 4.06Å; F87-D91 PolarHBondContact O-N 3.28Å; R88-D91 CarbonylContact O-C 3.52Å; R88-D91 PolarHBondContact O-N 2.95Å; D91-C93 PolarHBondContact O-N 3.21Å; D91-C93 VanDerWaalsContact O-N 3.11Å; D91-R94 WeakPolarHBondContact O-CA 3.28Å; D91-R94 PolarHBondContact O-N 2.83Å; D91-R94 PolarHBondContact OD1-N 3.49Å; D91-R94 WeakPolarHBondContact OD2-CA 3.28Å; D91-T95 PolarHBondContact OD1-N 3.17Å; D91-T95 PolarHBondContact OD1-OG1 3.1Å; D91-T95 PolarHBondContact OD2-N 3.44Å; D91-G96 WeakPolarHBondContact OD2-CA 3.13Å; D91-G96 PolarHBondContact OD2-N 2.99Å; D91-L98 VanDerWaalsContact CA-CD2 3.43Å; D91-L98 HydrophobicContact CB-CD2 3.57Å; D91-Q102 PolarHBondContact OD1-NE2 3.16Å
92	Q	86.5	Confident	91.4	Very high	134 Å²	134	44.2 Å²	44.2	63%	0.626	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-30	-179.4	-64.8	-178.5	-14.5	0	0	113.3	V89 F90 R94	V89-Q92 WeakPolarHBondContact O-CG 3.32Å; F90-Q92 PolarHBondContact O-N 3.33Å; Q92-R94 VanDerWaalsContact C-N 3.29Å; Q92-R94 PolarHBondContact O-N 3.5Å
93	C	86.7	Confident	91.6	Very high	75 Å²	75	44.6 Å²	44.6	51%	0.507	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-2.7	177.8	-61.2	0	0	0	0	113.5	D91 T95	D91-C93 PolarHBondContact O-N 3.21Å; D91-C93 VanDerWaalsContact O-N 3.11Å; C93-T95 VanDerWaalsContact C-N 3.25Å; C93-T95 HydrophobicContact CB-CG2 3.7Å; C93-T95 PolarHBondContact O-N 3.46Å
94	R	88.5	Confident	91.7	Very high	164 Å²	164	44.5 Å²	44.5	62%	0.619	23%	0.225	S	C	*	.			trans	51	42.1	-179.9	-58.4	-172.9	180	-170.4	-1	113.2	D91 Q92 D129	D91-R94 WeakPolarHBondContact O-CA 3.28Å; D91-R94 PolarHBondContact O-N 2.83Å; D91-R94 PolarHBondContact OD1-N 3.49Å; D91-R94 WeakPolarHBondContact OD2-CA 3.28Å; Q92-R94 VanDerWaalsContact C-N 3.29Å; Q92-R94 PolarHBondContact O-N 3.5Å; R94-D129 PolarHBondContact NH1-O 3.21Å; R94-D129 VanDerWaalsContact NH2-C 3.27Å; R94-D129 PolarHBondContact NH2-O 2.89Å
95	T	91.1	Very high	91.8	Very high	60 Å²	60	42.1 Å²	42.1	37%	0.368	22%	0.216	S	C	.	.	S	Bend	trans	-89.5	-11.1	-177.3	65.5	0	0	0	0	113.1	F24 D91 C93 Q97	F24-T95 HydrophobicContact CZ-CG2 4.37Å; D91-T95 PolarHBondContact OD1-N 3.17Å; D91-T95 PolarHBondContact OD1-OG1 3.1Å; D91-T95 PolarHBondContact OD2-N 3.44Å; C93-T95 VanDerWaalsContact C-N 3.25Å; C93-T95 HydrophobicContact CB-CG2 3.7Å; C93-T95 PolarHBondContact O-N 3.46Å; T95-Q97 PolarHBondContact O-N 2.72Å; T95-Q97 PolarHBondContact OG1-N 3.31Å; T95-Q97 PolarHBondContact OG1-O 3.02Å
96	G	92.1	Very high	91.8	Very high	40 Å²	40	42 Å²	42	41%	0.412	22%	0.217	S	C	.	.	S	Bend	trans	77	4.7	-167.6	0	0	0	0	0	113.4	F87 D91	F87-G96 WeakPolarHBondContact CZ-O 3.41Å; D91-G96 WeakPolarHBondContact OD2-CA 3.13Å; D91-G96 PolarHBondContact OD2-N 2.99Å
97	Q	93.6	Very high	91.8	Very high	79 Å²	79	43.4 Å²	43.4	37%	0.369	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.2	-177.9	-62.2	-174.9	-7.3	0	0	110.6	V60 A61 T95	V60-Q97 HydrophobicContact CB-CB 4.45Å; A61-Q97 CarbonylContact O-C 3.54Å; A61-Q97 WeakPolarHBondContact O-CA 3.47Å; T95-Q97 PolarHBondContact O-N 2.72Å; T95-Q97 PolarHBondContact OG1-N 3.31Å; T95-Q97 PolarHBondContact OG1-O 3.02Å
98	L	92.8	Very high	91.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.7	171.3	-56	178.4	0	0	0	109.9	V60 A61 F66 F87 F90 D91	V60-L98 CarbonylContact C-O 3.58Å; V60-L98 WeakPolarHBondContact CA-O 3.4Å; A61-L98 HydrophobicContact CB-CB 4.22Å; A61-L98 PolarHBondContact N-O 3.5Å; A61-L98 PolarHBondContact O-N 3.38Å; F66-L98 HydrophobicContact CD2-CD1 3.69Å; F66-L98 HydrophobicContact CE2-CD1 4.14Å; F66-L98 HydrophobicContact CG-CD1 4.45Å; F87-L98 HydrophobicContact CD2-CD1 3.78Å; F87-L98 HydrophobicContact CD2-CG 4.04Å; F87-L98 HydrophobicContact CE2-CD1 3.71Å; F87-L98 HydrophobicContact CE2-CD2 4.22Å; F87-L98 HydrophobicContact CE2-CG 3.51Å; F87-L98 HydrophobicContact CZ-CD2 4.36Å; F87-L98 HydrophobicContact CZ-CG 4Å; F90-L98 HydrophobicContact CB-CD1 3.69Å; F90-L98 HydrophobicContact CB-CD2 3.56Å; F90-L98 HydrophobicContact CB-CG 4.28Å; F90-L98 HydrophobicContact CG-CD1 4.32Å; D91-L98 VanDerWaalsContact CA-CD2 3.43Å; D91-L98 HydrophobicContact CB-CD2 3.57Å
99	T	92.4	Very high	91.8	Very high	45 Å²	45	42.6 Å²	42.6	28%	0.276	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	159.8	161.7	62	0	0	0	0	110.4	E101 Q102 F103	T99-E101 PolarHBondContact O-N 3.32Å; T99-Q102 PolarHBondContact O-N 3.29Å; T99-Q102 WeakPolarHBondContact OG1-CG 3.35Å; T99-Q102 PolarHBondContact OG1-N 3.34Å; T99-Q102 PolarHBondContact OG1-OE1 3.24Å; T99-F103 PolarHBondContact O-N 3.25Å
100	F	91.9	Very high	91.6	Very high	23 Å²	23	43 Å²	43	10%	0.101	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-34	173.1	178.2	-110.9	0	0	0	112.4	L34 L48 Y49 F52 F103 A104	L34-F100 HydrophobicContact CD1-CD1 3.91Å; L34-F100 HydrophobicContact CD1-CE1 3.72Å; L48-F100 HydrophobicContact CB-CE2 3.98Å; L48-F100 HydrophobicContact CB-CZ 4.01Å; Y49-F100 HydrophobicContact CD2-CB 4.26Å; Y49-F100 AromaticContact CD2-CD1 3.64Å; Y49-F100 HydrophobicContact CD2-CD1 3.64Å; Y49-F100 AromaticContact CD2-CD2 3.9Å; Y49-F100 HydrophobicContact CD2-CD2 3.9Å; Y49-F100 AromaticContact CD2-CE1 3.88Å; Y49-F100 HydrophobicContact CD2-CE1 3.88Å; Y49-F100 HydrophobicContact CD2-CE2 4.15Å; Y49-F100 AromaticContact CD2-CG 3.64Å; Y49-F100 HydrophobicContact CD2-CG 3.64Å; Y49-F100 HydrophobicContact CD2-CZ 4.14Å; Y49-F100 HydrophobicContact CE2-CB 4.43Å; Y49-F100 HydrophobicContact CE2-CD1 4.37Å; Y49-F100 HydrophobicContact CE2-CG 4.27Å; Y49-F100 HydrophobicContact CG-CE1 4.37Å; Y49-F100 HydrophobicContact CG-CZ 4.39Å; F52-F100 HydrophobicContact CB-CD2 3.8Å; F52-F100 HydrophobicContact CB-CE2 4.14Å; F52-F100 HydrophobicContact CD1-CB 4.27Å; F52-F100 HydrophobicContact CD1-CD2 4.16Å; F52-F100 HydrophobicContact CD2-CD2 4.14Å; F52-F100 HydrophobicContact CE1-CB 4.27Å; F52-F100 AromaticContact CG-CD2 3.78Å; F52-F100 HydrophobicContact CG-CD2 3.78Å; F100-F103 HydrophobicContact CD2-CD1 4.26Å; F100-F103 HydrophobicContact CE2-CD1 4.27Å; F100-F103 PolarHBondContact O-N 3Å; F100-A104 HydrophobicContact CE1-CB 4.43Å; F100-A104 HydrophobicContact CZ-CB 4.31Å; F100-A104 VanDerWaalsContact O-CB 3.29Å; F100-A104 WeakPolarHBondContact O-CB 3.44Å; F100-A104 PolarHBondContact O-N 3.26Å
101	E	92.6	Very high	91.5	Very high	58 Å²	58	42.9 Å²	42.9	27%	0.271	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-54.2	175.4	175.1	-174.3	-179.1	0	0	111.4	I29 L34 M37 T99 F103 A104 C105	I29-E101 HydrophobicContact CD1-CG 4.33Å; I29-E101 WeakPolarHBondContact CD1-OE1 3.24Å; I29-E101 WeakPolarHBondContact CD1-OE2 3.29Å; I29-E101 WeakPolarHBondContact CG1-OE2 3.33Å; L34-E101 HydrophobicContact CD2-CB 4.12Å; L34-E101 HydrophobicContact CD2-CG 3.99Å; M37-E101 WeakPolarHBondContact CE-OE1 3.11Å; T99-E101 PolarHBondContact O-N 3.32Å; E101-F103 VanDerWaalsContact C-N 3.27Å; E101-F103 PolarHBondContact O-N 3.24Å; E101-A104 PolarHBondContact O-N 3.47Å; E101-C105 WeakPolarHBondContact O-CB 3.29Å; E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.33Å; E101-C105 VanDerWaalsContact O-SG 3.32Å
102	Q	93.3	Very high	91.3	Very high	16 Å²	16	45.8 Å²	45.8	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-42.7	178.3	-73.7	166.2	-67.4	0	0	111.5	D91 T99 G106	D91-Q102 PolarHBondContact OD1-NE2 3.16Å; T99-Q102 PolarHBondContact O-N 3.29Å; T99-Q102 WeakPolarHBondContact OG1-CG 3.35Å; T99-Q102 PolarHBondContact OG1-N 3.34Å; T99-Q102 PolarHBondContact OG1-OE1 3.24Å; Q102-G106 PolarHBondContact O-N 2.99Å
103	F	91.7	Very high	91.5	Very high	47 Å²	47	39.9 Å²	39.9	21%	0.206	21%	0.212	C	C	.	.	H	α-helix	trans	-60.5	-50.2	175.6	175.8	-103.1	0	0	0	112.2	L48 F52 F90 T99 F100 E101 G106 L107	L48-F103 HydrophobicContact CD2-CE1 4.44Å; F52-F103 HydrophobicContact CD2-CB 4.21Å; F52-F103 AromaticContact CD2-CD1 3.8Å; F52-F103 HydrophobicContact CD2-CD1 3.8Å; F52-F103 HydrophobicContact CD2-CE1 4.33Å; F52-F103 AromaticContact CD2-CG 3.92Å; F52-F103 HydrophobicContact CD2-CG 3.92Å; F52-F103 HydrophobicContact CE2-CB 3.95Å; F52-F103 HydrophobicContact CE2-CD1 4.39Å; F52-F103 HydrophobicContact CE2-CG 4.07Å; F90-F103 HydrophobicContact CE1-CD2 4.4Å; T99-F103 PolarHBondContact O-N 3.25Å; F100-F103 HydrophobicContact CD2-CD1 4.26Å; F100-F103 HydrophobicContact CE2-CD1 4.27Å; F100-F103 PolarHBondContact O-N 3Å; E101-F103 VanDerWaalsContact C-N 3.27Å; E101-F103 PolarHBondContact O-N 3.24Å; F103-G106 PolarHBondContact O-N 3.37Å; F103-L107 HydrophobicContact CE1-CD2 4.22Å; F103-L107 HydrophobicContact CZ-CD2 4.08Å; F103-L107 VanDerWaalsContact O-CB 3.29Å; F103-L107 WeakPolarHBondContact O-CB 3.27Å; F103-L107 PolarHBondContact O-N 3.25Å
104	A	92.8	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-43.1	-179.2	0	0	0	0	0	112	T38 F40 L45 F100 E101 L107 S108	T38-A104 HydrophobicContact CG2-CB 4.43Å; F40-A104 WeakPolarHBondContact CE2-O 3.46Å; L45-A104 HydrophobicContact CD2-CB 4.23Å; F100-A104 HydrophobicContact CE1-CB 4.43Å; F100-A104 HydrophobicContact CZ-CB 4.31Å; F100-A104 VanDerWaalsContact O-CB 3.29Å; F100-A104 WeakPolarHBondContact O-CB 3.44Å; F100-A104 PolarHBondContact O-N 3.26Å; E101-A104 PolarHBondContact O-N 3.47Å; A104-L107 PolarHBondContact O-N 2.69Å; A104-S108 VanDerWaalsContact O-CB 3.22Å; A104-S108 WeakPolarHBondContact O-CB 3.38Å; A104-S108 PolarHBondContact O-N 2.8Å
105	C	93.2	Very high	91.9	Very high	27 Å²	27	34.6 Å²	34.6	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-49.2	176.8	-70.5	0	0	0	0	111.7	E101 L107 S108 Q109	E101-C105 WeakPolarHBondContact O-CB 3.29Å; E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.33Å; E101-C105 VanDerWaalsContact O-SG 3.32Å; C105-L107 PolarHBondContact O-N 2.78Å; C105-S108 WeakPolarHBondContact O-CB 2.79Å; C105-S108 PolarHBondContact O-N 3.28Å; C105-Q109 PolarHBondContact O-N 2.83Å
106	G	92.2	Very high	91.9	Very high	4 Å²	4	35 Å²	35	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-40.2	178.7	0	0	0	0	0	112.6	Q102 F103 Q109 L110	Q102-G106 PolarHBondContact O-N 2.99Å; F103-G106 PolarHBondContact O-N 3.37Å; G106-Q109 WeakPolarHBondContact O-CB 3.27Å; G106-Q109 PolarHBondContact O-N 2.72Å; G106-L110 WeakPolarHBondContact O-CG 3.27Å; G106-L110 PolarHBondContact O-N 3.46Å; G106-L110 VanDerWaalsContact O-N 3.14Å
107	L	91.9	Very high	91.9	Very high	38 Å²	38	35.3 Å²	35.3	20%	0.199	19%	0.187	C	C	.	.	H	α-helix	trans	-68.1	-39.7	177.5	-171.7	65.9	0	0	0	111.4	F40 L48 F103 A104 C105 Q109 L110 T111	F40-L107 HydrophobicContact CE2-CB 4.34Å; F40-L107 HydrophobicContact CE2-CG 4.47Å; F40-L107 HydrophobicContact CZ-CB 4.37Å; F40-L107 HydrophobicContact CZ-CD2 4.11Å; F40-L107 HydrophobicContact CZ-CG 4.03Å; L48-L107 HydrophobicContact CD1-CD2 4.2Å; L48-L107 HydrophobicContact CD2-CD2 3.6Å; F103-L107 HydrophobicContact CE1-CD2 4.22Å; F103-L107 HydrophobicContact CZ-CD2 4.08Å; F103-L107 VanDerWaalsContact O-CB 3.29Å; F103-L107 WeakPolarHBondContact O-CB 3.27Å; F103-L107 PolarHBondContact O-N 3.25Å; A104-L107 PolarHBondContact O-N 2.69Å; C105-L107 PolarHBondContact O-N 2.78Å; L107-Q109 VanDerWaalsContact C-N 3.31Å; L107-Q109 PolarHBondContact O-N 3.08Å; L107-L110 PolarHBondContact O-N 3.15Å; L107-T111 HydrophobicContact CD1-CG2 3.73Å; L107-T111 HydrophobicContact CG-CG2 4.2Å; L107-T111 WeakPolarHBondContact O-CB 3.32Å; L107-T111 PolarHBondContact O-N 2.84Å; L107-T111 PolarHBondContact O-OG1 2.98Å
108	S	93.5	Very high	91.8	Very high	6 Å²	6	31.6 Å²	31.6	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-43.8	174.7	179.5	0	0	0	0	111.2	N39 A104 C105 L110 K112 G113	N39-S108 PolarHBondContact N-OG 3.03Å; A104-S108 VanDerWaalsContact O-CB 3.22Å; A104-S108 WeakPolarHBondContact O-CB 3.38Å; A104-S108 PolarHBondContact O-N 2.8Å; C105-S108 WeakPolarHBondContact O-CB 2.79Å; C105-S108 PolarHBondContact O-N 3.28Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.3Å; S108-K112 CarbonylContact O-C 3.38Å; S108-K112 WeakPolarHBondContact O-CA 3.36Å; S108-K112 PolarHBondContact O-N 3.02Å; S108-G113 PolarHBondContact O-N 3.19Å
109	Q	92.7	Very high	91.8	Very high	42 Å²	42	31.9 Å²	31.9	20%	0.196	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-40.3	179	-166.8	179.3	-0.1	0	0	111.8	C105 G106 L107 G113 D117 W121	C105-Q109 PolarHBondContact O-N 2.83Å; G106-Q109 WeakPolarHBondContact O-CB 3.27Å; G106-Q109 PolarHBondContact O-N 2.72Å; L107-Q109 VanDerWaalsContact C-N 3.31Å; L107-Q109 PolarHBondContact O-N 3.08Å; Q109-G113 WeakPolarHBondContact O-CA 3.5Å; Q109-G113 PolarHBondContact O-N 2.73Å; Q109-D117 HydrophobicContact CG-CB 3.91Å; Q109-D117 WeakPolarHBondContact CG-O 3.25Å; Q109-D117 PolarHBondContact NE2-O 3.49Å; Q109-W121 HydrophobicContact CG-CB 4.25Å
110	L	89.4	Confident	91.8	Very high	18 Å²	18	33.4 Å²	33.4	9%	0.094	17%	0.174	C	C	.	.	H	α-helix	trans	-75.9	-46.5	-179.6	-73.9	172.5	0	0	0	113.1	F90 G106 L107 S108 K118 W121 F204	F90-L110 HydrophobicContact CE2-CD1 4.24Å; F90-L110 HydrophobicContact CZ-CD1 3.97Å; G106-L110 WeakPolarHBondContact O-CG 3.27Å; G106-L110 PolarHBondContact O-N 3.46Å; G106-L110 VanDerWaalsContact O-N 3.14Å; L107-L110 PolarHBondContact O-N 3.15Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.3Å; L110-K118 VanDerWaalsContact O-CE 3.28Å; L110-K118 WeakPolarHBondContact O-CE 2.98Å; L110-W121 HydrophobicContact CD1-CD2 4.38Å; L110-W121 HydrophobicContact CD1-CH2 4.4Å; L110-W121 HydrophobicContact CD1-CZ2 3.84Å; L110-W121 HydrophobicContact CD2-CB 4.41Å; L110-W121 HydrophobicContact CD2-CD2 3.44Å; L110-W121 VanDerWaalsContact CD2-CD2 3.44Å; L110-W121 HydrophobicContact CD2-CE3 3.6Å; L110-W121 HydrophobicContact CD2-CG 3.81Å; L110-W121 HydrophobicContact CD2-CH2 4.34Å; L110-W121 HydrophobicContact CD2-CZ2 4.23Å; L110-W121 HydrophobicContact CD2-CZ3 4.04Å; L110-W121 HydrophobicContact CG-CD2 4.08Å; L110-W121 HydrophobicContact CG-CG 4.24Å; L110-W121 HydrophobicContact CG-CZ2 4.45Å; L110-F204 HydrophobicContact CD2-CD1 3.86Å; L110-F204 HydrophobicContact CD2-CE1 3.79Å; L110-F204 HydrophobicContact CD2-CG 4.42Å; L110-F204 HydrophobicContact CD2-CZ 4.3Å; L110-F204 WeakPolarHBondContact O-CB 3.45Å
111	T	89	Confident	91.9	Very high	13 Å²	13	32.6 Å²	32.6	8%	0.08	17%	0.17	C	C	.	.	H	α-helix	trans	-97.8	-23.3	-166.2	59.2	0	0	0	0	114.6	L107 T208	L107-T111 HydrophobicContact CD1-CG2 3.73Å; L107-T111 HydrophobicContact CG-CG2 4.2Å; L107-T111 WeakPolarHBondContact O-CB 3.32Å; L107-T111 PolarHBondContact O-N 2.84Å; L107-T111 PolarHBondContact O-OG1 2.98Å; T111-T208 HydrophobicContact CG2-CG2 4.01Å
112	K	90.4	Very high	91.9	Very high	73 Å²	73	30.7 Å²	30.7	32%	0.317	16%	0.162	S	C	.	.	S	Bend	trans	-132.1	5.4	-178.1	-65.4	-173.7	-178.3	-84.7	0	112.3	N39 F40 E44 S108	N39-K112 HydrophobicContact CB-CB 3.65Å; N39-K112 HydrophobicContact CB-CD 4.23Å; N39-K112 PolarHBondContact ND2-O 3.11Å; N39-K112 WeakPolarHBondContact O-CD 3.44Å; F40-K112 HydrophobicContact CD1-CD 3.67Å; F40-K112 HydrophobicContact CE1-CD 3.67Å; F40-K112 HydrophobicContact CE1-CG 4.29Å; F40-K112 HydrophobicContact CG-CD 4.49Å; E44-K112 WeakPolarHBondContact OE1-CE 3.22Å; E44-K112 IonicContact OE1-NZ 2.8Å; E44-K112 PolarHBondContact OE1-NZ 3.34Å; E44-K112 IonicContact OE2-NZ 2.68Å; S108-K112 CarbonylContact O-C 3.38Å; S108-K112 WeakPolarHBondContact O-CA 3.36Å; S108-K112 PolarHBondContact O-N 3.02Å
113	G	90.5	Very high	92	Very high	9 Å²	9	30.4 Å²	30.4	9%	0.093	16%	0.16	C	C	.	.	S	Bend	trans	-78	156.4	177.7	0	0	0	0	0	111.3	S108 Q109	S108-G113 PolarHBondContact O-N 3.19Å; Q109-G113 WeakPolarHBondContact O-CA 3.5Å; Q109-G113 PolarHBondContact O-N 2.73Å
114	S	92	Very high	92.2	Very high	55 Å²	55	30.8 Å²	30.8	39%	0.385	17%	0.169	S	C	.	.			trans	-63.9	165.6	168.1	65.5	0	0	0	0	111	L116 D117 K118	S114-L116 PolarHBondContact O-N 2.86Å; S114-L116 VanDerWaalsContact O-N 3.17Å; S114-L116 WeakPolarHBondContact OG-CB 3.37Å; S114-L116 PolarHBondContact OG-N 2.81Å; S114-D117 WeakPolarHBondContact CB-OD2 3.46Å; S114-D117 PolarHBondContact N-OD2 3.22Å; S114-D117 WeakPolarHBondContact O-CA 3.46Å; S114-D117 WeakPolarHBondContact O-CB 3.47Å; S114-D117 PolarHBondContact O-N 3.17Å; S114-D117 PolarHBondContact OG-N 2.66Å; S114-D117 PolarHBondContact OG-OD2 3.17Å; S114-K118 PolarHBondContact O-N 2.95Å
115	N	89.9	Confident	92.3	Very high	73 Å²	73	31 Å²	31	39%	0.39	17%	0.17	S	C	.	.	H	α-helix	trans	-54.7	-35.4	171.2	-72	-10.8	0	0	0	111.7	D117 K118 I119 L201	N115-D117 PolarHBondContact O-N 2.99Å; N115-K118 PolarHBondContact O-N 3.34Å; N115-I119 WeakPolarHBondContact O-CB 3.43Å; N115-I119 WeakPolarHBondContact O-CD1 3.39Å; N115-I119 WeakPolarHBondContact O-CG1 3.47Å; N115-I119 PolarHBondContact O-N 2.93Å; N115-L201 HydrophobicContact CB-CD1 4.03Å
116	L	91.4	Very high	92.4	Very high	68 Å²	68	31.1 Å²	31.1	36%	0.356	17%	0.167	S	C	.	.	H	α-helix	trans	-60.2	-43.1	173.5	170.3	64.5	0	0	0	112.2	S114 I119 K120 F188	S114-L116 PolarHBondContact O-N 2.86Å; S114-L116 VanDerWaalsContact O-N 3.17Å; S114-L116 WeakPolarHBondContact OG-CB 3.37Å; S114-L116 PolarHBondContact OG-N 2.81Å; L116-I119 PolarHBondContact O-N 3.43Å; L116-K120 HydrophobicContact CD1-CD 4.47Å; L116-K120 HydrophobicContact CG-CD 4.49Å; L116-K120 WeakPolarHBondContact O-CG 3.46Å; L116-K120 PolarHBondContact O-N 3.07Å; L116-F188 HydrophobicContact CD1-CD2 3.88Å; L116-F188 HydrophobicContact CD1-CE2 3.02Å; L116-F188 HydrophobicContact CD1-CZ 3.43Å; L116-F188 VanDerWaalsContact CD1-CZ 3.43Å; L116-F188 HydrophobicContact CG-CE2 4.38Å
117	D	92.4	Very high	92.5	Very high	47 Å²	47	31.7 Å²	31.7	25%	0.251	17%	0.169	S	C	.	.	H	α-helix	trans	-66.9	-40.6	178.9	-61.3	-43.3	0	0	0	111.4	Q109 S114 N115 K120 W121	Q109-D117 HydrophobicContact CG-CB 3.91Å; Q109-D117 WeakPolarHBondContact CG-O 3.25Å; Q109-D117 PolarHBondContact NE2-O 3.49Å; S114-D117 WeakPolarHBondContact CB-OD2 3.46Å; S114-D117 PolarHBondContact N-OD2 3.22Å; S114-D117 WeakPolarHBondContact O-CA 3.46Å; S114-D117 WeakPolarHBondContact O-CB 3.47Å; S114-D117 PolarHBondContact O-N 3.17Å; S114-D117 PolarHBondContact OG-N 2.66Å; S114-D117 PolarHBondContact OG-OD2 3.17Å; N115-D117 PolarHBondContact O-N 2.99Å; D117-K120 PolarHBondContact O-N 3.2Å; D117-W121 PolarHBondContact O-N 3.28Å
118	K	91.7	Very high	92.7	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-44.3	174.5	-62.9	173.9	-176.6	177	0	111.7	L110 S114 N115 K120 W121 I122 L201 F204 D205	L110-K118 VanDerWaalsContact O-CE 3.28Å; L110-K118 WeakPolarHBondContact O-CE 2.98Å; S114-K118 PolarHBondContact O-N 2.95Å; N115-K118 PolarHBondContact O-N 3.34Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.08Å; K118-W121 WeakPolarHBondContact O-CB 3.33Å; K118-W121 PolarHBondContact O-N 3.19Å; K118-W121 VanDerWaalsContact O-N 3.15Å; K118-I122 VanDerWaalsContact O-CG1 3.29Å; K118-I122 WeakPolarHBondContact O-CG1 3.41Å; K118-I122 PolarHBondContact O-N 3.03Å; K118-L201 HydrophobicContact CB-CD1 4.48Å; K118-L201 HydrophobicContact CB-CD2 4.25Å; K118-L201 HydrophobicContact CD-CB 4.14Å; K118-L201 PolarHBondContact NZ-O 2.96Å; K118-L201 VanDerWaalsContact NZ-O 3.16Å; K118-F204 HydrophobicContact CD-CB 4.37Å; K118-F204 HydrophobicContact CD-CD2 4.23Å; K118-D205 IonicContact NZ-OD1 3.46Å; K118-D205 PolarHBondContact NZ-OD1 3.35Å; K118-D205 IonicContact NZ-OD2 3.57Å; K118-D205 PolarHBondContact NZ-OD2 3.22Å
119	I	93	Very high	92.7	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-58.2	-45.4	175.7	-70.7	160.1	0	0	0	110.7	N115 L116 W121 I122 F123 F187 F188 T192 F197 L201	N115-I119 WeakPolarHBondContact O-CB 3.43Å; N115-I119 WeakPolarHBondContact O-CD1 3.39Å; N115-I119 WeakPolarHBondContact O-CG1 3.47Å; N115-I119 PolarHBondContact O-N 2.93Å; L116-I119 PolarHBondContact O-N 3.43Å; I119-W121 VanDerWaalsContact C-N 3.32Å; I119-W121 PolarHBondContact O-N 3.36Å; I119-I122 PolarHBondContact O-N 2.98Å; I119-F123 PolarHBondContact O-N 3.15Å; I119-F187 HydrophobicContact CG2-CD1 4.12Å; I119-F187 HydrophobicContact CG2-CE1 3.96Å; I119-F188 HydrophobicContact CD1-CE2 4.43Å; I119-F188 HydrophobicContact CG2-CD2 3.9Å; I119-F188 HydrophobicContact CG2-CE2 4.48Å; I119-T192 HydrophobicContact CD1-CG2 3.71Å; I119-F197 HydrophobicContact CG1-CE1 3.85Å; I119-L201 HydrophobicContact CD1-CD1 4.3Å; I119-L201 HydrophobicContact CG1-CD1 3.91Å
120	K	93.5	Very high	92.7	Very high	78 Å²	78	35.1 Å²	35.1	34%	0.339	20%	0.198	S	C	.	.	H	α-helix	trans	-60.8	-41.7	176	-72.1	168.9	-175	166.3	0	112.1	L116 D117 K118 F123 S124	L116-K120 HydrophobicContact CD1-CD 4.47Å; L116-K120 HydrophobicContact CG-CD 4.49Å; L116-K120 WeakPolarHBondContact O-CG 3.46Å; L116-K120 PolarHBondContact O-N 3.07Å; D117-K120 PolarHBondContact O-N 3.2Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.08Å; K120-F123 WeakPolarHBondContact O-CB 3.18Å; K120-F123 PolarHBondContact O-N 2.81Å; K120-S124 PolarHBondContact O-N 3.44Å; K120-S124 VanDerWaalsContact O-N 3.13Å; K120-S124 PolarHBondContact O-OG 2.98Å
121	W	93.3	Very high	93	Very high	6 Å²	6	38.5 Å²	38.5	2%	0.023	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-43.8	177	-171.1	93.7	0	0	0	111.4	V89 F90 Q109 L110 D117 K118 I119 F123 S124 L125	V89-W121 HydrophobicContact CB-CZ2 4.18Å; V89-W121 HydrophobicContact CG1-CD2 4.08Å; V89-W121 HydrophobicContact CG1-CG 4.15Å; V89-W121 HydrophobicContact CG1-CZ2 4.07Å; V89-W121 VanDerWaalsContact CG1-NE1 3.3Å; F90-W121 HydrophobicContact CE2-CZ2 4.23Å; Q109-W121 HydrophobicContact CG-CB 4.25Å; L110-W121 HydrophobicContact CD1-CD2 4.38Å; L110-W121 HydrophobicContact CD1-CH2 4.4Å; L110-W121 HydrophobicContact CD1-CZ2 3.84Å; L110-W121 HydrophobicContact CD2-CB 4.41Å; L110-W121 HydrophobicContact CD2-CD2 3.44Å; L110-W121 VanDerWaalsContact CD2-CD2 3.44Å; L110-W121 HydrophobicContact CD2-CE3 3.6Å; L110-W121 HydrophobicContact CD2-CG 3.81Å; L110-W121 HydrophobicContact CD2-CH2 4.34Å; L110-W121 HydrophobicContact CD2-CZ2 4.23Å; L110-W121 HydrophobicContact CD2-CZ3 4.04Å; L110-W121 HydrophobicContact CG-CD2 4.08Å; L110-W121 HydrophobicContact CG-CG 4.24Å; L110-W121 HydrophobicContact CG-CZ2 4.45Å; D117-W121 PolarHBondContact O-N 3.28Å; K118-W121 WeakPolarHBondContact O-CB 3.33Å; K118-W121 PolarHBondContact O-N 3.19Å; K118-W121 VanDerWaalsContact O-N 3.15Å; I119-W121 VanDerWaalsContact C-N 3.32Å; I119-W121 PolarHBondContact O-N 3.36Å; W121-F123 VanDerWaalsContact C-N 3.32Å; W121-F123 PolarHBondContact O-N 3.27Å; W121-S124 PolarHBondContact O-N 3.09Å; W121-L125 HydrophobicContact CH2-CD1 4.22Å; W121-L125 HydrophobicContact CH2-CD2 4.45Å; W121-L125 HydrophobicContact CZ3-CB 4.29Å; W121-L125 HydrophobicContact CZ3-CD1 4.47Å; W121-L125 HydrophobicContact CZ3-CD2 4Å; W121-L125 HydrophobicContact CZ3-CG 4.5Å; W121-L125 PolarHBondContact O-N 3.23Å
122	I	93.3	Very high	93.3	Very high	17 Å²	17	39.3 Å²	39.3	9%	0.087	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-39.2	177.5	-66.5	166	0	0	0	110.8	K118 I119 S124 L125 Y126 F187 F197 L201 F204	K118-I122 VanDerWaalsContact O-CG1 3.29Å; K118-I122 WeakPolarHBondContact O-CG1 3.41Å; K118-I122 PolarHBondContact O-N 3.03Å; I119-I122 PolarHBondContact O-N 2.98Å; I122-S124 VanDerWaalsContact C-N 3.34Å; I122-S124 PolarHBondContact O-N 3.3Å; I122-L125 VanDerWaalsContact O-CB 3.27Å; I122-L125 WeakPolarHBondContact O-CB 3.47Å; I122-L125 PolarHBondContact O-N 2.75Å; I122-L125 VanDerWaalsContact O-N 3.08Å; I122-Y126 HydrophobicContact CG2-CD2 3.86Å; I122-Y126 HydrophobicContact CG2-CE2 3.6Å; I122-Y126 VanDerWaalsContact O-CD2 3.27Å; I122-Y126 WeakPolarHBondContact O-CD2 3.32Å; I122-Y126 PolarHBondContact O-N 2.72Å; I122-Y126 VanDerWaalsContact O-N 3.15Å; I122-F187 HydrophobicContact CG2-CE1 4.4Å; I122-F187 HydrophobicContact CG2-CZ 3.93Å; I122-F197 HydrophobicContact CD1-CE1 4.24Å; I122-F197 HydrophobicContact CD1-CZ 3.66Å; I122-F197 HydrophobicContact CG2-CE2 4.45Å; I122-F197 HydrophobicContact CG2-CZ 4.09Å; I122-L201 HydrophobicContact CD1-CD2 3.27Å; I122-F204 HydrophobicContact CD1-CE2 4.14Å
123	F	95.3	Very high	93.7	Very high	10 Å²	10	39.9 Å²	39.9	4%	0.044	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-48.5	172.9	-176.6	-88.9	0	0	0	111.1	I119 K120 W121 L125 Y126 D127 G132 I134 K184 F187	I119-F123 PolarHBondContact O-N 3.15Å; K120-F123 WeakPolarHBondContact O-CB 3.18Å; K120-F123 PolarHBondContact O-N 2.81Å; W121-F123 VanDerWaalsContact C-N 3.32Å; W121-F123 PolarHBondContact O-N 3.27Å; F123-L125 PolarHBondContact O-N 3.39Å; F123-Y126 WeakPolarHBondContact O-CA 3.28Å; F123-Y126 PolarHBondContact O-N 2.67Å; F123-D127 HydrophobicContact CD1-CB 4.24Å; F123-D127 HydrophobicContact CE1-CB 3.83Å; F123-D127 HydrophobicContact CZ-CB 4.37Å; F123-D127 PolarHBondContact O-N 2.86Å; F123-G132 WeakPolarHBondContact CZ-O 3.25Å; F123-I134 HydrophobicContact CD2-CD1 3.62Å; F123-I134 HydrophobicContact CD2-CG1 4.2Å; F123-I134 HydrophobicContact CE2-CD1 3.54Å; F123-I134 HydrophobicContact CE2-CG1 3.72Å; F123-I134 HydrophobicContact CZ-CD1 4.38Å; F123-I134 HydrophobicContact CZ-CG1 4.08Å; F123-K184 HydrophobicContact CD1-CG 4.5Å; F123-K184 HydrophobicContact CE1-CB 4.27Å; F123-K184 HydrophobicContact CE1-CG 4.49Å; F123-K184 HydrophobicContact CE2-CB 4.17Å; F123-K184 HydrophobicContact CZ-CB 3.97Å; F123-F187 HydrophobicContact CB-CD1 3.97Å; F123-F187 HydrophobicContact CB-CE1 4.1Å; F123-F187 HydrophobicContact CD2-CB 3.66Å; F123-F187 AromaticContact CD2-CD1 3.71Å; F123-F187 HydrophobicContact CD2-CD1 3.71Å; F123-F187 HydrophobicContact CD2-CD2 4.37Å; F123-F187 HydrophobicContact CD2-CE1 4.47Å; F123-F187 AromaticContact CD2-CG 3.65Å; F123-F187 HydrophobicContact CD2-CG 3.65Å; F123-F187 HydrophobicContact CE2-CB 3.95Å; F123-F187 HydrophobicContact CE2-CG 4.35Å; F123-F187 HydrophobicContact CG-CD1 4.34Å
124	S	94.9	Very high	94	Very high	55 Å²	55	39.6 Å²	39.6	39%	0.385	22%	0.224	S	C	.	.	H	α-helix	trans	-63.8	-22.2	176	-60.8	0	0	0	0	114.1	R88 V89 K120 W121 I122 D127	R88-S124 PolarHBondContact NH2-O 2.96Å; R88-S124 VanDerWaalsContact NH2-O 3.14Å; V89-S124 WeakPolarHBondContact CG2-O 3.43Å; K120-S124 PolarHBondContact O-N 3.44Å; K120-S124 VanDerWaalsContact O-N 3.13Å; K120-S124 PolarHBondContact O-OG 2.98Å; W121-S124 PolarHBondContact O-N 3.09Å; I122-S124 VanDerWaalsContact C-N 3.34Å; I122-S124 PolarHBondContact O-N 3.3Å; S124-D127 VanDerWaalsContact O-O 3.09Å
125	L	94.3	Very high	94.3	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-35.4	170.7	-174	72.9	0	0	0	111.7	Y82 L85 R88 V89 W121 I122 F123 V142	Y82-L125 HydrophobicContact CE2-CD2 3.94Å; L85-L125 HydrophobicContact CB-CD1 3.69Å; R88-L125 PolarHBondContact NH2-O 2.92Å; V89-L125 HydrophobicContact CG2-CB 4.01Å; V89-L125 HydrophobicContact CG2-CD1 3.8Å; W121-L125 HydrophobicContact CH2-CD1 4.22Å; W121-L125 HydrophobicContact CH2-CD2 4.45Å; W121-L125 HydrophobicContact CZ3-CB 4.29Å; W121-L125 HydrophobicContact CZ3-CD1 4.47Å; W121-L125 HydrophobicContact CZ3-CD2 4Å; W121-L125 HydrophobicContact CZ3-CG 4.5Å; W121-L125 PolarHBondContact O-N 3.23Å; I122-L125 VanDerWaalsContact O-CB 3.27Å; I122-L125 WeakPolarHBondContact O-CB 3.47Å; I122-L125 PolarHBondContact O-N 2.75Å; I122-L125 VanDerWaalsContact O-N 3.08Å; F123-L125 PolarHBondContact O-N 3.39Å; L125-V142 WeakPolarHBondContact O-CG2 3.35Å
126	Y	95	Very high	94.6	Very high	29 Å²	29	39.5 Å²	39.5	11%	0.114	21%	0.214	C	C	.	.	H	α-helix	trans	-82.3	-40.7	177.4	-75.1	-70.1	0	0	0	113.6	I122 F123 I128 I134 E138 L139 V142 F187	I122-Y126 HydrophobicContact CG2-CD2 3.86Å; I122-Y126 HydrophobicContact CG2-CE2 3.6Å; I122-Y126 VanDerWaalsContact O-CD2 3.27Å; I122-Y126 WeakPolarHBondContact O-CD2 3.32Å; I122-Y126 PolarHBondContact O-N 2.72Å; I122-Y126 VanDerWaalsContact O-N 3.15Å; F123-Y126 WeakPolarHBondContact O-CA 3.28Å; F123-Y126 PolarHBondContact O-N 2.67Å; Y126-I128 WeakPolarHBondContact O-CG1 3.43Å; Y126-I128 PolarHBondContact O-N 3.48Å; Y126-I134 VanDerWaalsContact CB-CD1 3.48Å; Y126-I134 HydrophobicContact CD2-CD1 4.49Å; Y126-I134 HydrophobicContact CG-CD1 4.21Å; Y126-E138 WeakPolarHBondContact O-CB 3.46Å; Y126-L139 HydrophobicContact CD1-CD1 3.56Å; Y126-L139 HydrophobicContact CE1-CD1 3.37Å; Y126-V142 HydrophobicContact CD1-CB 3.67Å; Y126-V142 HydrophobicContact CD1-CG1 3.65Å; Y126-V142 HydrophobicContact CD1-CG2 3.83Å; Y126-V142 HydrophobicContact CE1-CB 3.72Å; Y126-V142 HydrophobicContact CE1-CG1 3.37Å; Y126-V142 HydrophobicContact CE1-CG2 4.39Å; Y126-F187 HydrophobicContact CD2-CE2 4.27Å; Y126-F187 HydrophobicContact CD2-CZ 4.27Å; Y126-F187 HydrophobicContact CE2-CE2 4.44Å; Y126-F187 HydrophobicContact CE2-CZ 4.38Å
127	D	96.2	Very high	94.9	Very high	16 Å²	16	40.3 Å²	40.3	9%	0.086	23%	0.226	C	C	.	.			trans	-74.1	98.2	174.8	175.6	5.6	0	0	0	109.2	F123 S124 G130 D131 G132 I134	F123-D127 HydrophobicContact CD1-CB 4.24Å; F123-D127 HydrophobicContact CE1-CB 3.83Å; F123-D127 HydrophobicContact CZ-CB 4.37Å; F123-D127 PolarHBondContact O-N 2.86Å; S124-D127 VanDerWaalsContact O-O 3.09Å; D127-G130 WeakPolarHBondContact OD1-CA 3.17Å; D127-G130 PolarHBondContact OD1-N 3.35Å; D127-D131 PolarHBondContact OD1-N 2.74Å; D127-G132 WeakPolarHBondContact OD2-CA 3.22Å; D127-G132 PolarHBondContact OD2-N 3.2Å; D127-G132 VanDerWaalsContact OD2-N 3.08Å; D127-I134 HydrophobicContact CB-CG1 4.5Å
128	I	94.3	Very high	95.1	Very high	31 Å²	31	38.6 Å²	38.6	16%	0.159	22%	0.216	C	C	.	.	S	Bend	trans	-83.8	-45.2	-170.3	-59.9	-172.5	0	0	0	110.5	L85 R88 Y126 G130 E138 E141 V142	L85-I128 HydrophobicContact CD2-CD1 4.12Å; R88-I128 WeakPolarHBondContact CD-O 3.37Å; Y126-I128 WeakPolarHBondContact O-CG1 3.43Å; Y126-I128 PolarHBondContact O-N 3.48Å; I128-G130 VanDerWaalsContact C-N 3.35Å; I128-E138 WeakPolarHBondContact CA-OE1 3.5Å; I128-E138 HydrophobicContact CB-CG 3.91Å; I128-E138 WeakPolarHBondContact CB-OE1 3.47Å; I128-E138 HydrophobicContact CD1-CB 4.04Å; I128-E138 HydrophobicContact CD1-CG 4.11Å; I128-E138 HydrophobicContact CG1-CB 3.96Å; I128-E138 HydrophobicContact CG1-CG 3.9Å; I128-E138 PolarHBondContact N-OE1 3.05Å; I128-E141 HydrophobicContact CD1-CB 3.85Å; I128-E141 HydrophobicContact CD1-CG 3.88Å; I128-E141 WeakPolarHBondContact CD1-OE1 3.03Å; I128-V142 HydrophobicContact CD1-CG2 4.29Å
129	D	93.8	Very high	95.2	Very high	85 Å²	85	38.6 Å²	38.6	46%	0.455	22%	0.216	S	C	.	.	S	Bend	trans	-83.8	-12.5	-178	73.2	12.2	0	0	0	113.4	R94 D131 E138	R94-D129 PolarHBondContact NH1-O 3.21Å; R94-D129 VanDerWaalsContact NH2-C 3.27Å; R94-D129 PolarHBondContact NH2-O 2.89Å; D129-D131 VanDerWaalsContact OD1-CB 3.26Å; D129-D131 WeakPolarHBondContact OD1-CB 3.49Å; D129-D131 VanDerWaalsContact OD1-CG 3.32Å; D129-D131 PolarHBondContact OD1-N 3.42Å; D129-E138 PolarHBondContact N-OE1 2.84Å; D129-E138 VanDerWaalsContact N-OE1 3.08Å
130	G	92.6	Very high	95.2	Very high	42 Å²	42	42.1 Å²	42.1	43%	0.433	23%	0.231	S	C	.	.			trans	79	23.3	175.6	0	0	0	0	0	113.8	D127 I128 G132	D127-G130 WeakPolarHBondContact OD1-CA 3.17Å; D127-G130 PolarHBondContact OD1-N 3.35Å; I128-G130 VanDerWaalsContact C-N 3.35Å; G130-G132 PolarHBondContact O-N 3.39Å
131	D	95.7	Very high	95.2	Very high	90 Å²	90	43.2 Å²	43.2	48%	0.481	24%	0.238	S	C	.	.	S	Bend	trans	-77.5	-6.6	-179.6	82.4	-9.7	0	0	0	113.6	D127 D129 Y133	D127-D131 PolarHBondContact OD1-N 2.74Å; D129-D131 VanDerWaalsContact OD1-CB 3.26Å; D129-D131 WeakPolarHBondContact OD1-CB 3.49Å; D129-D131 VanDerWaalsContact OD1-CG 3.32Å; D129-D131 PolarHBondContact OD1-N 3.42Å; D131-Y133 WeakPolarHBondContact OD1-CA 3.33Å; D131-Y133 WeakPolarHBondContact OD1-CB 3.35Å; D131-Y133 PolarHBondContact OD1-N 3.03Å
132	G	96.1	Very high	95.1	Very high	29 Å²	29	43 Å²	43	30%	0.299	24%	0.237	S	C	.	.	S	Bend	trans	90.1	8.5	179.9	0	0	0	0	0	114.4	F123 D127 G130	F123-G132 WeakPolarHBondContact CZ-O 3.25Å; D127-G132 WeakPolarHBondContact OD2-CA 3.22Å; D127-G132 PolarHBondContact OD2-N 3.2Å; D127-G132 VanDerWaalsContact OD2-N 3.08Å; G130-G132 PolarHBondContact O-N 3.39Å
133	Y	98	Very high	95	Very high	86 Å²	86	42.7 Å²	42.7	34%	0.337	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	163.5	175.3	-58.6	-89.6	0	0	0	110.5	D131 K181 I182	D131-Y133 WeakPolarHBondContact OD1-CA 3.33Å; D131-Y133 WeakPolarHBondContact OD1-CB 3.35Å; D131-Y133 PolarHBondContact OD1-N 3.03Å; Y133-K181 HydrophobicContact CD1-CD 3.49Å; Y133-K181 VanDerWaalsContact CD1-CD 3.49Å; Y133-K181 HydrophobicContact CD1-CG 3.97Å; Y133-K181 HydrophobicContact CD2-CD 4.36Å; Y133-K181 HydrophobicContact CE1-CD 3.99Å; Y133-K181 VanDerWaalsContact CE1-NZ 3.33Å; Y133-K181 HydrophobicContact CG-CD 3.72Å; Y133-K181 HydrophobicContact CG-CG 4.43Å; Y133-I182 CarbonylContact C-O 3.04Å; Y133-I182 WeakPolarHBondContact CA-O 3.43Å
134	I	97.8	Very high	94.6	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.4	169.7	-56.3	162.8	0	0	0	107.3	F123 Y126 D127 L139 I182 F187	F123-I134 HydrophobicContact CD2-CD1 3.62Å; F123-I134 HydrophobicContact CD2-CG1 4.2Å; F123-I134 HydrophobicContact CE2-CD1 3.54Å; F123-I134 HydrophobicContact CE2-CG1 3.72Å; F123-I134 HydrophobicContact CZ-CD1 4.38Å; F123-I134 HydrophobicContact CZ-CG1 4.08Å; Y126-I134 VanDerWaalsContact CB-CD1 3.48Å; Y126-I134 HydrophobicContact CD2-CD1 4.49Å; Y126-I134 HydrophobicContact CG-CD1 4.21Å; D127-I134 HydrophobicContact CB-CG1 4.5Å; I134-L139 HydrophobicContact CG2-CB 4.03Å; I134-I182 HydrophobicContact CB-CB 4.2Å; I134-I182 PolarHBondContact N-O 3.25Å; I134-I182 PolarHBondContact O-N 2.85Å; I134-F187 HydrophobicContact CD1-CD2 3.86Å; I134-F187 HydrophobicContact CD1-CE2 4.24Å; I134-F187 HydrophobicContact CD1-CG 4.37Å
135	S	97.8	Very high	94.3	Very high	33 Å²	33	42.6 Å²	42.6	23%	0.231	23%	0.229	C	C	.	.			trans	-79.9	163.2	173	69.3	0	0	0	0	111.9	S137 E138 L139	S135-S137 VanDerWaalsContact C-N 3.27Å; S135-S137 PolarHBondContact O-N 3.44Å; S135-S137 PolarHBondContact OG-OG 2.89Å; S135-E138 VanDerWaalsContact CB-OE2 3.29Å; S135-E138 WeakPolarHBondContact CB-OE2 3.48Å; S135-E138 PolarHBondContact N-OE2 2.9Å; S135-E138 PolarHBondContact O-N 3.27Å; S135-E138 VanDerWaalsContact OG-CD 3.26Å; S135-E138 WeakPolarHBondContact OG-CG 3.43Å; S135-E138 PolarHBondContact OG-N 3.45Å; S135-E138 PolarHBondContact OG-OE2 3.15Å; S135-L139 WeakPolarHBondContact O-CB 3.38Å; S135-L139 PolarHBondContact O-N 3.45Å
136	R	96.4	Very high	93.8	Very high	94 Å²	94	44.8 Å²	44.8	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-59.3	-38.8	175.4	-63.2	-174.3	69.6	93.6	2.4	112.4	K140 V167 N168 F171	R136-K140 WeakPolarHBondContact O-CB 3.45Å; R136-K140 PolarHBondContact O-N 2.95Å; R136-V167 HydrophobicContact CB-CG1 4.36Å; R136-N168 PolarHBondContact NH2-OD1 3.49Å; R136-F171 HydrophobicContact CB-CE2 4.13Å; R136-F171 HydrophobicContact CB-CZ 4.16Å; R136-F171 HydrophobicContact CG-CD1 4.17Å; R136-F171 HydrophobicContact CG-CD2 4.01Å; R136-F171 HydrophobicContact CG-CE1 3.7Å; R136-F171 HydrophobicContact CG-CE2 3.53Å; R136-F171 HydrophobicContact CG-CG 4.32Å; R136-F171 HydrophobicContact CG-CZ 3.37Å
137	S	96.7	Very high	93.2	Very high	84 Å²	84	46 Å²	46	59%	0.587	25%	0.245	S	C	*	.	H	α-helix	trans	-63	-44.6	177.7	29.9	0	0	0	0	112.3	S135 K140 E141	S135-S137 VanDerWaalsContact C-N 3.27Å; S135-S137 PolarHBondContact O-N 3.44Å; S135-S137 PolarHBondContact OG-OG 2.89Å; S137-K140 WeakPolarHBondContact O-CB 3.44Å; S137-K140 PolarHBondContact O-N 3.35Å; S137-E141 PolarHBondContact O-N 3.14Å
138	E	96.9	Very high	92.4	Very high	12 Å²	12	48 Å²	48	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-69.9	-42.2	-178.8	-69.4	169.9	123	0	0	111.8	Y126 I128 D129 S135 K140 E141 V142	Y126-E138 WeakPolarHBondContact O-CB 3.46Å; I128-E138 WeakPolarHBondContact CA-OE1 3.5Å; I128-E138 HydrophobicContact CB-CG 3.91Å; I128-E138 WeakPolarHBondContact CB-OE1 3.47Å; I128-E138 HydrophobicContact CD1-CB 4.04Å; I128-E138 HydrophobicContact CD1-CG 4.11Å; I128-E138 HydrophobicContact CG1-CB 3.96Å; I128-E138 HydrophobicContact CG1-CG 3.9Å; I128-E138 PolarHBondContact N-OE1 3.05Å; D129-E138 PolarHBondContact N-OE1 2.84Å; D129-E138 VanDerWaalsContact N-OE1 3.08Å; S135-E138 VanDerWaalsContact CB-OE2 3.29Å; S135-E138 WeakPolarHBondContact CB-OE2 3.48Å; S135-E138 PolarHBondContact N-OE2 2.9Å; S135-E138 PolarHBondContact O-N 3.27Å; S135-E138 VanDerWaalsContact OG-CD 3.26Å; S135-E138 WeakPolarHBondContact OG-CG 3.43Å; S135-E138 PolarHBondContact OG-N 3.45Å; S135-E138 PolarHBondContact OG-OE2 3.15Å; E138-K140 VanDerWaalsContact C-N 3.28Å; E138-K140 PolarHBondContact O-N 3.31Å; E138-E141 PolarHBondContact O-N 3.3Å; E138-E141 VanDerWaalsContact O-N 3.17Å; E138-V142 WeakPolarHBondContact O-CG2 3.41Å; E138-V142 PolarHBondContact O-N 3.34Å
139	L	94.2	Very high	91.8	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-43.5	174.3	-177.1	58	0	0	0	111.2	Y126 I134 S135 V142 I143 V167 M170 F171	Y126-L139 HydrophobicContact CD1-CD1 3.56Å; Y126-L139 HydrophobicContact CE1-CD1 3.37Å; I134-L139 HydrophobicContact CG2-CB 4.03Å; S135-L139 WeakPolarHBondContact O-CB 3.38Å; S135-L139 PolarHBondContact O-N 3.45Å; L139-V142 PolarHBondContact O-N 2.98Å; L139-I143 HydrophobicContact CD1-CD1 3.82Å; L139-I143 HydrophobicContact CD1-CG1 4.2Å; L139-I143 HydrophobicContact CD2-CD1 4.45Å; L139-I143 HydrophobicContact CG-CD1 3.74Å; L139-I143 HydrophobicContact CG-CG1 4.5Å; L139-I143 WeakPolarHBondContact O-CB 3.26Å; L139-I143 WeakPolarHBondContact O-CD1 3.45Å; L139-I143 WeakPolarHBondContact O-CG1 3.4Å; L139-I143 PolarHBondContact O-N 3.01Å; L139-V167 HydrophobicContact CD2-CB 4.49Å; L139-V167 HydrophobicContact CD2-CG1 4.27Å; L139-V167 HydrophobicContact CD2-CG2 4.44Å; L139-V167 HydrophobicContact CG-CG2 4.25Å; L139-M170 HydrophobicContact CD1-CE 3.76Å; L139-M170 HydrophobicContact CD2-CB 3.6Å; L139-M170 HydrophobicContact CD2-CE 4.47Å; L139-M170 HydrophobicContact CD2-CG 4.21Å; L139-F171 HydrophobicContact CB-CE2 4.3Å; L139-F171 HydrophobicContact CD2-CD2 3.75Å; L139-F171 HydrophobicContact CD2-CE2 3.61Å
140	K	92.9	Very high	91	Very high	78 Å²	78	48.4 Å²	48.4	34%	0.339	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-44.8	175.2	179.5	171.9	-176.9	169.1	0	112.1	R136 S137 E138 V142 I143 Q144 I163 E164 V167	R136-K140 WeakPolarHBondContact O-CB 3.45Å; R136-K140 PolarHBondContact O-N 2.95Å; S137-K140 WeakPolarHBondContact O-CB 3.44Å; S137-K140 PolarHBondContact O-N 3.35Å; E138-K140 VanDerWaalsContact C-N 3.28Å; E138-K140 PolarHBondContact O-N 3.31Å; K140-V142 PolarHBondContact O-N 3.37Å; K140-I143 PolarHBondContact O-N 3.19Å; K140-Q144 WeakPolarHBondContact O-CB 3.42Å; K140-Q144 PolarHBondContact O-N 3.47Å; K140-I163 HydrophobicContact CB-CG2 4.46Å; K140-I163 HydrophobicContact CG-CG2 3.75Å; K140-E164 WeakPolarHBondContact CE-OE1 3.42Å; K140-E164 IonicContact NZ-OE1 2.67Å; K140-E164 PolarHBondContact NZ-OE1 2.93Å; K140-V167 HydrophobicContact CB-CG2 4.07Å
141	E	93.5	Very high	90	Very high	102 Å²	102	47 Å²	47	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-60.6	-45	178.9	-175.7	174.5	144.4	0	0	111.7	I128 S137 E138 Q144 A145	I128-E141 HydrophobicContact CD1-CB 3.85Å; I128-E141 HydrophobicContact CD1-CG 3.88Å; I128-E141 WeakPolarHBondContact CD1-OE1 3.03Å; S137-E141 PolarHBondContact O-N 3.14Å; E138-E141 PolarHBondContact O-N 3.3Å; E138-E141 VanDerWaalsContact O-N 3.17Å; E141-Q144 PolarHBondContact O-N 3.36Å; E141-A145 WeakPolarHBondContact O-CB 3.27Å; E141-A145 PolarHBondContact O-N 3.36Å
142	V	92	Very high	88.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.2	-42.8	179.8	178.2	0	0	0	0	111.4	L85 L125 Y126 I128 E138 L139 K140 A145 I146	L85-V142 HydrophobicContact CD1-CB 4.18Å; L85-V142 HydrophobicContact CD1-CG1 4.23Å; L85-V142 HydrophobicContact CD1-CG2 3.92Å; L85-V142 HydrophobicContact CD2-CG2 4.47Å; L125-V142 WeakPolarHBondContact O-CG2 3.35Å; Y126-V142 HydrophobicContact CD1-CB 3.67Å; Y126-V142 HydrophobicContact CD1-CG1 3.65Å; Y126-V142 HydrophobicContact CD1-CG2 3.83Å; Y126-V142 HydrophobicContact CE1-CB 3.72Å; Y126-V142 HydrophobicContact CE1-CG1 3.37Å; Y126-V142 HydrophobicContact CE1-CG2 4.39Å; I128-V142 HydrophobicContact CD1-CG2 4.29Å; E138-V142 WeakPolarHBondContact O-CG2 3.41Å; E138-V142 PolarHBondContact O-N 3.34Å; L139-V142 PolarHBondContact O-N 2.98Å; K140-V142 PolarHBondContact O-N 3.37Å; V142-A145 WeakPolarHBondContact O-CB 3.47Å; V142-A145 PolarHBondContact O-N 3.14Å; V142-I146 HydrophobicContact CG1-CD1 4.11Å; V142-I146 WeakPolarHBondContact O-CG1 3.43Å; V142-I146 PolarHBondContact O-N 2.81Å
143	I	89.6	Confident	86.4	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.062	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-44.8	177.2	-68.7	167.9	0	0	0	110.6	L139 K140 A145 I146 Y147 I163 R166 V167	L139-I143 HydrophobicContact CD1-CD1 3.82Å; L139-I143 HydrophobicContact CD1-CG1 4.2Å; L139-I143 HydrophobicContact CD2-CD1 4.45Å; L139-I143 HydrophobicContact CG-CD1 3.74Å; L139-I143 HydrophobicContact CG-CG1 4.5Å; L139-I143 WeakPolarHBondContact O-CB 3.26Å; L139-I143 WeakPolarHBondContact O-CD1 3.45Å; L139-I143 WeakPolarHBondContact O-CG1 3.4Å; L139-I143 PolarHBondContact O-N 3.01Å; K140-I143 PolarHBondContact O-N 3.19Å; I143-A145 VanDerWaalsContact C-N 3.31Å; I143-A145 PolarHBondContact O-N 3.08Å; I143-I146 PolarHBondContact O-N 3.45Å; I143-Y147 HydrophobicContact CG2-CD2 3.62Å; I143-Y147 HydrophobicContact CG2-CE2 3.39Å; I143-Y147 WeakPolarHBondContact O-CD2 3.48Å; I143-Y147 PolarHBondContact O-N 3.19Å; I143-I163 HydrophobicContact CB-CG2 4.45Å; I143-I163 HydrophobicContact CG2-CB 4.46Å; I143-I163 HydrophobicContact CG2-CG1 4.05Å; I143-I163 HydrophobicContact CG2-CG2 4.09Å; I143-R166 HydrophobicContact CD1-CB 4.26Å; I143-R166 HydrophobicContact CD1-CG 3.77Å; I143-R166 HydrophobicContact CG2-CG 4.46Å; I143-V167 HydrophobicContact CD1-CG2 3.85Å
144	Q	88.2	Confident	84.3	Confident	62 Å²	62	57.5 Å²	57.5	29%	0.29	29%	0.287	S	S	.	.	H	α-helix	trans	-57.3	-45.9	174.5	178.9	65.4	62.2	0	0	111.1	K140 E141 I146 Y147 D148 I163	K140-Q144 WeakPolarHBondContact O-CB 3.42Å; K140-Q144 PolarHBondContact O-N 3.47Å; E141-Q144 PolarHBondContact O-N 3.36Å; Q144-I146 VanDerWaalsContact C-N 3.28Å; Q144-I146 PolarHBondContact O-N 3.13Å; Q144-Y147 PolarHBondContact O-N 3.34Å; Q144-Y147 VanDerWaalsContact O-N 3.11Å; Q144-D148 PolarHBondContact NE2-OD1 3.19Å; Q144-D148 PolarHBondContact O-N 3.24Å; Q144-I163 HydrophobicContact CB-CD1 4.06Å; Q144-I163 HydrophobicContact CG-CD1 4.45Å
145	A	88.3	Confident	82.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-36.5	178.6	0	0	0	0	0	113	A81 L85 E141 V142 I143 L149	A81-A145 HydrophobicContact CB-CB 3.64Å; L85-A145 HydrophobicContact CD1-CB 3.47Å; L85-A145 VanDerWaalsContact CD1-CB 3.47Å; L85-A145 HydrophobicContact CG-CB 4.49Å; E141-A145 WeakPolarHBondContact O-CB 3.27Å; E141-A145 PolarHBondContact O-N 3.36Å; V142-A145 WeakPolarHBondContact O-CB 3.47Å; V142-A145 PolarHBondContact O-N 3.14Å; I143-A145 VanDerWaalsContact C-N 3.31Å; I143-A145 PolarHBondContact O-N 3.08Å; A145-L149 WeakPolarHBondContact O-CB 3.43Å; A145-L149 PolarHBondContact O-N 3.46Å
146	I	84.6	Confident	80.5	Confident	51 Å²	51	65.7 Å²	65.7	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-67.4	-42.9	173.5	-67.5	164.9	0	0	0	110.6	Y82 V142 I143 Q144 D148 L149 L150	Y82-I146 HydrophobicContact CD2-CG1 3.73Å; Y82-I146 HydrophobicContact CE2-CD1 4.34Å; Y82-I146 HydrophobicContact CE2-CG1 3.72Å; V142-I146 HydrophobicContact CG1-CD1 4.11Å; V142-I146 WeakPolarHBondContact O-CG1 3.43Å; V142-I146 PolarHBondContact O-N 2.81Å; I143-I146 PolarHBondContact O-N 3.45Å; Q144-I146 VanDerWaalsContact C-N 3.28Å; Q144-I146 PolarHBondContact O-N 3.13Å; I146-D148 PolarHBondContact O-N 3.22Å; I146-L149 CarbonylContact O-C 3.55Å; I146-L149 WeakPolarHBondContact O-CA 3.49Å; I146-L149 WeakPolarHBondContact O-CB 3.38Å; I146-L149 PolarHBondContact O-N 2.8Å; I146-L149 VanDerWaalsContact O-N 3.14Å; I146-L150 HydrophobicContact CG2-CD1 3.96Å; I146-L150 HydrophobicContact CG2-CG 4.31Å; I146-L150 WeakPolarHBondContact O-CG 3.45Å; I146-L150 PolarHBondContact O-N 2.98Å
147	Y	81	Confident	79.2	Confident	54 Å²	54	63.7 Å²	63.7	21%	0.212	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-42.1	176.5	-80.7	-63.9	0	0	0	112.5	I143 Q144 L149 L150 G151 L155 I163	I143-Y147 HydrophobicContact CG2-CD2 3.62Å; I143-Y147 HydrophobicContact CG2-CE2 3.39Å; I143-Y147 WeakPolarHBondContact O-CD2 3.48Å; I143-Y147 PolarHBondContact O-N 3.19Å; Q144-Y147 PolarHBondContact O-N 3.34Å; Q144-Y147 VanDerWaalsContact O-N 3.11Å; Y147-L149 VanDerWaalsContact C-N 3.26Å; Y147-L149 PolarHBondContact O-N 2.88Å; Y147-L150 PolarHBondContact O-N 2.93Å; Y147-G151 PolarHBondContact O-N 3.19Å; Y147-L155 HydrophobicContact CD1-CD1 3.47Å; Y147-L155 VanDerWaalsContact CD1-CD1 3.47Å; Y147-L155 HydrophobicContact CD1-CD2 4.4Å; Y147-L155 HydrophobicContact CD1-CG 4.32Å; Y147-L155 HydrophobicContact CE1-CD1 3.7Å; Y147-L155 HydrophobicContact CE1-CD2 3.92Å; Y147-L155 HydrophobicContact CE1-CG 4.32Å; Y147-L155 HydrophobicContact CG-CD1 4.17Å; Y147-I163 HydrophobicContact CD2-CD1 4.05Å; Y147-I163 HydrophobicContact CD2-CG1 3.66Å; Y147-I163 HydrophobicContact CE2-CG1 3.64Å
148	D	80.9	Confident	78.5	Confident	60 Å²	60	64.9 Å²	64.9	32%	0.321	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-37.9	173.8	-65.2	-16	0	0	0	111.2	R77 Q144 I146 G151	R77-D148 PolarHBondContact NH1-O 3.5Å; R77-D148 VanDerWaalsContact NH1-O 3.08Å; Q144-D148 PolarHBondContact NE2-OD1 3.19Å; Q144-D148 PolarHBondContact O-N 3.24Å; I146-D148 PolarHBondContact O-N 3.22Å; D148-G151 PolarHBondContact O-N 3.5Å
149	L	80.1	Confident	77.7	Confident	25 Å²	25	66 Å²	66	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-68.4	-38.9	176.2	-178.2	71.6	0	0	0	112.9	Y70 R77 Y82 A145 I146 Y147	Y70-L149 HydrophobicContact CE1-CD1 4.15Å; R77-L149 HydrophobicContact CB-CD1 3.87Å; R77-L149 WeakPolarHBondContact CD-O 3.5Å; R77-L149 HydrophobicContact CG-CD1 3.82Å; R77-L149 PolarHBondContact NE-O 3.39Å; R77-L149 PolarHBondContact NH1-O 2.71Å; R77-L149 VanDerWaalsContact NH1-O 3.11Å; R77-L149 PolarHBondContact NH2-O 3.01Å; Y82-L149 HydrophobicContact CD1-CD2 3.72Å; Y82-L149 HydrophobicContact CD2-CD2 4.5Å; Y82-L149 HydrophobicContact CE1-CD2 4.19Å; Y82-L149 HydrophobicContact CG-CD2 3.88Å; A145-L149 WeakPolarHBondContact O-CB 3.43Å; A145-L149 PolarHBondContact O-N 3.46Å; I146-L149 CarbonylContact O-C 3.55Å; I146-L149 WeakPolarHBondContact O-CA 3.49Å; I146-L149 WeakPolarHBondContact O-CB 3.38Å; I146-L149 PolarHBondContact O-N 2.8Å; I146-L149 VanDerWaalsContact O-N 3.14Å; Y147-L149 VanDerWaalsContact C-N 3.26Å; Y147-L149 PolarHBondContact O-N 2.88Å
150	L	78.2	Confident	77.3	Confident	99 Å²	99	69.8 Å²	69.8	52%	0.518	37%	0.372	S	S	.	.	H	α-helix	trans	-80.3	-22.2	177.3	-64.9	177.1	0	0	0	111.9	R77 I146 Y147	R77-L150 PolarHBondContact NH2-O 2.81Å; I146-L150 HydrophobicContact CG2-CD1 3.96Å; I146-L150 HydrophobicContact CG2-CG 4.31Å; I146-L150 WeakPolarHBondContact O-CG 3.45Å; I146-L150 PolarHBondContact O-N 2.98Å; Y147-L150 PolarHBondContact O-N 2.93Å
151	G	71.1	Confident	77.1	Confident	12 Å²	12	70.8 Å²	70.8	12%	0.124	38%	0.378	C	S	.	.			trans	91.3	131.9	175.1	0	0	0	0	0	113.3	Y147 D148 K153 L154	Y147-G151 PolarHBondContact O-N 3.19Å; D148-G151 PolarHBondContact O-N 3.5Å; G151-K153 PolarHBondContact O-N 2.97Å; G151-L154 PolarHBondContact O-N 2.74Å
152	N	60.7	Low	76.8	Confident	86 Å²	86	67.6 Å²	67.6	46%	0.46	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57.1	-18.2	-179.1	-60.9	-6.4	0	0	0	114	L154 L155 I159	N152-L154 PolarHBondContact O-N 2.66Å; N152-L154 VanDerWaalsContact O-N 3.12Å; N152-L155 PolarHBondContact O-N 3.2Å; N152-I159 HydrophobicContact CB-CD1 4.11Å
153	K	56.1	Low	76.6	Confident	206 Å²	206	67.7 Å²	67.7	90%	0.896	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-60.7	-19.7	177.7	-70.5	-170	178.2	-175.4	0	113.8	G151	G151-K153 PolarHBondContact O-N 2.97Å
154	L	54	Low	76.7	Confident	133 Å²	133	69.8 Å²	69.8	70%	0.696	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-84.3	-8.9	175.4	-63.5	177.7	0	0	0	113.4	G151 N152	G151-L154 PolarHBondContact O-N 2.74Å; N152-L154 PolarHBondContact O-N 2.66Å; N152-L154 VanDerWaalsContact O-N 3.12Å
155	L	55.1	Low	76.8	Confident	51 Å²	51	70.5 Å²	70.5	27%	0.267	39%	0.385	S	S	.	.			trans	-116.1	102.3	-175.7	-58.5	174.7	0	0	0	110.2	Y147 N152 G157 I159	Y147-L155 HydrophobicContact CD1-CD1 3.47Å; Y147-L155 VanDerWaalsContact CD1-CD1 3.47Å; Y147-L155 HydrophobicContact CD1-CD2 4.4Å; Y147-L155 HydrophobicContact CD1-CG 4.32Å; Y147-L155 HydrophobicContact CE1-CD1 3.7Å; Y147-L155 HydrophobicContact CE1-CD2 3.92Å; Y147-L155 HydrophobicContact CE1-CG 4.32Å; Y147-L155 HydrophobicContact CG-CD1 4.17Å; N152-L155 PolarHBondContact O-N 3.2Å; L155-G157 PolarHBondContact O-N 3.48Å; L155-I159 HydrophobicContact CB-CG1 4.15Å; L155-I159 HydrophobicContact CD1-CB 4.42Å; L155-I159 HydrophobicContact CD1-CD1 4.08Å; L155-I159 HydrophobicContact CD1-CG1 3.74Å; L155-I159 HydrophobicContact CD1-CG2 4.19Å
156	T	59.5	Low	76.9	Confident	157 Å²	157	76.8 Å²	76.8	96%	0.963	41%	0.408	S	S	*	.			trans	-83.2	20.2	173.3	52.7	0	0	0	0	112.8
157	G	69.1	Low	77.3	Confident	52 Å²	52	74.4 Å²	74.4	54%	0.536	40%	0.396	S	S	.	.	S	Bend	trans	-138.6	-176.2	-169.3	0	0	0	0	0	114.4	L155 I159	L155-G157 PolarHBondContact O-N 3.48Å; G157-I159 PolarHBondContact O-N 3.02Å
158	N	81.9	Confident	78	Confident	109 Å²	109	75.1 Å²	75.1	58%	0.583	40%	0.404	S	S	*	.			trans	-70	97.7	176.9	-174	-15.7	0	0	0	110.1	V160 Q161 A162	N158-V160 PolarHBondContact O-N 2.67Å; N158-V160 WeakPolarHBondContact OD1-CB 3.1Å; N158-V160 PolarHBondContact OD1-N 3.17Å; N158-Q161 HydrophobicContact CB-CB 4.15Å; N158-Q161 PolarHBondContact O-N 2.93Å; N158-Q161 VanDerWaalsContact O-N 3.12Å; N158-Q161 PolarHBondContact OD1-N 2.92Å; N158-A162 PolarHBondContact O-N 2.97Å; N158-A162 VanDerWaalsContact O-N 3.09Å
159	I	81	Confident	78.6	Confident	34 Å²	34	76.1 Å²	76.1	17%	0.174	41%	0.412	C	S	.	.	H	α-helix	trans	-54.1	-39.4	179.3	-58.8	-178.7	0	0	0	111.1	N152 L155 G157 Q161 A162 I163	N152-I159 HydrophobicContact CB-CD1 4.11Å; L155-I159 HydrophobicContact CB-CG1 4.15Å; L155-I159 HydrophobicContact CD1-CB 4.42Å; L155-I159 HydrophobicContact CD1-CD1 4.08Å; L155-I159 HydrophobicContact CD1-CG1 3.74Å; L155-I159 HydrophobicContact CD1-CG2 4.19Å; G157-I159 PolarHBondContact O-N 3.02Å; I159-Q161 PolarHBondContact O-N 2.74Å; I159-A162 PolarHBondContact O-N 3.44Å; I159-I163 HydrophobicContact CG2-CD1 3.73Å; I159-I163 HydrophobicContact CG2-CG1 4.33Å; I159-I163 VanDerWaalsContact O-CG1 3.24Å; I159-I163 WeakPolarHBondContact O-CG1 3.15Å; I159-I163 PolarHBondContact O-N 3.01Å
160	V	86	Confident	79.2	Confident	83 Å²	83	75.8 Å²	75.8	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-61.8	-45.4	-179.4	-177.2	0	0	0	0	110.5	N158 I163 E164	N158-V160 PolarHBondContact O-N 2.67Å; N158-V160 WeakPolarHBondContact OD1-CB 3.1Å; N158-V160 PolarHBondContact OD1-N 3.17Å; V160-I163 PolarHBondContact O-N 3.47Å; V160-E164 WeakPolarHBondContact O-CG 3.46Å; V160-E164 PolarHBondContact O-N 3.31Å
161	Q	88.5	Confident	80	Confident	99 Å²	99	71.4 Å²	71.4	46%	0.463	39%	0.387	S	S	.	.	H	α-helix	trans	-66	-43.6	178.3	-169.8	61.7	50.4	0	0	111.7	N158 I159 I163 E164 D165	N158-Q161 HydrophobicContact CB-CB 4.15Å; N158-Q161 PolarHBondContact O-N 2.93Å; N158-Q161 VanDerWaalsContact O-N 3.12Å; N158-Q161 PolarHBondContact OD1-N 2.92Å; I159-Q161 PolarHBondContact O-N 2.74Å; Q161-I163 PolarHBondContact O-N 2.96Å; Q161-E164 PolarHBondContact O-N 3.49Å; Q161-E164 VanDerWaalsContact O-N 3.16Å; Q161-D165 PolarHBondContact NE2-OD1 2.89Å; Q161-D165 WeakPolarHBondContact O-CB 3.38Å; Q161-D165 PolarHBondContact O-N 2.84Å
162	A	86.8	Confident	81.2	Confident	35 Å²	35	76.3 Å²	76.3	29%	0.289	41%	0.414	S	S	.	.	H	α-helix	trans	-60.4	-34.4	178.1	0	0	0	0	0	112.6	N158 I159 R166	N158-A162 PolarHBondContact O-N 2.97Å; N158-A162 VanDerWaalsContact O-N 3.09Å; I159-A162 PolarHBondContact O-N 3.44Å; A162-R166 WeakPolarHBondContact O-CB 3.46Å; A162-R166 PolarHBondContact O-N 2.82Å; A162-R166 VanDerWaalsContact O-N 3.16Å
163	I	87.7	Confident	82.8	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-70.3	-48.2	174.4	-67.4	170.2	0	0	0	110.8	K140 I143 Q144 Y147 I159 V160 Q161 D165 R166 V167	K140-I163 HydrophobicContact CB-CG2 4.46Å; K140-I163 HydrophobicContact CG-CG2 3.75Å; I143-I163 HydrophobicContact CB-CG2 4.45Å; I143-I163 HydrophobicContact CG2-CB 4.46Å; I143-I163 HydrophobicContact CG2-CG1 4.05Å; I143-I163 HydrophobicContact CG2-CG2 4.09Å; Q144-I163 HydrophobicContact CB-CD1 4.06Å; Q144-I163 HydrophobicContact CG-CD1 4.45Å; Y147-I163 HydrophobicContact CD2-CD1 4.05Å; Y147-I163 HydrophobicContact CD2-CG1 3.66Å; Y147-I163 HydrophobicContact CE2-CG1 3.64Å; I159-I163 HydrophobicContact CG2-CD1 3.73Å; I159-I163 HydrophobicContact CG2-CG1 4.33Å; I159-I163 VanDerWaalsContact O-CG1 3.24Å; I159-I163 WeakPolarHBondContact O-CG1 3.15Å; I159-I163 PolarHBondContact O-N 3.01Å; V160-I163 PolarHBondContact O-N 3.47Å; Q161-I163 PolarHBondContact O-N 2.96Å; I163-D165 VanDerWaalsContact C-N 3.32Å; I163-D165 PolarHBondContact O-N 3.37Å; I163-R166 PolarHBondContact O-N 3.39Å; I163-R166 VanDerWaalsContact O-N 3.16Å; I163-V167 HydrophobicContact CG2-CG2 4.29Å; I163-V167 VanDerWaalsContact O-CG2 3.31Å; I163-V167 WeakPolarHBondContact O-CG2 3.5Å; I163-V167 PolarHBondContact O-N 2.96Å
164	E	92	Very high	84.7	Confident	56 Å²	56	67.2 Å²	67.2	26%	0.262	37%	0.371	S	S	.	.	H	α-helix	trans	-58.6	-43.4	177.7	-70.8	-60.9	152.7	0	0	111.9	K140 V160 Q161 R166 V167 N168	K140-E164 WeakPolarHBondContact CE-OE1 3.42Å; K140-E164 IonicContact NZ-OE1 2.67Å; K140-E164 PolarHBondContact NZ-OE1 2.93Å; V160-E164 WeakPolarHBondContact O-CG 3.46Å; V160-E164 PolarHBondContact O-N 3.31Å; Q161-E164 PolarHBondContact O-N 3.49Å; Q161-E164 VanDerWaalsContact O-N 3.16Å; E164-R166 VanDerWaalsContact C-N 3.31Å; E164-R166 PolarHBondContact O-N 2.86Å; E164-V167 PolarHBondContact O-N 2.87Å; E164-N168 WeakPolarHBondContact O-CB 3.33Å; E164-N168 VanDerWaalsContact O-CG 3.31Å; E164-N168 PolarHBondContact O-N 3.46Å; E164-N168 PolarHBondContact O-ND2 3.48Å; E164-N168 VanDerWaalsContact O-ND2 3.15Å
165	D	91.2	Very high	86.7	Confident	77 Å²	77	61.3 Å²	61.3	41%	0.412	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-39.6	177.2	-65.3	-17.3	0	0	0	111.4	Q161 I163 N168 T169	Q161-D165 PolarHBondContact NE2-OD1 2.89Å; Q161-D165 WeakPolarHBondContact O-CB 3.38Å; Q161-D165 PolarHBondContact O-N 2.84Å; I163-D165 VanDerWaalsContact C-N 3.32Å; I163-D165 PolarHBondContact O-N 3.37Å; D165-N168 PolarHBondContact O-N 3Å; D165-T169 WeakPolarHBondContact O-CB 3.33Å; D165-T169 PolarHBondContact O-N 3.44Å; D165-T169 PolarHBondContact O-OG1 2.84Å
166	R	89.7	Confident	88.7	Confident	132 Å²	132	63.3 Å²	63.3	50%	0.498	35%	0.351	S	S	.	.	H	α-helix	trans	-68	-41.7	176.2	-173.7	62.4	177.2	179.9	1.2	111.9	I143 A162 I163 E164 T169 M170	I143-R166 HydrophobicContact CD1-CB 4.26Å; I143-R166 HydrophobicContact CD1-CG 3.77Å; I143-R166 HydrophobicContact CG2-CG 4.46Å; A162-R166 WeakPolarHBondContact O-CB 3.46Å; A162-R166 PolarHBondContact O-N 2.82Å; A162-R166 VanDerWaalsContact O-N 3.16Å; I163-R166 PolarHBondContact O-N 3.39Å; I163-R166 VanDerWaalsContact O-N 3.16Å; E164-R166 VanDerWaalsContact C-N 3.31Å; E164-R166 PolarHBondContact O-N 2.86Å; R166-T169 PolarHBondContact O-N 2.97Å; R166-M170 WeakPolarHBondContact O-CB 3.22Å; R166-M170 WeakPolarHBondContact O-CG 3.29Å; R166-M170 PolarHBondContact O-N 2.98Å
167	V	93.1	Very high	90.5	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-49	174.5	170.8	0	0	0	0	109.9	R136 L139 K140 I143 I163 E164 T169 M170 F171	R136-V167 HydrophobicContact CB-CG1 4.36Å; L139-V167 HydrophobicContact CD2-CB 4.49Å; L139-V167 HydrophobicContact CD2-CG1 4.27Å; L139-V167 HydrophobicContact CD2-CG2 4.44Å; L139-V167 HydrophobicContact CG-CG2 4.25Å; K140-V167 HydrophobicContact CB-CG2 4.07Å; I143-V167 HydrophobicContact CD1-CG2 3.85Å; I163-V167 HydrophobicContact CG2-CG2 4.29Å; I163-V167 VanDerWaalsContact O-CG2 3.31Å; I163-V167 WeakPolarHBondContact O-CG2 3.5Å; I163-V167 PolarHBondContact O-N 2.96Å; E164-V167 PolarHBondContact O-N 2.87Å; V167-T169 PolarHBondContact O-N 2.86Å; V167-M170 PolarHBondContact O-N 3.46Å; V167-F171 HydrophobicContact CG1-CD2 4.01Å; V167-F171 HydrophobicContact CG1-CE2 4.29Å; V167-F171 WeakPolarHBondContact O-CD2 3.48Å; V167-F171 PolarHBondContact O-N 3.28Å
168	N	95	Very high	91.7	Very high	69 Å²	69	65.4 Å²	65.4	37%	0.369	34%	0.338	S	S	.	.	H	α-helix	trans	-55.8	-50	176.1	-76.1	-36.9	0	0	0	111.9	R136 E164 D165 M170 F171 T172	R136-N168 PolarHBondContact NH2-OD1 3.49Å; E164-N168 WeakPolarHBondContact O-CB 3.33Å; E164-N168 VanDerWaalsContact O-CG 3.31Å; E164-N168 PolarHBondContact O-N 3.46Å; E164-N168 PolarHBondContact O-ND2 3.48Å; E164-N168 VanDerWaalsContact O-ND2 3.15Å; D165-N168 PolarHBondContact O-N 3Å; N168-M170 VanDerWaalsContact C-N 3.31Å; N168-M170 PolarHBondContact O-N 3.49Å; N168-F171 PolarHBondContact O-N 3.29Å; N168-T172 PolarHBondContact O-N 3.36Å; N168-T172 PolarHBondContact O-OG1 3.44Å
169	T	93.3	Very high	92.5	Very high	81 Å²	81	64 Å²	64	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-43.2	179.9	-57.7	0	0	0	0	111.9	D165 R166 V167 K173	D165-T169 WeakPolarHBondContact O-CB 3.33Å; D165-T169 PolarHBondContact O-N 3.44Å; D165-T169 PolarHBondContact O-OG1 2.84Å; R166-T169 PolarHBondContact O-N 2.97Å; V167-T169 PolarHBondContact O-N 2.86Å; T169-K173 WeakPolarHBondContact O-CB 3.39Å; T169-K173 PolarHBondContact O-N 3.2Å
170	M	92.9	Very high	93.2	Very high	17 Å²	17	64.3 Å²	64.3	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-46.5	177.9	-72.1	-86.1	-77.5	0	0	110.9	L139 R166 V167 N168 T172 K173 Y174	L139-M170 HydrophobicContact CD1-CE 3.76Å; L139-M170 HydrophobicContact CD2-CB 3.6Å; L139-M170 HydrophobicContact CD2-CE 4.47Å; L139-M170 HydrophobicContact CD2-CG 4.21Å; R166-M170 WeakPolarHBondContact O-CB 3.22Å; R166-M170 WeakPolarHBondContact O-CG 3.29Å; R166-M170 PolarHBondContact O-N 2.98Å; V167-M170 PolarHBondContact O-N 3.46Å; N168-M170 VanDerWaalsContact C-N 3.31Å; N168-M170 PolarHBondContact O-N 3.49Å; M170-T172 PolarHBondContact O-N 3.06Å; M170-K173 PolarHBondContact O-N 2.86Å; M170-K173 VanDerWaalsContact O-N 3.08Å; M170-Y174 HydrophobicContact CE-CE2 4.31Å; M170-Y174 WeakPolarHBondContact O-CB 3.49Å; M170-Y174 WeakPolarHBondContact O-CD2 3.45Å; M170-Y174 PolarHBondContact O-N 2.78Å; M170-Y174 HydrophobicContact SD-CD2 4.15Å; M170-Y174 HydrophobicContact SD-CE2 3.79Å
171	F	95.9	Very high	93.8	Very high	8 Å²	8	63.4 Å²	63.4	4%	0.035	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-46	177.9	-93.1	-96.2	0	0	0	112.1	R136 L139 V167 N168 K173 Y174 D175 G180 I182	R136-F171 HydrophobicContact CB-CE2 4.13Å; R136-F171 HydrophobicContact CB-CZ 4.16Å; R136-F171 HydrophobicContact CG-CD1 4.17Å; R136-F171 HydrophobicContact CG-CD2 4.01Å; R136-F171 HydrophobicContact CG-CE1 3.7Å; R136-F171 HydrophobicContact CG-CE2 3.53Å; R136-F171 HydrophobicContact CG-CG 4.32Å; R136-F171 HydrophobicContact CG-CZ 3.37Å; L139-F171 HydrophobicContact CB-CE2 4.3Å; L139-F171 HydrophobicContact CD2-CD2 3.75Å; L139-F171 HydrophobicContact CD2-CE2 3.61Å; V167-F171 HydrophobicContact CG1-CD2 4.01Å; V167-F171 HydrophobicContact CG1-CE2 4.29Å; V167-F171 WeakPolarHBondContact O-CD2 3.48Å; V167-F171 PolarHBondContact O-N 3.28Å; N168-F171 PolarHBondContact O-N 3.29Å; F171-K173 PolarHBondContact O-N 3.3Å; F171-K173 VanDerWaalsContact O-N 3.12Å; F171-Y174 PolarHBondContact O-N 3.3Å; F171-D175 HydrophobicContact CD1-CB 3.92Å; F171-D175 VanDerWaalsContact O-CB 3.28Å; F171-D175 WeakPolarHBondContact O-CB 3.39Å; F171-D175 PolarHBondContact O-N 2.92Å; F171-G180 WeakPolarHBondContact CE1-O 3.31Å; F171-I182 HydrophobicContact CD1-CG1 4.37Å; F171-I182 HydrophobicContact CD2-CD1 4.22Å; F171-I182 HydrophobicContact CE1-CD1 4.35Å; F171-I182 HydrophobicContact CE1-CG1 4.08Å; F171-I182 HydrophobicContact CE2-CD1 4.03Å; F171-I182 HydrophobicContact CG-CD1 4.46Å; F171-I182 HydrophobicContact CZ-CD1 4.09Å; F171-I182 HydrophobicContact CZ-CG1 4.2Å
172	T	95.6	Very high	94.2	Very high	114 Å²	114	58.8 Å²	58.8	70%	0.699	31%	0.31	S	S	*	.	H	α-helix	trans	-57.8	-30.2	175.2	-59.1	0	0	0	0	113.1	N168 M170	N168-T172 PolarHBondContact O-N 3.36Å; N168-T172 PolarHBondContact O-OG1 3.44Å; M170-T172 PolarHBondContact O-N 3.06Å
173	K	94.5	Very high	94.7	Very high	96 Å²	96	58.3 Å²	58.3	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-85.6	-37.2	-178.9	-171.6	-178.6	-179.6	174.2	0	113.1	T169 M170 F171 V190 D194	T169-K173 WeakPolarHBondContact O-CB 3.39Å; T169-K173 PolarHBondContact O-N 3.2Å; M170-K173 PolarHBondContact O-N 2.86Å; M170-K173 VanDerWaalsContact O-N 3.08Å; F171-K173 PolarHBondContact O-N 3.3Å; F171-K173 VanDerWaalsContact O-N 3.12Å; K173-V190 HydrophobicContact CD-CG1 4.25Å; K173-V190 HydrophobicContact CG-CG1 3.92Å; K173-D194 IonicContact NZ-OD2 2.74Å; K173-D194 PolarHBondContact NZ-OD2 3.21Å
174	Y	95.3	Very high	95.1	Very high	5 Å²	5	63.6 Å²	63.6	2%	0.02	33%	0.328	C	S	.	.	H	α-helix	trans	-108.7	-27.8	-166.2	-78.3	-86.3	0	0	0	114.6	M170 F171 L176 E186 F187 V190 S191	M170-Y174 HydrophobicContact CE-CE2 4.31Å; M170-Y174 WeakPolarHBondContact O-CB 3.49Å; M170-Y174 WeakPolarHBondContact O-CD2 3.45Å; M170-Y174 PolarHBondContact O-N 2.78Å; M170-Y174 HydrophobicContact SD-CD2 4.15Å; M170-Y174 HydrophobicContact SD-CE2 3.79Å; F171-Y174 PolarHBondContact O-N 3.3Å; Y174-L176 PolarHBondContact O-N 3.11Å; Y174-E186 VanDerWaalsContact O-CB 3.27Å; Y174-E186 WeakPolarHBondContact O-CB 3.33Å; Y174-F187 AromaticContact CD1-CD2 3.97Å; Y174-F187 HydrophobicContact CD1-CD2 3.97Å; Y174-F187 AromaticContact CE1-CD2 3.91Å; Y174-F187 HydrophobicContact CE1-CD2 3.91Å; Y174-F187 HydrophobicContact CE1-CE2 4.14Å; Y174-V190 HydrophobicContact CD1-CB 3.53Å; Y174-V190 HydrophobicContact CD1-CG1 3.6Å; Y174-V190 HydrophobicContact CD1-CG2 4.17Å; Y174-V190 HydrophobicContact CD2-CG1 4.33Å; Y174-V190 HydrophobicContact CE1-CB 3.54Å; Y174-V190 HydrophobicContact CE1-CG1 3.41Å; Y174-V190 VanDerWaalsContact CE1-CG1 3.41Å; Y174-V190 HydrophobicContact CE2-CG1 4.16Å; Y174-V190 HydrophobicContact CG-CB 4.35Å; Y174-V190 HydrophobicContact CG-CG1 4.08Å; Y174-S191 WeakPolarHBondContact CE1-OG 3.29Å; Y174-S191 PolarHBondContact OH-OG 3.36Å
175	D	96.8	Very high	95.3	Very high	10 Å²	10	67.2 Å²	67.2	5%	0.053	35%	0.349	C	S	.	.			trans	-87.1	91.4	176.4	175.6	1.3	0	0	0	107.8	F171 H178 D179 G180 I182	F171-D175 HydrophobicContact CD1-CB 3.92Å; F171-D175 VanDerWaalsContact O-CB 3.28Å; F171-D175 WeakPolarHBondContact O-CB 3.39Å; F171-D175 PolarHBondContact O-N 2.92Å; D175-H178 PolarHBondContact O-CE1 2.87Å; D175-H178 PolarHBondContact O-ND1 3.5Å; D175-H178 WeakPolarHBondContact OD1-CA 3.49Å; D175-H178 PolarHBondContact OD1-N 2.89Å; D175-D179 PolarHBondContact OD1-N 3.17Å; D175-G180 VanDerWaalsContact OD2-CA 3.29Å; D175-G180 WeakPolarHBondContact OD2-CA 3.44Å; D175-G180 PolarHBondContact OD2-N 2.87Å; D175-I182 HydrophobicContact CB-CG1 4.12Å
176	L	96.7	Very high	95.6	Very high	93 Å²	93	64.3 Å²	64.3	49%	0.487	33%	0.333	S	S	.	.	S	Bend	trans	-82.1	-32.6	-168.1	-62.5	-178.3	0	0	0	112.1	Y174 E186 V190	Y174-L176 PolarHBondContact O-N 3.11Å; L176-E186 HydrophobicContact CB-CG 4.2Å; L176-E186 HydrophobicContact CD1-CB 4.39Å; L176-E186 HydrophobicContact CD1-CG 4.18Å; L176-E186 HydrophobicContact CG-CB 4.36Å; L176-E186 HydrophobicContact CG-CG 4.16Å; L176-E186 PolarHBondContact N-OE1 2.78Å; L176-V190 HydrophobicContact CD1-CG2 4.29Å; L176-V190 HydrophobicContact CD2-CG2 4.05Å; L176-V190 HydrophobicContact CG-CG2 4.39Å
177	D	97.3	Very high	95.9	Very high	106 Å²	106	58.1 Å²	58.1	57%	0.567	31%	0.31	S	S	*	.	S	Bend	trans	-92.9	-6.3	176.8	73.2	7.5	0	0	0	113.6	D179 E186	D177-D179 VanDerWaalsContact C-N 3.34Å; D177-D179 VanDerWaalsContact OD1-CB 3.32Å; D177-D179 WeakPolarHBondContact OD1-CB 3.39Å; D177-D179 PolarHBondContact OD1-N 3.12Å; D177-D179 VanDerWaalsContact OD1-N 3.11Å; D177-E186 PolarHBondContact N-OE1 3.3Å
178	H	95.6	Very high	96	Very high	146 Å²	146	61.6 Å²	61.6	68%	0.676	33%	0.325	S	S	*	.			trans	64.5	33.2	176.7	-53.8	-42.4	0	0	0	113.6	D175 G180	D175-H178 PolarHBondContact O-CE1 2.87Å; D175-H178 PolarHBondContact O-ND1 3.5Å; D175-H178 WeakPolarHBondContact OD1-CA 3.49Å; D175-H178 PolarHBondContact OD1-N 2.89Å; H178-G180 VanDerWaalsContact C-N 3.26Å; H178-G180 PolarHBondContact O-N 3.04Å
179	D	97.4	Very high	95.9	Very high	79 Å²	79	60.5 Å²	60.5	42%	0.422	32%	0.322	S	S	.	.	S	Bend	trans	-81.3	-4.8	177.1	84.1	-8.3	0	0	0	113.7	D175 D177 K181	D175-D179 PolarHBondContact OD1-N 3.17Å; D177-D179 VanDerWaalsContact C-N 3.34Å; D177-D179 VanDerWaalsContact OD1-CB 3.32Å; D177-D179 WeakPolarHBondContact OD1-CB 3.39Å; D177-D179 PolarHBondContact OD1-N 3.12Å; D177-D179 VanDerWaalsContact OD1-N 3.11Å; D179-K181 WeakPolarHBondContact OD1-CG 3.37Å; D179-K181 PolarHBondContact OD1-N 3.42Å; D179-K181 VanDerWaalsContact OD1-O 3.06Å; D179-K181 WeakPolarHBondContact OD2-CE 3.49Å; D179-K181 IonicContact OD2-NZ 3.92Å
180	G	96.4	Very high	96	Very high	41 Å²	41	57.4 Å²	57.4	42%	0.423	30%	0.303	S	S	.	.	S	Bend	trans	91	10	175.3	0	0	0	0	0	114.6	F171 D175 H178	F171-G180 WeakPolarHBondContact CE1-O 3.31Å; D175-G180 VanDerWaalsContact OD2-CA 3.29Å; D175-G180 WeakPolarHBondContact OD2-CA 3.44Å; D175-G180 PolarHBondContact OD2-N 2.87Å; H178-G180 VanDerWaalsContact C-N 3.26Å; H178-G180 PolarHBondContact O-N 3.04Å
181	K	97.7	Very high	95.9	Very high	65 Å²	65	56.6 Å²	56.6	28%	0.283	30%	0.3	S	S	.	.	S	Bend	trans	-141.7	159.8	173.4	53	179.7	-175.3	167	0	109.2	Y133 D179	Y133-K181 HydrophobicContact CD1-CD 3.49Å; Y133-K181 VanDerWaalsContact CD1-CD 3.49Å; Y133-K181 HydrophobicContact CD1-CG 3.97Å; Y133-K181 HydrophobicContact CD2-CD 4.36Å; Y133-K181 HydrophobicContact CE1-CD 3.99Å; Y133-K181 VanDerWaalsContact CE1-NZ 3.33Å; Y133-K181 HydrophobicContact CG-CD 3.72Å; Y133-K181 HydrophobicContact CG-CG 4.43Å; D179-K181 WeakPolarHBondContact OD1-CG 3.37Å; D179-K181 PolarHBondContact OD1-N 3.42Å; D179-K181 VanDerWaalsContact OD1-O 3.06Å; D179-K181 WeakPolarHBondContact OD2-CE 3.49Å; D179-K181 IonicContact OD2-NZ 3.92Å
182	I	97.9	Very high	95.7	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.9	178.5	-58.8	160.1	0	0	0	108.1	Y133 I134 F171 D175 E186 F187	Y133-I182 CarbonylContact C-O 3.04Å; Y133-I182 WeakPolarHBondContact CA-O 3.43Å; I134-I182 HydrophobicContact CB-CB 4.2Å; I134-I182 PolarHBondContact N-O 3.25Å; I134-I182 PolarHBondContact O-N 2.85Å; F171-I182 HydrophobicContact CD1-CG1 4.37Å; F171-I182 HydrophobicContact CD2-CD1 4.22Å; F171-I182 HydrophobicContact CE1-CD1 4.35Å; F171-I182 HydrophobicContact CE1-CG1 4.08Å; F171-I182 HydrophobicContact CE2-CD1 4.03Å; F171-I182 HydrophobicContact CG-CD1 4.46Å; F171-I182 HydrophobicContact CZ-CD1 4.09Å; F171-I182 HydrophobicContact CZ-CG1 4.2Å; D175-I182 HydrophobicContact CB-CG1 4.12Å; I182-E186 HydrophobicContact CG2-CB 4.38Å; I182-F187 HydrophobicContact CG2-CB 3.94Å; I182-F187 HydrophobicContact CG2-CD2 4.4Å
183	S	97.7	Very high	95.3	Very high	25 Å²	25	60.2 Å²	60.2	18%	0.175	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	163	174.7	70.6	0	0	0	0	112	D185 E186 F187	S183-D185 VanDerWaalsContact C-N 3.28Å; S183-D185 PolarHBondContact O-N 3.04Å; S183-E186 VanDerWaalsContact CB-OE2 3.29Å; S183-E186 WeakPolarHBondContact CB-OE2 3.49Å; S183-E186 PolarHBondContact N-OE2 3.42Å; S183-E186 PolarHBondContact O-N 3.26Å; S183-E186 VanDerWaalsContact OG-CD 3.32Å; S183-E186 VanDerWaalsContact OG-CG 3.22Å; S183-E186 WeakPolarHBondContact OG-CG 3.45Å; S183-E186 PolarHBondContact OG-N 3.23Å; S183-E186 PolarHBondContact OG-OE2 3.35Å; S183-F187 WeakPolarHBondContact O-CB 3.42Å; S183-F187 PolarHBondContact O-N 2.84Å
184	K	95.8	Very high	95	Very high	112 Å²	112	56.7 Å²	56.7	49%	0.487	30%	0.298	S	S	.	.	H	α-helix	trans	-57.3	-39.9	174.8	-171.8	177.4	-177.1	175.5	0	113.1	F123 F188	F123-K184 HydrophobicContact CD1-CG 4.5Å; F123-K184 HydrophobicContact CE1-CB 4.27Å; F123-K184 HydrophobicContact CE1-CG 4.49Å; F123-K184 HydrophobicContact CE2-CB 4.17Å; F123-K184 HydrophobicContact CZ-CB 3.97Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 2.94Å
185	D	96.5	Very high	94.5	Very high	131 Å²	131	61.1 Å²	61.1	70%	0.701	33%	0.327	S	S	*	.	H	α-helix	trans	-70.9	-39.2	-177.4	-71.6	-21	0	0	0	111.3	S183 F188 S189	S183-D185 VanDerWaalsContact C-N 3.28Å; S183-D185 PolarHBondContact O-N 3.04Å; D185-F188 PolarHBondContact O-N 3.44Å; D185-S189 VanDerWaalsContact O-CB 3.25Å; D185-S189 WeakPolarHBondContact O-CB 3.31Å; D185-S189 PolarHBondContact O-N 3.36Å
186	E	97.2	Very high	93.9	Very high	16 Å²	16	66.5 Å²	66.5	8%	0.075	36%	0.356	C	S	.	.	H	α-helix	trans	-67.8	-47.5	174.9	-66.1	167.2	120.3	0	0	111.9	Y174 L176 D177 I182 S183 F188 S189 V190	Y174-E186 VanDerWaalsContact O-CB 3.27Å; Y174-E186 WeakPolarHBondContact O-CB 3.33Å; L176-E186 HydrophobicContact CB-CG 4.2Å; L176-E186 HydrophobicContact CD1-CB 4.39Å; L176-E186 HydrophobicContact CD1-CG 4.18Å; L176-E186 HydrophobicContact CG-CB 4.36Å; L176-E186 HydrophobicContact CG-CG 4.16Å; L176-E186 PolarHBondContact N-OE1 2.78Å; D177-E186 PolarHBondContact N-OE1 3.3Å; I182-E186 HydrophobicContact CG2-CB 4.38Å; S183-E186 VanDerWaalsContact CB-OE2 3.29Å; S183-E186 WeakPolarHBondContact CB-OE2 3.49Å; S183-E186 PolarHBondContact N-OE2 3.42Å; S183-E186 PolarHBondContact O-N 3.26Å; S183-E186 VanDerWaalsContact OG-CD 3.32Å; S183-E186 VanDerWaalsContact OG-CG 3.22Å; S183-E186 WeakPolarHBondContact OG-CG 3.45Å; S183-E186 PolarHBondContact OG-N 3.23Å; S183-E186 PolarHBondContact OG-OE2 3.35Å; E186-F188 PolarHBondContact O-N 2.81Å; E186-S189 PolarHBondContact O-N 2.86Å; E186-V190 WeakPolarHBondContact O-CG2 3.29Å; E186-V190 PolarHBondContact O-N 3.2Å
187	F	96	Very high	93.3	Very high	3 Å²	3	63.7 Å²	63.7	1%	0.013	34%	0.34	C	S	.	.	H	α-helix	trans	-54.9	-43.1	175.9	-172.4	-96.7	0	0	0	111.2	I119 I122 F123 Y126 I134 Y174 I182 S183 S191 F197	I119-F187 HydrophobicContact CG2-CD1 4.12Å; I119-F187 HydrophobicContact CG2-CE1 3.96Å; I122-F187 HydrophobicContact CG2-CE1 4.4Å; I122-F187 HydrophobicContact CG2-CZ 3.93Å; F123-F187 HydrophobicContact CB-CD1 3.97Å; F123-F187 HydrophobicContact CB-CE1 4.1Å; F123-F187 HydrophobicContact CD2-CB 3.66Å; F123-F187 AromaticContact CD2-CD1 3.71Å; F123-F187 HydrophobicContact CD2-CD1 3.71Å; F123-F187 HydrophobicContact CD2-CD2 4.37Å; F123-F187 HydrophobicContact CD2-CE1 4.47Å; F123-F187 AromaticContact CD2-CG 3.65Å; F123-F187 HydrophobicContact CD2-CG 3.65Å; F123-F187 HydrophobicContact CE2-CB 3.95Å; F123-F187 HydrophobicContact CE2-CG 4.35Å; F123-F187 HydrophobicContact CG-CD1 4.34Å; Y126-F187 HydrophobicContact CD2-CE2 4.27Å; Y126-F187 HydrophobicContact CD2-CZ 4.27Å; Y126-F187 HydrophobicContact CE2-CE2 4.44Å; Y126-F187 HydrophobicContact CE2-CZ 4.38Å; I134-F187 HydrophobicContact CD1-CD2 3.86Å; I134-F187 HydrophobicContact CD1-CE2 4.24Å; I134-F187 HydrophobicContact CD1-CG 4.37Å; Y174-F187 AromaticContact CD1-CD2 3.97Å; Y174-F187 HydrophobicContact CD1-CD2 3.97Å; Y174-F187 AromaticContact CE1-CD2 3.91Å; Y174-F187 HydrophobicContact CE1-CD2 3.91Å; Y174-F187 HydrophobicContact CE1-CE2 4.14Å; I182-F187 HydrophobicContact CG2-CB 3.94Å; I182-F187 HydrophobicContact CG2-CD2 4.4Å; S183-F187 WeakPolarHBondContact O-CB 3.42Å; S183-F187 PolarHBondContact O-N 2.84Å; F187-S191 WeakPolarHBondContact O-CB 3.39Å; F187-S191 PolarHBondContact O-N 3.09Å; F187-S191 PolarHBondContact O-OG 2.73Å; F187-F197 HydrophobicContact CZ-CE2 4.45Å; F187-F197 HydrophobicContact CZ-CZ 4.24Å
188	F	94.3	Very high	92.6	Very high	75 Å²	75	61.2 Å²	61.2	33%	0.329	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-48.2	178.5	-175	-104.7	0	0	0	112.5	L116 I119 K184 D185 E186 V190 S191 T192	L116-F188 HydrophobicContact CD1-CD2 3.88Å; L116-F188 HydrophobicContact CD1-CE2 3.02Å; L116-F188 HydrophobicContact CD1-CZ 3.43Å; L116-F188 VanDerWaalsContact CD1-CZ 3.43Å; L116-F188 HydrophobicContact CG-CE2 4.38Å; I119-F188 HydrophobicContact CD1-CE2 4.43Å; I119-F188 HydrophobicContact CG2-CD2 3.9Å; I119-F188 HydrophobicContact CG2-CE2 4.48Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 2.94Å; D185-F188 PolarHBondContact O-N 3.44Å; E186-F188 PolarHBondContact O-N 2.81Å; F188-V190 VanDerWaalsContact C-N 3.31Å; F188-V190 PolarHBondContact O-N 3.12Å; F188-S191 PolarHBondContact O-N 3.15Å; F188-T192 HydrophobicContact CD1-CG2 4.45Å; F188-T192 HydrophobicContact CD2-CG2 3.89Å; F188-T192 HydrophobicContact CE1-CG2 4.03Å; F188-T192 HydrophobicContact CE2-CG2 3.32Å; F188-T192 HydrophobicContact CG-CG2 4.39Å; F188-T192 HydrophobicContact CZ-CG2 3.44Å; F188-T192 VanDerWaalsContact CZ-CG2 3.44Å; F188-T192 WeakPolarHBondContact O-CB 3.34Å; F188-T192 WeakPolarHBondContact O-CG2 3.38Å; F188-T192 PolarHBondContact O-N 2.99Å; F188-T192 PolarHBondContact O-OG1 2.98Å
189	S	94	Very high	91.8	Very high	45 Å²	45	56.9 Å²	56.9	32%	0.315	32%	0.316	S	S	.	.	H	α-helix	trans	-56	-45.6	179.7	-179.3	0	0	0	0	111.8	D185 E186 T192 Q193	D185-S189 VanDerWaalsContact O-CB 3.25Å; D185-S189 WeakPolarHBondContact O-CB 3.31Å; D185-S189 PolarHBondContact O-N 3.36Å; E186-S189 PolarHBondContact O-N 2.86Å; S189-T192 PolarHBondContact O-OG1 3.32Å; S189-Q193 WeakPolarHBondContact O-CG 3.45Å; S189-Q193 PolarHBondContact O-NE2 2.84Å
190	V	93.9	Very high	91	Very high	17 Å²	17	58.6 Å²	58.6	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-77.6	-44.8	-178.2	176.1	0	0	0	0	111.6	K173 Y174 L176 E186 F188 T192 Q193 D194	K173-V190 HydrophobicContact CD-CG1 4.25Å; K173-V190 HydrophobicContact CG-CG1 3.92Å; Y174-V190 HydrophobicContact CD1-CB 3.53Å; Y174-V190 HydrophobicContact CD1-CG1 3.6Å; Y174-V190 HydrophobicContact CD1-CG2 4.17Å; Y174-V190 HydrophobicContact CD2-CG1 4.33Å; Y174-V190 HydrophobicContact CE1-CB 3.54Å; Y174-V190 HydrophobicContact CE1-CG1 3.41Å; Y174-V190 VanDerWaalsContact CE1-CG1 3.41Å; Y174-V190 HydrophobicContact CE2-CG1 4.16Å; Y174-V190 HydrophobicContact CG-CB 4.35Å; Y174-V190 HydrophobicContact CG-CG1 4.08Å; L176-V190 HydrophobicContact CD1-CG2 4.29Å; L176-V190 HydrophobicContact CD2-CG2 4.05Å; L176-V190 HydrophobicContact CG-CG2 4.39Å; E186-V190 WeakPolarHBondContact O-CG2 3.29Å; E186-V190 PolarHBondContact O-N 3.2Å; F188-V190 VanDerWaalsContact C-N 3.31Å; F188-V190 PolarHBondContact O-N 3.12Å; V190-T192 VanDerWaalsContact C-N 3.29Å; V190-T192 PolarHBondContact O-N 3.35Å; V190-Q193 PolarHBondContact O-N 3.34Å; V190-Q193 VanDerWaalsContact O-N 3.1Å; V190-D194 PolarHBondContact O-N 2.79Å
191	S	92.3	Very high	90.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66	-31.1	-177	-60.1	0	0	0	0	113.1	Y174 F187 F188 Q193 D194	Y174-S191 WeakPolarHBondContact CE1-OG 3.29Å; Y174-S191 PolarHBondContact OH-OG 3.36Å; F187-S191 WeakPolarHBondContact O-CB 3.39Å; F187-S191 PolarHBondContact O-N 3.09Å; F187-S191 PolarHBondContact O-OG 2.73Å; F188-S191 PolarHBondContact O-N 3.15Å; S191-Q193 PolarHBondContact O-N 3.25Å; S191-D194 PolarHBondContact O-N 2.91Å
192	T	90.2	Very high	88.9	Confident	54 Å²	54	57 Å²	57	33%	0.331	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-14.1	176.6	51.7	0	0	0	0	113.7	I119 F188 S189 V190 I198	I119-T192 HydrophobicContact CD1-CG2 3.71Å; F188-T192 HydrophobicContact CD1-CG2 4.45Å; F188-T192 HydrophobicContact CD2-CG2 3.89Å; F188-T192 HydrophobicContact CE1-CG2 4.03Å; F188-T192 HydrophobicContact CE2-CG2 3.32Å; F188-T192 HydrophobicContact CG-CG2 4.39Å; F188-T192 HydrophobicContact CZ-CG2 3.44Å; F188-T192 VanDerWaalsContact CZ-CG2 3.44Å; F188-T192 WeakPolarHBondContact O-CB 3.34Å; F188-T192 WeakPolarHBondContact O-CG2 3.38Å; F188-T192 PolarHBondContact O-N 2.99Å; F188-T192 PolarHBondContact O-OG1 2.98Å; S189-T192 PolarHBondContact O-OG1 3.32Å; V190-T192 VanDerWaalsContact C-N 3.29Å; V190-T192 PolarHBondContact O-N 3.35Å; T192-I198 WeakPolarHBondContact O-CD1 3.37Å
193	Q	88.8	Confident	87.8	Confident	144 Å²	144	62.7 Å²	62.7	67%	0.673	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-3.9	177.1	-65.8	177.7	52.2	0	0	112.6	S189 V190 S191 P195	S189-Q193 WeakPolarHBondContact O-CG 3.45Å; S189-Q193 PolarHBondContact O-NE2 2.84Å; V190-Q193 PolarHBondContact O-N 3.34Å; V190-Q193 VanDerWaalsContact O-N 3.1Å; S191-Q193 PolarHBondContact O-N 3.25Å; Q193-P195 VanDerWaalsContact O-CD 3.27Å; Q193-P195 WeakPolarHBondContact O-CD 3.47Å
194	D	87.8	Confident	86.3	Confident	21 Å²	21	63.9 Å²	63.9	11%	0.112	35%	0.347	C	S	.	.			trans	-95	103.6	-178.7	-176.3	-16.5	0	0	0	110.7	K173 V190 S191 D196 F197 I198	K173-D194 IonicContact NZ-OD2 2.74Å; K173-D194 PolarHBondContact NZ-OD2 3.21Å; V190-D194 PolarHBondContact O-N 2.79Å; S191-D194 PolarHBondContact O-N 2.91Å; D194-D196 VanDerWaalsContact C-N 3.3Å; D194-D196 PolarHBondContact O-N 3.16Å; D194-D196 PolarHBondContact OD1-N 3.19Å; D194-D196 VanDerWaalsContact OD1-N 3.08Å; D194-F197 HydrophobicContact CB-CB 3.7Å; D194-F197 VanDerWaalsContact CG-CB 3.42Å; D194-F197 PolarHBondContact O-N 2.99Å; D194-F197 PolarHBondContact OD1-N 2.9Å; D194-I198 VanDerWaalsContact O-CG1 3.32Å; D194-I198 WeakPolarHBondContact O-CG1 3.27Å; D194-I198 PolarHBondContact O-N 3.32Å
195	P	85	Confident	85	Confident	98 Å²	98	62 Å²	62	64%	0.636	34%	0.343	S	S	*	.	H	α-helix	trans	-65.1	-32.8	-176.9	-20.2	34.8	0	0	0	112.8	Q193 I198 A199	Q193-P195 VanDerWaalsContact O-CD 3.27Å; Q193-P195 WeakPolarHBondContact O-CD 3.47Å; P195-I198 PolarHBondContact O-N 3.02Å; P195-A199 VanDerWaalsContact O-CB 3.25Å; P195-A199 WeakPolarHBondContact O-CB 3.44Å; P195-A199 PolarHBondContact O-N 3.3Å
196	D	84.2	Confident	83.2	Confident	123 Å²	123	60.9 Å²	60.9	66%	0.658	34%	0.34	S	S	*	.	H	α-helix	trans	-71.9	-41.2	179.4	-67.5	-29.9	0	0	0	110.4	D194 A199 N200	D194-D196 VanDerWaalsContact C-N 3.3Å; D194-D196 PolarHBondContact O-N 3.16Å; D194-D196 PolarHBondContact OD1-N 3.19Å; D194-D196 VanDerWaalsContact OD1-N 3.08Å; D196-A199 PolarHBondContact O-N 3.44Å; D196-N200 PolarHBondContact O-N 3.31Å; D196-N200 VanDerWaalsContact O-N 3.09Å; D196-N200 PolarHBondContact O-ND2 2.68Å
197	F	83.7	Confident	80.9	Confident	35 Å²	35	65.3 Å²	65.3	15%	0.154	37%	0.368	C	S	.	.	H	α-helix	trans	-60	-48	172.9	-175.6	-87.8	0	0	0	110.9	I119 I122 F187 D194 A199 N200 L201	I119-F197 HydrophobicContact CG1-CE1 3.85Å; I122-F197 HydrophobicContact CD1-CE1 4.24Å; I122-F197 HydrophobicContact CD1-CZ 3.66Å; I122-F197 HydrophobicContact CG2-CE2 4.45Å; I122-F197 HydrophobicContact CG2-CZ 4.09Å; F187-F197 HydrophobicContact CZ-CE2 4.45Å; F187-F197 HydrophobicContact CZ-CZ 4.24Å; D194-F197 HydrophobicContact CB-CB 3.7Å; D194-F197 VanDerWaalsContact CG-CB 3.42Å; D194-F197 PolarHBondContact O-N 2.99Å; D194-F197 PolarHBondContact OD1-N 2.9Å; F197-A199 PolarHBondContact O-N 3.17Å; F197-N200 WeakPolarHBondContact O-CB 3.47Å; F197-N200 PolarHBondContact O-N 3.49Å; F197-L201 HydrophobicContact CD1-CD1 4.37Å; F197-L201 HydrophobicContact CD1-CD2 4.4Å; F197-L201 HydrophobicContact CD1-CG 4.36Å; F197-L201 HydrophobicContact CE1-CD1 4.13Å; F197-L201 HydrophobicContact CE1-CD2 3.79Å; F197-L201 HydrophobicContact CE1-CG 4.17Å; F197-L201 HydrophobicContact CZ-CD2 4.26Å; F197-L201 PolarHBondContact O-N 2.76Å
198	I	82	Confident	78.3	Confident	53 Å²	53	71.8 Å²	71.8	27%	0.272	41%	0.408	S	S	.	.	H	α-helix	trans	-63.9	-41.6	179.2	-68.1	166.8	0	0	0	111.4	T192 D194 P195 N200 L201	T192-I198 WeakPolarHBondContact O-CD1 3.37Å; D194-I198 VanDerWaalsContact O-CG1 3.32Å; D194-I198 WeakPolarHBondContact O-CG1 3.27Å; D194-I198 PolarHBondContact O-N 3.32Å; P195-I198 PolarHBondContact O-N 3.02Å; I198-N200 PolarHBondContact O-N 2.93Å; I198-L201 VanDerWaalsContact O-CB 3.28Å; I198-L201 WeakPolarHBondContact O-CB 3.49Å; I198-L201 PolarHBondContact O-N 2.7Å
199	A	80.1	Confident	77.5	Confident	56 Å²	56	71.6 Å²	71.6	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-58.2	-40.5	176	0	0	0	0	0	111.2	P195 D196 F197 L201 S202	P195-A199 VanDerWaalsContact O-CB 3.25Å; P195-A199 WeakPolarHBondContact O-CB 3.44Å; P195-A199 PolarHBondContact O-N 3.3Å; D196-A199 PolarHBondContact O-N 3.44Å; F197-A199 PolarHBondContact O-N 3.17Å; A199-L201 VanDerWaalsContact C-N 3.25Å; A199-L201 PolarHBondContact O-N 2.97Å; A199-S202 WeakPolarHBondContact O-CB 2.96Å; A199-S202 PolarHBondContact O-N 3.11Å; A199-S202 PolarHBondContact O-OG 3.17Å
200	N	79.2	Confident	76.6	Confident	115 Å²	115	73 Å²	73	62%	0.615	42%	0.417	S	S	*	.	H	α-helix	trans	-66.8	-22.4	175.8	-72.1	-47.2	0	0	0	113.6	D196 F197 I198 S202 L203	D196-N200 PolarHBondContact O-N 3.31Å; D196-N200 VanDerWaalsContact O-N 3.09Å; D196-N200 PolarHBondContact O-ND2 2.68Å; F197-N200 WeakPolarHBondContact O-CB 3.47Å; F197-N200 PolarHBondContact O-N 3.49Å; I198-N200 PolarHBondContact O-N 2.93Å; N200-S202 PolarHBondContact O-N 3.05Å; N200-L203 VanDerWaalsContact O-CB 3.28Å; N200-L203 WeakPolarHBondContact O-CB 3.18Å; N200-L203 PolarHBondContact O-N 2.88Å
201	L	78.7	Confident	75.6	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.016	44%	0.435	C	S	.	.	H	α-helix	trans	-67.3	-22.7	174.8	-58.4	-178.9	0	0	0	113.2	N115 K118 I119 I122 F197 I198 A199 L203 F204	N115-L201 HydrophobicContact CB-CD1 4.03Å; K118-L201 HydrophobicContact CB-CD1 4.48Å; K118-L201 HydrophobicContact CB-CD2 4.25Å; K118-L201 HydrophobicContact CD-CB 4.14Å; K118-L201 PolarHBondContact NZ-O 2.96Å; K118-L201 VanDerWaalsContact NZ-O 3.16Å; I119-L201 HydrophobicContact CD1-CD1 4.3Å; I119-L201 HydrophobicContact CG1-CD1 3.91Å; I122-L201 HydrophobicContact CD1-CD2 3.27Å; F197-L201 HydrophobicContact CD1-CD1 4.37Å; F197-L201 HydrophobicContact CD1-CD2 4.4Å; F197-L201 HydrophobicContact CD1-CG 4.36Å; F197-L201 HydrophobicContact CE1-CD1 4.13Å; F197-L201 HydrophobicContact CE1-CD2 3.79Å; F197-L201 HydrophobicContact CE1-CG 4.17Å; F197-L201 HydrophobicContact CZ-CD2 4.26Å; F197-L201 PolarHBondContact O-N 2.76Å; I198-L201 VanDerWaalsContact O-CB 3.28Å; I198-L201 WeakPolarHBondContact O-CB 3.49Å; I198-L201 PolarHBondContact O-N 2.7Å; A199-L201 VanDerWaalsContact C-N 3.25Å; A199-L201 PolarHBondContact O-N 2.97Å; L201-L203 PolarHBondContact O-N 2.8Å; L201-F204 HydrophobicContact CD2-CE2 4.24Å; L201-F204 WeakPolarHBondContact O-CD2 3.42Å; L201-F204 PolarHBondContact O-N 2.78Å
202	S	72.4	Confident	74.7	Confident	69 Å²	69	80.6 Å²	80.6	48%	0.483	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-65.6	-20.6	176.3	69.9	0	0	0	0	112.5	A199 N200 F204 D205	A199-S202 WeakPolarHBondContact O-CB 2.96Å; A199-S202 PolarHBondContact O-N 3.11Å; A199-S202 PolarHBondContact O-OG 3.17Å; N200-S202 PolarHBondContact O-N 3.05Å; S202-F204 PolarHBondContact O-N 2.87Å; S202-D205 WeakPolarHBondContact O-CB 3.49Å; S202-D205 PolarHBondContact O-N 3.24Å
203	L	73.2	Confident	73.7	Confident	121 Å²	121	82.3 Å²	82.3	63%	0.634	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-59.1	-33.6	175.1	-174.4	64.5	0	0	0	111.7	N200 L201 D205 T206	N200-L203 VanDerWaalsContact O-CB 3.28Å; N200-L203 WeakPolarHBondContact O-CB 3.18Å; N200-L203 PolarHBondContact O-N 2.88Å; L201-L203 PolarHBondContact O-N 2.8Å; L203-D205 PolarHBondContact O-N 3.28Å; L203-T206 PolarHBondContact O-N 2.75Å; L203-T206 PolarHBondContact O-OG1 3.36Å
204	F	66.1	Low	72.7	Confident	50 Å²	50	78.1 Å²	78.1	22%	0.219	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-68	-22.4	178	-64.5	-70.6	0	0	0	113.4	L110 K118 I122 L201 S202 T206	L110-F204 HydrophobicContact CD2-CD1 3.86Å; L110-F204 HydrophobicContact CD2-CE1 3.79Å; L110-F204 HydrophobicContact CD2-CG 4.42Å; L110-F204 HydrophobicContact CD2-CZ 4.3Å; L110-F204 WeakPolarHBondContact O-CB 3.45Å; K118-F204 HydrophobicContact CD-CB 4.37Å; K118-F204 HydrophobicContact CD-CD2 4.23Å; I122-F204 HydrophobicContact CD1-CE2 4.14Å; L201-F204 HydrophobicContact CD2-CE2 4.24Å; L201-F204 WeakPolarHBondContact O-CD2 3.42Å; L201-F204 PolarHBondContact O-N 2.78Å; S202-F204 PolarHBondContact O-N 2.87Å; F204-T206 VanDerWaalsContact C-N 3.32Å
205	D	68.8	Low	71.6	Confident	74 Å²	74	82.2 Å²	82.2	40%	0.396	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-77.7	-19.8	179.6	-59.6	-41	0	0	0	112.3	K118 S202 L203 V207	K118-D205 IonicContact NZ-OD1 3.46Å; K118-D205 PolarHBondContact NZ-OD1 3.35Å; K118-D205 IonicContact NZ-OD2 3.57Å; K118-D205 PolarHBondContact NZ-OD2 3.22Å; S202-D205 WeakPolarHBondContact O-CB 3.49Å; S202-D205 PolarHBondContact O-N 3.24Å; L203-D205 PolarHBondContact O-N 3.28Å; D205-V207 VanDerWaalsContact C-N 3.28Å; D205-V207 PolarHBondContact O-N 3.14Å
206	T	59.2	Low	70.6	Confident	106 Å²	106	81 Å²	81	65%	0.65	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-80.4	-1	-179.6	53.4	0	0	0	0	114.9	L203 F204	L203-T206 PolarHBondContact O-N 2.75Å; L203-T206 PolarHBondContact O-OG1 3.36Å; F204-T206 VanDerWaalsContact C-N 3.32Å
207	V	50.1	Low	69.5	Low	110 Å²	110	77.5 Å²	77.5	67%	0.667	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-94.1	-3.2	-174	-174.7	0	0	0	0	113.5	D205	D205-V207 VanDerWaalsContact C-N 3.28Å; D205-V207 PolarHBondContact O-N 3.14Å
208	T	40	Very low	68.2	Low	138 Å²	138	81.4 Å²	81.4	85%	0.847	48%	0.478	S	S	*	.			trans	-103.8	0	172.4	54.6	0	0	0	0	112.4	T111	T111-T208 HydrophobicContact CG2-CG2 4.01Å

Retrieved 208 of 208 residues in 648.4 ms (Link to these results)

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