A0A087WR18_MOUSE Loading...

Interferon 1ha5

AlphaFold DB , UniProt , Accession A0A087WR18, Species MOUSE (Mus musculus, Mouse), Gene Gm13276, Length 182 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50	Low	53.7	Low	246 Å²	246	141.3 Å²	141.3	100%	1.212	81%	0.813	S	S	*	*				0	122.1	0	-67.6	-102.8	167.6	0	0	106.2
2	L	45.3	Very low	54.1	Low	177 Å²	177	140.4 Å²	140.4	93%	0.927	81%	0.811	S	S	*	*			trans	-62	161.1	-163.6	-102.1	99.3	0	0	0	114.8
3	P	53.6	Low	54.9	Low	99 Å²	99	143.2 Å²	143.2	64%	0.643	82%	0.816	S	S	*	*			trans	-99.4	-163.7	-157.9	41.6	-32.8	0	0	0	111.2
4	V	54.3	Low	55.2	Low	129 Å²	129	143.8 Å²	143.8	78%	0.782	81%	0.814	S	S	*	*			trans	171.7	103.4	131.8	162	0	0	0	0	107.7	L6	V4-L6 HydrophobicContact CG1-CD1 4.44Å
5	H	52.1	Low	55.7	Low	168 Å²	168	141.4 Å²	141.4	78%	0.778	81%	0.81	S	S	*	*			trans	-50.9	159.3	153.2	-78.1	-97.3	0	0	0	109.9
6	L	56.8	Low	55.3	Low	141 Å²	141	139.8 Å²	139.8	74%	0.738	81%	0.808	S	S	*	*				171.9	108.1	126.9	-101.4	107	0	0	0	111.3	V4	V4-L6 HydrophobicContact CG1-CD1 4.44Å
7	F	59.2	Low	55.6	Low	170 Å²	170	137.6 Å²	137.6	75%	0.746	80%	0.803	S	S	*	*			trans	54.1	163.2	133.9	-60.2	-89	0	0	0	120.9
8	L	54.9	Low	55.4	Low	139 Å²	139	136.2 Å²	136.2	73%	0.728	80%	0.799	S	S	*	*			cis	-158.2	131	9.8	-111.9	128.4	0	0	0	107
9	V	56.9	Low	55.4	Low	129 Å²	129	134.4 Å²	134.4	78%	0.782	80%	0.801	S	S	*	*				30.7	117.2	119.1	-174.2	0	0	0	0	119.3
10	G	49.5	Very low	55	Low	81 Å²	81	132.5 Å²	132.5	84%	0.835	80%	0.795	S	S	*	*				72.7	117.3	112.1	0	0	0	0	0	119.7
11	G	57.7	Low	54.8	Low	75 Å²	75	130.8 Å²	130.8	77%	0.773	79%	0.789	S	S	*	*			trans	-170.4	81.6	163.5	0	0	0	0	0	112.7	M13	G11-M13 PolarHBondContact O-N 2.88Å
12	V	58.8	Low	54.9	Low	131 Å²	131	127.1 Å²	127.1	79%	0.794	77%	0.774	S	S	*	*			trans	-73.1	112.9	159.7	169.2	0	0	0	0	106.9	L14	V12-L14 HydrophobicContact CG1-CD1 4.2Å
13	M	65.1	Low	55.3	Low	176 Å²	176	124.6 Å²	124.6	87%	0.867	76%	0.761	S	S	*	*			trans	-112.9	97	164.6	-83	-68.7	-170.9	0	0	108.5	G11 S15	G11-M13 PolarHBondContact O-N 2.88Å; M13-S15 PolarHBondContact O-N 3.32Å
14	L	59.2	Low	55.6	Low	152 Å²	152	123.9 Å²	123.9	80%	0.796	76%	0.759	S	S	*	*			trans	-70.3	102.2	163.2	-126.1	90.6	0	0	0	107.3	V12	V12-L14 HydrophobicContact CG1-CD1 4.2Å
15	S	61.9	Low	56	Low	108 Å²	108	120.1 Å²	120.1	76%	0.755	75%	0.746	S	S	*	*			trans	-100.7	87.2	171.1	54.9	0	0	0	0	110.5	M13 S17	M13-S15 PolarHBondContact O-N 3.32Å; S15-S17 PolarHBondContact O-N 3.01Å
16	C	50.1	Low	56.7	Low	115 Å²	115	114.1 Å²	114.1	78%	0.777	72%	0.718	S	S	*	*			trans	-77.2	103.8	158.6	-80.8	0	0	0	0	108.8
17	S	59.1	Low	57.3	Low	103 Å²	103	110.9 Å²	110.9	72%	0.72	71%	0.707	S	S	*	*			trans	-108.2	103.3	168	-66.3	0	0	0	0	110	S15 A19	S15-S17 PolarHBondContact O-N 3.01Å; S17-A19 PolarHBondContact O-N 3.39Å
18	P	52.7	Low	58.2	Low	112 Å²	112	104.8 Å²	104.8	73%	0.727	69%	0.692	S	S	*	*			trans	-88.3	81.7	163.4	34.3	-26.4	0	0	0	108	S20	P18-S20 PolarHBondContact O-N 3.4Å; P18-S20 VanDerWaalsContact O-N 3.13Å
19	A	54.9	Low	59.6	Low	102 Å²	102	99.7 Å²	99.7	84%	0.843	67%	0.668	S	S	*	*			trans	-79.4	25.9	173.2	0	0	0	0	0	113	S17	S17-A19 PolarHBondContact O-N 3.39Å
20	S	48.9	Very low	61.2	Low	96 Å²	96	94.8 Å²	94.8	67%	0.671	64%	0.637	S	S	*	*			trans	-136	90.4	-173.6	26.3	0	0	0	0	111	P18	P18-S20 PolarHBondContact O-N 3.4Å; P18-S20 VanDerWaalsContact O-N 3.13Å
21	S	50.5	Low	63.1	Low	97 Å²	97	97.1 Å²	97.1	68%	0.678	63%	0.626	S	S	*	*			trans	-161.2	-7.9	164.8	-88.6	0	0	0	0	118	D23	S21-D23 PolarHBondContact O-N 2.97Å
22	L	51.3	Low	64.7	Low	170 Å²	170	98.1 Å²	98.1	89%	0.89	61%	0.613	S	S	*	*	H	α-helix	trans	-74.2	-26.6	-177.9	-83.1	160.6	0	0	0	114.6
23	D	54	Low	66.4	Low	123 Å²	123	93 Å²	93	66%	0.658	58%	0.581	S	S	*	*	H	α-helix	trans	-81.8	-26.5	179.4	-159.5	34	0	0	0	112.7	S21 G25 K26 S27	S21-D23 PolarHBondContact O-N 2.97Å; D23-G25 VanDerWaalsContact C-N 3.32Å; D23-G25 PolarHBondContact O-N 2.06Å; D23-K26 PolarHBondContact O-N 3.38Å; D23-S27 PolarHBondContact O-N 3.43Å
24	S	60.4	Low	67.7	Low	85 Å²	85	86.8 Å²	86.8	59%	0.594	55%	0.548	S	S	*	.	H	α-helix	trans	-63.2	-36.9	179.7	-175.7	0	0	0	0	112.1	K26 S27 G28	S24-K26 PolarHBondContact O-N 3.21Å; S24-S27 PolarHBondContact O-N 3.15Å; S24-G28 PolarHBondContact O-N 2.72Å
25	G	62.8	Low	69.4	Low	50 Å²	50	82.2 Å²	82.2	52%	0.515	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-37.4	-179.6	0	0	0	0	0	114.1	D23 S29	D23-G25 VanDerWaalsContact C-N 3.32Å; D23-G25 PolarHBondContact O-N 2.06Å; G25-S29 WeakPolarHBondContact O-CB 3.35Å; G25-S29 PolarHBondContact O-N 3.45Å
26	K	65.8	Low	71	Confident	42 Å²	42	79.5 Å²	79.5	18%	0.183	50%	0.504	C	S	.	.	H	α-helix	trans	-73.8	-44.4	178.2	-171.7	-176.2	177.8	-169.7	0	110.9	D23 S24 G28 S29 L30 E125	D23-K26 PolarHBondContact O-N 3.38Å; S24-K26 PolarHBondContact O-N 3.21Å; K26-G28 VanDerWaalsContact C-N 3.31Å; K26-G28 PolarHBondContact O-N 2.73Å; K26-S29 PolarHBondContact O-N 2.95Å; K26-L30 PolarHBondContact O-N 3.2Å; K26-E125 IonicContact NZ-OE1 2.73Å; K26-E125 PolarHBondContact NZ-OE1 2.89Å
27	S	69.4	Low	73.2	Confident	73 Å²	73	74.2 Å²	74.2	51%	0.51	47%	0.467	S	S	.	.	H	α-helix	trans	-60.5	-41.9	176	-175.7	0	0	0	0	111.4	D23 S24 L30 H31	D23-S27 PolarHBondContact O-N 3.43Å; S24-S27 PolarHBondContact O-N 3.15Å; S27-L30 PolarHBondContact O-N 3.43Å; S27-H31 WeakPolarHBondContact O-CB 3.05Å; S27-H31 PolarHBondContact O-N 3.49Å
28	G	77.7	Confident	75	Confident	42 Å²	42	70.6 Å²	70.6	43%	0.433	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-45.3	175.1	0	0	0	0	0	113.2	S24 K26 L30 H31 L32	S24-G28 PolarHBondContact O-N 2.72Å; K26-G28 VanDerWaalsContact C-N 3.31Å; K26-G28 PolarHBondContact O-N 2.73Å; G28-L30 PolarHBondContact O-N 3.07Å; G28-H31 PolarHBondContact O-N 3Å; G28-L32 WeakPolarHBondContact O-CB 3.4Å; G28-L32 PolarHBondContact O-N 3.38Å
29	S	85.9	Confident	77.1	Confident	32 Å²	32	70.1 Å²	70.1	22%	0.224	43%	0.428	C	S	.	.	H	α-helix	trans	-60.7	-44.8	175	173.4	0	0	0	0	111.7	G25 K26 L32 E33 V119 R122	G25-S29 WeakPolarHBondContact O-CB 3.35Å; G25-S29 PolarHBondContact O-N 3.45Å; K26-S29 PolarHBondContact O-N 2.95Å; S29-L32 PolarHBondContact O-N 2.65Å; S29-E33 WeakPolarHBondContact O-CG 3.22Å; S29-E33 PolarHBondContact O-N 2.8Å; S29-E33 VanDerWaalsContact O-N 3.1Å; S29-V119 WeakPolarHBondContact OG-CG2 3.32Å; S29-R122 PolarHBondContact OG-NH2 3.32Å
30	L	88.8	Confident	79.1	Confident	25 Å²	25	66 Å²	66	13%	0.131	39%	0.391	C	S	.	.	H	α-helix	trans	-66.4	-43	178.9	179.9	59.1	0	0	0	112.2	K26 S27 G28 L32 E33 R34 E116 V119 L120 L175	K26-L30 PolarHBondContact O-N 3.2Å; S27-L30 PolarHBondContact O-N 3.43Å; G28-L30 PolarHBondContact O-N 3.07Å; L30-L32 VanDerWaalsContact C-N 3.29Å; L30-L32 PolarHBondContact O-N 3.13Å; L30-E33 PolarHBondContact O-N 3.42Å; L30-R34 HydrophobicContact CD1-CG 4.2Å; L30-R34 HydrophobicContact CG-CG 4.44Å; L30-R34 WeakPolarHBondContact O-CB 3.38Å; L30-R34 VanDerWaalsContact O-CG 3.29Å; L30-R34 WeakPolarHBondContact O-CG 3.31Å; L30-R34 PolarHBondContact O-N 3.01Å; L30-E116 HydrophobicContact CD1-CG 4.21Å; L30-V119 HydrophobicContact CB-CG1 3.99Å; L30-V119 HydrophobicContact CD1-CG1 4.34Å; L30-L120 HydrophobicContact CD1-CD2 3.63Å; L30-L120 HydrophobicContact CD1-CG 4.05Å; L30-L120 HydrophobicContact CD2-CD2 3.88Å; L30-L120 HydrophobicContact CG-CD2 4.42Å; L30-L175 HydrophobicContact CD2-CD1 3.86Å; L30-L175 HydrophobicContact CG-CD1 4.43Å
31	H	89.5	Confident	81.4	Confident	130 Å²	130	61.5 Å²	61.5	60%	0.602	36%	0.359	S	S	*	.	H	α-helix	trans	-59.8	-41.5	177.1	179.4	-82.2	0	0	0	112	S27 G28 S35	S27-H31 WeakPolarHBondContact O-CB 3.05Å; S27-H31 PolarHBondContact O-N 3.49Å; G28-H31 PolarHBondContact O-N 3Å; H31-S35 WeakPolarHBondContact O-CB 3.45Å; H31-S35 PolarHBondContact O-N 3.47Å; H31-S35 PolarHBondContact O-OG 2.94Å
32	L	92.2	Very high	83.5	Confident	96 Å²	96	58.6 Å²	58.6	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-60.9	-53.2	176.1	-179.3	63.2	0	0	0	111.1	G28 S29 L30 R34 S35 E36	G28-L32 WeakPolarHBondContact O-CB 3.4Å; G28-L32 PolarHBondContact O-N 3.38Å; S29-L32 PolarHBondContact O-N 2.65Å; L30-L32 VanDerWaalsContact C-N 3.29Å; L30-L32 PolarHBondContact O-N 3.13Å; L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3Å; L32-S35 WeakPolarHBondContact O-CB 3.29Å; L32-S35 PolarHBondContact O-N 3.26Å; L32-S35 VanDerWaalsContact O-N 3.1Å; L32-E36 PolarHBondContact O-N 3.44Å
33	E	93.4	Very high	85.5	Confident	25 Å²	25	54.9 Å²	54.9	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-40.6	-180	-62.8	-60.3	159.3	0	0	111.9	S29 L30 S35 E36 T37 R115 E116 V119	S29-E33 WeakPolarHBondContact O-CG 3.22Å; S29-E33 PolarHBondContact O-N 2.8Å; S29-E33 VanDerWaalsContact O-N 3.1Å; L30-E33 PolarHBondContact O-N 3.42Å; E33-S35 VanDerWaalsContact C-N 3.31Å; E33-S35 PolarHBondContact O-N 3.48Å; E33-E36 PolarHBondContact O-N 2.9Å; E33-T37 PolarHBondContact O-N 3.34Å; E33-T37 PolarHBondContact O-OG1 3.47Å; E33-R115 IonicContact OE1-NE 3.71Å; E33-R115 WeakPolarHBondContact OE2-CB 3.29Å; E33-R115 IonicContact OE2-CZ 2.58Å; E33-R115 IonicContact OE2-NE 3.58Å; E33-R115 PolarHBondContact OE2-NE 3.42Å; E33-R115 IonicContact OE2-NH2 3.76Å; E33-E116 HydrophobicContact CB-CB 3.88Å; E33-E116 HydrophobicContact CB-CG 3.85Å; E33-V119 HydrophobicContact CG-CG2 3.8Å
34	R	94.2	Very high	87.4	Confident	45 Å²	45	49.2 Å²	49.2	17%	0.17	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-42.9	174.7	-75.8	-173.1	87	-166.9	0.1	112.4	L30 L32 A38 Y81 E116 L170 P171 F173	L30-R34 HydrophobicContact CD1-CG 4.2Å; L30-R34 HydrophobicContact CG-CG 4.44Å; L30-R34 WeakPolarHBondContact O-CB 3.38Å; L30-R34 VanDerWaalsContact O-CG 3.29Å; L30-R34 WeakPolarHBondContact O-CG 3.31Å; L30-R34 PolarHBondContact O-N 3.01Å; L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3Å; R34-A38 WeakPolarHBondContact O-CB 3.28Å; R34-A38 PolarHBondContact O-N 3.46Å; R34-Y81 HydrophobicContact CG-CE1 4.39Å; R34-Y81 WeakPolarHBondContact CG-OH 3.41Å; R34-Y81 PolarHBondContact NE-OH 2.85Å; R34-Y81 VanDerWaalsContact NE-OH 3.07Å; R34-E116 WeakPolarHBondContact CG-OE1 3.35Å; R34-L170 PolarHBondContact NH2-O 3Å; R34-P171 PolarHBondContact NH2-O 3.28Å; R34-F173 PolarHBondContact NH1-O 2.58Å; R34-F173 PolarHBondContact NH2-O 3.38Å
35	S	94.5	Very high	88.8	Confident	55 Å²	55	52.7 Å²	52.7	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-66.7	-40.3	179.3	-57.9	0	0	0	0	111	H31 L32 E33 A38 R39	H31-S35 WeakPolarHBondContact O-CB 3.45Å; H31-S35 PolarHBondContact O-N 3.47Å; H31-S35 PolarHBondContact O-OG 2.94Å; L32-S35 WeakPolarHBondContact O-CB 3.29Å; L32-S35 PolarHBondContact O-N 3.26Å; L32-S35 VanDerWaalsContact O-N 3.1Å; E33-S35 VanDerWaalsContact C-N 3.31Å; E33-S35 PolarHBondContact O-N 3.48Å; S35-A38 PolarHBondContact O-N 3.45Å; S35-R39 WeakPolarHBondContact O-CB 3.18Å; S35-R39 PolarHBondContact O-N 2.7Å
36	E	95.9	Very high	90	Very high	52 Å²	52	52.7 Å²	52.7	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-46.9	175.3	-70.6	-168.9	153.5	0	0	112.4	L32 E33 A38 R39 F40 R115	L32-E36 PolarHBondContact O-N 3.44Å; E33-E36 PolarHBondContact O-N 2.9Å; E36-A38 VanDerWaalsContact C-N 3.31Å; E36-A38 PolarHBondContact O-N 3.14Å; E36-R39 WeakPolarHBondContact O-CB 3.47Å; E36-R39 PolarHBondContact O-N 3.09Å; E36-R39 VanDerWaalsContact O-N 3.15Å; E36-F40 HydrophobicContact CB-CD2 4.42Å; E36-F40 HydrophobicContact CB-CE2 4.32Å; E36-F40 WeakPolarHBondContact O-CD2 3.45Å; E36-F40 PolarHBondContact O-N 2.77Å; E36-R115 IonicContact OE2-CZ 2.85Å; E36-R115 IonicContact OE2-NE 2.98Å; E36-R115 IonicContact OE2-NH2 2.69Å; E36-R115 PolarHBondContact OE2-NH2 3.41Å
37	T	96.4	Very high	91.3	Very high	3 Å²	3	52 Å²	52	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-44.9	175.4	-67.8	0	0	0	0	111.3	E33 R39 F40 L41 L109 S112 L113 E116	E33-T37 PolarHBondContact O-N 3.34Å; E33-T37 PolarHBondContact O-OG1 3.47Å; T37-R39 VanDerWaalsContact C-N 3.33Å; T37-R39 PolarHBondContact O-N 3.19Å; T37-F40 PolarHBondContact O-N 2.87Å; T37-L41 VanDerWaalsContact O-CB 3.31Å; T37-L41 WeakPolarHBondContact O-CB 3.01Å; T37-L41 PolarHBondContact O-N 2.88Å; T37-L109 HydrophobicContact CG2-CD1 4.2Å; T37-S112 WeakPolarHBondContact CA-OG 3.36Å; T37-S112 PolarHBondContact OG1-OG 3.28Å; T37-L113 HydrophobicContact CG2-CD2 3.56Å; T37-L113 HydrophobicContact CG2-CG 4.15Å; T37-E116 VanDerWaalsContact CB-OE2 3.24Å; T37-E116 WeakPolarHBondContact CB-OE2 3.49Å; T37-E116 PolarHBondContact OG1-OE2 3.15Å
38	A	96	Very high	92.4	Very high	28 Å²	28	50.4 Å²	50.4	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-40.6	176.6	0	0	0	0	0	112.3	R34 S35 E36 A42 P171	R34-A38 WeakPolarHBondContact O-CB 3.28Å; R34-A38 PolarHBondContact O-N 3.46Å; S35-A38 PolarHBondContact O-N 3.45Å; E36-A38 VanDerWaalsContact C-N 3.31Å; E36-A38 PolarHBondContact O-N 3.14Å; A38-A42 PolarHBondContact O-N 3.28Å; A38-A42 VanDerWaalsContact O-N 3.09Å; A38-P171 HydrophobicContact CB-CG 4.05Å
39	R	96.9	Very high	92.9	Very high	101 Å²	101	49.9 Å²	49.9	38%	0.381	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-50.8	176.7	-176.3	-176.8	56.3	66.2	7.5	111.6	S35 E36 T37 L41 A42 E43	S35-R39 WeakPolarHBondContact O-CB 3.18Å; S35-R39 PolarHBondContact O-N 2.7Å; E36-R39 WeakPolarHBondContact O-CB 3.47Å; E36-R39 PolarHBondContact O-N 3.09Å; E36-R39 VanDerWaalsContact O-N 3.15Å; T37-R39 VanDerWaalsContact C-N 3.33Å; T37-R39 PolarHBondContact O-N 3.19Å; R39-L41 VanDerWaalsContact C-N 3.28Å; R39-L41 PolarHBondContact O-N 3.13Å; R39-A42 WeakPolarHBondContact O-CA 3.32Å; R39-A42 VanDerWaalsContact O-CB 3.32Å; R39-A42 WeakPolarHBondContact O-CB 3.48Å; R39-A42 PolarHBondContact O-N 2.95Å; R39-E43 WeakPolarHBondContact CG-OE1 2.76Å; R39-E43 IonicContact CZ-OE1 3.65Å; R39-E43 IonicContact NH1-OE1 3.94Å; R39-E43 PolarHBondContact NH1-OE1 2.69Å; R39-E43 IonicContact NH1-OE2 3.47Å; R39-E43 PolarHBondContact NH1-OE2 3.08Å; R39-E43 WeakPolarHBondContact O-CG 2.8Å; R39-E43 PolarHBondContact O-N 3.35Å
40	F	97.3	Very high	93.2	Very high	17 Å²	17	54.6 Å²	54.6	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-34.1	180	-71	-55.4	0	0	0	112.5	E36 T37 A42 E43 L44 Q108 L109	E36-F40 HydrophobicContact CB-CD2 4.42Å; E36-F40 HydrophobicContact CB-CE2 4.32Å; E36-F40 WeakPolarHBondContact O-CD2 3.45Å; E36-F40 PolarHBondContact O-N 2.77Å; T37-F40 PolarHBondContact O-N 2.87Å; F40-A42 VanDerWaalsContact C-N 3.3Å; F40-A42 PolarHBondContact O-N 3.18Å; F40-E43 VanDerWaalsContact CD1-OE2 3.27Å; F40-E43 WeakPolarHBondContact CD1-OE2 3.31Å; F40-E43 PolarHBondContact O-N 2.94Å; F40-L44 PolarHBondContact O-N 2.98Å; F40-Q108 HydrophobicContact CD1-CB 3.54Å; F40-Q108 HydrophobicContact CD1-CG 4.31Å; F40-Q108 HydrophobicContact CE1-CB 3.46Å; F40-Q108 VanDerWaalsContact CE1-CB 3.46Å; F40-Q108 HydrophobicContact CE1-CG 3.78Å; F40-Q108 HydrophobicContact CE2-CB 4.44Å; F40-Q108 HydrophobicContact CG-CB 4.07Å; F40-Q108 HydrophobicContact CZ-CB 3.9Å; F40-Q108 HydrophobicContact CZ-CG 4.18Å; F40-L109 HydrophobicContact CB-CB 4.12Å; F40-L109 HydrophobicContact CB-CD1 4.26Å
41	L	96.8	Very high	93.5	Very high	1 Å²	1	59 Å²	59	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-31.1	173.1	-172.8	64.2	0	0	0	112.8	T37 R39 F92 L109 R163 L166 Q167 L170	T37-L41 VanDerWaalsContact O-CB 3.31Å; T37-L41 WeakPolarHBondContact O-CB 3.01Å; T37-L41 PolarHBondContact O-N 2.88Å; R39-L41 VanDerWaalsContact C-N 3.28Å; R39-L41 PolarHBondContact O-N 3.13Å; L41-F92 HydrophobicContact CD1-CE1 4.43Å; L41-F92 HydrophobicContact CD1-CE2 3.93Å; L41-F92 HydrophobicContact CD1-CZ 3.59Å; L41-L109 HydrophobicContact CB-CD1 4.13Å; L41-L109 HydrophobicContact CD1-CD2 3.95Å; L41-R163 HydrophobicContact CD1-CG 3.85Å; L41-R163 HydrophobicContact CG-CG 4.24Å; L41-R163 WeakPolarHBondContact O-CD 3.45Å; L41-R163 WeakPolarHBondContact O-CG 3.49Å; L41-R163 PolarHBondContact O-NH1 3.14Å; L41-L166 VanDerWaalsContact CD2-C 3.44Å; L41-L166 HydrophobicContact CD2-CB 3.62Å; L41-Q167 HydrophobicContact CD2-CB 4.22Å; L41-Q167 HydrophobicContact CG-CB 4.44Å; L41-L170 HydrophobicContact CD2-CD1 4.1Å
42	A	94.4	Very high	93.8	Very high	36 Å²	36	52.8 Å²	52.8	30%	0.298	27%	0.272	S	S	.	.	H	α-helix	trans	-71.7	-34.9	172.7	0	0	0	0	0	112.3	A38 R39 F40 L44 Q167	A38-A42 PolarHBondContact O-N 3.28Å; A38-A42 VanDerWaalsContact O-N 3.09Å; R39-A42 WeakPolarHBondContact O-CA 3.32Å; R39-A42 VanDerWaalsContact O-CB 3.32Å; R39-A42 WeakPolarHBondContact O-CB 3.48Å; R39-A42 PolarHBondContact O-N 2.95Å; F40-A42 VanDerWaalsContact C-N 3.3Å; F40-A42 PolarHBondContact O-N 3.18Å; A42-L44 VanDerWaalsContact C-N 3.31Å; A42-Q167 VanDerWaalsContact CB-NE2 3.27Å
43	E	94.3	Very high	93.9	Very high	92 Å²	92	52.3 Å²	52.3	43%	0.43	27%	0.27	S	S	.	.	H	α-helix	trans	-72	-22.7	179	-73.4	169.9	-172.4	0	0	113.2	R39 F40 R45	R39-E43 WeakPolarHBondContact CG-OE1 2.76Å; R39-E43 IonicContact CZ-OE1 3.65Å; R39-E43 IonicContact NH1-OE1 3.94Å; R39-E43 PolarHBondContact NH1-OE1 2.69Å; R39-E43 IonicContact NH1-OE2 3.47Å; R39-E43 PolarHBondContact NH1-OE2 3.08Å; R39-E43 WeakPolarHBondContact O-CG 2.8Å; R39-E43 PolarHBondContact O-N 3.35Å; F40-E43 VanDerWaalsContact CD1-OE2 3.27Å; F40-E43 WeakPolarHBondContact CD1-OE2 3.31Å; F40-E43 PolarHBondContact O-N 2.94Å; E43-R45 PolarHBondContact O-N 2.98Å
44	L	93.7	Very high	94	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.307	C	S	.	.			trans	-68	40.2	172.4	-80.9	-175.3	0	0	0	113.9	F40 A42 F92 W101 A105 L106 L109 R163	F40-L44 PolarHBondContact O-N 2.98Å; A42-L44 VanDerWaalsContact C-N 3.31Å; L44-F92 HydrophobicContact CD1-CD1 4.13Å; L44-F92 HydrophobicContact CD1-CE1 3.82Å; L44-W101 HydrophobicContact CB-CD2 4.44Å; L44-W101 HydrophobicContact CB-CE3 4.34Å; L44-W101 HydrophobicContact CD2-CB 3.75Å; L44-W101 HydrophobicContact CD2-CD2 4.1Å; L44-W101 HydrophobicContact CD2-CE3 4.41Å; L44-W101 HydrophobicContact CD2-CG 3.81Å; L44-W101 VanDerWaalsContact O-CE3 3.23Å; L44-W101 VanDerWaalsContact O-CH2 3.31Å; L44-W101 WeakPolarHBondContact O-CH2 3.39Å; L44-W101 WeakPolarHBondContact O-CZ3 3.46Å; L44-A105 HydrophobicContact CD2-CB 3.79Å; L44-L106 HydrophobicContact CD1-CD1 4.29Å; L44-L106 HydrophobicContact CD2-CB 4.31Å; L44-L109 HydrophobicContact CD1-CB 4.16Å; L44-L109 HydrophobicContact CD1-CD2 3.34Å; L44-L109 HydrophobicContact CD1-CG 4.33Å; L44-R163 VanDerWaalsContact C-CD 3.47Å; L44-R163 HydrophobicContact CB-CG 4.37Å; L44-R163 WeakPolarHBondContact O-CD 3.26Å; L44-R163 PolarHBondContact O-NE 3.25Å
45	R	89.4	Confident	94.1	Very high	158 Å²	158	62 Å²	62	60%	0.596	31%	0.307	S	S	*	.			trans	-86.1	121.9	-178.5	-173.6	175.3	176.7	-179.9	-5.6	111.2	E43	E43-R45 PolarHBondContact O-N 2.98Å
46	S	87.5	Confident	94	Very high	49 Å²	49	67.9 Å²	67.9	34%	0.343	32%	0.321	S	S	.	.			trans	-100.1	-39.9	178.1	57.9	0	0	0	0	112.9	W101	S46-W101 VanDerWaalsContact OG-CZ3 3.29Å; S46-W101 WeakPolarHBondContact OG-CZ3 3.3Å
47	V	92.9	Very high	94	Very high	27 Å²	27	68.1 Å²	68.1	16%	0.164	33%	0.327	C	S	.	.	S	Bend	trans	-138	154.7	-175.2	-66.5	0	0	0	0	111.3	G49 C52 A156 E160	V47-G49 PolarHBondContact O-N 3.22Å; V47-C52 WeakPolarHBondContact CG2-SG 3.48Å; V47-A156 HydrophobicContact CG1-CB 3.89Å; V47-E160 HydrophobicContact CG2-CB 3.71Å; V47-E160 HydrophobicContact CG2-CG 3.94Å
48	P	92.1	Very high	93.8	Very high	41 Å²	41	74.3 Å²	74.3	27%	0.266	36%	0.36	S	S	.	.			trans	-65.9	127.1	173.3	-21.7	34.4	0	0	0	111.9	H50 Q51	P48-H50 WeakPolarHBondContact CB-CE1 3.48Å; P48-H50 PolarHBondContact O-N 3.37Å; P48-Q51 HydrophobicContact CB-CG 4.34Å; P48-Q51 WeakPolarHBondContact O-CB 3.5Å; P48-Q51 PolarHBondContact O-N 3.03Å
49	G	88.8	Confident	93.8	Very high	31 Å²	31	73.6 Å²	73.6	32%	0.32	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-56.7	-25.1	-175.3	0	0	0	0	0	115.9	V47 Q51 C52	V47-G49 PolarHBondContact O-N 3.22Å; G49-Q51 PolarHBondContact O-N 3.09Å; G49-C52 PolarHBondContact O-N 3.46Å; G49-C52 VanDerWaalsContact O-N 3.15Å
50	H	93	Very high	93.7	Very high	130 Å²	130	72.9 Å²	72.9	60%	0.602	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-67.4	-20.2	174.6	68.9	-98.8	0	0	0	113.3	P48 C52 L53	P48-H50 WeakPolarHBondContact CB-CE1 3.48Å; P48-H50 PolarHBondContact O-N 3.37Å; H50-C52 VanDerWaalsContact C-N 3.31Å; H50-L53 WeakPolarHBondContact O-CD1 3.5Å; H50-L53 VanDerWaalsContact O-CG 3.22Å; H50-L53 WeakPolarHBondContact O-CG 3.47Å
51	Q	94.8	Very high	93.6	Very high	117 Å²	117	72.4 Å²	72.4	55%	0.547	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-78	-21.6	175.1	-60.3	-177	12.5	0	0	111.7	P48 G49	P48-Q51 HydrophobicContact CB-CG 4.34Å; P48-Q51 WeakPolarHBondContact O-CB 3.5Å; P48-Q51 PolarHBondContact O-N 3.03Å; G49-Q51 PolarHBondContact O-N 3.09Å
52	C	96	Very high	93.4	Very high	1 Å²	1	73 Å²	73	1%	0.007	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-98.8	12.5	-175.3	-54.2	0	0	0	0	113.7	V47 G49 H50 R54 D55 R56 C157 I161	V47-C52 WeakPolarHBondContact CG2-SG 3.48Å; G49-C52 PolarHBondContact O-N 3.46Å; G49-C52 VanDerWaalsContact O-N 3.15Å; H50-C52 VanDerWaalsContact C-N 3.31Å; C52-R54 PolarHBondContact O-N 3.02Å; C52-D55 PolarHBondContact O-N 3.35Å; C52-R56 PolarHBondContact O-N 2.99Å; C52-C157 WeakPolarHBondContact CA-SG 3.43Å; C52-C157 HydrophobicContact CB-CB 3.56Å; C52-C157 WeakPolarHBondContact CB-SG 3.36Å; C52-C157 WeakPolarHBondContact SG-CA 3.41Å; C52-C157 WeakPolarHBondContact SG-CB 3.44Å; C52-C157 CovalentContact SG-SG 2.06Å; C52-C157 PolarHBondContact SG-SG 3.33Å; C52-I161 HydrophobicContact CB-CD1 4.32Å; C52-I161 HydrophobicContact CB-CG1 4.4Å
53	L	94.7	Very high	93.3	Very high	85 Å²	85	71.7 Å²	71.7	45%	0.445	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.8	-34.7	-179	-65	176.3	0	0	0	112.8	H50 D55 R56	H50-L53 WeakPolarHBondContact O-CD1 3.5Å; H50-L53 VanDerWaalsContact O-CG 3.22Å; H50-L53 WeakPolarHBondContact O-CG 3.47Å; L53-D55 PolarHBondContact O-N 2.88Å; L53-R56 VanDerWaalsContact CD2-NE 3.34Å; L53-R56 PolarHBondContact O-N 3.46Å
54	R	95	Very high	93	Very high	241 Å²	241	72 Å²	72	91%	0.909	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-70.6	-18.5	177.9	-64.1	-175.3	-179.8	-174.4	0.3	113.7	C52	C52-R54 PolarHBondContact O-N 3.02Å
55	D	95.1	Very high	92.1	Very high	32 Å²	32	77.4 Å²	77.4	17%	0.171	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-100.4	-1.4	-177.9	-81.6	-7.9	0	0	0	112.8	C52 L53 T57 Y148 K152 C157 I161	C52-D55 PolarHBondContact O-N 3.35Å; L53-D55 PolarHBondContact O-N 2.88Å; D55-T57 PolarHBondContact O-N 3.15Å; D55-Y148 WeakPolarHBondContact O-CE2 3.35Å; D55-Y148 PolarHBondContact O-OH 2.94Å; D55-K152 IonicContact OD1-NZ 2.69Å; D55-K152 PolarHBondContact OD1-NZ 3.45Å; D55-C157 HydrophobicContact CB-CB 4.21Å; D55-C157 WeakPolarHBondContact OD2-CB 3.29Å; D55-I161 HydrophobicContact CB-CG1 4.35Å
56	R	94.2	Very high	90.7	Very high	179 Å²	179	72.2 Å²	72.2	68%	0.675	37%	0.37	S	S	*	.			trans	-54.1	133.8	178.1	-79.2	-178.7	170.5	178.9	-0.9	111.1	C52 L53 I161	C52-R56 PolarHBondContact O-N 2.99Å; L53-R56 VanDerWaalsContact CD2-NE 3.34Å; L53-R56 PolarHBondContact O-N 3.46Å; R56-I161 HydrophobicContact CG-CD1 3.87Å
57	T	94.5	Very high	89.4	Confident	58 Å²	58	74.7 Å²	74.7	36%	0.356	38%	0.384	S	S	.	.			trans	-139.5	148.9	172.9	-177.1	0	0	0	0	107.5	D55 F59 Y148 I161	D55-T57 PolarHBondContact O-N 3.15Å; T57-F59 HydrophobicContact CG2-CD2 3.9Å; T57-F59 HydrophobicContact CG2-CE1 4.01Å; T57-F59 HydrophobicContact CG2-CE2 3.17Å; T57-F59 HydrophobicContact CG2-CZ 3.23Å; T57-Y148 HydrophobicContact CG2-CD2 3.52Å; T57-Y148 HydrophobicContact CG2-CE1 4.43Å; T57-Y148 HydrophobicContact CG2-CE2 3.39Å; T57-Y148 HydrophobicContact CG2-CG 4.09Å; T57-I161 HydrophobicContact CG2-CG2 4.05Å
58	D	93.3	Very high	88.2	Confident	133 Å²	133	77.6 Å²	77.6	71%	0.711	40%	0.398	S	S	*	.			trans	-88.7	135.9	173.4	-167.4	10.9	0	0	0	109.6
59	F	96.1	Very high	87.4	Confident	12 Å²	12	76.2 Å²	76.2	5%	0.053	39%	0.389	C	S	.	.			trans	-120.6	105.1	174.5	-65.3	-75.7	0	0	0	107.9	T57 C61 Y141 F145 Y148 I161 Q165	T57-F59 HydrophobicContact CG2-CD2 3.9Å; T57-F59 HydrophobicContact CG2-CE1 4.01Å; T57-F59 HydrophobicContact CG2-CE2 3.17Å; T57-F59 HydrophobicContact CG2-CZ 3.23Å; F59-C61 PolarHBondContact O-N 2.98Å; F59-Y141 HydrophobicContact CB-CD2 4.24Å; F59-Y141 HydrophobicContact CB-CE2 3.81Å; F59-F145 HydrophobicContact CB-CE1 4.11Å; F59-F145 AromaticContact CD1-CD1 3.78Å; F59-F145 HydrophobicContact CD1-CD1 3.78Å; F59-F145 AromaticContact CD1-CE1 3.86Å; F59-F145 HydrophobicContact CD1-CE1 3.86Å; F59-F145 AromaticContact CD2-CD1 3.93Å; F59-F145 HydrophobicContact CD2-CD1 3.93Å; F59-F145 AromaticContact CD2-CE1 3.4Å; F59-F145 HydrophobicContact CD2-CE1 3.4Å; F59-F145 VanDerWaalsContact CD2-CE1 3.4Å; F59-F145 HydrophobicContact CD2-CZ 4.49Å; F59-F145 AromaticContact CE1-CD1 3.58Å; F59-F145 HydrophobicContact CE1-CD1 3.58Å; F59-F145 HydrophobicContact CE1-CE1 4.05Å; F59-F145 AromaticContact CE2-CD1 3.66Å; F59-F145 HydrophobicContact CE2-CD1 3.66Å; F59-F145 AromaticContact CE2-CE1 3.54Å; F59-F145 HydrophobicContact CE2-CE1 3.54Å; F59-F145 AromaticContact CG-CD1 3.95Å; F59-F145 HydrophobicContact CG-CD1 3.95Å; F59-F145 AromaticContact CG-CE1 3.53Å; F59-F145 HydrophobicContact CG-CE1 3.53Å; F59-F145 HydrophobicContact CG-CZ 4.47Å; F59-F145 AromaticContact CZ-CD1 3.5Å; F59-F145 HydrophobicContact CZ-CD1 3.5Å; F59-F145 AromaticContact CZ-CE1 3.88Å; F59-F145 HydrophobicContact CZ-CE1 3.88Å; F59-Y148 HydrophobicContact CE1-CG 4.37Å; F59-Y148 AromaticContact CZ-CD1 3.83Å; F59-Y148 HydrophobicContact CZ-CD1 3.83Å; F59-Y148 HydrophobicContact CZ-CD2 4.24Å; F59-Y148 HydrophobicContact CZ-CE1 4.49Å; F59-Y148 AromaticContact CZ-CG 3.68Å; F59-Y148 HydrophobicContact CZ-CG 3.68Å; F59-I161 HydrophobicContact CE2-CG2 4.06Å; F59-Q165 HydrophobicContact CB-CG 4.17Å; F59-Q165 HydrophobicContact CD2-CB 4.37Å; F59-Q165 HydrophobicContact CD2-CG 3.98Å; F59-Q165 HydrophobicContact CG-CG 4.49Å
60	P	93.6	Very high	86.7	Confident	86 Å²	86	78.7 Å²	78.7	56%	0.558	40%	0.398	S	S	*	.			trans	-64.2	110.4	-176.9	24.9	-33	0	0	0	109.6	P62 Y141	P60-P62 WeakPolarHBondContact O-CD 3.36Å; P60-Y141 WeakPolarHBondContact O-CD2 3.43Å
61	C	94.7	Very high	86.3	Confident	8 Å²	8	80.5 Å²	80.5	5%	0.054	41%	0.406	C	S	.	.			trans	-83.6	112.3	-173.3	-173	0	0	0	0	110.1	F59 W63 K64 Y141 D169	F59-C61 PolarHBondContact O-N 2.98Å; C61-W63 PolarHBondContact O-N 3.18Å; C61-W63 VanDerWaalsContact O-N 3.09Å; C61-W63 PolarHBondContact SG-NE1 3.13Å; C61-K64 HydrophobicContact CB-CB 4.22Å; C61-K64 HydrophobicContact CB-CD 3.97Å; C61-K64 HydrophobicContact CB-CG 4.01Å; C61-K64 PolarHBondContact O-N 3.19Å; C61-Y141 HydrophobicContact CB-CE2 4.38Å; C61-D169 VanDerWaalsContact CB-OD2 3.29Å; C61-D169 WeakPolarHBondContact CB-OD2 2.98Å; C61-D169 PolarHBondContact SG-OD2 3.43Å
62	P	93	Very high	85.9	Confident	13 Å²	13	75.7 Å²	75.7	8%	0.084	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-18.1	-166.6	25.5	-32.2	0	0	0	113.5	P60 F134 A137 Y141	P60-P62 WeakPolarHBondContact O-CD 3.36Å; P62-F134 HydrophobicContact CB-CE2 4.28Å; P62-F134 HydrophobicContact CB-CZ 4.47Å; P62-F134 WeakPolarHBondContact O-CE2 3.4Å; P62-A137 HydrophobicContact CB-CB 3.69Å; P62-A137 HydrophobicContact CG-CB 4.35Å; P62-Y141 HydrophobicContact CG-CG 4.43Å
63	W	92.2	Very high	85.6	Confident	9 Å²	9	78.6 Å²	78.6	3%	0.034	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-3.7	175.9	50.7	89.6	0	0	0	115.6	C61 I69 F134 I138 Y141 F142 D169 F173	C61-W63 PolarHBondContact O-N 3.18Å; C61-W63 VanDerWaalsContact O-N 3.09Å; C61-W63 PolarHBondContact SG-NE1 3.13Å; W63-I69 HydrophobicContact CB-CD1 3.13Å; W63-F134 HydrophobicContact CB-CZ 3.96Å; W63-F134 HydrophobicContact CE3-CZ 4.35Å; W63-I138 HydrophobicContact CE3-CG1 4.37Å; W63-I138 HydrophobicContact CZ3-CG1 4.09Å; W63-Y141 AromaticContact CH2-CD1 3.76Å; W63-Y141 HydrophobicContact CH2-CD1 3.76Å; W63-Y141 AromaticContact CH2-CE1 3.52Å; W63-Y141 HydrophobicContact CH2-CE1 3.52Å; W63-Y141 HydrophobicContact CZ2-CE1 4.08Å; W63-Y141 HydrophobicContact CZ3-CD1 4.14Å; W63-Y141 HydrophobicContact CZ3-CE1 4.33Å; W63-F142 HydrophobicContact CH2-CE2 4.13Å; W63-D169 HydrophobicContact CZ2-CB 3.99Å; W63-D169 PolarHBondContact NE1-O 3.08Å; W63-F173 HydrophobicContact CB-CD2 4.06Å; W63-F173 HydrophobicContact CB-CE2 4.18Å; W63-F173 AromaticContact CD1-CD2 3.88Å; W63-F173 AromaticContact CD2-CD2 3.37Å; W63-F173 HydrophobicContact CD2-CD2 3.37Å; W63-F173 AromaticContact CD2-CE2 3.7Å; W63-F173 HydrophobicContact CD2-CE2 3.7Å; W63-F173 HydrophobicContact CD2-CG 4.39Å; W63-F173 AromaticContact CE2-CD2 3.66Å; W63-F173 AromaticContact CE3-CD2 3.72Å; W63-F173 HydrophobicContact CE3-CD2 3.72Å; W63-F173 AromaticContact CE3-CE2 3.57Å; W63-F173 HydrophobicContact CE3-CE2 3.57Å; W63-F173 HydrophobicContact CG-CB 4.48Å; W63-F173 AromaticContact CG-CD2 3.54Å; W63-F173 HydrophobicContact CG-CD2 3.54Å; W63-F173 AromaticContact CG-CE2 4Å; W63-F173 HydrophobicContact CG-CE2 4Å; W63-F173 HydrophobicContact CG-CG 4.17Å; W63-F173 HydrophobicContact CZ2-CD2 4.27Å; W63-F173 HydrophobicContact CZ3-CD2 4.34Å; W63-F173 HydrophobicContact CZ3-CE2 4.18Å; W63-F173 AromaticContact NE1-CD2 3.91Å
64	K	89.2	Confident	85.2	Confident	98 Å²	98	78.4 Å²	78.4	43%	0.426	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-21.9	168.6	-68.3	-174.1	-175.1	173	0	112	C61 G66 V168 D169	C61-K64 HydrophobicContact CB-CB 4.22Å; C61-K64 HydrophobicContact CB-CD 3.97Å; C61-K64 HydrophobicContact CB-CG 4.01Å; C61-K64 PolarHBondContact O-N 3.19Å; K64-G66 PolarHBondContact O-N 3.39Å; K64-G66 VanDerWaalsContact O-N 3.13Å; K64-V168 VanDerWaalsContact NZ-CG1 3.28Å; K64-D169 WeakPolarHBondContact CE-OD1 3.47Å; K64-D169 IonicContact NZ-OD1 2.73Å; K64-D169 PolarHBondContact NZ-OD1 3.22Å
65	E	74.3	Confident	84.8	Confident	117 Å²	117	67.1 Å²	67.1	55%	0.547	36%	0.36	S	S	.	.	S	Bend	trans	-79.8	91.2	173.8	-65.6	175.2	-163.4	0	0	109	T67	E65-T67 PolarHBondContact O-N 2.88Å
66	G	58.9	Low	84.6	Confident	49 Å²	49	68.2 Å²	68.2	51%	0.505	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	13	-159.8	0	0	0	0	0	118.8	K64 T70	K64-G66 PolarHBondContact O-N 3.39Å; K64-G66 VanDerWaalsContact O-N 3.13Å; G66-T70 WeakPolarHBondContact O-CG2 3.49Å
67	T	61.5	Low	84.5	Confident	101 Å²	101	60.1 Å²	60.1	62%	0.62	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-33.7	-175	48.5	0	0	0	0	114	E65 T70	E65-T67 PolarHBondContact O-N 2.88Å; T67-T70 PolarHBondContact O-OG1 3.29Å
68	N	67.7	Low	84.3	Confident	89 Å²	89	57.8 Å²	57.8	48%	0.476	32%	0.32	S	S	.	.	S	Bend	trans	-90.5	-34	-171.2	-73.2	-26.5	0	0	0	113.9	F134	N68-F134 HydrophobicContact CB-CD2 4.15Å
69	I	74.9	Confident	84.2	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.062	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-79.7	-28.6	-173.4	-57.2	171	0	0	0	112.3	W63 Q71 M72 T77 F134 P174	W63-I69 HydrophobicContact CB-CD1 3.13Å; I69-Q71 PolarHBondContact O-N 3.24Å; I69-M72 HydrophobicContact CG1-CE 4.49Å; I69-M72 HydrophobicContact CG1-SD 4.46Å; I69-M72 HydrophobicContact CG2-SD 4.37Å; I69-M72 PolarHBondContact O-N 3.38Å; I69-T77 HydrophobicContact CG2-CG2 4.03Å; I69-F134 HydrophobicContact CD1-CE1 4.32Å; I69-F134 HydrophobicContact CD1-CE2 3.81Å; I69-F134 HydrophobicContact CD1-CZ 3.5Å; I69-F134 VanDerWaalsContact CD1-CZ 3.5Å; I69-F134 HydrophobicContact CG1-CD2 4.24Å; I69-F134 HydrophobicContact CG1-CE1 4.32Å; I69-F134 HydrophobicContact CG1-CE2 3.54Å; I69-F134 HydrophobicContact CG1-CZ 3.63Å; I69-P174 HydrophobicContact CB-CG 4.12Å; I69-P174 HydrophobicContact CD1-CG 3.65Å; I69-P174 HydrophobicContact CG2-CG 3.53Å
70	T	74.2	Confident	84.1	Confident	83 Å²	83	52.2 Å²	52.2	51%	0.509	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-59.5	-21.5	180	49.5	0	0	0	0	112.5	G66 T67 R178	G66-T70 WeakPolarHBondContact O-CG2 3.49Å; T67-T70 PolarHBondContact O-OG1 3.29Å; T70-R178 PolarHBondContact O-NH2 2.94Å
71	Q	83.8	Confident	84.1	Confident	167 Å²	167	48.2 Å²	48.2	78%	0.78	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-91.3	-12.7	179.7	-62.6	-177.1	-6.8	0	0	114.1	I69	I69-Q71 PolarHBondContact O-N 3.24Å
72	M	87.3	Confident	84.1	Confident	17 Å²	17	48.4 Å²	48.4	8%	0.084	27%	0.268	C	S	.	.	S	Bend	trans	-75.1	146.9	-176.6	-66.7	174.7	-167	0	0	111.7	I69 E76 T77 P131 F134	I69-M72 HydrophobicContact CG1-CE 4.49Å; I69-M72 HydrophobicContact CG1-SD 4.46Å; I69-M72 HydrophobicContact CG2-SD 4.37Å; I69-M72 PolarHBondContact O-N 3.38Å; M72-E76 VanDerWaalsContact CA-OE2 3.28Å; M72-E76 WeakPolarHBondContact CA-OE2 3.42Å; M72-E76 HydrophobicContact CB-CB 3.97Å; M72-E76 HydrophobicContact CG-CB 4.36Å; M72-T77 WeakPolarHBondContact CB-OG1 3.39Å; M72-P131 HydrophobicContact CE-CG 4.14Å; M72-P131 HydrophobicContact CG-CG 4.15Å; M72-P131 HydrophobicContact SD-CG 4.35Å; M72-F134 HydrophobicContact CE-CB 3.39Å; M72-F134 HydrophobicContact CE-CD1 3.96Å; M72-F134 HydrophobicContact CE-CD2 3.73Å; M72-F134 HydrophobicContact CE-CG 3.4Å; M72-F134 VanDerWaalsContact CE-CG 3.4Å; M72-F134 HydrophobicContact SD-CD1 4.47Å; M72-F134 HydrophobicContact SD-CG 4.45Å
73	T	88.2	Confident	84.2	Confident	61 Å²	61	49.7 Å²	49.7	37%	0.374	27%	0.273	S	S	.	.			trans	-67	167.3	166.2	66.1	0	0	0	0	110.5	G75 E76 T77 Q128	T73-G75 VanDerWaalsContact C-N 3.32Å; T73-G75 PolarHBondContact O-N 2.91Å; T73-E76 PolarHBondContact N-OE2 3.47Å; T73-E76 PolarHBondContact O-N 2.79Å; T73-E76 WeakPolarHBondContact OG1-CB 3.33Å; T73-E76 WeakPolarHBondContact OG1-CG 3.27Å; T73-E76 PolarHBondContact OG1-N 2.94Å; T73-E76 VanDerWaalsContact OG1-N 3.09Å; T73-E76 PolarHBondContact OG1-OE2 3.33Å; T73-T77 WeakPolarHBondContact O-CB 3.25Å; T73-T77 PolarHBondContact O-N 3.31Å; T73-T77 PolarHBondContact O-OG1 3.2Å; T73-Q128 PolarHBondContact OG1-OE1 3.43Å
74	L	86.4	Confident	84.4	Confident	82 Å²	82	49.3 Å²	49.3	43%	0.429	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-43.2	173.4	-179.3	61.1	0	0	0	111.6	T77 T78	L74-T77 PolarHBondContact O-N 3.27Å; L74-T78 WeakPolarHBondContact O-CB 3.14Å; L74-T78 PolarHBondContact O-N 2.92Å; L74-T78 PolarHBondContact O-OG1 3.01Å; L74-T78 VanDerWaalsContact O-OG1 3.05Å
75	G	88.5	Confident	84.8	Confident	4 Å²	4	44.6 Å²	44.6	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-67.6	-38.5	-179.4	0	0	0	0	0	113.2	T73 S79	T73-G75 VanDerWaalsContact C-N 3.32Å; T73-G75 PolarHBondContact O-N 2.91Å; G75-S79 VanDerWaalsContact O-CB 3.25Å; G75-S79 WeakPolarHBondContact O-CB 3.39Å; G75-S79 PolarHBondContact O-N 3.29Å
76	E	90.8	Very high	85.9	Confident	54 Å²	54	45.2 Å²	45.2	25%	0.252	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-47.4	171.7	-73.1	174.6	150.2	0	0	111.1	M72 T73 T78 S79 C80 Q128 P131	M72-E76 VanDerWaalsContact CA-OE2 3.28Å; M72-E76 WeakPolarHBondContact CA-OE2 3.42Å; M72-E76 HydrophobicContact CB-CB 3.97Å; M72-E76 HydrophobicContact CG-CB 4.36Å; T73-E76 PolarHBondContact N-OE2 3.47Å; T73-E76 PolarHBondContact O-N 2.79Å; T73-E76 WeakPolarHBondContact OG1-CB 3.33Å; T73-E76 WeakPolarHBondContact OG1-CG 3.27Å; T73-E76 PolarHBondContact OG1-N 2.94Å; T73-E76 VanDerWaalsContact OG1-N 3.09Å; T73-E76 PolarHBondContact OG1-OE2 3.33Å; E76-T78 PolarHBondContact O-N 3.36Å; E76-S79 WeakPolarHBondContact O-CB 3.32Å; E76-S79 PolarHBondContact O-N 3.13Å; E76-S79 VanDerWaalsContact O-N 3.15Å; E76-C80 PolarHBondContact O-N 3.2Å; E76-C80 PolarHBondContact O-SG 2.96Å; E76-Q128 HydrophobicContact CG-CB 4.1Å; E76-P131 HydrophobicContact CB-CG 4.42Å; E76-P131 HydrophobicContact CG-CG 4.34Å
77	T	90.6	Very high	87.7	Confident	10 Å²	10	45.1 Å²	45.1	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-44.1	-179.9	-53.7	0	0	0	0	111.5	I69 M72 T73 L74 S79 C80 Y81 F173 P174 L175	I69-T77 HydrophobicContact CG2-CG2 4.03Å; M72-T77 WeakPolarHBondContact CB-OG1 3.39Å; T73-T77 WeakPolarHBondContact O-CB 3.25Å; T73-T77 PolarHBondContact O-N 3.31Å; T73-T77 PolarHBondContact O-OG1 3.2Å; L74-T77 PolarHBondContact O-N 3.27Å; T77-S79 VanDerWaalsContact C-N 3.33Å; T77-S79 PolarHBondContact O-N 3.4Å; T77-C80 WeakPolarHBondContact O-CB 3.34Å; T77-C80 PolarHBondContact O-N 3.2Å; T77-Y81 WeakPolarHBondContact O-CB 3.04Å; T77-Y81 PolarHBondContact O-N 3.01Å; T77-F173 HydrophobicContact CG2-CE1 3.93Å; T77-P174 VanDerWaalsContact CG2-O 3.32Å; T77-P174 WeakPolarHBondContact CG2-O 3.2Å; T77-L175 HydrophobicContact CG2-CD2 4.25Å
78	T	90.6	Very high	89.5	Confident	9 Å²	9	40.3 Å²	40.3	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-39	173.3	-66.4	0	0	0	0	112	L74 E76 Y81 S82 L120 E125	L74-T78 WeakPolarHBondContact O-CB 3.14Å; L74-T78 PolarHBondContact O-N 2.92Å; L74-T78 PolarHBondContact O-OG1 3.01Å; L74-T78 VanDerWaalsContact O-OG1 3.05Å; E76-T78 PolarHBondContact O-N 3.36Å; T78-Y81 PolarHBondContact O-N 3.06Å; T78-S82 WeakPolarHBondContact O-CB 3.29Å; T78-S82 PolarHBondContact O-N 3.08Å; T78-S82 PolarHBondContact O-OG 3.21Å; T78-L120 HydrophobicContact CG2-CB 4.37Å; T78-L120 HydrophobicContact CG2-CD2 3.74Å; T78-E125 WeakPolarHBondContact CB-OE2 3.42Å; T78-E125 WeakPolarHBondContact CG2-OE2 3.33Å; T78-E125 PolarHBondContact OG1-OE2 3.42Å
79	S	91.8	Very high	90.9	Very high	27 Å²	27	36.7 Å²	36.7	19%	0.189	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-44.2	175.1	-166.2	0	0	0	0	111	G75 E76 T77 S82 Q83 Q128 C130	G75-S79 VanDerWaalsContact O-CB 3.25Å; G75-S79 WeakPolarHBondContact O-CB 3.39Å; G75-S79 PolarHBondContact O-N 3.29Å; E76-S79 WeakPolarHBondContact O-CB 3.32Å; E76-S79 PolarHBondContact O-N 3.13Å; E76-S79 VanDerWaalsContact O-N 3.15Å; T77-S79 VanDerWaalsContact C-N 3.33Å; T77-S79 PolarHBondContact O-N 3.4Å; S79-S82 PolarHBondContact O-N 3.47Å; S79-Q83 WeakPolarHBondContact O-CG 3.47Å; S79-Q83 PolarHBondContact O-N 3.22Å; S79-Q128 WeakPolarHBondContact CB-O 3.23Å; S79-Q128 PolarHBondContact OG-O 2.7Å; S79-C130 PolarHBondContact OG-N 3.03Å; S79-C130 VanDerWaalsContact OG-N 3.13Å
80	C	93.7	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-41.3	174.6	-64.6	0	0	0	0	112.6	E76 T77 Q83 S84 C130 F134 I138 F173	E76-C80 PolarHBondContact O-N 3.2Å; E76-C80 PolarHBondContact O-SG 2.96Å; T77-C80 WeakPolarHBondContact O-CB 3.34Å; T77-C80 PolarHBondContact O-N 3.2Å; C80-Q83 PolarHBondContact O-N 3.35Å; C80-S84 PolarHBondContact O-N 3.47Å; C80-S84 PolarHBondContact O-OG 3.4Å; C80-C130 WeakPolarHBondContact CA-SG 3.21Å; C80-C130 HydrophobicContact CB-CB 3.87Å; C80-C130 WeakPolarHBondContact CB-SG 3.38Å; C80-C130 WeakPolarHBondContact SG-CA 3.46Å; C80-C130 WeakPolarHBondContact SG-CB 3.17Å; C80-C130 CovalentContact SG-SG 2.03Å; C80-C130 PolarHBondContact SG-SG 2.89Å; C80-F134 HydrophobicContact CB-CD1 3.84Å; C80-F134 HydrophobicContact CB-CE1 3.95Å; C80-F134 VanDerWaalsContact SG-CD1 3.51Å; C80-I138 HydrophobicContact CB-CD1 3.96Å; C80-I138 WeakPolarHBondContact O-CD1 3.47Å; C80-F173 HydrophobicContact CB-CZ 3.87Å
81	Y	94.4	Very high	93.2	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-45.1	175.9	-173.7	-116.2	0	0	0	112	R34 T77 T78 Q83 S84 L85 E116 L120 F173 L175	R34-Y81 HydrophobicContact CG-CE1 4.39Å; R34-Y81 WeakPolarHBondContact CG-OH 3.41Å; R34-Y81 PolarHBondContact NE-OH 2.85Å; R34-Y81 VanDerWaalsContact NE-OH 3.07Å; T77-Y81 WeakPolarHBondContact O-CB 3.04Å; T77-Y81 PolarHBondContact O-N 3.01Å; T78-Y81 PolarHBondContact O-N 3.06Å; Y81-Q83 VanDerWaalsContact C-N 3.26Å; Y81-Q83 PolarHBondContact O-N 3.16Å; Y81-S84 WeakPolarHBondContact O-CA 3.33Å; Y81-S84 WeakPolarHBondContact O-CB 3.5Å; Y81-S84 PolarHBondContact O-N 2.72Å; Y81-L85 HydrophobicContact CD1-CD1 4.14Å; Y81-L85 HydrophobicContact CD1-CG 4.4Å; Y81-L85 HydrophobicContact CE1-CD1 3.71Å; Y81-L85 HydrophobicContact CE1-CD2 4.32Å; Y81-L85 HydrophobicContact CE1-CG 4.04Å; Y81-L85 HydrophobicContact CE2-CD2 4.45Å; Y81-L85 PolarHBondContact O-N 2.98Å; Y81-E116 WeakPolarHBondContact CE1-OE1 3.28Å; Y81-E116 PolarHBondContact OH-OE1 3.1Å; Y81-L120 HydrophobicContact CD1-CD1 3.6Å; Y81-L120 HydrophobicContact CD1-CD2 4.09Å; Y81-L120 HydrophobicContact CE1-CD1 3.95Å; Y81-F173 HydrophobicContact CD2-CB 3.74Å; Y81-F173 AromaticContact CD2-CD1 3.53Å; Y81-F173 HydrophobicContact CD2-CD1 3.53Å; Y81-F173 AromaticContact CD2-CD2 3.78Å; Y81-F173 HydrophobicContact CD2-CD2 3.78Å; Y81-F173 HydrophobicContact CD2-CE1 4.05Å; Y81-F173 HydrophobicContact CD2-CE2 4.26Å; Y81-F173 AromaticContact CD2-CG 3.4Å; Y81-F173 HydrophobicContact CD2-CG 3.4Å; Y81-F173 HydrophobicContact CD2-CZ 4.39Å; Y81-F173 HydrophobicContact CE2-CB 3.79Å; Y81-F173 HydrophobicContact CE2-CD1 4.4Å; Y81-F173 HydrophobicContact CE2-CD2 4.45Å; Y81-F173 AromaticContact CE2-CG 3.99Å; Y81-F173 HydrophobicContact CE2-CG 3.99Å; Y81-F173 HydrophobicContact CG-CD1 4.1Å; Y81-F173 HydrophobicContact CG-CE1 4.31Å; Y81-F173 HydrophobicContact CG-CG 4.38Å; Y81-L175 HydrophobicContact CD1-CD1 3.33Å; Y81-L175 HydrophobicContact CD1-CD2 4.17Å; Y81-L175 HydrophobicContact CD1-CG 4.17Å; Y81-L175 HydrophobicContact CD2-CD1 4.18Å; Y81-L175 HydrophobicContact CD2-CG 4.46Å; Y81-L175 HydrophobicContact CE1-CD1 3.44Å; Y81-L175 VanDerWaalsContact CE1-CD1 3.44Å; Y81-L175 HydrophobicContact CE2-CD1 4.27Å; Y81-L175 HydrophobicContact CG-CD1 3.71Å; Y81-L175 HydrophobicContact CG-CD2 3.99Å; Y81-L175 HydrophobicContact CG-CG 4.08Å
82	S	94.7	Very high	93.8	Very high	11 Å²	11	29.8 Å²	29.8	8%	0.077	15%	0.147	C	C	.	.	H	α-helix	trans	-58.1	-39.2	174.5	-60.1	0	0	0	0	111.8	T78 S79 S84 R86 L117	T78-S82 WeakPolarHBondContact O-CB 3.29Å; T78-S82 PolarHBondContact O-N 3.08Å; T78-S82 PolarHBondContact O-OG 3.21Å; S79-S82 PolarHBondContact O-N 3.47Å; S82-S84 VanDerWaalsContact C-N 3.35Å; S82-R86 WeakPolarHBondContact O-CG 3.09Å; S82-R86 PolarHBondContact O-N 2.94Å; S82-R86 VanDerWaalsContact O-N 3.16Å; S82-L117 WeakPolarHBondContact O-CD2 3.36Å
83	Q	94.6	Very high	94.3	Very high	41 Å²	41	33.1 Å²	33.1	19%	0.192	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-39.6	173.5	-72.8	-174.3	32.7	0	0	112	S79 C80 Y81 R86 Q87 C130	S79-Q83 WeakPolarHBondContact O-CG 3.47Å; S79-Q83 PolarHBondContact O-N 3.22Å; C80-Q83 PolarHBondContact O-N 3.35Å; Y81-Q83 VanDerWaalsContact C-N 3.26Å; Y81-Q83 PolarHBondContact O-N 3.16Å; Q83-R86 PolarHBondContact O-N 2.91Å; Q83-Q87 WeakPolarHBondContact O-CG 3.49Å; Q83-Q87 PolarHBondContact O-N 3.03Å; Q83-C130 VanDerWaalsContact NE2-CB 3.3Å
84	S	96.4	Very high	94.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-46.4	177	-55.8	0	0	0	0	111.3	C80 Y81 S82 R86 Q87 V88 F142	C80-S84 PolarHBondContact O-N 3.47Å; C80-S84 PolarHBondContact O-OG 3.4Å; Y81-S84 WeakPolarHBondContact O-CA 3.33Å; Y81-S84 WeakPolarHBondContact O-CB 3.5Å; Y81-S84 PolarHBondContact O-N 2.72Å; S82-S84 VanDerWaalsContact C-N 3.35Å; S84-R86 VanDerWaalsContact C-N 3.32Å; S84-R86 PolarHBondContact O-N 3.31Å; S84-Q87 WeakPolarHBondContact O-CB 3.39Å; S84-Q87 PolarHBondContact O-N 3.09Å; S84-V88 WeakPolarHBondContact O-CG2 3.44Å; S84-V88 PolarHBondContact O-N 3.39Å; S84-F142 WeakPolarHBondContact O-CZ 3.43Å
85	L	97	Very high	95.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.1	-38.4	175.8	-67.2	-178.1	0	0	0	113.1	Y81 Q87 V88 L89 L113 E116 L117 L120	Y81-L85 HydrophobicContact CD1-CD1 4.14Å; Y81-L85 HydrophobicContact CD1-CG 4.4Å; Y81-L85 HydrophobicContact CE1-CD1 3.71Å; Y81-L85 HydrophobicContact CE1-CD2 4.32Å; Y81-L85 HydrophobicContact CE1-CG 4.04Å; Y81-L85 HydrophobicContact CE2-CD2 4.45Å; Y81-L85 PolarHBondContact O-N 2.98Å; L85-Q87 VanDerWaalsContact C-N 3.29Å; L85-Q87 PolarHBondContact O-N 3.07Å; L85-V88 PolarHBondContact O-N 3.14Å; L85-L89 PolarHBondContact O-N 3.34Å; L85-L113 HydrophobicContact CD2-CD2 3.84Å; L85-E116 HydrophobicContact CD1-CB 4.08Å; L85-E116 HydrophobicContact CD1-CG 3.69Å; L85-L117 HydrophobicContact CB-CD1 4.38Å; L85-L117 HydrophobicContact CB-CD2 3.87Å; L85-L117 HydrophobicContact CB-CG 3.97Å; L85-L117 HydrophobicContact CD1-CD2 4.15Å; L85-L117 HydrophobicContact CD1-CG 4.1Å; L85-L120 HydrophobicContact CD1-CD1 3.49Å; L85-L120 VanDerWaalsContact CD1-CD1 3.49Å
86	R	97.4	Very high	95.7	Very high	130 Å²	130	37.8 Å²	37.8	49%	0.491	19%	0.187	S	C	.	.	H	α-helix	trans	-63.3	-35.3	174.6	-70.9	175.3	-161.4	154.2	6.2	112.5	S82 Q83 S84 H90 L117	S82-R86 WeakPolarHBondContact O-CG 3.09Å; S82-R86 PolarHBondContact O-N 2.94Å; S82-R86 VanDerWaalsContact O-N 3.16Å; Q83-R86 PolarHBondContact O-N 2.91Å; S84-R86 VanDerWaalsContact C-N 3.32Å; S84-R86 PolarHBondContact O-N 3.31Å; R86-H90 WeakPolarHBondContact O-CB 3.36Å; R86-H90 PolarHBondContact O-N 2.88Å; R86-L117 HydrophobicContact CG-CD1 4.05Å; R86-L117 HydrophobicContact CG-CD2 4.14Å
87	Q	98.1	Very high	96	Very high	46 Å²	46	35.2 Å²	35.2	22%	0.215	18%	0.175	C	C	.	.	H	α-helix	trans	-70.1	-37.4	175.4	-64	-71.4	-23.6	0	0	111.7	Q83 S84 L85 H90 L91 I138 F142	Q83-Q87 WeakPolarHBondContact O-CG 3.49Å; Q83-Q87 PolarHBondContact O-N 3.03Å; S84-Q87 WeakPolarHBondContact O-CB 3.39Å; S84-Q87 PolarHBondContact O-N 3.09Å; L85-Q87 VanDerWaalsContact C-N 3.29Å; L85-Q87 PolarHBondContact O-N 3.07Å; Q87-H90 PolarHBondContact O-N 3.12Å; Q87-L91 WeakPolarHBondContact O-CB 3.41Å; Q87-L91 PolarHBondContact O-N 2.78Å; Q87-I138 HydrophobicContact CG-CG2 4.41Å; Q87-F142 HydrophobicContact CB-CB 4.03Å; Q87-F142 HydrophobicContact CB-CD1 3.44Å; Q87-F142 VanDerWaalsContact CB-CD1 3.44Å; Q87-F142 HydrophobicContact CB-CD2 3.37Å; Q87-F142 HydrophobicContact CB-CE1 3.61Å; Q87-F142 HydrophobicContact CB-CE2 3.56Å; Q87-F142 HydrophobicContact CB-CG 3.32Å; Q87-F142 HydrophobicContact CB-CZ 3.68Å; Q87-F142 HydrophobicContact CG-CB 4.24Å; Q87-F142 HydrophobicContact CG-CD1 4.46Å; Q87-F142 HydrophobicContact CG-CD2 3.65Å; Q87-F142 HydrophobicContact CG-CE2 4.09Å; Q87-F142 HydrophobicContact CG-CG 3.88Å
88	V	98.2	Very high	96.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-48.7	172.8	-177.9	0	0	0	0	110.4	S84 L85 H90 L91 F92 L113 F142 L166 L170	S84-V88 WeakPolarHBondContact O-CG2 3.44Å; S84-V88 PolarHBondContact O-N 3.39Å; L85-V88 PolarHBondContact O-N 3.14Å; V88-H90 VanDerWaalsContact C-N 3.34Å; V88-H90 PolarHBondContact O-N 2.95Å; V88-L91 WeakPolarHBondContact O-CB 3.34Å; V88-L91 PolarHBondContact O-N 3.24Å; V88-L91 VanDerWaalsContact O-N 3.16Å; V88-F92 HydrophobicContact CG1-CD2 3.64Å; V88-F92 HydrophobicContact CG1-CE2 3.84Å; V88-F92 WeakPolarHBondContact O-CD2 3.36Å; V88-F92 PolarHBondContact O-N 3.11Å; V88-L113 HydrophobicContact CB-CD1 4.38Å; V88-L113 HydrophobicContact CB-CD2 4.21Å; V88-L113 HydrophobicContact CG1-CD1 3.67Å; V88-L113 HydrophobicContact CG1-CD2 3.89Å; V88-L113 HydrophobicContact CG1-CG 4.46Å; V88-F142 HydrophobicContact CG2-CE1 3.7Å; V88-F142 HydrophobicContact CG2-CZ 3.66Å; V88-L166 HydrophobicContact CG2-CD2 4.13Å; V88-L170 HydrophobicContact CG1-CD1 4.36Å; V88-L170 HydrophobicContact CG2-CD1 3.86Å; V88-L170 HydrophobicContact CG2-CD2 3.87Å; V88-L170 HydrophobicContact CG2-CG 4.39Å
89	L	97.8	Very high	96.6	Very high	14 Å²	14	44 Å²	44	7%	0.073	23%	0.225	C	C	.	.	H	α-helix	trans	-54.5	-50.2	174.5	-83.3	175.4	0	0	0	111.6	L85 L91 F92 D93 L110 L113 W114 L117	L85-L89 PolarHBondContact O-N 3.34Å; L89-L91 VanDerWaalsContact C-N 3.26Å; L89-L91 PolarHBondContact O-N 3.49Å; L89-F92 PolarHBondContact O-N 3.42Å; L89-D93 WeakPolarHBondContact O-CB 3.45Å; L89-D93 PolarHBondContact O-N 3.03Å; L89-L110 HydrophobicContact CD2-CD2 3.85Å; L89-L113 HydrophobicContact CD1-CB 4.36Å; L89-L113 HydrophobicContact CD2-CB 3.48Å; L89-L113 VanDerWaalsContact CD2-CB 3.48Å; L89-L113 HydrophobicContact CD2-CD1 3.78Å; L89-L113 HydrophobicContact CD2-CG 4.28Å; L89-L113 HydrophobicContact CG-CB 3.74Å; L89-L113 HydrophobicContact CG-CD1 4.09Å; L89-L113 HydrophobicContact CG-CG 4.48Å; L89-W114 HydrophobicContact CD1-CD2 4.03Å; L89-W114 HydrophobicContact CD1-CE3 4.4Å; L89-W114 HydrophobicContact CD1-CG 4.41Å; L89-W114 HydrophobicContact CD1-CZ2 4.26Å; L89-W114 HydrophobicContact CD2-CG 4.48Å; L89-L117 HydrophobicContact CD1-CD1 3.33Å
90	H	97.6	Very high	96.7	Very high	115 Å²	115	44 Å²	44	53%	0.532	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-35.5	179.7	-178	-161	0	0	0	112.7	R86 Q87 V88 T94	R86-H90 WeakPolarHBondContact O-CB 3.36Å; R86-H90 PolarHBondContact O-N 2.88Å; Q87-H90 PolarHBondContact O-N 3.12Å; V88-H90 VanDerWaalsContact C-N 3.34Å; V88-H90 PolarHBondContact O-N 2.95Å; H90-T94 VanDerWaalsContact O-CG2 3.24Å; H90-T94 WeakPolarHBondContact O-CG2 3.36Å
91	L	98.2	Very high	96.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-45.1	177.3	-178.5	65.4	0	0	0	112.2	Q87 V88 L89 T94 F145 F146 L149 W159 V162 L166	Q87-L91 WeakPolarHBondContact O-CB 3.41Å; Q87-L91 PolarHBondContact O-N 2.78Å; V88-L91 WeakPolarHBondContact O-CB 3.34Å; V88-L91 PolarHBondContact O-N 3.24Å; V88-L91 VanDerWaalsContact O-N 3.16Å; L89-L91 VanDerWaalsContact C-N 3.26Å; L89-L91 PolarHBondContact O-N 3.49Å; L91-T94 PolarHBondContact O-OG1 3Å; L91-F145 HydrophobicContact CD1-CB 4.39Å; L91-F145 HydrophobicContact CD2-CB 4.35Å; L91-F145 HydrophobicContact CD2-CD2 4.11Å; L91-F146 HydrophobicContact CB-CZ 4.11Å; L91-F146 HydrophobicContact CD1-CD1 4.06Å; L91-F146 HydrophobicContact CD1-CE1 3.75Å; L91-F146 HydrophobicContact CD1-CE2 4.26Å; L91-F146 HydrophobicContact CD1-CG 4.45Å; L91-F146 HydrophobicContact CD1-CZ 3.86Å; L91-L149 HydrophobicContact CD1-CD1 3.66Å; L91-W159 HydrophobicContact CD1-CH2 4.48Å; L91-W159 HydrophobicContact CD1-CZ3 4.48Å; L91-W159 HydrophobicContact CG-CZ3 4.36Å; L91-V162 HydrophobicContact CD2-CG1 3.71Å; L91-L166 HydrophobicContact CD2-CD1 3.84Å
92	F	98.1	Very high	96.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-85.1	-20.8	-175.2	-78.9	-77.8	0	0	0	114.2	L41 L44 V88 L89 T94 S97 W101 L106 L109 L110 L166	L41-F92 HydrophobicContact CD1-CE1 4.43Å; L41-F92 HydrophobicContact CD1-CE2 3.93Å; L41-F92 HydrophobicContact CD1-CZ 3.59Å; L44-F92 HydrophobicContact CD1-CD1 4.13Å; L44-F92 HydrophobicContact CD1-CE1 3.82Å; V88-F92 HydrophobicContact CG1-CD2 3.64Å; V88-F92 HydrophobicContact CG1-CE2 3.84Å; V88-F92 WeakPolarHBondContact O-CD2 3.36Å; V88-F92 PolarHBondContact O-N 3.11Å; L89-F92 PolarHBondContact O-N 3.42Å; F92-T94 PolarHBondContact O-N 3.39Å; F92-S97 WeakPolarHBondContact CA-OG 3.49Å; F92-S97 WeakPolarHBondContact O-CB 3.43Å; F92-S97 PolarHBondContact O-OG 2.9Å; F92-W101 AromaticContact CD1-NE1 3.88Å; F92-W101 HydrophobicContact CE1-CZ2 4.42Å; F92-W101 AromaticContact CE1-NE1 3.68Å; F92-L106 HydrophobicContact CB-CD1 4.04Å; F92-L106 HydrophobicContact CD1-CD1 3.91Å; F92-L106 HydrophobicContact CG-CD1 4.39Å; F92-L109 HydrophobicContact CB-CD2 4.47Å; F92-L109 HydrophobicContact CD1-CD2 3.93Å; F92-L109 HydrophobicContact CD2-CD2 3.88Å; F92-L109 HydrophobicContact CE1-CD2 4.08Å; F92-L109 HydrophobicContact CE2-CD2 4.03Å; F92-L109 HydrophobicContact CG-CD2 3.84Å; F92-L109 HydrophobicContact CZ-CD2 4.13Å; F92-L110 HydrophobicContact CB-CD2 3.86Å; F92-L166 HydrophobicContact CE2-CD1 3.64Å; F92-L166 HydrophobicContact CZ-CD1 4.21Å
93	D	97.3	Very high	96.9	Very high	88 Å²	88	57.3 Å²	57.3	47%	0.471	29%	0.288	S	S	.	.	S	Bend	trans	-89.2	38.1	175.2	-163.7	29.5	0	0	0	112.3	L89 R98 L110	L89-D93 WeakPolarHBondContact O-CB 3.45Å; L89-D93 PolarHBondContact O-N 3.03Å; D93-R98 IonicContact OD1-CZ 3.58Å; D93-R98 IonicContact OD1-NE 3.59Å; D93-R98 IonicContact OD1-NH2 3.9Å; D93-R98 PolarHBondContact OD1-NH2 2.98Å; D93-L110 HydrophobicContact CB-CD2 4.21Å
94	T	97.7	Very high	97	Very high	36 Å²	36	64.7 Å²	64.7	22%	0.221	31%	0.314	C	S	.	.	S	Bend	trans	-108.6	153	175.1	58.8	0	0	0	0	110.3	H90 L91 F92 A96 S97 R98	H90-T94 VanDerWaalsContact O-CG2 3.24Å; H90-T94 WeakPolarHBondContact O-CG2 3.36Å; L91-T94 PolarHBondContact O-OG1 3Å; F92-T94 PolarHBondContact O-N 3.39Å; T94-A96 PolarHBondContact O-N 3Å; T94-S97 WeakPolarHBondContact O-CB 3.18Å; T94-S97 PolarHBondContact O-N 2.99Å; T94-S97 VanDerWaalsContact O-N 3.08Å; T94-S97 WeakPolarHBondContact OG1-CB 3.25Å; T94-S97 PolarHBondContact OG1-N 3.5Å; T94-R98 PolarHBondContact O-N 3.19Å
95	E	97.5	Very high	97	Very high	178 Å²	178	65.7 Å²	65.7	83%	0.832	32%	0.322	S	S	*	.	H	α-helix	trans	-57.2	-39.8	175.3	-65.6	-178.3	162.7	0	0	111.9	S97 R98 A99	E95-S97 VanDerWaalsContact C-N 3.31Å; E95-S97 PolarHBondContact O-N 2.89Å; E95-R98 PolarHBondContact O-N 3.35Å; E95-A99 PolarHBondContact O-N 3.2Å
96	A	97.4	Very high	97	Very high	31 Å²	31	65.7 Å²	65.7	26%	0.256	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-33.2	177.7	0	0	0	0	0	113	T94 A100 H154 W159	T94-A96 PolarHBondContact O-N 3Å; A96-A100 WeakPolarHBondContact O-CB 3.34Å; A96-A100 PolarHBondContact O-N 3Å; A96-H154 HydrophobicContact CB-CB 4.35Å; A96-H154 WeakPolarHBondContact CB-ND1 3.43Å; A96-W159 HydrophobicContact CB-CZ2 4.11Å; A96-W159 PolarHBondContact O-NE1 3.48Å
97	S	97.3	Very high	97	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-70.5	-44.6	171.9	173.5	0	0	0	0	110.8	F92 T94 E95 A99 A100 W101	F92-S97 WeakPolarHBondContact CA-OG 3.49Å; F92-S97 WeakPolarHBondContact O-CB 3.43Å; F92-S97 PolarHBondContact O-OG 2.9Å; T94-S97 WeakPolarHBondContact O-CB 3.18Å; T94-S97 PolarHBondContact O-N 2.99Å; T94-S97 VanDerWaalsContact O-N 3.08Å; T94-S97 WeakPolarHBondContact OG1-CB 3.25Å; T94-S97 PolarHBondContact OG1-N 3.5Å; E95-S97 VanDerWaalsContact C-N 3.31Å; E95-S97 PolarHBondContact O-N 2.89Å; S97-A99 PolarHBondContact O-N 3.15Å; S97-A100 WeakPolarHBondContact O-CB 3.31Å; S97-A100 PolarHBondContact O-N 3.46Å; S97-W101 PolarHBondContact O-N 3.3Å
98	R	96.9	Very high	97	Very high	112 Å²	112	64.3 Å²	64.3	42%	0.423	32%	0.323	S	S	.	.	H	α-helix	trans	-59.1	-34.2	176.2	-69	-177.4	179.6	-76.4	-4.9	112.6	D93 T94 E95 A100 L106 D107	D93-R98 IonicContact OD1-CZ 3.58Å; D93-R98 IonicContact OD1-NE 3.59Å; D93-R98 IonicContact OD1-NH2 3.9Å; D93-R98 PolarHBondContact OD1-NH2 2.98Å; T94-R98 PolarHBondContact O-N 3.19Å; E95-R98 PolarHBondContact O-N 3.35Å; R98-A100 VanDerWaalsContact C-N 3.35Å; R98-L106 HydrophobicContact CB-CD2 4.26Å; R98-L106 HydrophobicContact CG-CD2 3.7Å; R98-D107 IonicContact NH1-OD1 2.77Å
99	A	95.7	Very high	97	Very high	90 Å²	90	64.3 Å²	64.3	74%	0.744	32%	0.323	S	S	*	.	H	α-helix	trans	-74.1	-22	174	0	0	0	0	0	114	E95 S97	E95-A99 PolarHBondContact O-N 3.2Å; S97-A99 PolarHBondContact O-N 3.15Å
100	A	95.6	Very high	97	Very high	29 Å²	29	64.2 Å²	64.2	24%	0.24	32%	0.322	C	S	.	.	H	α-helix	trans	-88.1	-21.3	-175.4	0	0	0	0	0	114	A96 S97 R98 W159	A96-A100 WeakPolarHBondContact O-CB 3.34Å; A96-A100 PolarHBondContact O-N 3Å; S97-A100 WeakPolarHBondContact O-CB 3.31Å; S97-A100 PolarHBondContact O-N 3.46Å; R98-A100 VanDerWaalsContact C-N 3.35Å; A100-W159 HydrophobicContact CB-CB 4.35Å; A100-W159 HydrophobicContact CB-CD2 4.09Å; A100-W159 HydrophobicContact CB-CG 3.7Å
101	W	96.2	Very high	97	Very high	19 Å²	19	61.5 Å²	61.5	7%	0.072	32%	0.316	C	S	.	.	S	Bend	trans	-127.4	155.4	-168.3	-53.1	119.8	0	0	0	112.6	L44 S46 F92 S97 E103 L106 W159 R163	L44-W101 HydrophobicContact CB-CD2 4.44Å; L44-W101 HydrophobicContact CB-CE3 4.34Å; L44-W101 HydrophobicContact CD2-CB 3.75Å; L44-W101 HydrophobicContact CD2-CD2 4.1Å; L44-W101 HydrophobicContact CD2-CE3 4.41Å; L44-W101 HydrophobicContact CD2-CG 3.81Å; L44-W101 VanDerWaalsContact O-CE3 3.23Å; L44-W101 VanDerWaalsContact O-CH2 3.31Å; L44-W101 WeakPolarHBondContact O-CH2 3.39Å; L44-W101 WeakPolarHBondContact O-CZ3 3.46Å; S46-W101 VanDerWaalsContact OG-CZ3 3.29Å; S46-W101 WeakPolarHBondContact OG-CZ3 3.3Å; F92-W101 AromaticContact CD1-NE1 3.88Å; F92-W101 HydrophobicContact CE1-CZ2 4.42Å; F92-W101 AromaticContact CE1-NE1 3.68Å; S97-W101 PolarHBondContact O-N 3.3Å; W101-E103 PolarHBondContact O-N 3.29Å; W101-L106 HydrophobicContact CB-CB 4.21Å; W101-W159 HydrophobicContact CH2-CB 3.84Å; W101-W159 HydrophobicContact CZ2-CB 3.58Å; W101-W159 HydrophobicContact CZ2-CD2 4.34Å; W101-W159 HydrophobicContact CZ2-CE3 4.09Å; W101-W159 HydrophobicContact CZ2-CG 4.19Å; W101-W159 AromaticContact NE1-CE3 3.98Å; W101-R163 HydrophobicContact CH2-CB 4.16Å; W101-R163 HydrophobicContact CH2-CG 4.48Å; W101-R163 HydrophobicContact CZ2-CB 4.26Å
102	H	94.9	Very high	96.9	Very high	141 Å²	141	61.5 Å²	61.5	65%	0.653	32%	0.316	S	S	*	.			trans	-66.9	126.6	171	-165.8	-59.7	0	0	0	109.9	R104 A105 L106	H102-R104 PolarHBondContact O-N 3.22Å; H102-A105 PolarHBondContact O-N 3.36Å; H102-L106 PolarHBondContact O-N 3.24Å; H102-L106 VanDerWaalsContact O-N 3.13Å
103	E	95.3	Very high	96.9	Very high	133 Å²	133	61.5 Å²	61.5	62%	0.621	32%	0.316	S	S	*	.	H	α-helix	trans	-46.2	-55.4	-171.6	-176.9	179.6	-167.7	0	0	113.1	W101 A105 L106 D107	W101-E103 PolarHBondContact O-N 3.29Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 2.83Å; E103-L106 PolarHBondContact O-N 2.85Å; E103-L106 VanDerWaalsContact O-N 3.12Å; E103-D107 PolarHBondContact O-N 2.92Å
104	R	96	Very high	96.9	Very high	196 Å²	196	63.9 Å²	63.9	74%	0.74	32%	0.319	S	S	*	.	H	α-helix	trans	-55	-41.8	179.3	-64.4	-173.3	-175.8	-167.9	1.6	114.2	H102 Q108	H102-R104 PolarHBondContact O-N 3.22Å; R104-Q108 WeakPolarHBondContact O-CB 3.33Å; R104-Q108 VanDerWaalsContact O-CG 3.25Å; R104-Q108 WeakPolarHBondContact O-CG 3.39Å; R104-Q108 PolarHBondContact O-N 3.08Å; R104-Q108 VanDerWaalsContact O-N 3.11Å
105	A	96.3	Very high	96.8	Very high	20 Å²	20	66.4 Å²	66.4	17%	0.165	32%	0.324	C	S	.	.	H	α-helix	trans	-71.1	-37.4	-178.7	0	0	0	0	0	111.1	L44 H102 E103 L109	L44-A105 HydrophobicContact CD2-CB 3.79Å; H102-A105 PolarHBondContact O-N 3.36Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 2.83Å; A105-L109 PolarHBondContact O-N 2.75Å
106	L	97.9	Very high	96.6	Very high	1 Å²	1	58 Å²	58	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-66.6	-45.3	175.1	-178.4	60.3	0	0	0	111.6	L44 F92 R98 W101 H102 E103 Q108 L109 L110	L44-L106 HydrophobicContact CD1-CD1 4.29Å; L44-L106 HydrophobicContact CD2-CB 4.31Å; F92-L106 HydrophobicContact CB-CD1 4.04Å; F92-L106 HydrophobicContact CD1-CD1 3.91Å; F92-L106 HydrophobicContact CG-CD1 4.39Å; R98-L106 HydrophobicContact CB-CD2 4.26Å; R98-L106 HydrophobicContact CG-CD2 3.7Å; W101-L106 HydrophobicContact CB-CB 4.21Å; H102-L106 PolarHBondContact O-N 3.24Å; H102-L106 VanDerWaalsContact O-N 3.13Å; E103-L106 PolarHBondContact O-N 2.85Å; E103-L106 VanDerWaalsContact O-N 3.12Å; L106-Q108 VanDerWaalsContact C-N 3.26Å; L106-Q108 PolarHBondContact O-N 3.3Å; L106-L109 PolarHBondContact O-N 3.32Å; L106-L109 VanDerWaalsContact O-N 3.15Å; L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CD1-CG 4.32Å; L106-L110 HydrophobicContact CG-CD1 4.13Å; L106-L110 HydrophobicContact CG-CG 4.41Å; L106-L110 WeakPolarHBondContact O-CG 3.24Å; L106-L110 PolarHBondContact O-N 3.26Å
107	D	97.5	Very high	96.4	Very high	60 Å²	60	56.6 Å²	56.6	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-34.7	178.8	-72.5	-20.3	0	0	0	112.3	R98 E103 L110 S111	R98-D107 IonicContact NH1-OD1 2.77Å; E103-D107 PolarHBondContact O-N 2.92Å; D107-L110 PolarHBondContact O-N 2.96Å; D107-S111 WeakPolarHBondContact O-CB 3.46Å; D107-S111 PolarHBondContact O-N 3.31Å; D107-S111 PolarHBondContact O-OG 3.09Å
108	Q	97.6	Very high	96.2	Very high	87 Å²	87	61.7 Å²	61.7	41%	0.407	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-45	173.2	-78.9	175.4	-39.1	0	0	112.4	F40 R104 L106 S111 S112	F40-Q108 HydrophobicContact CD1-CB 3.54Å; F40-Q108 HydrophobicContact CD1-CG 4.31Å; F40-Q108 HydrophobicContact CE1-CB 3.46Å; F40-Q108 VanDerWaalsContact CE1-CB 3.46Å; F40-Q108 HydrophobicContact CE1-CG 3.78Å; F40-Q108 HydrophobicContact CE2-CB 4.44Å; F40-Q108 HydrophobicContact CG-CB 4.07Å; F40-Q108 HydrophobicContact CZ-CB 3.9Å; F40-Q108 HydrophobicContact CZ-CG 4.18Å; R104-Q108 WeakPolarHBondContact O-CB 3.33Å; R104-Q108 VanDerWaalsContact O-CG 3.25Å; R104-Q108 WeakPolarHBondContact O-CG 3.39Å; R104-Q108 PolarHBondContact O-N 3.08Å; R104-Q108 VanDerWaalsContact O-N 3.11Å; L106-Q108 VanDerWaalsContact C-N 3.26Å; L106-Q108 PolarHBondContact O-N 3.3Å; Q108-S111 PolarHBondContact O-N 2.89Å; Q108-S112 PolarHBondContact O-N 3.37Å
109	L	97.9	Very high	95.9	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-49.7	174	174	65.9	0	0	0	111.2	T37 F40 L41 L44 F92 A105 L106 S111 S112 L113	T37-L109 HydrophobicContact CG2-CD1 4.2Å; F40-L109 HydrophobicContact CB-CB 4.12Å; F40-L109 HydrophobicContact CB-CD1 4.26Å; L41-L109 HydrophobicContact CB-CD1 4.13Å; L41-L109 HydrophobicContact CD1-CD2 3.95Å; L44-L109 HydrophobicContact CD1-CB 4.16Å; L44-L109 HydrophobicContact CD1-CD2 3.34Å; L44-L109 HydrophobicContact CD1-CG 4.33Å; F92-L109 HydrophobicContact CB-CD2 4.47Å; F92-L109 HydrophobicContact CD1-CD2 3.93Å; F92-L109 HydrophobicContact CD2-CD2 3.88Å; F92-L109 HydrophobicContact CE1-CD2 4.08Å; F92-L109 HydrophobicContact CE2-CD2 4.03Å; F92-L109 HydrophobicContact CG-CD2 3.84Å; F92-L109 HydrophobicContact CZ-CD2 4.13Å; A105-L109 PolarHBondContact O-N 2.75Å; L106-L109 PolarHBondContact O-N 3.32Å; L106-L109 VanDerWaalsContact O-N 3.15Å; L109-S111 VanDerWaalsContact C-N 3.27Å; L109-S111 PolarHBondContact O-N 3.4Å; L109-S112 PolarHBondContact O-N 3.01Å; L109-S112 PolarHBondContact O-OG 2.95Å; L109-L113 HydrophobicContact CD1-CD1 3.99Å; L109-L113 HydrophobicContact CD1-CG 4.09Å; L109-L113 HydrophobicContact CD2-CD1 4.36Å; L109-L113 HydrophobicContact CG-CD1 3.81Å; L109-L113 HydrophobicContact CG-CG 4.37Å; L109-L113 WeakPolarHBondContact O-CG 3.41Å; L109-L113 PolarHBondContact O-N 3.16Å
110	L	98.1	Very high	95.6	Very high	12 Å²	12	52.9 Å²	52.9	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-42.2	-179.3	-67.9	176.6	0	0	0	110.7	L89 F92 D93 L106 D107 L113 W114	L89-L110 HydrophobicContact CD2-CD2 3.85Å; F92-L110 HydrophobicContact CB-CD2 3.86Å; D93-L110 HydrophobicContact CB-CD2 4.21Å; L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CD1-CG 4.32Å; L106-L110 HydrophobicContact CG-CD1 4.13Å; L106-L110 HydrophobicContact CG-CG 4.41Å; L106-L110 WeakPolarHBondContact O-CG 3.24Å; L106-L110 PolarHBondContact O-N 3.26Å; D107-L110 PolarHBondContact O-N 2.96Å; L110-L113 PolarHBondContact O-N 3.37Å; L110-W114 PolarHBondContact O-N 3.17Å
111	S	97.7	Very high	95	Very high	58 Å²	58	56.3 Å²	56.3	41%	0.406	26%	0.255	S	S	.	.	H	α-helix	trans	-63.5	-40.8	176.8	-62.1	0	0	0	0	112.7	D107 Q108 L109 W114 R115	D107-S111 WeakPolarHBondContact O-CB 3.46Å; D107-S111 PolarHBondContact O-N 3.31Å; D107-S111 PolarHBondContact O-OG 3.09Å; Q108-S111 PolarHBondContact O-N 2.89Å; L109-S111 VanDerWaalsContact C-N 3.27Å; L109-S111 PolarHBondContact O-N 3.4Å; S111-W114 PolarHBondContact O-N 2.9Å; S111-R115 WeakPolarHBondContact O-CG 3.24Å; S111-R115 PolarHBondContact O-N 2.96Å
112	S	97	Very high	93.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-42.7	177.9	77.9	0	0	0	0	111.9	T37 Q108 L109 W114 R115 E116	T37-S112 WeakPolarHBondContact CA-OG 3.36Å; T37-S112 PolarHBondContact OG1-OG 3.28Å; Q108-S112 PolarHBondContact O-N 3.37Å; L109-S112 PolarHBondContact O-N 3.01Å; L109-S112 PolarHBondContact O-OG 2.95Å; S112-W114 VanDerWaalsContact C-N 3.27Å; S112-W114 PolarHBondContact O-N 3.26Å; S112-R115 PolarHBondContact O-N 2.9Å; S112-E116 WeakPolarHBondContact O-CB 3.43Å; S112-E116 PolarHBondContact O-N 3.07Å
113	L	97.2	Very high	92	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-40.6	175.1	-72.5	166.8	0	0	0	111.8	T37 L85 V88 L89 L109 L110 L117	T37-L113 HydrophobicContact CG2-CD2 3.56Å; T37-L113 HydrophobicContact CG2-CG 4.15Å; L85-L113 HydrophobicContact CD2-CD2 3.84Å; V88-L113 HydrophobicContact CB-CD1 4.38Å; V88-L113 HydrophobicContact CB-CD2 4.21Å; V88-L113 HydrophobicContact CG1-CD1 3.67Å; V88-L113 HydrophobicContact CG1-CD2 3.89Å; V88-L113 HydrophobicContact CG1-CG 4.46Å; L89-L113 HydrophobicContact CD1-CB 4.36Å; L89-L113 HydrophobicContact CD2-CB 3.48Å; L89-L113 VanDerWaalsContact CD2-CB 3.48Å; L89-L113 HydrophobicContact CD2-CD1 3.78Å; L89-L113 HydrophobicContact CD2-CG 4.28Å; L89-L113 HydrophobicContact CG-CB 3.74Å; L89-L113 HydrophobicContact CG-CD1 4.09Å; L89-L113 HydrophobicContact CG-CG 4.48Å; L109-L113 HydrophobicContact CD1-CD1 3.99Å; L109-L113 HydrophobicContact CD1-CG 4.09Å; L109-L113 HydrophobicContact CD2-CD1 4.36Å; L109-L113 HydrophobicContact CG-CD1 3.81Å; L109-L113 HydrophobicContact CG-CG 4.37Å; L109-L113 WeakPolarHBondContact O-CG 3.41Å; L109-L113 PolarHBondContact O-N 3.16Å; L110-L113 PolarHBondContact O-N 3.37Å; L113-L117 WeakPolarHBondContact O-CG 3.49Å; L113-L117 PolarHBondContact O-N 3.31Å; L113-L117 VanDerWaalsContact O-N 3.07Å
114	W	96.4	Very high	90	Very high	139 Å²	139	63.1 Å²	63.1	53%	0.527	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-49.3	174.3	-85.3	115.7	0	0	0	112.2	L89 L110 S111 S112 E116 L117 Q118	L89-W114 HydrophobicContact CD1-CD2 4.03Å; L89-W114 HydrophobicContact CD1-CE3 4.4Å; L89-W114 HydrophobicContact CD1-CG 4.41Å; L89-W114 HydrophobicContact CD1-CZ2 4.26Å; L89-W114 HydrophobicContact CD2-CG 4.48Å; L110-W114 PolarHBondContact O-N 3.17Å; S111-W114 PolarHBondContact O-N 2.9Å; S112-W114 VanDerWaalsContact C-N 3.27Å; S112-W114 PolarHBondContact O-N 3.26Å; W114-E116 VanDerWaalsContact C-N 3.31Å; W114-E116 PolarHBondContact O-N 3.5Å; W114-L117 PolarHBondContact O-N 3.43Å; W114-Q118 VanDerWaalsContact O-CG 3.29Å; W114-Q118 WeakPolarHBondContact O-CG 3.43Å; W114-Q118 PolarHBondContact O-N 3.37Å
115	R	95.3	Very high	88.1	Confident	89 Å²	89	55.8 Å²	55.8	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-58.3	-44.9	177.4	-72.6	-168.9	-55.2	-91.5	6.5	111.8	E33 E36 S111 S112 L117 Q118 V119	E33-R115 IonicContact OE1-NE 3.71Å; E33-R115 WeakPolarHBondContact OE2-CB 3.29Å; E33-R115 IonicContact OE2-CZ 2.58Å; E33-R115 IonicContact OE2-NE 3.58Å; E33-R115 PolarHBondContact OE2-NE 3.42Å; E33-R115 IonicContact OE2-NH2 3.76Å; E36-R115 IonicContact OE2-CZ 2.85Å; E36-R115 IonicContact OE2-NE 2.98Å; E36-R115 IonicContact OE2-NH2 2.69Å; E36-R115 PolarHBondContact OE2-NH2 3.41Å; S111-R115 WeakPolarHBondContact O-CG 3.24Å; S111-R115 PolarHBondContact O-N 2.96Å; S112-R115 PolarHBondContact O-N 2.9Å; R115-L117 VanDerWaalsContact C-N 3.35Å; R115-L117 PolarHBondContact O-N 2.93Å; R115-Q118 WeakPolarHBondContact O-CA 3.45Å; R115-Q118 WeakPolarHBondContact O-CB 3.37Å; R115-Q118 PolarHBondContact O-N 3.36Å; R115-V119 PolarHBondContact O-N 3.03Å
116	E	94.4	Very high	86.2	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-44.8	178.6	-164.9	176.7	163.3	0	0	112	L30 E33 R34 T37 Y81 L85 S112 W114 Q118 V119 L120	L30-E116 HydrophobicContact CD1-CG 4.21Å; E33-E116 HydrophobicContact CB-CB 3.88Å; E33-E116 HydrophobicContact CB-CG 3.85Å; R34-E116 WeakPolarHBondContact CG-OE1 3.35Å; T37-E116 VanDerWaalsContact CB-OE2 3.24Å; T37-E116 WeakPolarHBondContact CB-OE2 3.49Å; T37-E116 PolarHBondContact OG1-OE2 3.15Å; Y81-E116 WeakPolarHBondContact CE1-OE1 3.28Å; Y81-E116 PolarHBondContact OH-OE1 3.1Å; L85-E116 HydrophobicContact CD1-CB 4.08Å; L85-E116 HydrophobicContact CD1-CG 3.69Å; S112-E116 WeakPolarHBondContact O-CB 3.43Å; S112-E116 PolarHBondContact O-N 3.07Å; W114-E116 VanDerWaalsContact C-N 3.31Å; W114-E116 PolarHBondContact O-N 3.5Å; E116-Q118 VanDerWaalsContact C-N 3.3Å; E116-Q118 PolarHBondContact O-N 3.1Å; E116-V119 WeakPolarHBondContact O-CB 3.43Å; E116-V119 PolarHBondContact O-N 2.69Å; E116-L120 WeakPolarHBondContact O-CG 3.46Å; E116-L120 PolarHBondContact O-N 3.43Å; E116-L120 VanDerWaalsContact O-N 3.12Å
117	L	93.9	Very high	84.7	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-36.2	172.7	-81.5	170.9	0	0	0	113.2	S82 L85 R86 L89 L113 W114 R115 L120 K121	S82-L117 WeakPolarHBondContact O-CD2 3.36Å; L85-L117 HydrophobicContact CB-CD1 4.38Å; L85-L117 HydrophobicContact CB-CD2 3.87Å; L85-L117 HydrophobicContact CB-CG 3.97Å; L85-L117 HydrophobicContact CD1-CD2 4.15Å; L85-L117 HydrophobicContact CD1-CG 4.1Å; R86-L117 HydrophobicContact CG-CD1 4.05Å; R86-L117 HydrophobicContact CG-CD2 4.14Å; L89-L117 HydrophobicContact CD1-CD1 3.33Å; L113-L117 WeakPolarHBondContact O-CG 3.49Å; L113-L117 PolarHBondContact O-N 3.31Å; L113-L117 VanDerWaalsContact O-N 3.07Å; W114-L117 PolarHBondContact O-N 3.43Å; R115-L117 VanDerWaalsContact C-N 3.35Å; R115-L117 PolarHBondContact O-N 2.93Å; L117-L120 PolarHBondContact O-N 3.01Å; L117-K121 WeakPolarHBondContact O-CG 3.49Å; L117-K121 PolarHBondContact O-N 2.73Å; L117-K121 VanDerWaalsContact O-N 3.08Å
118	Q	92.2	Very high	84	Confident	106 Å²	106	66.9 Å²	66.9	50%	0.495	32%	0.324	S	S	.	.	H	α-helix	trans	-68.8	-35.4	177.2	-62.8	-66.5	88.4	0	0	111.7	W114 R115 E116 L120	W114-Q118 VanDerWaalsContact O-CG 3.29Å; W114-Q118 WeakPolarHBondContact O-CG 3.43Å; W114-Q118 PolarHBondContact O-N 3.37Å; R115-Q118 WeakPolarHBondContact O-CA 3.45Å; R115-Q118 WeakPolarHBondContact O-CB 3.37Å; R115-Q118 PolarHBondContact O-N 3.36Å; E116-Q118 VanDerWaalsContact C-N 3.3Å; E116-Q118 PolarHBondContact O-N 3.1Å; Q118-L120 VanDerWaalsContact C-N 3.32Å
119	V	90.1	Very high	83.7	Confident	9 Å²	9	66.8 Å²	66.8	6%	0.055	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-40.9	172.1	174.5	0	0	0	0	111.1	S29 L30 E33 R115 E116	S29-V119 WeakPolarHBondContact OG-CG2 3.32Å; L30-V119 HydrophobicContact CB-CG1 3.99Å; L30-V119 HydrophobicContact CD1-CG1 4.34Å; E33-V119 HydrophobicContact CG-CG2 3.8Å; R115-V119 PolarHBondContact O-N 3.03Å; E116-V119 WeakPolarHBondContact O-CB 3.43Å; E116-V119 PolarHBondContact O-N 2.69Å
120	L	89	Confident	83.4	Confident	9 Å²	9	67.1 Å²	67.1	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-71.1	-32.3	-179.3	-64.5	165.2	0	0	0	113.6	L30 T78 Y81 L85 E116 L117 Q118 R122	L30-L120 HydrophobicContact CD1-CD2 3.63Å; L30-L120 HydrophobicContact CD1-CG 4.05Å; L30-L120 HydrophobicContact CD2-CD2 3.88Å; L30-L120 HydrophobicContact CG-CD2 4.42Å; T78-L120 HydrophobicContact CG2-CB 4.37Å; T78-L120 HydrophobicContact CG2-CD2 3.74Å; Y81-L120 HydrophobicContact CD1-CD1 3.6Å; Y81-L120 HydrophobicContact CD1-CD2 4.09Å; Y81-L120 HydrophobicContact CE1-CD1 3.95Å; L85-L120 HydrophobicContact CD1-CD1 3.49Å; L85-L120 VanDerWaalsContact CD1-CD1 3.49Å; E116-L120 WeakPolarHBondContact O-CG 3.46Å; E116-L120 PolarHBondContact O-N 3.43Å; E116-L120 VanDerWaalsContact O-N 3.12Å; L117-L120 PolarHBondContact O-N 3.01Å; Q118-L120 VanDerWaalsContact C-N 3.32Å; L120-R122 PolarHBondContact O-N 2.91Å
121	K	83.4	Confident	83.1	Confident	100 Å²	100	68.1 Å²	68.1	44%	0.435	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.5	-179	-77.6	176.2	-170.4	169.6	0	115.2	L117 Q126	L117-K121 WeakPolarHBondContact O-CG 3.49Å; L117-K121 PolarHBondContact O-N 2.73Å; L117-K121 VanDerWaalsContact O-N 3.08Å; K121-Q126 PolarHBondContact O-NE2 3.19Å
122	R	68.7	Low	82.9	Confident	107 Å²	107	71 Å²	71	40%	0.404	35%	0.353	S	S	.	.	S	Bend	trans	-61	148.3	-173.1	-79.4	-171.2	-107.2	153.5	-6.5	113.2	S29 L120 R124	S29-R122 PolarHBondContact OG-NH2 3.32Å; L120-R122 PolarHBondContact O-N 2.91Å; R122-R124 VanDerWaalsContact C-N 3.34Å; R122-R124 PolarHBondContact O-N 3.27Å
123	P	59.9	Low	82.7	Confident	98 Å²	98	75.7 Å²	75.7	64%	0.636	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-67.7	-8.8	-142.3	-24.5	35	0	0	0	119.6	E125	P123-E125 PolarHBondContact O-N 2.94Å
124	R	53	Low	82.5	Confident	232 Å²	232	75.9 Å²	75.9	88%	0.875	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-83.9	-7	-168.5	-78.7	-170.5	175.3	158.3	-0.7	115.9	R122	R122-R124 VanDerWaalsContact C-N 3.34Å; R122-R124 PolarHBondContact O-N 3.27Å
125	E	56.3	Low	82.4	Confident	42 Å²	42	69.5 Å²	69.5	20%	0.196	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-117.6	10.1	-178.1	-68.4	163.4	-121.5	0	0	112.5	K26 T78 P123 G127 Q128	K26-E125 IonicContact NZ-OE1 2.73Å; K26-E125 PolarHBondContact NZ-OE1 2.89Å; T78-E125 WeakPolarHBondContact CB-OE2 3.42Å; T78-E125 WeakPolarHBondContact CG2-OE2 3.33Å; T78-E125 PolarHBondContact OG1-OE2 3.42Å; P123-E125 PolarHBondContact O-N 2.94Å; E125-G127 PolarHBondContact O-N 3.34Å; E125-Q128 PolarHBondContact O-N 3.45Å
126	Q	56.9	Low	82.4	Confident	146 Å²	146	69.3 Å²	69.3	68%	0.682	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	8.2	-172.1	-72.2	-177.3	7.8	0	0	115.8	K121	K121-Q126 PolarHBondContact O-NE2 3.19Å
127	G	67	Low	82.4	Confident	79 Å²	79	70.8 Å²	70.8	81%	0.814	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-10.8	178	0	0	0	0	0	115.5	E125	E125-G127 PolarHBondContact O-N 3.34Å
128	Q	82	Confident	82.5	Confident	89 Å²	89	70.7 Å²	70.7	42%	0.416	38%	0.378	S	S	.	.			trans	-113.1	133	-171.2	-69.5	168.6	18	0	0	110.9	T73 E76 S79 E125	T73-Q128 PolarHBondContact OG1-OE1 3.43Å; E76-Q128 HydrophobicContact CG-CB 4.1Å; S79-Q128 WeakPolarHBondContact CB-O 3.23Å; S79-Q128 PolarHBondContact OG-O 2.7Å; E125-Q128 PolarHBondContact O-N 3.45Å
129	S	90.5	Very high	82.7	Confident	85 Å²	85	71.8 Å²	71.8	59%	0.594	38%	0.378	S	S	*	.			trans	-104.2	150.2	177.9	64.2	0	0	0	0	109.7	P131	S129-P131 WeakPolarHBondContact O-CD 3.29Å
130	C	91.9	Very high	83	Confident	6 Å²	6	75.1 Å²	75.1	4%	0.041	40%	0.398	C	S	.	.			trans	-57.8	124.4	170.2	-173.8	0	0	0	0	109.4	S79 C80 Q83 L132 A135	S79-C130 PolarHBondContact OG-N 3.03Å; S79-C130 VanDerWaalsContact OG-N 3.13Å; C80-C130 WeakPolarHBondContact CA-SG 3.21Å; C80-C130 HydrophobicContact CB-CB 3.87Å; C80-C130 WeakPolarHBondContact CB-SG 3.38Å; C80-C130 WeakPolarHBondContact SG-CA 3.46Å; C80-C130 WeakPolarHBondContact SG-CB 3.17Å; C80-C130 CovalentContact SG-SG 2.03Å; C80-C130 PolarHBondContact SG-SG 2.89Å; Q83-C130 VanDerWaalsContact NE2-CB 3.3Å; C130-L132 PolarHBondContact O-N 3.05Å; C130-A135 HydrophobicContact CB-CB 4.23Å
131	P	92.8	Very high	83.4	Confident	34 Å²	34	75.2 Å²	75.2	22%	0.221	40%	0.398	C	S	.	.			trans	-52.6	134.1	-180	-30	36.6	0	0	0	111.4	M72 E76 S129 P133 F134 A135	M72-P131 HydrophobicContact CE-CG 4.14Å; M72-P131 HydrophobicContact CG-CG 4.15Å; M72-P131 HydrophobicContact SD-CG 4.35Å; E76-P131 HydrophobicContact CB-CG 4.42Å; E76-P131 HydrophobicContact CG-CG 4.34Å; S129-P131 WeakPolarHBondContact O-CD 3.29Å; P131-P133 VanDerWaalsContact C-CD 3.45Å; P131-F134 PolarHBondContact O-N 2.77Å; P131-A135 PolarHBondContact O-N 2.48Å
132	L	93.2	Very high	84.1	Confident	119 Å²	119	70.4 Å²	70.4	62%	0.623	38%	0.377	S	S	*	.	H	α-helix	trans	-51.3	-44.8	-171.1	-178.8	66.8	0	0	0	113.7	C130 F134 A135 L136	C130-L132 PolarHBondContact O-N 3.05Å; L132-F134 VanDerWaalsContact C-N 3.28Å; L132-F134 PolarHBondContact O-N 3.32Å; L132-A135 PolarHBondContact O-N 3.07Å; L132-L136 HydrophobicContact CD1-CD1 4.29Å; L132-L136 HydrophobicContact CD1-CG 4.14Å; L132-L136 HydrophobicContact CG-CD1 4.11Å; L132-L136 HydrophobicContact CG-CG 4.39Å; L132-L136 VanDerWaalsContact O-CG 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 3.02Å
133	P	92.3	Very high	85.5	Confident	97 Å²	97	73 Å²	73	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-57.2	-42.2	177.5	-25.5	35.8	0	0	0	112.7	P131 L136 A137	P131-P133 VanDerWaalsContact C-CD 3.45Å; P133-L136 PolarHBondContact O-N 3.31Å; P133-A137 PolarHBondContact O-N 2.98Å
134	F	93	Very high	87.3	Confident	4 Å²	4	69 Å²	69	2%	0.018	36%	0.363	C	S	.	.	H	α-helix	trans	-75	-38.7	-179.9	-162.4	-98.8	0	0	0	112.5	P62 W63 N68 I69 M72 C80 P131 L132 L136 A137 I138 F173	P62-F134 HydrophobicContact CB-CE2 4.28Å; P62-F134 HydrophobicContact CB-CZ 4.47Å; P62-F134 WeakPolarHBondContact O-CE2 3.4Å; W63-F134 HydrophobicContact CB-CZ 3.96Å; W63-F134 HydrophobicContact CE3-CZ 4.35Å; N68-F134 HydrophobicContact CB-CD2 4.15Å; I69-F134 HydrophobicContact CD1-CE1 4.32Å; I69-F134 HydrophobicContact CD1-CE2 3.81Å; I69-F134 HydrophobicContact CD1-CZ 3.5Å; I69-F134 VanDerWaalsContact CD1-CZ 3.5Å; I69-F134 HydrophobicContact CG1-CD2 4.24Å; I69-F134 HydrophobicContact CG1-CE1 4.32Å; I69-F134 HydrophobicContact CG1-CE2 3.54Å; I69-F134 HydrophobicContact CG1-CZ 3.63Å; M72-F134 HydrophobicContact CE-CB 3.39Å; M72-F134 HydrophobicContact CE-CD1 3.96Å; M72-F134 HydrophobicContact CE-CD2 3.73Å; M72-F134 HydrophobicContact CE-CG 3.4Å; M72-F134 VanDerWaalsContact CE-CG 3.4Å; M72-F134 HydrophobicContact SD-CD1 4.47Å; M72-F134 HydrophobicContact SD-CG 4.45Å; C80-F134 HydrophobicContact CB-CD1 3.84Å; C80-F134 HydrophobicContact CB-CE1 3.95Å; C80-F134 VanDerWaalsContact SG-CD1 3.51Å; P131-F134 PolarHBondContact O-N 2.77Å; L132-F134 VanDerWaalsContact C-N 3.28Å; L132-F134 PolarHBondContact O-N 3.32Å; F134-L136 VanDerWaalsContact C-N 3.27Å; F134-L136 PolarHBondContact O-N 3.07Å; F134-A137 WeakPolarHBondContact O-CB 3.04Å; F134-A137 PolarHBondContact O-N 3.35Å; F134-A137 VanDerWaalsContact O-N 3.12Å; F134-I138 HydrophobicContact CD1-CD1 3.62Å; F134-I138 HydrophobicContact CD1-CG1 4.03Å; F134-I138 HydrophobicContact CE1-CD1 3.57Å; F134-I138 HydrophobicContact CE1-CG1 3.78Å; F134-I138 HydrophobicContact CZ-CG1 4.47Å; F134-I138 WeakPolarHBondContact O-CG1 3.12Å; F134-I138 PolarHBondContact O-N 3.35Å; F134-F173 HydrophobicContact CE1-CE2 4.34Å; F134-F173 HydrophobicContact CE1-CZ 4.11Å
135	A	93.9	Very high	89.5	Confident	6 Å²	6	57.9 Å²	57.9	5%	0.05	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-39.2	173.1	0	0	0	0	0	111.9	C130 P131 L132 R139	C130-A135 HydrophobicContact CB-CB 4.23Å; P131-A135 PolarHBondContact O-N 2.48Å; L132-A135 PolarHBondContact O-N 3.07Å; A135-R139 WeakPolarHBondContact O-CG 3.5Å; A135-R139 PolarHBondContact O-N 3.04Å
136	L	95	Very high	91.5	Very high	84 Å²	84	59 Å²	59	44%	0.44	33%	0.326	S	S	.	.	H	α-helix	trans	-67.8	-38.8	174	-69.5	174.4	0	0	0	112.1	L132 P133 F134 R139 T140	L132-L136 HydrophobicContact CD1-CD1 4.29Å; L132-L136 HydrophobicContact CD1-CG 4.14Å; L132-L136 HydrophobicContact CG-CD1 4.11Å; L132-L136 HydrophobicContact CG-CG 4.39Å; L132-L136 VanDerWaalsContact O-CG 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 3.02Å; P133-L136 PolarHBondContact O-N 3.31Å; F134-L136 VanDerWaalsContact C-N 3.27Å; F134-L136 PolarHBondContact O-N 3.07Å; L136-R139 PolarHBondContact O-N 3.06Å; L136-T140 WeakPolarHBondContact O-CB 3.45Å; L136-T140 PolarHBondContact O-N 3.01Å; L136-T140 PolarHBondContact O-OG1 2.93Å
137	A	95	Very high	93.4	Very high	32 Å²	32	59.1 Å²	59.1	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-46.6	174.8	0	0	0	0	0	111.7	P62 P133 F134 R139 T140 Y141	P62-A137 HydrophobicContact CB-CB 3.69Å; P62-A137 HydrophobicContact CG-CB 4.35Å; P133-A137 PolarHBondContact O-N 2.98Å; F134-A137 WeakPolarHBondContact O-CB 3.04Å; F134-A137 PolarHBondContact O-N 3.35Å; F134-A137 VanDerWaalsContact O-N 3.12Å; A137-R139 PolarHBondContact O-N 3.16Å; A137-T140 PolarHBondContact O-N 3.4Å; A137-Y141 WeakPolarHBondContact O-CB 3.21Å; A137-Y141 PolarHBondContact O-N 3.23Å
138	I	95.5	Very high	94.9	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-55.1	-51.2	172.9	-67.1	164.3	0	0	0	110.4	W63 C80 Q87 F134 T140 Y141 F142	W63-I138 HydrophobicContact CE3-CG1 4.37Å; W63-I138 HydrophobicContact CZ3-CG1 4.09Å; C80-I138 HydrophobicContact CB-CD1 3.96Å; C80-I138 WeakPolarHBondContact O-CD1 3.47Å; Q87-I138 HydrophobicContact CG-CG2 4.41Å; F134-I138 HydrophobicContact CD1-CD1 3.62Å; F134-I138 HydrophobicContact CD1-CG1 4.03Å; F134-I138 HydrophobicContact CE1-CD1 3.57Å; F134-I138 HydrophobicContact CE1-CG1 3.78Å; F134-I138 HydrophobicContact CZ-CG1 4.47Å; F134-I138 WeakPolarHBondContact O-CG1 3.12Å; F134-I138 PolarHBondContact O-N 3.35Å; I138-T140 VanDerWaalsContact C-N 3.26Å; I138-T140 PolarHBondContact O-N 2.99Å; I138-Y141 WeakPolarHBondContact O-CB 3.32Å; I138-Y141 PolarHBondContact O-N 3.42Å; I138-F142 HydrophobicContact CG2-CD2 3.84Å; I138-F142 HydrophobicContact CG2-CE2 3.94Å; I138-F142 WeakPolarHBondContact O-CD2 3.47Å; I138-F142 PolarHBondContact O-N 3.03Å; I138-F142 VanDerWaalsContact O-N 3.07Å
139	R	96.7	Very high	95.7	Very high	128 Å²	128	52.2 Å²	52.2	48%	0.483	27%	0.266	S	S	.	.	H	α-helix	trans	-59.7	-37.8	179.5	-74.5	174.6	179.3	177.2	-0.1	112.4	A135 L136 A137 R143	A135-R139 WeakPolarHBondContact O-CG 3.5Å; A135-R139 PolarHBondContact O-N 3.04Å; L136-R139 PolarHBondContact O-N 3.06Å; A137-R139 PolarHBondContact O-N 3.16Å; R139-R143 VanDerWaalsContact O-CB 3.23Å; R139-R143 WeakPolarHBondContact O-CB 3.43Å; R139-R143 PolarHBondContact O-N 2.97Å
140	T	96.8	Very high	96.1	Very high	80 Å²	80	56.1 Å²	56.1	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-68	-43.3	-180	-60.3	0	0	0	0	111.3	L136 A137 I138 R143 G144	L136-T140 WeakPolarHBondContact O-CB 3.45Å; L136-T140 PolarHBondContact O-N 3.01Å; L136-T140 PolarHBondContact O-OG1 2.93Å; A137-T140 PolarHBondContact O-N 3.4Å; I138-T140 VanDerWaalsContact C-N 3.26Å; I138-T140 PolarHBondContact O-N 2.99Å; T140-R143 PolarHBondContact O-N 2.9Å; T140-G144 PolarHBondContact O-N 3.12Å
141	Y	97.3	Very high	96.4	Very high	10 Å²	10	60 Å²	60	4%	0.039	30%	0.304	C	S	.	.	H	α-helix	trans	-57	-53.8	173.9	169.4	-105.9	0	0	0	111.8	F59 P60 C61 P62 W63 A137 I138 R143 G144 F145 D169	F59-Y141 HydrophobicContact CB-CD2 4.24Å; F59-Y141 HydrophobicContact CB-CE2 3.81Å; P60-Y141 WeakPolarHBondContact O-CD2 3.43Å; C61-Y141 HydrophobicContact CB-CE2 4.38Å; P62-Y141 HydrophobicContact CG-CG 4.43Å; W63-Y141 AromaticContact CH2-CD1 3.76Å; W63-Y141 HydrophobicContact CH2-CD1 3.76Å; W63-Y141 AromaticContact CH2-CE1 3.52Å; W63-Y141 HydrophobicContact CH2-CE1 3.52Å; W63-Y141 HydrophobicContact CZ2-CE1 4.08Å; W63-Y141 HydrophobicContact CZ3-CD1 4.14Å; W63-Y141 HydrophobicContact CZ3-CE1 4.33Å; A137-Y141 WeakPolarHBondContact O-CB 3.21Å; A137-Y141 PolarHBondContact O-N 3.23Å; I138-Y141 WeakPolarHBondContact O-CB 3.32Å; I138-Y141 PolarHBondContact O-N 3.42Å; Y141-R143 PolarHBondContact O-N 3.17Å; Y141-G144 WeakPolarHBondContact O-CA 3.33Å; Y141-G144 PolarHBondContact O-N 2.62Å; Y141-F145 HydrophobicContact CD1-CE2 4.27Å; Y141-F145 HydrophobicContact CE1-CD2 4.48Å; Y141-F145 AromaticContact CE1-CE2 3.52Å; Y141-F145 HydrophobicContact CE1-CE2 3.52Å; Y141-F145 AromaticContact CE1-CZ 3.93Å; Y141-F145 HydrophobicContact CE1-CZ 3.93Å; Y141-F145 HydrophobicContact CE2-CE2 4.23Å; Y141-F145 AromaticContact CE2-CZ 3.86Å; Y141-F145 HydrophobicContact CE2-CZ 3.86Å; Y141-F145 AromaticContact CZ-CE2 3.49Å; Y141-F145 VanDerWaalsContact CZ-CE2 3.49Å; Y141-F145 AromaticContact CZ-CZ 3.36Å; Y141-F145 PolarHBondContact O-N 3.3Å; Y141-F145 WeakPolarHBondContact OH-CE2 3.4Å; Y141-F145 WeakPolarHBondContact OH-CZ 3.34Å; Y141-D169 PolarHBondContact OH-OD2 2.53Å
142	F	98.3	Very high	96.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-34	178.2	-79.1	-83.3	0	0	0	113.4	W63 S84 Q87 V88 I138 G144 F145 F146 L166	W63-F142 HydrophobicContact CH2-CE2 4.13Å; S84-F142 WeakPolarHBondContact O-CZ 3.43Å; Q87-F142 HydrophobicContact CB-CB 4.03Å; Q87-F142 HydrophobicContact CB-CD1 3.44Å; Q87-F142 VanDerWaalsContact CB-CD1 3.44Å; Q87-F142 HydrophobicContact CB-CD2 3.37Å; Q87-F142 HydrophobicContact CB-CE1 3.61Å; Q87-F142 HydrophobicContact CB-CE2 3.56Å; Q87-F142 HydrophobicContact CB-CG 3.32Å; Q87-F142 HydrophobicContact CB-CZ 3.68Å; Q87-F142 HydrophobicContact CG-CB 4.24Å; Q87-F142 HydrophobicContact CG-CD1 4.46Å; Q87-F142 HydrophobicContact CG-CD2 3.65Å; Q87-F142 HydrophobicContact CG-CE2 4.09Å; Q87-F142 HydrophobicContact CG-CG 3.88Å; V88-F142 HydrophobicContact CG2-CE1 3.7Å; V88-F142 HydrophobicContact CG2-CZ 3.66Å; I138-F142 HydrophobicContact CG2-CD2 3.84Å; I138-F142 HydrophobicContact CG2-CE2 3.94Å; I138-F142 WeakPolarHBondContact O-CD2 3.47Å; I138-F142 PolarHBondContact O-N 3.03Å; I138-F142 VanDerWaalsContact O-N 3.07Å; F142-G144 PolarHBondContact O-N 3.01Å; F142-F145 AromaticContact CD1-CD2 3.79Å; F142-F145 HydrophobicContact CD1-CD2 3.79Å; F142-F145 HydrophobicContact CD1-CE2 4.16Å; F142-F145 HydrophobicContact CE1-CD2 4.26Å; F142-F145 HydrophobicContact CE1-CE2 4.22Å; F142-F145 HydrophobicContact CG-CD2 4.45Å; F142-F145 WeakPolarHBondContact O-CB 3.43Å; F142-F145 PolarHBondContact O-N 3.37Å; F142-F145 VanDerWaalsContact O-N 3.08Å; F142-F146 VanDerWaalsContact O-CD2 3.28Å; F142-F146 WeakPolarHBondContact O-CD2 3.46Å; F142-F146 PolarHBondContact O-N 3.34Å; F142-L166 HydrophobicContact CE1-CD2 4.01Å; F142-L166 HydrophobicContact CZ-CD2 4.2Å
143	R	98	Very high	96.8	Very high	161 Å²	161	60.2 Å²	60.2	61%	0.608	31%	0.313	S	S	*	.	H	α-helix	trans	-61.3	-27.5	170.5	-172.9	-177.8	-69.5	179.1	-3.6	111.9	R139 T140 Y141 R147	R139-R143 VanDerWaalsContact O-CB 3.23Å; R139-R143 WeakPolarHBondContact O-CB 3.43Å; R139-R143 PolarHBondContact O-N 2.97Å; T140-R143 PolarHBondContact O-N 2.9Å; Y141-R143 PolarHBondContact O-N 3.17Å; R143-R147 WeakPolarHBondContact O-CB 3.4Å; R143-R147 WeakPolarHBondContact O-CG 3.46Å; R143-R147 PolarHBondContact O-N 3.38Å; R143-R147 VanDerWaalsContact O-N 3.14Å; R143-R147 PolarHBondContact O-NE 2.91Å; R143-R147 VanDerWaalsContact O-NE 3.07Å
144	G	98.3	Very high	97	Very high	13 Å²	13	59.1 Å²	59.1	13%	0.134	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-50.2	169.9	0	0	0	0	0	111.7	T140 Y141 F142 R147 Y148	T140-G144 PolarHBondContact O-N 3.12Å; Y141-G144 WeakPolarHBondContact O-CA 3.33Å; Y141-G144 PolarHBondContact O-N 2.62Å; F142-G144 PolarHBondContact O-N 3.01Å; G144-R147 PolarHBondContact O-N 3.07Å; G144-Y148 WeakPolarHBondContact O-CB 3.3Å; G144-Y148 PolarHBondContact O-N 2.9Å
145	F	98.4	Very high	97.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.5	-50	177.2	-63.7	-38.7	0	0	0	113.2	F59 L91 Y141 F142 R147 Y148 L149 V162 Q165 L166	F59-F145 HydrophobicContact CB-CE1 4.11Å; F59-F145 AromaticContact CD1-CD1 3.78Å; F59-F145 HydrophobicContact CD1-CD1 3.78Å; F59-F145 AromaticContact CD1-CE1 3.86Å; F59-F145 HydrophobicContact CD1-CE1 3.86Å; F59-F145 AromaticContact CD2-CD1 3.93Å; F59-F145 HydrophobicContact CD2-CD1 3.93Å; F59-F145 AromaticContact CD2-CE1 3.4Å; F59-F145 HydrophobicContact CD2-CE1 3.4Å; F59-F145 VanDerWaalsContact CD2-CE1 3.4Å; F59-F145 HydrophobicContact CD2-CZ 4.49Å; F59-F145 AromaticContact CE1-CD1 3.58Å; F59-F145 HydrophobicContact CE1-CD1 3.58Å; F59-F145 HydrophobicContact CE1-CE1 4.05Å; F59-F145 AromaticContact CE2-CD1 3.66Å; F59-F145 HydrophobicContact CE2-CD1 3.66Å; F59-F145 AromaticContact CE2-CE1 3.54Å; F59-F145 HydrophobicContact CE2-CE1 3.54Å; F59-F145 AromaticContact CG-CD1 3.95Å; F59-F145 HydrophobicContact CG-CD1 3.95Å; F59-F145 AromaticContact CG-CE1 3.53Å; F59-F145 HydrophobicContact CG-CE1 3.53Å; F59-F145 HydrophobicContact CG-CZ 4.47Å; F59-F145 AromaticContact CZ-CD1 3.5Å; F59-F145 HydrophobicContact CZ-CD1 3.5Å; F59-F145 AromaticContact CZ-CE1 3.88Å; F59-F145 HydrophobicContact CZ-CE1 3.88Å; L91-F145 HydrophobicContact CD1-CB 4.39Å; L91-F145 HydrophobicContact CD2-CB 4.35Å; L91-F145 HydrophobicContact CD2-CD2 4.11Å; Y141-F145 HydrophobicContact CD1-CE2 4.27Å; Y141-F145 HydrophobicContact CE1-CD2 4.48Å; Y141-F145 AromaticContact CE1-CE2 3.52Å; Y141-F145 HydrophobicContact CE1-CE2 3.52Å; Y141-F145 AromaticContact CE1-CZ 3.93Å; Y141-F145 HydrophobicContact CE1-CZ 3.93Å; Y141-F145 HydrophobicContact CE2-CE2 4.23Å; Y141-F145 AromaticContact CE2-CZ 3.86Å; Y141-F145 HydrophobicContact CE2-CZ 3.86Å; Y141-F145 AromaticContact CZ-CE2 3.49Å; Y141-F145 VanDerWaalsContact CZ-CE2 3.49Å; Y141-F145 AromaticContact CZ-CZ 3.36Å; Y141-F145 PolarHBondContact O-N 3.3Å; Y141-F145 WeakPolarHBondContact OH-CE2 3.4Å; Y141-F145 WeakPolarHBondContact OH-CZ 3.34Å; F142-F145 AromaticContact CD1-CD2 3.79Å; F142-F145 HydrophobicContact CD1-CD2 3.79Å; F142-F145 HydrophobicContact CD1-CE2 4.16Å; F142-F145 HydrophobicContact CE1-CD2 4.26Å; F142-F145 HydrophobicContact CE1-CE2 4.22Å; F142-F145 HydrophobicContact CG-CD2 4.45Å; F142-F145 WeakPolarHBondContact O-CB 3.43Å; F142-F145 PolarHBondContact O-N 3.37Å; F142-F145 VanDerWaalsContact O-N 3.08Å; F145-R147 VanDerWaalsContact C-N 3.31Å; F145-R147 PolarHBondContact O-N 2.95Å; F145-Y148 PolarHBondContact O-N 3.32Å; F145-L149 WeakPolarHBondContact O-CB 3.39Å; F145-L149 WeakPolarHBondContact O-CG 3.41Å; F145-L149 PolarHBondContact O-N 3.49Å; F145-V162 HydrophobicContact CB-CG1 4.38Å; F145-V162 HydrophobicContact CB-CG2 4.36Å; F145-V162 HydrophobicContact CD1-CB 4.44Å; F145-V162 HydrophobicContact CD1-CG1 4.11Å; F145-V162 HydrophobicContact CD1-CG2 3.84Å; F145-V162 HydrophobicContact CD2-CG1 4.42Å; F145-V162 HydrophobicContact CE1-CG1 4.4Å; F145-V162 HydrophobicContact CE1-CG2 4.43Å; F145-V162 HydrophobicContact CG-CG1 4.09Å; F145-V162 HydrophobicContact CG-CG2 4.34Å; F145-Q165 HydrophobicContact CE1-CB 4.03Å; F145-Q165 HydrophobicContact CE1-CG 3.82Å; F145-Q165 HydrophobicContact CZ-CB 4.04Å; F145-Q165 HydrophobicContact CZ-CG 3.68Å; F145-L166 HydrophobicContact CE2-CD1 4.29Å; F145-L166 HydrophobicContact CE2-CD2 3.7Å; F145-L166 HydrophobicContact CE2-CG 3.88Å; F145-L166 HydrophobicContact CZ-CD2 4.18Å; F145-L166 HydrophobicContact CZ-CG 4.07Å
146	F	98	Very high	97.2	Very high	65 Å²	65	63 Å²	63	29%	0.285	33%	0.329	S	S	.	.	H	α-helix	trans	-59.4	-42.2	179	-75.3	-73.1	0	0	0	112.4	L91 F142 K150	L91-F146 HydrophobicContact CB-CZ 4.11Å; L91-F146 HydrophobicContact CD1-CD1 4.06Å; L91-F146 HydrophobicContact CD1-CE1 3.75Å; L91-F146 HydrophobicContact CD1-CE2 4.26Å; L91-F146 HydrophobicContact CD1-CG 4.45Å; L91-F146 HydrophobicContact CD1-CZ 3.86Å; F142-F146 VanDerWaalsContact O-CD2 3.28Å; F142-F146 WeakPolarHBondContact O-CD2 3.46Å; F142-F146 PolarHBondContact O-N 3.34Å; F146-K150 WeakPolarHBondContact O-CB 3.39Å; F146-K150 PolarHBondContact O-N 3.46Å; F146-K150 VanDerWaalsContact O-N 3.09Å
147	R	98.1	Very high	97.3	Very high	149 Å²	149	60.2 Å²	60.2	56%	0.562	32%	0.316	S	S	*	.	H	α-helix	trans	-64.7	-44.3	176.6	-77.8	-179.5	-73.9	159.6	-7.3	112	R143 G144 F145 K150 A151	R143-R147 WeakPolarHBondContact O-CB 3.4Å; R143-R147 WeakPolarHBondContact O-CG 3.46Å; R143-R147 PolarHBondContact O-N 3.38Å; R143-R147 VanDerWaalsContact O-N 3.14Å; R143-R147 PolarHBondContact O-NE 2.91Å; R143-R147 VanDerWaalsContact O-NE 3.07Å; G144-R147 PolarHBondContact O-N 3.07Å; F145-R147 VanDerWaalsContact C-N 3.31Å; F145-R147 PolarHBondContact O-N 2.95Å; R147-K150 PolarHBondContact O-N 3.44Å; R147-A151 WeakPolarHBondContact O-CB 3.38Å; R147-A151 PolarHBondContact O-N 3.04Å
148	Y	98.5	Very high	97.4	Very high	23 Å²	23	58.7 Å²	58.7	9%	0.09	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-49.4	179.3	169.6	-99.5	0	0	0	112	D55 T57 F59 G144 F145 K150 A151 K152 S158 I161 V162	D55-Y148 WeakPolarHBondContact O-CE2 3.35Å; D55-Y148 PolarHBondContact O-OH 2.94Å; T57-Y148 HydrophobicContact CG2-CD2 3.52Å; T57-Y148 HydrophobicContact CG2-CE1 4.43Å; T57-Y148 HydrophobicContact CG2-CE2 3.39Å; T57-Y148 HydrophobicContact CG2-CG 4.09Å; F59-Y148 HydrophobicContact CE1-CG 4.37Å; F59-Y148 AromaticContact CZ-CD1 3.83Å; F59-Y148 HydrophobicContact CZ-CD1 3.83Å; F59-Y148 HydrophobicContact CZ-CD2 4.24Å; F59-Y148 HydrophobicContact CZ-CE1 4.49Å; F59-Y148 AromaticContact CZ-CG 3.68Å; F59-Y148 HydrophobicContact CZ-CG 3.68Å; G144-Y148 WeakPolarHBondContact O-CB 3.3Å; G144-Y148 PolarHBondContact O-N 2.9Å; F145-Y148 PolarHBondContact O-N 3.32Å; Y148-K150 VanDerWaalsContact C-N 3.32Å; Y148-K150 PolarHBondContact O-N 3.46Å; Y148-A151 PolarHBondContact O-N 3.07Å; Y148-K152 HydrophobicContact CD2-CG 4.2Å; Y148-K152 HydrophobicContact CE1-CG 4.44Å; Y148-K152 HydrophobicContact CE2-CG 3.83Å; Y148-K152 WeakPolarHBondContact O-CB 3.48Å; Y148-K152 WeakPolarHBondContact O-CG 3.48Å; Y148-K152 PolarHBondContact O-N 2.79Å; Y148-S158 WeakPolarHBondContact CE1-O 3.5Å; Y148-I161 HydrophobicContact CE1-CB 4.14Å; Y148-I161 HydrophobicContact CE1-CG2 4.01Å; Y148-I161 WeakPolarHBondContact OH-CB 3.38Å; Y148-I161 WeakPolarHBondContact OH-CG1 2.84Å; Y148-V162 HydrophobicContact CD1-CG2 3.89Å; Y148-V162 HydrophobicContact CE1-CG2 4.14Å
149	L	98.3	Very high	97.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-44.6	177.4	-73.1	169.9	0	0	0	111.3	L91 F145 K152 A153 H154 W159 V162	L91-L149 HydrophobicContact CD1-CD1 3.66Å; F145-L149 WeakPolarHBondContact O-CB 3.39Å; F145-L149 WeakPolarHBondContact O-CG 3.41Å; F145-L149 PolarHBondContact O-N 3.49Å; L149-K152 CarbonylContact O-C 3.49Å; L149-K152 PolarHBondContact O-N 2.87Å; L149-A153 PolarHBondContact O-N 3.31Å; L149-A153 VanDerWaalsContact O-N 3.13Å; L149-H154 PolarHBondContact O-N 2.93Å; L149-W159 HydrophobicContact CD1-CE3 4.19Å; L149-W159 HydrophobicContact CD1-CH2 3.68Å; L149-W159 HydrophobicContact CD1-CZ2 4.06Å; L149-W159 HydrophobicContact CD1-CZ3 3.76Å; L149-W159 HydrophobicContact CD2-CD2 3.76Å; L149-W159 HydrophobicContact CD2-CE3 3.98Å; L149-W159 HydrophobicContact CD2-CG 4.1Å; L149-W159 HydrophobicContact CD2-CZ2 4.39Å; L149-W159 HydrophobicContact CD2-CZ3 4.39Å; L149-V162 HydrophobicContact CD1-CG2 4.33Å; L149-V162 HydrophobicContact CD2-CG2 3.95Å; L149-V162 HydrophobicContact CG-CG2 3.99Å
150	K	98.1	Very high	97.6	Very high	167 Å²	167	52.9 Å²	52.9	73%	0.726	28%	0.282	S	S	*	.	H	α-helix	trans	-61.5	-45.6	175.8	-173.9	176	-177.7	176.8	0	112	F146 R147 Y148 K152 A153	F146-K150 WeakPolarHBondContact O-CB 3.39Å; F146-K150 PolarHBondContact O-N 3.46Å; F146-K150 VanDerWaalsContact O-N 3.09Å; R147-K150 PolarHBondContact O-N 3.44Å; Y148-K150 VanDerWaalsContact C-N 3.32Å; Y148-K150 PolarHBondContact O-N 3.46Å; K150-K152 PolarHBondContact O-N 3.32Å; K150-A153 PolarHBondContact O-N 3.38Å; K150-A153 VanDerWaalsContact O-N 3.14Å
151	A	97.9	Very high	97.6	Very high	87 Å²	87	50.1 Å²	50.1	72%	0.719	26%	0.264	S	S	*	.	H	α-helix	trans	-64.3	-29.6	179.1	0	0	0	0	0	112.9	R147 Y148 A153	R147-A151 WeakPolarHBondContact O-CB 3.38Å; R147-A151 PolarHBondContact O-N 3.04Å; Y148-A151 PolarHBondContact O-N 3.07Å; A151-A153 VanDerWaalsContact C-N 3.35Å
152	K	97.5	Very high	97.6	Very high	73 Å²	73	49.7 Å²	49.7	32%	0.317	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	11.6	176.8	-65.3	-69	-174.6	169.6	0	113.6	D55 Y148 L149 K150 H154 S155 S158	D55-K152 IonicContact OD1-NZ 2.69Å; D55-K152 PolarHBondContact OD1-NZ 3.45Å; Y148-K152 HydrophobicContact CD2-CG 4.2Å; Y148-K152 HydrophobicContact CE1-CG 4.44Å; Y148-K152 HydrophobicContact CE2-CG 3.83Å; Y148-K152 WeakPolarHBondContact O-CB 3.48Å; Y148-K152 WeakPolarHBondContact O-CG 3.48Å; Y148-K152 PolarHBondContact O-N 2.79Å; L149-K152 CarbonylContact O-C 3.49Å; L149-K152 PolarHBondContact O-N 2.87Å; K150-K152 PolarHBondContact O-N 3.32Å; K152-H154 PolarHBondContact O-N 3.17Å; K152-H154 VanDerWaalsContact O-N 3.13Å; K152-S155 WeakPolarHBondContact O-CB 3.4Å; K152-S155 PolarHBondContact O-N 3.01Å; K152-S155 VanDerWaalsContact O-N 3.08Å; K152-S158 VanDerWaalsContact CB-CB 3.43Å
153	A	97.4	Very high	97.5	Very high	85 Å²	85	50.1 Å²	50.1	70%	0.702	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	36.8	-178.4	0	0	0	0	0	113.4	L149 K150 A151 S155	L149-A153 PolarHBondContact O-N 3.31Å; L149-A153 VanDerWaalsContact O-N 3.13Å; K150-A153 PolarHBondContact O-N 3.38Å; K150-A153 VanDerWaalsContact O-N 3.14Å; A151-A153 VanDerWaalsContact C-N 3.35Å; A153-S155 PolarHBondContact O-N 3.06Å
154	H	97.1	Very high	97.4	Very high	74 Å²	74	45.2 Å²	45.2	34%	0.343	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	35.1	-178.8	-63.3	-90.6	0	0	0	113.9	A96 L149 K152 W159	A96-H154 HydrophobicContact CB-CB 4.35Å; A96-H154 WeakPolarHBondContact CB-ND1 3.43Å; L149-H154 PolarHBondContact O-N 2.93Å; K152-H154 PolarHBondContact O-N 3.17Å; K152-H154 VanDerWaalsContact O-N 3.13Å; H154-W159 AromaticContact ND1-CE2 3.86Å; H154-W159 AromaticContact ND1-CZ2 3.6Å; H154-W159 AromaticContact ND1-NE1 3.79Å
155	S	96	Very high	97.3	Very high	41 Å²	41	46.3 Å²	46.3	29%	0.287	25%	0.253	S	S	.	.			trans	-56.8	154.6	175.4	76.6	0	0	0	0	112.1	K152 A153 C157 S158 W159	K152-S155 WeakPolarHBondContact O-CB 3.4Å; K152-S155 PolarHBondContact O-N 3.01Å; K152-S155 VanDerWaalsContact O-N 3.08Å; A153-S155 PolarHBondContact O-N 3.06Å; S155-C157 PolarHBondContact O-N 3Å; S155-S158 PolarHBondContact N-OG 3.05Å; S155-S158 VanDerWaalsContact N-OG 3.09Å; S155-S158 PolarHBondContact O-N 2.99Å; S155-S158 PolarHBondContact O-OG 2.63Å; S155-S158 WeakPolarHBondContact OG-CB 3.49Å; S155-S158 PolarHBondContact OG-N 2.88Å; S155-S158 PolarHBondContact OG-OG 3.37Å; S155-W159 PolarHBondContact O-N 2.84Å; S155-W159 VanDerWaalsContact O-N 3.14Å
156	A	95.9	Very high	97.3	Very high	51 Å²	51	46.3 Å²	46.3	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-53.9	-39.5	175.9	0	0	0	0	0	112.3	V47 W159 E160	V47-A156 HydrophobicContact CG1-CB 3.89Å; A156-W159 PolarHBondContact O-N 3.41Å; A156-E160 PolarHBondContact O-N 3.41Å
157	C	97.1	Very high	97.1	Very high	24 Å²	24	46.6 Å²	46.6	16%	0.162	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-35.4	176.5	-85.5	0	0	0	0	113.8	C52 D55 S155 W159 E160 I161	C52-C157 WeakPolarHBondContact CA-SG 3.43Å; C52-C157 HydrophobicContact CB-CB 3.56Å; C52-C157 WeakPolarHBondContact CB-SG 3.36Å; C52-C157 WeakPolarHBondContact SG-CA 3.41Å; C52-C157 WeakPolarHBondContact SG-CB 3.44Å; C52-C157 CovalentContact SG-SG 2.06Å; C52-C157 PolarHBondContact SG-SG 3.33Å; D55-C157 HydrophobicContact CB-CB 4.21Å; D55-C157 WeakPolarHBondContact OD2-CB 3.29Å; S155-C157 PolarHBondContact O-N 3Å; C157-W159 VanDerWaalsContact C-N 3.31Å; C157-W159 PolarHBondContact O-N 3.28Å; C157-E160 PolarHBondContact O-N 2.86Å; C157-I161 VanDerWaalsContact O-CG1 3.29Å; C157-I161 WeakPolarHBondContact O-CG1 3.49Å; C157-I161 PolarHBondContact O-N 3.12Å
158	S	97.2	Very high	97	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.7	-39.6	175.5	73	0	0	0	0	112.1	Y148 K152 S155 I161 V162	Y148-S158 WeakPolarHBondContact CE1-O 3.5Å; K152-S158 VanDerWaalsContact CB-CB 3.43Å; S155-S158 PolarHBondContact N-OG 3.05Å; S155-S158 VanDerWaalsContact N-OG 3.09Å; S155-S158 PolarHBondContact O-N 2.99Å; S155-S158 PolarHBondContact O-OG 2.63Å; S155-S158 WeakPolarHBondContact OG-CB 3.49Å; S155-S158 PolarHBondContact OG-N 2.88Å; S155-S158 PolarHBondContact OG-OG 3.37Å; S158-I161 PolarHBondContact O-N 2.87Å; S158-V162 WeakPolarHBondContact O-CG2 2.97Å; S158-V162 PolarHBondContact O-N 3.32Å; S158-V162 VanDerWaalsContact O-N 3.15Å
159	W	97.6	Very high	96.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-41.8	174.6	-83.5	117.7	0	0	0	112.6	L91 A96 A100 W101 L149 H154 S155 A156 C157 I161 V162 R163	L91-W159 HydrophobicContact CD1-CH2 4.48Å; L91-W159 HydrophobicContact CD1-CZ3 4.48Å; L91-W159 HydrophobicContact CG-CZ3 4.36Å; A96-W159 HydrophobicContact CB-CZ2 4.11Å; A96-W159 PolarHBondContact O-NE1 3.48Å; A100-W159 HydrophobicContact CB-CB 4.35Å; A100-W159 HydrophobicContact CB-CD2 4.09Å; A100-W159 HydrophobicContact CB-CG 3.7Å; W101-W159 HydrophobicContact CH2-CB 3.84Å; W101-W159 HydrophobicContact CZ2-CB 3.58Å; W101-W159 HydrophobicContact CZ2-CD2 4.34Å; W101-W159 HydrophobicContact CZ2-CE3 4.09Å; W101-W159 HydrophobicContact CZ2-CG 4.19Å; W101-W159 AromaticContact NE1-CE3 3.98Å; L149-W159 HydrophobicContact CD1-CE3 4.19Å; L149-W159 HydrophobicContact CD1-CH2 3.68Å; L149-W159 HydrophobicContact CD1-CZ2 4.06Å; L149-W159 HydrophobicContact CD1-CZ3 3.76Å; L149-W159 HydrophobicContact CD2-CD2 3.76Å; L149-W159 HydrophobicContact CD2-CE3 3.98Å; L149-W159 HydrophobicContact CD2-CG 4.1Å; L149-W159 HydrophobicContact CD2-CZ2 4.39Å; L149-W159 HydrophobicContact CD2-CZ3 4.39Å; H154-W159 AromaticContact ND1-CE2 3.86Å; H154-W159 AromaticContact ND1-CZ2 3.6Å; H154-W159 AromaticContact ND1-NE1 3.79Å; S155-W159 PolarHBondContact O-N 2.84Å; S155-W159 VanDerWaalsContact O-N 3.14Å; A156-W159 PolarHBondContact O-N 3.41Å; C157-W159 VanDerWaalsContact C-N 3.31Å; C157-W159 PolarHBondContact O-N 3.28Å; W159-I161 VanDerWaalsContact C-N 3.35Å; W159-I161 PolarHBondContact O-N 3.49Å; W159-V162 PolarHBondContact O-N 2.81Å; W159-R163 VanDerWaalsContact O-CB 3.3Å; W159-R163 WeakPolarHBondContact O-CB 3.39Å; W159-R163 PolarHBondContact O-N 2.84Å
160	E	96.8	Very high	96.7	Very high	5 Å²	5	42.6 Å²	42.6	2%	0.023	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-40.6	175.5	-177.6	63.1	-171.1	0	0	112	V47 A156 C157 R163 V164	V47-E160 HydrophobicContact CG2-CB 3.71Å; V47-E160 HydrophobicContact CG2-CG 3.94Å; A156-E160 PolarHBondContact O-N 3.41Å; C157-E160 PolarHBondContact O-N 2.86Å; E160-R163 PolarHBondContact O-N 3.39Å; E160-R163 IonicContact OE1-CZ 3.96Å; E160-R163 IonicContact OE1-NE 3.72Å; E160-R163 IonicContact OE1-NH2 3.01Å; E160-R163 PolarHBondContact OE1-NH2 3.29Å; E160-R163 IonicContact OE2-CZ 3.61Å; E160-R163 IonicContact OE2-NE 3.66Å; E160-R163 PolarHBondContact OE2-NE 3.15Å; E160-R163 IonicContact OE2-NH2 2.72Å; E160-R163 PolarHBondContact OE2-NH2 2.98Å; E160-V164 HydrophobicContact CG-CG2 4.45Å; E160-V164 WeakPolarHBondContact O-CB 3.35Å; E160-V164 VanDerWaalsContact O-CG2 3.26Å; E160-V164 WeakPolarHBondContact O-CG2 3.37Å; E160-V164 PolarHBondContact O-N 3.32Å
161	I	97	Very high	96.4	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-47.4	175.8	-70.2	-63.1	0	0	0	111.4	C52 D55 R56 T57 F59 Y148 C157 S158 W159 V164 Q165	C52-I161 HydrophobicContact CB-CD1 4.32Å; C52-I161 HydrophobicContact CB-CG1 4.4Å; D55-I161 HydrophobicContact CB-CG1 4.35Å; R56-I161 HydrophobicContact CG-CD1 3.87Å; T57-I161 HydrophobicContact CG2-CG2 4.05Å; F59-I161 HydrophobicContact CE2-CG2 4.06Å; Y148-I161 HydrophobicContact CE1-CB 4.14Å; Y148-I161 HydrophobicContact CE1-CG2 4.01Å; Y148-I161 WeakPolarHBondContact OH-CB 3.38Å; Y148-I161 WeakPolarHBondContact OH-CG1 2.84Å; C157-I161 VanDerWaalsContact O-CG1 3.29Å; C157-I161 WeakPolarHBondContact O-CG1 3.49Å; C157-I161 PolarHBondContact O-N 3.12Å; S158-I161 PolarHBondContact O-N 2.87Å; W159-I161 VanDerWaalsContact C-N 3.35Å; W159-I161 PolarHBondContact O-N 3.49Å; I161-V164 PolarHBondContact O-N 2.78Å; I161-Q165 WeakPolarHBondContact O-CB 3.36Å; I161-Q165 PolarHBondContact O-N 2.97Å
162	V	97.5	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-42.4	179	170.1	0	0	0	0	111.7	L91 F145 Y148 L149 S158 W159 Q165 L166	L91-V162 HydrophobicContact CD2-CG1 3.71Å; F145-V162 HydrophobicContact CB-CG1 4.38Å; F145-V162 HydrophobicContact CB-CG2 4.36Å; F145-V162 HydrophobicContact CD1-CB 4.44Å; F145-V162 HydrophobicContact CD1-CG1 4.11Å; F145-V162 HydrophobicContact CD1-CG2 3.84Å; F145-V162 HydrophobicContact CD2-CG1 4.42Å; F145-V162 HydrophobicContact CE1-CG1 4.4Å; F145-V162 HydrophobicContact CE1-CG2 4.43Å; F145-V162 HydrophobicContact CG-CG1 4.09Å; F145-V162 HydrophobicContact CG-CG2 4.34Å; Y148-V162 HydrophobicContact CD1-CG2 3.89Å; Y148-V162 HydrophobicContact CE1-CG2 4.14Å; L149-V162 HydrophobicContact CD1-CG2 4.33Å; L149-V162 HydrophobicContact CD2-CG2 3.95Å; L149-V162 HydrophobicContact CG-CG2 3.99Å; S158-V162 WeakPolarHBondContact O-CG2 2.97Å; S158-V162 PolarHBondContact O-N 3.32Å; S158-V162 VanDerWaalsContact O-N 3.15Å; W159-V162 PolarHBondContact O-N 2.81Å; V162-Q165 PolarHBondContact O-N 2.87Å; V162-L166 HydrophobicContact CG1-CD1 4.13Å; V162-L166 WeakPolarHBondContact O-CG 3.28Å; V162-L166 PolarHBondContact O-N 2.86Å
163	R	97.1	Very high	95.9	Very high	10 Å²	10	32.8 Å²	32.8	4%	0.038	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-48.8	177.4	-174.4	-160	70.3	66.8	1.5	111.7	L41 L44 W101 W159 E160 Q165 L166 Q167	L41-R163 HydrophobicContact CD1-CG 3.85Å; L41-R163 HydrophobicContact CG-CG 4.24Å; L41-R163 WeakPolarHBondContact O-CD 3.45Å; L41-R163 WeakPolarHBondContact O-CG 3.49Å; L41-R163 PolarHBondContact O-NH1 3.14Å; L44-R163 VanDerWaalsContact C-CD 3.47Å; L44-R163 HydrophobicContact CB-CG 4.37Å; L44-R163 WeakPolarHBondContact O-CD 3.26Å; L44-R163 PolarHBondContact O-NE 3.25Å; W101-R163 HydrophobicContact CH2-CB 4.16Å; W101-R163 HydrophobicContact CH2-CG 4.48Å; W101-R163 HydrophobicContact CZ2-CB 4.26Å; W159-R163 VanDerWaalsContact O-CB 3.3Å; W159-R163 WeakPolarHBondContact O-CB 3.39Å; W159-R163 PolarHBondContact O-N 2.84Å; E160-R163 PolarHBondContact O-N 3.39Å; E160-R163 IonicContact OE1-CZ 3.96Å; E160-R163 IonicContact OE1-NE 3.72Å; E160-R163 IonicContact OE1-NH2 3.01Å; E160-R163 PolarHBondContact OE1-NH2 3.29Å; E160-R163 IonicContact OE2-CZ 3.61Å; E160-R163 IonicContact OE2-NE 3.66Å; E160-R163 PolarHBondContact OE2-NE 3.15Å; E160-R163 IonicContact OE2-NH2 2.72Å; E160-R163 PolarHBondContact OE2-NH2 2.98Å; R163-Q165 VanDerWaalsContact C-N 3.33Å; R163-Q165 PolarHBondContact O-N 3.37Å; R163-L166 PolarHBondContact O-N 2.9Å; R163-Q167 WeakPolarHBondContact O-CB 3.34Å; R163-Q167 PolarHBondContact O-N 2.03Å
164	V	95.5	Very high	95.4	Very high	57 Å²	57	30.9 Å²	30.9	35%	0.345	19%	0.187	S	C	.	.	H	α-helix	trans	-60.8	-43	177.6	169.9	0	0	0	0	110.8	E160 I161 L166 Q167 V168	E160-V164 HydrophobicContact CG-CG2 4.45Å; E160-V164 WeakPolarHBondContact O-CB 3.35Å; E160-V164 VanDerWaalsContact O-CG2 3.26Å; E160-V164 WeakPolarHBondContact O-CG2 3.37Å; E160-V164 PolarHBondContact O-N 3.32Å; I161-V164 PolarHBondContact O-N 2.78Å; V164-L166 PolarHBondContact O-N 3.43Å; V164-Q167 WeakPolarHBondContact O-CB 3.35Å; V164-Q167 PolarHBondContact O-N 3.35Å; V164-V168 WeakPolarHBondContact O-CG2 3.05Å; V164-V168 PolarHBondContact O-N 3.39Å
165	Q	96.7	Very high	94.7	Very high	37 Å²	37	28.9 Å²	28.9	17%	0.173	18%	0.179	C	C	.	.	H	α-helix	trans	-58	-50.1	176.4	-172.3	68.6	35.9	0	0	111.1	F59 F145 I161 V162 R163 Q167 V168 D169	F59-Q165 HydrophobicContact CB-CG 4.17Å; F59-Q165 HydrophobicContact CD2-CB 4.37Å; F59-Q165 HydrophobicContact CD2-CG 3.98Å; F59-Q165 HydrophobicContact CG-CG 4.49Å; F145-Q165 HydrophobicContact CE1-CB 4.03Å; F145-Q165 HydrophobicContact CE1-CG 3.82Å; F145-Q165 HydrophobicContact CZ-CB 4.04Å; F145-Q165 HydrophobicContact CZ-CG 3.68Å; I161-Q165 WeakPolarHBondContact O-CB 3.36Å; I161-Q165 PolarHBondContact O-N 2.97Å; V162-Q165 PolarHBondContact O-N 2.87Å; R163-Q165 VanDerWaalsContact C-N 3.33Å; R163-Q165 PolarHBondContact O-N 3.37Å; Q165-Q167 VanDerWaalsContact C-N 3.3Å; Q165-Q167 PolarHBondContact O-N 3.48Å; Q165-V168 PolarHBondContact O-N 3.36Å; Q165-D169 VanDerWaalsContact NE2-CG 3.28Å; Q165-D169 PolarHBondContact NE2-OD1 3.32Å; Q165-D169 PolarHBondContact NE2-OD2 3.22Å; Q165-D169 WeakPolarHBondContact O-CB 3.4Å; Q165-D169 PolarHBondContact O-N 2.73Å
166	L	97.3	Very high	93.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-32	179.3	-74	171.8	0	0	0	112.9	L41 V88 L91 F92 F142 F145 V162 R163 V164 V168 D169 L170	L41-L166 VanDerWaalsContact CD2-C 3.44Å; L41-L166 HydrophobicContact CD2-CB 3.62Å; V88-L166 HydrophobicContact CG2-CD2 4.13Å; L91-L166 HydrophobicContact CD2-CD1 3.84Å; F92-L166 HydrophobicContact CE2-CD1 3.64Å; F92-L166 HydrophobicContact CZ-CD1 4.21Å; F142-L166 HydrophobicContact CE1-CD2 4.01Å; F142-L166 HydrophobicContact CZ-CD2 4.2Å; F145-L166 HydrophobicContact CE2-CD1 4.29Å; F145-L166 HydrophobicContact CE2-CD2 3.7Å; F145-L166 HydrophobicContact CE2-CG 3.88Å; F145-L166 HydrophobicContact CZ-CD2 4.18Å; F145-L166 HydrophobicContact CZ-CG 4.07Å; V162-L166 HydrophobicContact CG1-CD1 4.13Å; V162-L166 WeakPolarHBondContact O-CG 3.28Å; V162-L166 PolarHBondContact O-N 2.86Å; R163-L166 PolarHBondContact O-N 2.9Å; V164-L166 PolarHBondContact O-N 3.43Å; L166-V168 PolarHBondContact O-N 3.2Å; L166-D169 PolarHBondContact O-N 3.18Å; L166-L170 HydrophobicContact CB-CD1 4.36Å; L166-L170 HydrophobicContact CD2-CD1 4.36Å; L166-L170 HydrophobicContact CD2-CG 4.22Å; L166-L170 WeakPolarHBondContact O-CB 3.35Å; L166-L170 PolarHBondContact O-N 3.35Å
167	Q	95.4	Very high	90.8	Very high	71 Å²	71	31.4 Å²	31.4	33%	0.332	20%	0.197	S	C	.	.	H	α-helix	trans	-63.3	-32.3	176.3	-172.8	-177.3	-2.6	0	0	111.8	L41 A42 R163 V164 Q165 P171	L41-Q167 HydrophobicContact CD2-CB 4.22Å; L41-Q167 HydrophobicContact CG-CB 4.44Å; A42-Q167 VanDerWaalsContact CB-NE2 3.27Å; R163-Q167 WeakPolarHBondContact O-CB 3.34Å; R163-Q167 PolarHBondContact O-N 2.03Å; V164-Q167 WeakPolarHBondContact O-CB 3.35Å; V164-Q167 PolarHBondContact O-N 3.35Å; Q165-Q167 VanDerWaalsContact C-N 3.3Å; Q165-Q167 PolarHBondContact O-N 3.48Å; Q167-P171 VanDerWaalsContact O-CD 3.25Å; Q167-P171 WeakPolarHBondContact O-CD 3.38Å; Q167-P171 WeakPolarHBondContact O-CG 3.36Å
168	V	94.5	Very high	88.2	Confident	82 Å²	82	39.1 Å²	39.1	50%	0.497	22%	0.223	S	C	.	.	H	α-helix	trans	-85.5	-39.5	175.4	-176.1	0	0	0	0	111	K64 V164 Q165 L166 A172	K64-V168 VanDerWaalsContact NZ-CG1 3.28Å; V164-V168 WeakPolarHBondContact O-CG2 3.05Å; V164-V168 PolarHBondContact O-N 3.39Å; Q165-V168 PolarHBondContact O-N 3.36Å; L166-V168 PolarHBondContact O-N 3.2Å; V168-A172 WeakPolarHBondContact O-CB 3.25Å
169	D	95.4	Very high	85.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-80.8	-42	-167	-71.3	7.6	0	0	0	113	C61 W63 K64 Y141 Q165 L166 A172 F173	C61-D169 VanDerWaalsContact CB-OD2 3.29Å; C61-D169 WeakPolarHBondContact CB-OD2 2.98Å; C61-D169 PolarHBondContact SG-OD2 3.43Å; W63-D169 HydrophobicContact CZ2-CB 3.99Å; W63-D169 PolarHBondContact NE1-O 3.08Å; K64-D169 WeakPolarHBondContact CE-OD1 3.47Å; K64-D169 IonicContact NZ-OD1 2.73Å; K64-D169 PolarHBondContact NZ-OD1 3.22Å; Y141-D169 PolarHBondContact OH-OD2 2.53Å; Q165-D169 VanDerWaalsContact NE2-CG 3.28Å; Q165-D169 PolarHBondContact NE2-OD1 3.32Å; Q165-D169 PolarHBondContact NE2-OD2 3.22Å; Q165-D169 WeakPolarHBondContact O-CB 3.4Å; Q165-D169 PolarHBondContact O-N 2.73Å; L166-D169 PolarHBondContact O-N 3.18Å; D169-A172 PolarHBondContact O-N 3.39Å; D169-F173 PolarHBondContact O-N 3.29Å
170	L	95	Very high	82.4	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.031	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-44.6	-177.5	-68.7	172.2	0	0	0	113.3	R34 L41 V88 L166 A172 F173	R34-L170 PolarHBondContact NH2-O 3Å; L41-L170 HydrophobicContact CD2-CD1 4.1Å; V88-L170 HydrophobicContact CG1-CD1 4.36Å; V88-L170 HydrophobicContact CG2-CD1 3.86Å; V88-L170 HydrophobicContact CG2-CD2 3.87Å; V88-L170 HydrophobicContact CG2-CG 4.39Å; L166-L170 HydrophobicContact CB-CD1 4.36Å; L166-L170 HydrophobicContact CD2-CD1 4.36Å; L166-L170 HydrophobicContact CD2-CG 4.22Å; L166-L170 WeakPolarHBondContact O-CB 3.35Å; L166-L170 PolarHBondContact O-N 3.35Å; L170-A172 PolarHBondContact O-N 3.09Å; L170-F173 WeakPolarHBondContact O-CB 3.38Å; L170-F173 PolarHBondContact O-N 3.13Å
171	P	92.4	Very high	79.7	Confident	68 Å²	68	59.3 Å²	59.3	44%	0.442	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.4	175	-24.1	36.9	0	0	0	112.8	R34 A38 Q167 F173	R34-P171 PolarHBondContact NH2-O 3.28Å; A38-P171 HydrophobicContact CB-CG 4.05Å; Q167-P171 VanDerWaalsContact O-CD 3.25Å; Q167-P171 WeakPolarHBondContact O-CD 3.38Å; Q167-P171 WeakPolarHBondContact O-CG 3.36Å; P171-F173 PolarHBondContact O-N 3.28Å
172	A	92.5	Very high	76.8	Confident	49 Å²	49	73.3 Å²	73.3	41%	0.405	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-8.8	179.1	0	0	0	0	0	113.9	V168 D169 L170 P174	V168-A172 WeakPolarHBondContact O-CB 3.25Å; D169-A172 PolarHBondContact O-N 3.39Å; L170-A172 PolarHBondContact O-N 3.09Å; A172-P174 WeakPolarHBondContact O-CD 3.46Å
173	F	93	Very high	75.8	Confident	3 Å²	3	77 Å²	77	1%	0.013	40%	0.403	C	S	.	.	S	Bend	trans	-63.6	124.2	178.1	-157.7	-72.1	0	0	0	110.4	R34 W63 T77 C80 Y81 F134 D169 L170 P171 L175	R34-F173 PolarHBondContact NH1-O 2.58Å; R34-F173 PolarHBondContact NH2-O 3.38Å; W63-F173 HydrophobicContact CB-CD2 4.06Å; W63-F173 HydrophobicContact CB-CE2 4.18Å; W63-F173 AromaticContact CD1-CD2 3.88Å; W63-F173 AromaticContact CD2-CD2 3.37Å; W63-F173 HydrophobicContact CD2-CD2 3.37Å; W63-F173 AromaticContact CD2-CE2 3.7Å; W63-F173 HydrophobicContact CD2-CE2 3.7Å; W63-F173 HydrophobicContact CD2-CG 4.39Å; W63-F173 AromaticContact CE2-CD2 3.66Å; W63-F173 AromaticContact CE3-CD2 3.72Å; W63-F173 HydrophobicContact CE3-CD2 3.72Å; W63-F173 AromaticContact CE3-CE2 3.57Å; W63-F173 HydrophobicContact CE3-CE2 3.57Å; W63-F173 HydrophobicContact CG-CB 4.48Å; W63-F173 AromaticContact CG-CD2 3.54Å; W63-F173 HydrophobicContact CG-CD2 3.54Å; W63-F173 AromaticContact CG-CE2 4Å; W63-F173 HydrophobicContact CG-CE2 4Å; W63-F173 HydrophobicContact CG-CG 4.17Å; W63-F173 HydrophobicContact CZ2-CD2 4.27Å; W63-F173 HydrophobicContact CZ3-CD2 4.34Å; W63-F173 HydrophobicContact CZ3-CE2 4.18Å; W63-F173 AromaticContact NE1-CD2 3.91Å; T77-F173 HydrophobicContact CG2-CE1 3.93Å; C80-F173 HydrophobicContact CB-CZ 3.87Å; Y81-F173 HydrophobicContact CD2-CB 3.74Å; Y81-F173 AromaticContact CD2-CD1 3.53Å; Y81-F173 HydrophobicContact CD2-CD1 3.53Å; Y81-F173 AromaticContact CD2-CD2 3.78Å; Y81-F173 HydrophobicContact CD2-CD2 3.78Å; Y81-F173 HydrophobicContact CD2-CE1 4.05Å; Y81-F173 HydrophobicContact CD2-CE2 4.26Å; Y81-F173 AromaticContact CD2-CG 3.4Å; Y81-F173 HydrophobicContact CD2-CG 3.4Å; Y81-F173 HydrophobicContact CD2-CZ 4.39Å; Y81-F173 HydrophobicContact CE2-CB 3.79Å; Y81-F173 HydrophobicContact CE2-CD1 4.4Å; Y81-F173 HydrophobicContact CE2-CD2 4.45Å; Y81-F173 AromaticContact CE2-CG 3.99Å; Y81-F173 HydrophobicContact CE2-CG 3.99Å; Y81-F173 HydrophobicContact CG-CD1 4.1Å; Y81-F173 HydrophobicContact CG-CE1 4.31Å; Y81-F173 HydrophobicContact CG-CG 4.38Å; F134-F173 HydrophobicContact CE1-CE2 4.34Å; F134-F173 HydrophobicContact CE1-CZ 4.11Å; D169-F173 PolarHBondContact O-N 3.29Å; L170-F173 WeakPolarHBondContact O-CB 3.38Å; L170-F173 PolarHBondContact O-N 3.13Å; P171-F173 PolarHBondContact O-N 3.28Å; F173-L175 HydrophobicContact CD1-CD2 4.46Å; F173-L175 HydrophobicContact CD1-CG 4.32Å; F173-L175 PolarHBondContact O-N 3.13Å
174	P	87.4	Confident	74.7	Confident	45 Å²	45	80.5 Å²	80.5	29%	0.292	42%	0.422	S	S	.	.			trans	-81.2	77.2	-169.4	34.1	-38.7	0	0	0	111.8	I69 T77 A172 S176	I69-P174 HydrophobicContact CB-CG 4.12Å; I69-P174 HydrophobicContact CD1-CG 3.65Å; I69-P174 HydrophobicContact CG2-CG 3.53Å; T77-P174 VanDerWaalsContact CG2-O 3.32Å; T77-P174 WeakPolarHBondContact CG2-O 3.2Å; A172-P174 WeakPolarHBondContact O-CD 3.46Å; P174-S176 PolarHBondContact O-N 2.93Å
175	L	82.4	Confident	73.5	Confident	33 Å²	33	81.8 Å²	81.8	17%	0.173	43%	0.426	C	S	.	.			trans	-80.8	71.3	165.1	-65.1	171.3	0	0	0	109.2	L30 T77 Y81 F173	L30-L175 HydrophobicContact CD2-CD1 3.86Å; L30-L175 HydrophobicContact CG-CD1 4.43Å; T77-L175 HydrophobicContact CG2-CD2 4.25Å; Y81-L175 HydrophobicContact CD1-CD1 3.33Å; Y81-L175 HydrophobicContact CD1-CD2 4.17Å; Y81-L175 HydrophobicContact CD1-CG 4.17Å; Y81-L175 HydrophobicContact CD2-CD1 4.18Å; Y81-L175 HydrophobicContact CD2-CG 4.46Å; Y81-L175 HydrophobicContact CE1-CD1 3.44Å; Y81-L175 VanDerWaalsContact CE1-CD1 3.44Å; Y81-L175 HydrophobicContact CE2-CD1 4.27Å; Y81-L175 HydrophobicContact CG-CD1 3.71Å; Y81-L175 HydrophobicContact CG-CD2 3.99Å; Y81-L175 HydrophobicContact CG-CG 4.08Å; F173-L175 HydrophobicContact CD1-CD2 4.46Å; F173-L175 HydrophobicContact CD1-CG 4.32Å; F173-L175 PolarHBondContact O-N 3.13Å
176	S	61.6	Low	72.2	Confident	81 Å²	81	84.4 Å²	84.4	57%	0.566	44%	0.441	S	S	*	.			trans	-89.1	117.1	172.8	-70.1	0	0	0	0	109.3	P174 R178	P174-S176 PolarHBondContact O-N 2.93Å; S176-R178 PolarHBondContact O-N 3.43Å
177	A	48.1	Very low	70.6	Confident	63 Å²	63	89.7 Å²	89.7	52%	0.521	47%	0.469	S	S	.	.			trans	-61.2	95.6	152.5	0	0	0	0	0	105.8	R179	A177-R179 PolarHBondContact O-N 2.96Å
178	R	42.2	Very low	69	Low	186 Å²	186	90.9 Å²	90.9	70%	0.702	48%	0.478	S	S	*	.			trans	-52.6	110.7	168.3	-85.7	-178.3	173.1	-128.9	0.7	105.9	T70 S176 G180	T70-R178 PolarHBondContact O-NH2 2.94Å; S176-R178 PolarHBondContact O-N 3.43Å; R178-G180 VanDerWaalsContact C-N 3.31Å; R178-G180 PolarHBondContact O-N 3.42Å
179	R	37.6	Very low	67.1	Low	245 Å²	245	91.6 Å²	91.6	93%	0.925	48%	0.476	S	S	*	.			trans	-57.2	109.9	151.9	-76.6	-178.6	-166.3	161.9	5.1	103.6	A177	A177-R179 PolarHBondContact O-N 2.96Å
180	G	34.4	Very low	65	Low	51 Å²	51	98.6 Å²	98.6	53%	0.526	51%	0.513	S	S	.	.			trans	-51.1	156.4	169.6	0	0	0	0	0	109.6	R178 R182	R178-G180 VanDerWaalsContact C-N 3.31Å; R178-G180 PolarHBondContact O-N 3.42Å; G180-R182 PolarHBondContact O-N 3.41Å
181	P	40.1	Very low	62.5	Low	136 Å²	136	106.3 Å²	106.3	88%	0.883	55%	0.553	S	S	*	*			trans	-57.1	135.4	176	27.3	-32.1	0	0	0	108.8
182	R	37.7	Very low	59.7	Low	316 Å²	316	109.8 Å²	109.8	100%	1.192	56%	0.563	S	S	*	*			trans	-64.4	0	162.5	-76.9	-174.8	-176.4	-179.8	0.5	109.7	G180	G180-R182 PolarHBondContact O-N 3.41Å

Retrieved 182 of 182 residues in 354.7 ms (Link to these results)

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