A0A077Z2U3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z2U3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 294 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	35.9	Very low	33.7	Very low	250 Å²	250	134.3 Å²	134.3	100%	1.232	80%	0.802	S	S	*	*				0	115.9	0	-84	171.5	154.4	0	0	107
2	T	34.5	Very low	33.6	Very low	137 Å²	137	132.3 Å²	132.3	84%	0.84	80%	0.795	S	S	*	*			trans	-73.9	131.6	178.1	37.4	0	0	0	0	110.5
3	A	39.2	Very low	33.6	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	81%	0.806	S	S	*	*			trans	-148.4	79.1	154.1	0	0	0	0	0	106.4	D5	A3-D5 PolarHBondContact O-N 3.07Å
4	E	33.7	Very low	34	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	80%	0.8	S	S	*	*			trans	-61.8	91.1	151.2	-73.5	171.7	127.1	0	0	107
5	D	36.9	Very low	33.8	Very low	143 Å²	143	135.5 Å²	135.5	77%	0.765	80%	0.801	S	S	*	*			trans	-107.3	71.9	154.8	-86.2	-37.7	0	0	0	107.1	A3 S7	A3-D5 PolarHBondContact O-N 3.07Å; D5-S7 PolarHBondContact O-N 2.95Å
6	A	33.4	Very low	33.9	Very low	100 Å²	100	131.5 Å²	131.5	83%	0.826	80%	0.797	S	S	*	*			trans	-68.2	71.1	156.1	0	0	0	0	0	108.1	N8	A6-N8 VanDerWaalsContact C-N 3.26Å; A6-N8 PolarHBondContact O-N 2.91Å
7	S	37.2	Very low	34.3	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	79%	0.786	S	S	*	*			trans	-76.4	85	171.5	62.5	0	0	0	0	109.2	D5	D5-S7 PolarHBondContact O-N 2.95Å
8	N	28.2	Very low	34.8	Very low	115 Å²	115	132.3 Å²	132.3	62%	0.615	79%	0.789	S	S	*	*			trans	21.3	118.5	150.9	-145.7	22.8	0	0	0	119.4	A6 D10	A6-N8 VanDerWaalsContact C-N 3.26Å; A6-N8 PolarHBondContact O-N 2.91Å; N8-D10 PolarHBondContact ND2-OD2 2.99Å; N8-D10 PolarHBondContact O-N 3.16Å; N8-D10 VanDerWaalsContact O-N 3.16Å
9	P	28.5	Very low	35.7	Very low	127 Å²	127	132.3 Å²	132.3	83%	0.825	79%	0.79	S	S	*	*			trans	-83.7	79.3	166.6	35.1	-29.3	0	0	0	109.4
10	D	34.2	Very low	36.3	Very low	125 Å²	125	129.2 Å²	129.2	67%	0.668	77%	0.769	S	S	*	*			trans	-125.3	119.9	171.5	-93.3	-38.9	0	0	0	112.3	N8	N8-D10 PolarHBondContact ND2-OD2 2.99Å; N8-D10 PolarHBondContact O-N 3.16Å; N8-D10 VanDerWaalsContact O-N 3.16Å
11	S	28.6	Very low	37	Very low	101 Å²	101	126.3 Å²	126.3	71%	0.706	75%	0.754	S	S	*	*			trans	96.5	109.3	146.8	-139.9	0	0	0	0	117.4	R13	S11-R13 PolarHBondContact O-N 2.77Å
12	P	33	Very low	38	Very low	110 Å²	110	119.3 Å²	119.3	71%	0.714	73%	0.727	S	S	*	*			trans	-61.9	128.1	170.5	25.4	-29.3	0	0	0	108.9	T14	P12-T14 VanDerWaalsContact C-N 3.33Å; P12-T14 PolarHBondContact O-N 3.32Å
13	R	33.4	Very low	38.4	Very low	248 Å²	248	119.5 Å²	119.5	94%	0.936	72%	0.716	S	S	*	*			trans	-52.2	95.8	171.5	-80.7	175.7	167.3	165.5	-4	109.8	S11 G15	S11-R13 PolarHBondContact O-N 2.77Å; R13-G15 PolarHBondContact O-N 2.9Å
14	T	39.1	Very low	38.8	Very low	118 Å²	118	117.7 Å²	117.7	72%	0.724	70%	0.696	S	S	*	*			trans	-71.9	58.5	157.7	39.4	0	0	0	0	108.7	P12 G16	P12-T14 VanDerWaalsContact C-N 3.33Å; P12-T14 PolarHBondContact O-N 3.32Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.1Å; T14-G16 VanDerWaalsContact O-N 3.1Å
15	G	31	Very low	39.6	Very low	80 Å²	80	116 Å²	116	83%	0.825	68%	0.682	S	S	*	*			trans	-83.4	74.7	175.5	0	0	0	0	0	110.2	R13	R13-G15 PolarHBondContact O-N 2.9Å
16	G	35.6	Very low	40.3	Very low	71 Å²	71	116.2 Å²	116.2	73%	0.732	68%	0.679	S	S	*	*			trans	-165	18.3	176.9	0	0	0	0	0	115	T14	T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.1Å; T14-G16 VanDerWaalsContact O-N 3.1Å
17	T	40.2	Very low	40.5	Very low	100 Å²	100	114.5 Å²	114.5	61%	0.613	66%	0.655	S	S	*	*			trans	-102.8	12	-173.3	39.4	0	0	0	0	115.3	R25	T17-R25 PolarHBondContact O-NH2 3.1Å; T17-R25 VanDerWaalsContact O-NH2 3.1Å
18	E	44.3	Very low	41	Very low	177 Å²	177	114.6 Å²	114.6	83%	0.827	64%	0.642	S	S	*	*	S	Bend	trans	-98.2	116.4	170.1	-78.4	-176.7	160.2	0	0	110.5
19	T	51.8	Low	42.3	Very low	133 Å²	133	112.3 Å²	112.3	82%	0.816	64%	0.639	S	S	*	*			trans	88.1	27.3	161.4	72.4	0	0	0	0	120.6	P21	T19-P21 WeakPolarHBondContact O-CD 3.43Å
20	D	47.2	Very low	43.1	Very low	69 Å²	69	109.8 Å²	109.8	37%	0.369	62%	0.623	S	S	.	*			trans	-66.7	118.1	149.7	-89.7	-14.4	0	0	0	107	V24 R25 K28	D20-V24 HydrophobicContact CB-CB 4.42Å; D20-V24 HydrophobicContact CB-CG1 4.33Å; D20-R25 HydrophobicContact CB-CG 4.11Å; D20-K28 IonicContact OD2-NZ 2.8Å; D20-K28 PolarHBondContact OD2-NZ 2.89Å
21	P	51.9	Low	43.6	Very low	69 Å²	69	108.5 Å²	108.5	45%	0.448	62%	0.615	S	S	.	*			trans	-52	148.3	177.4	-23	30.5	0	0	0	110.7	T19 F23 V24 R25	T19-P21 WeakPolarHBondContact O-CD 3.43Å; P21-F23 PolarHBondContact O-N 2.8Å; P21-V24 HydrophobicContact CB-CG2 4.11Å; P21-V24 HydrophobicContact CG-CG2 3.91Å; P21-V24 WeakPolarHBondContact O-CA 3.18Å; P21-V24 WeakPolarHBondContact O-CB 3.43Å; P21-V24 PolarHBondContact O-N 3.12Å; P21-R25 PolarHBondContact O-N 3.04Å; P21-R25 VanDerWaalsContact O-N 3.12Å
22	P	55.1	Low	44.8	Very low	104 Å²	104	109 Å²	109	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-53.6	-34.4	-178.2	17.9	-29.8	0	0	0	112.5	R25 Q26	P22-R25 PolarHBondContact O-N 3.47Å; P22-Q26 WeakPolarHBondContact O-CG 3.37Å; P22-Q26 PolarHBondContact O-N 3.21Å
23	F	44.5	Very low	45.8	Very low	140 Å²	140	106.3 Å²	106.3	61%	0.614	60%	0.596	S	S	*	*	H	α-helix	trans	-62.1	-40.4	172.8	-178.5	-108	0	0	0	113.5	P21 Q26 L27	P21-F23 PolarHBondContact O-N 2.8Å; F23-Q26 PolarHBondContact O-N 2.91Å; F23-L27 HydrophobicContact CD1-CD1 3.68Å; F23-L27 HydrophobicContact CD2-CD1 4.33Å; F23-L27 HydrophobicContact CE1-CD1 3.17Å; F23-L27 HydrophobicContact CE1-CG 4.35Å; F23-L27 HydrophobicContact CE2-CD1 3.89Å; F23-L27 HydrophobicContact CE2-CG 4.36Å; F23-L27 HydrophobicContact CG-CD1 4.24Å; F23-L27 HydrophobicContact CZ-CD1 3.31Å; F23-L27 HydrophobicContact CZ-CG 4.22Å; F23-L27 WeakPolarHBondContact O-CB 3.41Å; F23-L27 WeakPolarHBondContact O-CG 3.4Å; F23-L27 PolarHBondContact O-N 3.48Å
24	V	46.2	Very low	46.2	Very low	53 Å²	53	99 Å²	99	32%	0.321	58%	0.575	S	S	.	*	H	α-helix	trans	-69	-41.1	177.9	178.3	0	0	0	0	110.8	D20 P21 L27 K28	D20-V24 HydrophobicContact CB-CB 4.42Å; D20-V24 HydrophobicContact CB-CG1 4.33Å; P21-V24 HydrophobicContact CB-CG2 4.11Å; P21-V24 HydrophobicContact CG-CG2 3.91Å; P21-V24 WeakPolarHBondContact O-CA 3.18Å; P21-V24 WeakPolarHBondContact O-CB 3.43Å; P21-V24 PolarHBondContact O-N 3.12Å; V24-L27 PolarHBondContact O-N 3.43Å; V24-K28 WeakPolarHBondContact O-CB 3.32Å; V24-K28 PolarHBondContact O-N 2.79Å
25	R	51.3	Low	46.3	Very low	145 Å²	145	100.6 Å²	100.6	55%	0.547	57%	0.572	S	S	.	*	H	α-helix	trans	-61.6	-43.5	173.5	-83.5	-172.8	-175.2	171.1	4.5	112	T17 D20 P21 P22 L27 K28	T17-R25 PolarHBondContact O-NH2 3.1Å; T17-R25 VanDerWaalsContact O-NH2 3.1Å; D20-R25 HydrophobicContact CB-CG 4.11Å; P21-R25 PolarHBondContact O-N 3.04Å; P21-R25 VanDerWaalsContact O-N 3.12Å; P22-R25 PolarHBondContact O-N 3.47Å; R25-L27 VanDerWaalsContact C-N 3.3Å; R25-L27 PolarHBondContact O-N 3.45Å; R25-K28 PolarHBondContact O-N 3.02Å
26	Q	50.5	Low	47.3	Very low	148 Å²	148	103.6 Å²	103.6	69%	0.692	56%	0.563	S	S	*	*	H	α-helix	trans	-65.3	-32.7	177.3	-75.6	-179.8	-7.4	0	0	112.6	P22 F23 P30	P22-Q26 WeakPolarHBondContact O-CG 3.37Å; P22-Q26 PolarHBondContact O-N 3.21Å; F23-Q26 PolarHBondContact O-N 2.91Å; Q26-P30 WeakPolarHBondContact O-CD 3.31Å; Q26-P30 VanDerWaalsContact O-CG 3.31Å; Q26-P30 WeakPolarHBondContact O-CG 3.44Å
27	L	38.3	Very low	47.9	Very low	64 Å²	64	109.6 Å²	109.6	34%	0.335	56%	0.563	S	S	.	*	H	α-helix	trans	-83.7	-25.2	178.3	-81.3	174.1	0	0	0	114.6	F23 V24 R25 A29 P30 L31	F23-L27 HydrophobicContact CD1-CD1 3.68Å; F23-L27 HydrophobicContact CD2-CD1 4.33Å; F23-L27 HydrophobicContact CE1-CD1 3.17Å; F23-L27 HydrophobicContact CE1-CG 4.35Å; F23-L27 HydrophobicContact CE2-CD1 3.89Å; F23-L27 HydrophobicContact CE2-CG 4.36Å; F23-L27 HydrophobicContact CG-CD1 4.24Å; F23-L27 HydrophobicContact CZ-CD1 3.31Å; F23-L27 HydrophobicContact CZ-CG 4.22Å; F23-L27 WeakPolarHBondContact O-CB 3.41Å; F23-L27 WeakPolarHBondContact O-CG 3.4Å; F23-L27 PolarHBondContact O-N 3.48Å; V24-L27 PolarHBondContact O-N 3.43Å; R25-L27 VanDerWaalsContact C-N 3.3Å; R25-L27 PolarHBondContact O-N 3.45Å; L27-A29 VanDerWaalsContact C-N 3.33Å; L27-A29 PolarHBondContact O-N 3.01Å; L27-P30 VanDerWaalsContact O-CD 3.3Å; L27-P30 WeakPolarHBondContact O-CD 3.34Å; L27-L31 HydrophobicContact CB-CD1 3.98Å; L27-L31 VanDerWaalsContact O-CB 3.26Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.03Å; L27-L31 PolarHBondContact O-N 2.91Å
28	K	48.4	Very low	47.9	Very low	109 Å²	109	108.9 Å²	108.9	47%	0.474	56%	0.555	S	S	.	*	H	α-helix	trans	-58.2	-45.3	-174.1	-138.4	170.8	-170	165.5	0	111.8	D20 V24 R25 L32	D20-K28 IonicContact OD2-NZ 2.8Å; D20-K28 PolarHBondContact OD2-NZ 2.89Å; V24-K28 WeakPolarHBondContact O-CB 3.32Å; V24-K28 PolarHBondContact O-N 2.79Å; R25-K28 PolarHBondContact O-N 3.02Å; K28-L32 WeakPolarHBondContact O-CB 3.39Å; K28-L32 WeakPolarHBondContact O-CD1 3.01Å; K28-L32 WeakPolarHBondContact O-CG 3.32Å; K28-L32 PolarHBondContact O-N 2.7Å
29	A	55.2	Low	47.9	Very low	68 Å²	68	103.3 Å²	103.3	56%	0.562	54%	0.536	S	S	*	.	H	α-helix	trans	-67.5	-49.8	179.3	0	0	0	0	0	113	L27 L31 L32 A33	L27-A29 VanDerWaalsContact C-N 3.33Å; L27-A29 PolarHBondContact O-N 3.01Å; A29-L31 VanDerWaalsContact C-N 3.33Å; A29-L31 PolarHBondContact O-N 3.35Å; A29-L32 PolarHBondContact O-N 3.04Å; A29-A33 WeakPolarHBondContact O-CB 3.44Å; A29-A33 PolarHBondContact O-N 2.72Å
30	P	46.2	Very low	47.8	Very low	73 Å²	73	100.5 Å²	100.5	47%	0.474	52%	0.515	S	S	.	.	H	α-helix	trans	-55.7	-42.6	171.2	-25.8	30.5	0	0	0	113.8	Q26 L27 A33 L34	Q26-P30 WeakPolarHBondContact O-CD 3.31Å; Q26-P30 VanDerWaalsContact O-CG 3.31Å; Q26-P30 WeakPolarHBondContact O-CG 3.44Å; L27-P30 VanDerWaalsContact O-CD 3.3Å; L27-P30 WeakPolarHBondContact O-CD 3.34Å; P30-A33 PolarHBondContact O-N 3.31Å; P30-L34 VanDerWaalsContact O-CB 3.3Å; P30-L34 WeakPolarHBondContact O-CB 3.32Å; P30-L34 PolarHBondContact O-N 3.4Å
31	L	43.9	Very low	47.6	Very low	98 Å²	98	101.6 Å²	101.6	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.9	-77.4	166.5	0	0	0	111.9	L27 A29 L34 K35	L27-L31 HydrophobicContact CB-CD1 3.98Å; L27-L31 VanDerWaalsContact O-CB 3.26Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.03Å; L27-L31 PolarHBondContact O-N 2.91Å; A29-L31 VanDerWaalsContact C-N 3.33Å; A29-L31 PolarHBondContact O-N 3.35Å; L31-L34 PolarHBondContact O-N 2.89Å; L31-K35 VanDerWaalsContact O-CB 3.28Å; L31-K35 WeakPolarHBondContact O-CB 3.28Å; L31-K35 PolarHBondContact O-N 3.41Å
32	L	54.7	Low	47	Very low	111 Å²	111	103 Å²	103	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-41.3	173.4	-84.6	158.8	0	0	0	111.5	K28 A29 K35 K36	K28-L32 WeakPolarHBondContact O-CB 3.39Å; K28-L32 WeakPolarHBondContact O-CD1 3.01Å; K28-L32 WeakPolarHBondContact O-CG 3.32Å; K28-L32 PolarHBondContact O-N 2.7Å; A29-L32 PolarHBondContact O-N 3.04Å; L32-K35 PolarHBondContact O-N 2.94Å; L32-K36 WeakPolarHBondContact O-CB 3.42Å; L32-K36 PolarHBondContact O-N 3.05Å
33	A	53.7	Low	46.6	Very low	54 Å²	54	104.1 Å²	104.1	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-40.9	175.7	0	0	0	0	0	112	A29 P30 K36 R37	A29-A33 WeakPolarHBondContact O-CB 3.44Å; A29-A33 PolarHBondContact O-N 2.72Å; P30-A33 PolarHBondContact O-N 3.31Å; A33-K36 PolarHBondContact O-N 2.89Å; A33-R37 PolarHBondContact O-N 2.72Å
34	L	41.7	Very low	46.7	Very low	94 Å²	94	102.2 Å²	102.2	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-46.5	175.1	-175.5	67.2	0	0	0	110.8	P30 L31 K36 R37 I38	P30-L34 VanDerWaalsContact O-CB 3.3Å; P30-L34 WeakPolarHBondContact O-CB 3.32Å; P30-L34 PolarHBondContact O-N 3.4Å; L31-L34 PolarHBondContact O-N 2.89Å; L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 3.27Å; L34-R37 PolarHBondContact O-N 3.44Å; L34-I38 HydrophobicContact CD1-CD1 4.23Å; L34-I38 HydrophobicContact CD1-CG1 4.44Å; L34-I38 HydrophobicContact CD2-CD1 4.39Å; L34-I38 HydrophobicContact CG-CD1 3.82Å; L34-I38 HydrophobicContact CG-CG1 4.4Å; L34-I38 WeakPolarHBondContact O-CB 3.26Å; L34-I38 VanDerWaalsContact O-CG1 3.28Å; L34-I38 WeakPolarHBondContact O-CG1 3.3Å; L34-I38 PolarHBondContact O-N 3.42Å
35	K	41.1	Very low	46.3	Very low	152 Å²	152	101.2 Å²	101.2	66%	0.661	52%	0.523	S	S	*	.	H	α-helix	trans	-56.9	-43.7	174.5	-176.1	-179.4	177.3	-178.2	0	111.1	L31 L32 I38 S39	L31-K35 VanDerWaalsContact O-CB 3.28Å; L31-K35 WeakPolarHBondContact O-CB 3.28Å; L31-K35 PolarHBondContact O-N 3.41Å; L32-K35 PolarHBondContact O-N 2.94Å; K35-I38 PolarHBondContact O-N 3.15Å; K35-S39 WeakPolarHBondContact O-CB 3.39Å; K35-S39 PolarHBondContact O-N 3.48Å
36	K	52.4	Low	45.7	Very low	144 Å²	144	97.5 Å²	97.5	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-65.7	-43.5	176.5	-168.6	176.1	-178.3	179.3	0	111.9	L32 A33 L34 S39 N40	L32-K36 WeakPolarHBondContact O-CB 3.42Å; L32-K36 PolarHBondContact O-N 3.05Å; A33-K36 PolarHBondContact O-N 2.89Å; L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 3.27Å; K36-S39 PolarHBondContact O-N 3.37Å; K36-N40 WeakPolarHBondContact O-CB 3.41Å; K36-N40 VanDerWaalsContact O-CG 3.31Å; K36-N40 PolarHBondContact O-N 2.85Å; K36-N40 PolarHBondContact O-OD1 3.4Å
37	R	48	Very low	45.6	Very low	196 Å²	196	99.2 Å²	99.2	74%	0.74	51%	0.514	S	S	*	.	H	α-helix	trans	-61.2	-44.5	174.5	-86.1	-176.4	176.4	175.9	-0.6	112.2	A33 L34 S39 N40 C41	A33-R37 PolarHBondContact O-N 2.72Å; L34-R37 PolarHBondContact O-N 3.44Å; R37-S39 VanDerWaalsContact C-N 3.35Å; R37-N40 PolarHBondContact O-N 2.81Å; R37-C41 VanDerWaalsContact O-CB 3.25Å; R37-C41 WeakPolarHBondContact O-CB 3.31Å; R37-C41 PolarHBondContact O-N 2.91Å
38	I	39.7	Very low	45.9	Very low	86 Å²	86	101.3 Å²	101.3	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-44.3	176.4	-69.3	169.4	0	0	0	109.8	L34 K35 C41 L42	L34-I38 HydrophobicContact CD1-CD1 4.23Å; L34-I38 HydrophobicContact CD1-CG1 4.44Å; L34-I38 HydrophobicContact CD2-CD1 4.39Å; L34-I38 HydrophobicContact CG-CD1 3.82Å; L34-I38 HydrophobicContact CG-CG1 4.4Å; L34-I38 WeakPolarHBondContact O-CB 3.26Å; L34-I38 VanDerWaalsContact O-CG1 3.28Å; L34-I38 WeakPolarHBondContact O-CG1 3.3Å; L34-I38 PolarHBondContact O-N 3.42Å; K35-I38 PolarHBondContact O-N 3.15Å; I38-C41 PolarHBondContact O-N 3.46Å; I38-L42 HydrophobicContact CG2-CD1 3.64Å; I38-L42 HydrophobicContact CG2-CG 4.31Å; I38-L42 VanDerWaalsContact O-CB 3.28Å; I38-L42 WeakPolarHBondContact O-CB 3.03Å; I38-L42 VanDerWaalsContact O-CG 3.27Å; I38-L42 WeakPolarHBondContact O-CG 3.31Å; I38-L42 PolarHBondContact O-N 2.91Å
39	S	44.2	Very low	45.4	Very low	60 Å²	60	97.7 Å²	97.7	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-45.8	177.3	-164.4	0	0	0	0	112.1	K35 K36 R37 L42 E43	K35-S39 WeakPolarHBondContact O-CB 3.39Å; K35-S39 PolarHBondContact O-N 3.48Å; K36-S39 PolarHBondContact O-N 3.37Å; R37-S39 VanDerWaalsContact C-N 3.35Å; S39-L42 PolarHBondContact O-N 3.37Å; S39-E43 PolarHBondContact O-N 3.46Å
40	N	50.1	Low	44.9	Very low	73 Å²	73	97.7 Å²	97.7	39%	0.39	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-43.6	177.4	-70.8	12.8	0	0	0	111.4	K36 R37 L42 E43 D44	K36-N40 WeakPolarHBondContact O-CB 3.41Å; K36-N40 VanDerWaalsContact O-CG 3.31Å; K36-N40 PolarHBondContact O-N 2.85Å; K36-N40 PolarHBondContact O-OD1 3.4Å; R37-N40 PolarHBondContact O-N 2.81Å; N40-L42 VanDerWaalsContact C-N 3.28Å; N40-L42 PolarHBondContact O-N 3.31Å; N40-E43 PolarHBondContact O-N 2.86Å; N40-D44 WeakPolarHBondContact O-CB 3.38Å; N40-D44 PolarHBondContact O-N 3.33Å
41	C	43.7	Very low	44.9	Very low	93 Å²	93	100 Å²	100	63%	0.628	51%	0.507	S	S	*	.	H	α-helix	trans	-64.9	-35.4	177.9	-157.6	0	0	0	0	111.4	R37 I38 G45	R37-C41 VanDerWaalsContact O-CB 3.25Å; R37-C41 WeakPolarHBondContact O-CB 3.31Å; R37-C41 PolarHBondContact O-N 2.91Å; I38-C41 PolarHBondContact O-N 3.46Å; C41-G45 WeakPolarHBondContact O-CA 3.43Å; C41-G45 PolarHBondContact O-N 3.41Å
42	L	38.5	Very low	44.8	Very low	97 Å²	97	101.5 Å²	101.5	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-68.8	-40.6	172.2	-78.9	165.2	0	0	0	111.7	I38 S39 N40 L46	I38-L42 HydrophobicContact CG2-CD1 3.64Å; I38-L42 HydrophobicContact CG2-CG 4.31Å; I38-L42 VanDerWaalsContact O-CB 3.28Å; I38-L42 WeakPolarHBondContact O-CB 3.03Å; I38-L42 VanDerWaalsContact O-CG 3.27Å; I38-L42 WeakPolarHBondContact O-CG 3.31Å; I38-L42 PolarHBondContact O-N 2.91Å; S39-L42 PolarHBondContact O-N 3.37Å; N40-L42 VanDerWaalsContact C-N 3.28Å; N40-L42 PolarHBondContact O-N 3.31Å; L42-L46 WeakPolarHBondContact O-CB 3.5Å; L42-L46 PolarHBondContact O-N 3.41Å
43	E	46.1	Very low	44	Very low	128 Å²	128	96.6 Å²	96.6	60%	0.598	48%	0.482	S	S	*	.	H	α-helix	trans	-64.9	-46.5	174.7	-92.5	-174.5	149	0	0	112.1	S39 N40 G45 L46 R47	S39-E43 PolarHBondContact O-N 3.46Å; N40-E43 PolarHBondContact O-N 2.86Å; E43-G45 VanDerWaalsContact C-N 3.34Å; E43-L46 WeakPolarHBondContact O-CB 3.43Å; E43-L46 PolarHBondContact O-N 3.01Å; E43-R47 WeakPolarHBondContact O-CB 3.47Å; E43-R47 PolarHBondContact O-N 2.86Å
44	D	47.4	Very low	43.6	Very low	101 Å²	101	96.8 Å²	96.8	54%	0.54	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-44.3	175.6	-73.4	-24.3	0	0	0	110.5	N40 L46 R47 N48	N40-D44 WeakPolarHBondContact O-CB 3.38Å; N40-D44 PolarHBondContact O-N 3.33Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.19Å; D44-R47 PolarHBondContact O-N 2.91Å; D44-N48 WeakPolarHBondContact O-CB 3.19Å; D44-N48 VanDerWaalsContact O-CG 3.23Å; D44-N48 PolarHBondContact O-N 2.88Å; D44-N48 PolarHBondContact O-ND2 2.96Å
45	G	37.4	Very low	43.8	Very low	31 Å²	31	96.6 Å²	96.6	32%	0.32	48%	0.475	S	S	.	.	H	α-helix	trans	-59.5	-42.9	173.2	0	0	0	0	0	112	C41 E43 T49	C41-G45 WeakPolarHBondContact O-CA 3.43Å; C41-G45 PolarHBondContact O-N 3.41Å; E43-G45 VanDerWaalsContact C-N 3.34Å; G45-T49 WeakPolarHBondContact O-CB 3.42Å; G45-T49 PolarHBondContact O-N 3.16Å; G45-T49 PolarHBondContact O-OG1 3.1Å
46	L	39.1	Very low	43.7	Very low	67 Å²	67	91.5 Å²	91.5	35%	0.351	45%	0.454	S	S	.	.	H	α-helix	trans	-64	-44.7	177.1	-165.1	82.9	0	0	0	110.5	L42 E43 D44 T49 I50 V233	L42-L46 WeakPolarHBondContact O-CB 3.5Å; L42-L46 PolarHBondContact O-N 3.41Å; E43-L46 WeakPolarHBondContact O-CB 3.43Å; E43-L46 PolarHBondContact O-N 3.01Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.19Å; L46-T49 CarbonylContact O-C 3.58Å; L46-T49 PolarHBondContact O-N 2.88Å; L46-I50 HydrophobicContact CD2-CD1 4.45Å; L46-I50 HydrophobicContact CG-CD1 4.29Å; L46-I50 VanDerWaalsContact O-CG1 3.29Å; L46-I50 WeakPolarHBondContact O-CG1 3.15Å; L46-I50 PolarHBondContact O-N 3.36Å; L46-V233 HydrophobicContact CD1-CB 4.18Å; L46-V233 HydrophobicContact CD1-CG1 3.88Å; L46-V233 HydrophobicContact CD1-CG2 3.95Å; L46-V233 HydrophobicContact CG-CG1 4.18Å
47	R	48.1	Very low	43.1	Very low	184 Å²	184	89.6 Å²	89.6	69%	0.694	44%	0.443	S	S	*	.	H	α-helix	trans	-63.3	-46.2	179.1	-158.2	-179.6	-146.8	-169.4	5	111.6	E43 D44 T49 I50 Q51	E43-R47 WeakPolarHBondContact O-CB 3.47Å; E43-R47 PolarHBondContact O-N 2.86Å; D44-R47 PolarHBondContact O-N 2.91Å; R47-T49 VanDerWaalsContact C-N 3.26Å; R47-T49 PolarHBondContact O-N 2.95Å; R47-I50 PolarHBondContact O-N 2.81Å; R47-Q51 PolarHBondContact O-N 3.35Å
48	N	44.9	Very low	43.1	Very low	109 Å²	109	84.2 Å²	84.2	58%	0.583	43%	0.429	S	S	*	.	H	α-helix	trans	-62	-37.5	174.1	-69.7	-20.8	0	0	0	111.3	D44 Q51 Y52	D44-N48 WeakPolarHBondContact O-CB 3.19Å; D44-N48 VanDerWaalsContact O-CG 3.23Å; D44-N48 PolarHBondContact O-N 2.88Å; D44-N48 PolarHBondContact O-ND2 2.96Å; N48-Q51 PolarHBondContact O-N 2.9Å; N48-Y52 VanDerWaalsContact O-CB 3.29Å; N48-Y52 WeakPolarHBondContact O-CB 3.21Å; N48-Y52 PolarHBondContact O-N 2.87Å
49	T	37.6	Very low	43.1	Very low	33 Å²	33	83.7 Å²	83.7	20%	0.202	43%	0.425	C	S	.	.	H	α-helix	trans	-69.4	-43.4	177.3	-51.3	0	0	0	0	111.1	G45 L46 R47 Q51 Y52 C53 L229 V233	G45-T49 WeakPolarHBondContact O-CB 3.42Å; G45-T49 PolarHBondContact O-N 3.16Å; G45-T49 PolarHBondContact O-OG1 3.1Å; L46-T49 CarbonylContact O-C 3.58Å; L46-T49 PolarHBondContact O-N 2.88Å; R47-T49 VanDerWaalsContact C-N 3.26Å; R47-T49 PolarHBondContact O-N 2.95Å; T49-Q51 VanDerWaalsContact C-N 3.3Å; T49-Q51 PolarHBondContact O-N 2.89Å; T49-Y52 CarbonylContact O-C 3.37Å; T49-Y52 PolarHBondContact O-N 3.34Å; T49-C53 VanDerWaalsContact O-CB 3.25Å; T49-C53 WeakPolarHBondContact O-CB 3.34Å; T49-C53 PolarHBondContact O-N 2.79Å; T49-C53 PolarHBondContact O-SG 2.74Å; T49-L229 HydrophobicContact CG2-CB 4.11Å; T49-L229 HydrophobicContact CG2-CD2 3.95Å; T49-L229 HydrophobicContact CG2-CG 4.49Å; T49-V233 HydrophobicContact CG2-CG2 3.45Å; T49-V233 VanDerWaalsContact CG2-CG2 3.45Å
50	I	43.9	Very low	42.8	Very low	68 Å²	68	82.2 Å²	82.2	35%	0.349	41%	0.411	S	S	.	.	H	α-helix	trans	-57.8	-46	174.3	-68.3	166.5	0	0	0	110	L46 R47 C53 D54 V233	L46-I50 HydrophobicContact CD2-CD1 4.45Å; L46-I50 HydrophobicContact CG-CD1 4.29Å; L46-I50 VanDerWaalsContact O-CG1 3.29Å; L46-I50 WeakPolarHBondContact O-CG1 3.15Å; L46-I50 PolarHBondContact O-N 3.36Å; R47-I50 PolarHBondContact O-N 2.81Å; I50-C53 CarbonylContact O-C 3.57Å; I50-C53 WeakPolarHBondContact O-CA 3.3Å; I50-C53 VanDerWaalsContact O-CB 3.22Å; I50-C53 WeakPolarHBondContact O-CB 3.39Å; I50-C53 PolarHBondContact O-N 3.44Å; I50-C53 VanDerWaalsContact O-N 3.11Å; I50-D54 PolarHBondContact O-N 3.11Å; I50-V233 HydrophobicContact CD1-CG1 4Å; I50-V233 HydrophobicContact CG1-CG1 3.29Å
51	Q	47.5	Very low	42.5	Very low	120 Å²	120	84.1 Å²	84.1	56%	0.561	42%	0.417	S	S	*	.	H	α-helix	trans	-64.7	-43.4	179.5	-171.2	149.5	6.5	0	0	111.8	R47 N48 T49 C53 D54 D55	R47-Q51 PolarHBondContact O-N 3.35Å; N48-Q51 PolarHBondContact O-N 2.9Å; T49-Q51 VanDerWaalsContact C-N 3.3Å; T49-Q51 PolarHBondContact O-N 2.89Å; Q51-C53 PolarHBondContact O-N 3.24Å; Q51-D54 PolarHBondContact O-N 2.95Å; Q51-D55 VanDerWaalsContact O-CG 3.24Å; Q51-D55 PolarHBondContact O-N 3.43Å
52	Y	40.7	Very low	42.7	Very low	130 Å²	130	84.3 Å²	84.3	51%	0.51	41%	0.405	S	S	.	.	H	α-helix	trans	-61.9	-33.7	172.6	-173.8	-112.2	0	0	0	112.5	N48 T49 L56	N48-Y52 VanDerWaalsContact O-CB 3.29Å; N48-Y52 WeakPolarHBondContact O-CB 3.21Å; N48-Y52 PolarHBondContact O-N 2.87Å; T49-Y52 CarbonylContact O-C 3.37Å; T49-Y52 PolarHBondContact O-N 3.34Å; Y52-L56 HydrophobicContact CD1-CD1 3.46Å; Y52-L56 VanDerWaalsContact CD1-CD1 3.46Å; Y52-L56 HydrophobicContact CD1-CG 4.32Å; Y52-L56 HydrophobicContact CE1-CD1 3.2Å; Y52-L56 HydrophobicContact CE1-CG 4.03Å; Y52-L56 HydrophobicContact CG-CD1 4.23Å; Y52-L56 VanDerWaalsContact O-CB 3.25Å; Y52-L56 WeakPolarHBondContact O-CB 3.23Å; Y52-L56 WeakPolarHBondContact O-CD1 3.38Å; Y52-L56 VanDerWaalsContact O-CG 3.24Å; Y52-L56 WeakPolarHBondContact O-CG 3.45Å; Y52-L56 PolarHBondContact O-N 2.93Å
53	C	38	Very low	42.7	Very low	9 Å²	9	85.2 Å²	85.2	6%	0.061	40%	0.402	C	S	.	.	H	α-helix	trans	-68.3	-40.4	175.2	-74.1	0	0	0	0	112.1	T49 I50 Q51 L56 R57 I230	T49-C53 VanDerWaalsContact O-CB 3.25Å; T49-C53 WeakPolarHBondContact O-CB 3.34Å; T49-C53 PolarHBondContact O-N 2.79Å; T49-C53 PolarHBondContact O-SG 2.74Å; I50-C53 CarbonylContact O-C 3.57Å; I50-C53 WeakPolarHBondContact O-CA 3.3Å; I50-C53 VanDerWaalsContact O-CB 3.22Å; I50-C53 WeakPolarHBondContact O-CB 3.39Å; I50-C53 PolarHBondContact O-N 3.44Å; I50-C53 VanDerWaalsContact O-N 3.11Å; Q51-C53 PolarHBondContact O-N 3.24Å; C53-L56 PolarHBondContact O-N 2.79Å; C53-R57 WeakPolarHBondContact O-CB 3.3Å; C53-R57 PolarHBondContact O-N 3.23Å; C53-I230 HydrophobicContact CB-CB 4.43Å; C53-I230 HydrophobicContact CB-CG1 3.54Å; C53-I230 WeakPolarHBondContact SG-CA 3.41Å; C53-I230 WeakPolarHBondContact SG-CG1 2.98Å
54	D	45.7	Very low	42.4	Very low	57 Å²	57	82.3 Å²	82.3	31%	0.305	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-45.7	172.7	-73.9	-38.1	0	0	0	110.4	I50 Q51 L56 R57 D58	I50-D54 PolarHBondContact O-N 3.11Å; Q51-D54 PolarHBondContact O-N 2.95Å; D54-L56 VanDerWaalsContact C-N 3.28Å; D54-L56 PolarHBondContact O-N 3.22Å; D54-R57 WeakPolarHBondContact O-CB 3.46Å; D54-R57 PolarHBondContact O-N 3.33Å; D54-R57 VanDerWaalsContact O-N 3.09Å; D54-R57 IonicContact OD1-CZ 3.29Å; D54-R57 VanDerWaalsContact OD1-CZ 3.29Å; D54-R57 IonicContact OD1-NH1 2.73Å; D54-R57 PolarHBondContact OD1-NH1 3.24Å; D54-R57 IonicContact OD1-NH2 3.29Å; D54-R57 PolarHBondContact OD1-NH2 2.79Å; D54-D58 WeakPolarHBondContact O-CB 3.42Å; D54-D58 PolarHBondContact O-N 3.06Å
55	D	46.2	Very low	42.6	Very low	91 Å²	91	81.5 Å²	81.5	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-58.3	-41.4	174.7	-65.8	-22.1	0	0	0	111.5	Q51 D58 E59	Q51-D55 VanDerWaalsContact O-CG 3.24Å; Q51-D55 PolarHBondContact O-N 3.43Å; D55-D58 PolarHBondContact O-N 3.2Å; D55-E59 VanDerWaalsContact O-CB 3.29Å; D55-E59 WeakPolarHBondContact O-CB 3.33Å; D55-E59 PolarHBondContact O-N 3.43Å
56	L	38.5	Very low	43	Very low	44 Å²	44	82.8 Å²	82.8	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-67.3	-39	175.3	-83.3	164.2	0	0	0	112.5	Y52 C53 D54 F60 P226	Y52-L56 HydrophobicContact CD1-CD1 3.46Å; Y52-L56 VanDerWaalsContact CD1-CD1 3.46Å; Y52-L56 HydrophobicContact CD1-CG 4.32Å; Y52-L56 HydrophobicContact CE1-CD1 3.2Å; Y52-L56 HydrophobicContact CE1-CG 4.03Å; Y52-L56 HydrophobicContact CG-CD1 4.23Å; Y52-L56 VanDerWaalsContact O-CB 3.25Å; Y52-L56 WeakPolarHBondContact O-CB 3.23Å; Y52-L56 WeakPolarHBondContact O-CD1 3.38Å; Y52-L56 VanDerWaalsContact O-CG 3.24Å; Y52-L56 WeakPolarHBondContact O-CG 3.45Å; Y52-L56 PolarHBondContact O-N 2.93Å; C53-L56 PolarHBondContact O-N 2.79Å; D54-L56 VanDerWaalsContact C-N 3.28Å; D54-L56 PolarHBondContact O-N 3.22Å; L56-F60 WeakPolarHBondContact O-CB 3.5Å; L56-F60 PolarHBondContact O-N 3.37Å; L56-P226 HydrophobicContact CD1-CB 3.77Å; L56-P226 HydrophobicContact CD1-CG 3.75Å; L56-P226 HydrophobicContact CD2-CG 4.16Å
57	R	39.4	Very low	43	Very low	105 Å²	105	80.2 Å²	80.2	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-46.6	174.4	-178.1	-167.7	65.7	-132.3	-12.5	109.9	C53 D54 F60 E61	C53-R57 WeakPolarHBondContact O-CB 3.3Å; C53-R57 PolarHBondContact O-N 3.23Å; D54-R57 WeakPolarHBondContact O-CB 3.46Å; D54-R57 PolarHBondContact O-N 3.33Å; D54-R57 VanDerWaalsContact O-N 3.09Å; D54-R57 IonicContact OD1-CZ 3.29Å; D54-R57 VanDerWaalsContact OD1-CZ 3.29Å; D54-R57 IonicContact OD1-NH1 2.73Å; D54-R57 PolarHBondContact OD1-NH1 3.24Å; D54-R57 IonicContact OD1-NH2 3.29Å; D54-R57 PolarHBondContact OD1-NH2 2.79Å; R57-F60 CarbonylContact O-C 3.55Å; R57-F60 WeakPolarHBondContact O-CA 2.98Å; R57-F60 WeakPolarHBondContact O-CB 3.4Å; R57-F60 PolarHBondContact O-N 2.73Å; R57-F60 VanDerWaalsContact O-N 3.13Å; R57-E61 HydrophobicContact CG-CG 4.5Å; R57-E61 WeakPolarHBondContact O-CG 2.95Å; R57-E61 PolarHBondContact O-N 2.91Å
58	D	47.5	Very low	42.8	Very low	82 Å²	82	75.7 Å²	75.7	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-67.4	-43.1	-177	-65.5	-1.2	0	0	0	110.6	D54 D55 F60 E61 R62	D54-D58 WeakPolarHBondContact O-CB 3.42Å; D54-D58 PolarHBondContact O-N 3.06Å; D55-D58 PolarHBondContact O-N 3.2Å; D58-F60 VanDerWaalsContact C-N 3.29Å; D58-F60 PolarHBondContact O-N 3.17Å; D58-E61 PolarHBondContact O-N 2.85Å; D58-R62 WeakPolarHBondContact O-CB 3.46Å; D58-R62 PolarHBondContact O-N 2.97Å
59	E	41.6	Very low	43.2	Very low	75 Å²	75	75 Å²	75	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-61.7	-38.5	170.6	177	62.2	-166.2	0	0	111.1	D55 R62 R63	D55-E59 VanDerWaalsContact O-CB 3.29Å; D55-E59 WeakPolarHBondContact O-CB 3.33Å; D55-E59 PolarHBondContact O-N 3.43Å; E59-R62 VanDerWaalsContact CD-NH2 3.29Å; E59-R62 WeakPolarHBondContact O-CB 3.25Å; E59-R62 PolarHBondContact O-N 2.83Å; E59-R62 IonicContact OE1-CZ 3.59Å; E59-R62 IonicContact OE1-NE 3.76Å; E59-R62 IonicContact OE1-NH2 2.61Å; E59-R62 PolarHBondContact OE1-NH2 3.3Å; E59-R62 IonicContact OE2-CZ 2.73Å; E59-R62 IonicContact OE2-NE 2.76Å; E59-R62 PolarHBondContact OE2-NE 3.34Å; E59-R62 IonicContact OE2-NH2 3.62Å; E59-R62 PolarHBondContact OE2-NH2 2.92Å; E59-R62 VanDerWaalsContact OE2-NH2 3.15Å; E59-R63 VanDerWaalsContact O-CG 3.28Å; E59-R63 WeakPolarHBondContact O-CG 3.38Å; E59-R63 PolarHBondContact O-N 2.81Å; E59-R63 IonicContact OE1-CZ 3.36Å; E59-R63 IonicContact OE1-NE 3.15Å; E59-R63 PolarHBondContact OE1-NE 3.36Å; E59-R63 IonicContact OE1-NH2 3.57Å; E59-R63 PolarHBondContact OE1-NH2 2.8Å
60	F	37.1	Very low	43.5	Very low	29 Å²	29	75.8 Å²	75.8	13%	0.127	38%	0.378	C	S	.	.	H	α-helix	trans	-67.2	-46.3	177.2	175.1	-98	0	0	0	112.5	L56 R57 D58 R62 R63 L64 A192 P195 L196	L56-F60 WeakPolarHBondContact O-CB 3.5Å; L56-F60 PolarHBondContact O-N 3.37Å; R57-F60 CarbonylContact O-C 3.55Å; R57-F60 WeakPolarHBondContact O-CA 2.98Å; R57-F60 WeakPolarHBondContact O-CB 3.4Å; R57-F60 PolarHBondContact O-N 2.73Å; R57-F60 VanDerWaalsContact O-N 3.13Å; D58-F60 VanDerWaalsContact C-N 3.29Å; D58-F60 PolarHBondContact O-N 3.17Å; F60-R62 PolarHBondContact O-N 3.18Å; F60-R63 CarbonylContact O-C 3.56Å; F60-R63 PolarHBondContact O-N 2.7Å; F60-R63 VanDerWaalsContact O-N 3.1Å; F60-L64 HydrophobicContact CD1-CD1 4.18Å; F60-L64 HydrophobicContact CE1-CD1 3.28Å; F60-L64 HydrophobicContact CE2-CD1 4.43Å; F60-L64 HydrophobicContact CZ-CD1 3.44Å; F60-L64 VanDerWaalsContact CZ-CD1 3.44Å; F60-L64 WeakPolarHBondContact O-CB 3.03Å; F60-L64 PolarHBondContact O-N 3.19Å; F60-A192 HydrophobicContact CD1-CB 4Å; F60-A192 HydrophobicContact CE1-CB 3.26Å; F60-A192 HydrophobicContact CE2-CB 4.5Å; F60-A192 HydrophobicContact CZ-CB 3.57Å; F60-A192 WeakPolarHBondContact CZ-O 2.95Å; F60-P195 HydrophobicContact CZ-CB 4.19Å; F60-P195 HydrophobicContact CZ-CG 4.45Å; F60-L196 HydrophobicContact CD2-CD1 3.32Å; F60-L196 HydrophobicContact CD2-CG 3.59Å; F60-L196 HydrophobicContact CE2-CB 3.85Å; F60-L196 HydrophobicContact CE2-CD1 3.31Å; F60-L196 HydrophobicContact CE2-CG 3.36Å; F60-L196 HydrophobicContact CG-CD1 4.49Å; F60-L196 HydrophobicContact CZ-CD1 4.45Å
61	E	44.6	Very low	43.5	Very low	113 Å²	113	75.8 Å²	75.8	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-58.5	-39.7	174.2	-76.5	-176.4	179.3	0	0	110.9	R57 D58 L64 S65	R57-E61 HydrophobicContact CG-CG 4.5Å; R57-E61 WeakPolarHBondContact O-CG 2.95Å; R57-E61 PolarHBondContact O-N 2.91Å; D58-E61 PolarHBondContact O-N 2.85Å; E61-L64 WeakPolarHBondContact O-CB 3.36Å; E61-L64 PolarHBondContact O-N 2.74Å; E61-S65 PolarHBondContact O-N 2.83Å
62	R	47	Very low	43.7	Very low	97 Å²	97	74.1 Å²	74.1	37%	0.366	37%	0.373	S	S	.	.	H	α-helix	trans	-58.7	-50.7	172	-163.8	-176.8	72.9	73.4	8.3	111.2	D58 E59 F60 L64 S65 E66	D58-R62 WeakPolarHBondContact O-CB 3.46Å; D58-R62 PolarHBondContact O-N 2.97Å; E59-R62 VanDerWaalsContact CD-NH2 3.29Å; E59-R62 WeakPolarHBondContact O-CB 3.25Å; E59-R62 PolarHBondContact O-N 2.83Å; E59-R62 IonicContact OE1-CZ 3.59Å; E59-R62 IonicContact OE1-NE 3.76Å; E59-R62 IonicContact OE1-NH2 2.61Å; E59-R62 PolarHBondContact OE1-NH2 3.3Å; E59-R62 IonicContact OE2-CZ 2.73Å; E59-R62 IonicContact OE2-NE 2.76Å; E59-R62 PolarHBondContact OE2-NE 3.34Å; E59-R62 IonicContact OE2-NH2 3.62Å; E59-R62 PolarHBondContact OE2-NH2 2.92Å; E59-R62 VanDerWaalsContact OE2-NH2 3.15Å; F60-R62 PolarHBondContact O-N 3.18Å; R62-L64 VanDerWaalsContact C-N 3.29Å; R62-L64 PolarHBondContact O-N 2.8Å; R62-S65 PolarHBondContact O-N 3.3Å; R62-S65 PolarHBondContact O-OG 2.83Å; R62-E66 IonicContact CZ-OE1 3.87Å; R62-E66 IonicContact NH1-OE1 2.73Å; R62-E66 PolarHBondContact NH1-OE1 2.95Å; R62-E66 IonicContact NH1-OE2 2.7Å; R62-E66 WeakPolarHBondContact O-CG 3.05Å; R62-E66 PolarHBondContact O-N 3.2Å
63	R	38.8	Very low	44.2	Very low	116 Å²	116	72 Å²	72	44%	0.438	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-32.4	176.5	-65.6	-58.7	-178.5	163	2.6	113.6	E59 F60 E66 A67	E59-R63 VanDerWaalsContact O-CG 3.28Å; E59-R63 WeakPolarHBondContact O-CG 3.38Å; E59-R63 PolarHBondContact O-N 2.81Å; E59-R63 IonicContact OE1-CZ 3.36Å; E59-R63 IonicContact OE1-NE 3.15Å; E59-R63 PolarHBondContact OE1-NE 3.36Å; E59-R63 IonicContact OE1-NH2 3.57Å; E59-R63 PolarHBondContact OE1-NH2 2.8Å; F60-R63 CarbonylContact O-C 3.56Å; F60-R63 PolarHBondContact O-N 2.7Å; F60-R63 VanDerWaalsContact O-N 3.1Å; R63-E66 WeakPolarHBondContact CD-OE2 3.16Å; R63-E66 IonicContact NH1-OE2 2.87Å; R63-E66 CarbonylContact O-C 3.59Å; R63-E66 PolarHBondContact O-N 3.42Å; R63-A67 PolarHBondContact O-N 3.04Å
64	L	38.9	Very low	44.3	Very low	68 Å²	68	72.6 Å²	72.6	36%	0.356	37%	0.373	S	S	.	.	H	α-helix	trans	-69.5	-40.1	177.7	-159.1	140.6	0	0	0	110.9	F60 E61 R62 E66 A67 P195	F60-L64 HydrophobicContact CD1-CD1 4.18Å; F60-L64 HydrophobicContact CE1-CD1 3.28Å; F60-L64 HydrophobicContact CE2-CD1 4.43Å; F60-L64 HydrophobicContact CZ-CD1 3.44Å; F60-L64 VanDerWaalsContact CZ-CD1 3.44Å; F60-L64 WeakPolarHBondContact O-CB 3.03Å; F60-L64 PolarHBondContact O-N 3.19Å; E61-L64 WeakPolarHBondContact O-CB 3.36Å; E61-L64 PolarHBondContact O-N 2.74Å; R62-L64 VanDerWaalsContact C-N 3.29Å; R62-L64 PolarHBondContact O-N 2.8Å; L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 2.9Å; L64-A67 VanDerWaalsContact O-CB 3.28Å; L64-A67 WeakPolarHBondContact O-CB 3.44Å; L64-A67 PolarHBondContact O-N 3.34Å; L64-P195 HydrophobicContact CD1-CB 3.59Å; L64-P195 HydrophobicContact CD1-CG 3.41Å; L64-P195 VanDerWaalsContact CD1-CG 3.41Å; L64-P195 HydrophobicContact CG-CB 3.71Å; L64-P195 HydrophobicContact CG-CG 3.8Å
65	S	52.4	Low	44.4	Very low	84 Å²	84	76.3 Å²	76.3	59%	0.587	38%	0.383	S	S	*	.	H	α-helix	trans	-67.5	-28.3	172.6	75.4	0	0	0	0	112.8	E61 R62 P68	E61-S65 PolarHBondContact O-N 2.83Å; R62-S65 PolarHBondContact O-N 3.3Å; R62-S65 PolarHBondContact O-OG 2.83Å; S65-P68 WeakPolarHBondContact O-CD 3.3Å
66	E	45.7	Very low	44.6	Very low	57 Å²	57	76.7 Å²	76.7	27%	0.266	38%	0.38	S	S	.	.	H	α-helix	trans	-78.7	-19.1	172.4	-69.7	173.7	-179.8	0	0	112.9	R62 R63 L64 P68 T69 V70	R62-E66 IonicContact CZ-OE1 3.87Å; R62-E66 IonicContact NH1-OE1 2.73Å; R62-E66 PolarHBondContact NH1-OE1 2.95Å; R62-E66 IonicContact NH1-OE2 2.7Å; R62-E66 WeakPolarHBondContact O-CG 3.05Å; R62-E66 PolarHBondContact O-N 3.2Å; R63-E66 WeakPolarHBondContact CD-OE2 3.16Å; R63-E66 IonicContact NH1-OE2 2.87Å; R63-E66 CarbonylContact O-C 3.59Å; R63-E66 PolarHBondContact O-N 3.42Å; L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 2.9Å; E66-P68 VanDerWaalsContact C-CD 3.46Å; E66-T69 PolarHBondContact O-N 3.37Å; E66-T69 VanDerWaalsContact O-N 3.12Å; E66-T69 PolarHBondContact O-OG1 3.43Å; E66-V70 HydrophobicContact CB-CG2 4.24Å; E66-V70 WeakPolarHBondContact O-CG2 3.29Å; E66-V70 PolarHBondContact O-N 3.4Å
67	A	39.4	Very low	45.1	Very low	14 Å²	14	78.1 Å²	78.1	12%	0.116	39%	0.385	C	S	.	.	H	α-helix	trans	-56.9	-42.8	-172.9	0	0	0	0	0	113.9	R63 L64 T69 V70 V71	R63-A67 PolarHBondContact O-N 3.04Å; L64-A67 VanDerWaalsContact O-CB 3.28Å; L64-A67 WeakPolarHBondContact O-CB 3.44Å; L64-A67 PolarHBondContact O-N 3.34Å; A67-T69 VanDerWaalsContact C-N 3.35Å; A67-T69 PolarHBondContact O-N 2.98Å; A67-V70 PolarHBondContact O-N 3.03Å; A67-V71 WeakPolarHBondContact O-CB 3.28Å; A67-V71 VanDerWaalsContact O-CG2 3.25Å; A67-V71 WeakPolarHBondContact O-CG2 3.43Å; A67-V71 PolarHBondContact O-N 3.43Å
68	P	43.6	Very low	45.2	Very low	89 Å²	89	78.3 Å²	78.3	58%	0.578	39%	0.392	S	S	*	.	H	α-helix	trans	-61.2	-43.4	176.7	-20.2	32.2	0	0	0	112.1	S65 E66 V71 E72	S65-P68 WeakPolarHBondContact O-CD 3.3Å; E66-P68 VanDerWaalsContact C-CD 3.46Å; P68-V71 PolarHBondContact O-N 2.94Å; P68-E72 WeakPolarHBondContact O-CB 3.27Å; P68-E72 PolarHBondContact O-N 3.23Å
69	T	52.2	Low	45.2	Very low	95 Å²	95	80.3 Å²	80.3	58%	0.583	40%	0.399	S	S	*	.	H	α-helix	trans	-63.7	-42.3	176.8	11.1	0	0	0	0	110.9	E66 A67 E72 D73	E66-T69 PolarHBondContact O-N 3.37Å; E66-T69 VanDerWaalsContact O-N 3.12Å; E66-T69 PolarHBondContact O-OG1 3.43Å; A67-T69 VanDerWaalsContact C-N 3.35Å; A67-T69 PolarHBondContact O-N 2.98Å; T69-E72 PolarHBondContact O-N 3.11Å; T69-D73 WeakPolarHBondContact O-CB 3.28Å; T69-D73 PolarHBondContact O-N 3.42Å
70	V	45.5	Very low	45.9	Very low	49 Å²	49	83.8 Å²	83.8	30%	0.297	42%	0.415	S	S	.	.	H	α-helix	trans	-67.4	-40.7	178.4	-162.5	0	0	0	0	111.4	E66 A67 E72 D73 V74 S202	E66-V70 HydrophobicContact CB-CG2 4.24Å; E66-V70 WeakPolarHBondContact O-CG2 3.29Å; E66-V70 PolarHBondContact O-N 3.4Å; A67-V70 PolarHBondContact O-N 3.03Å; V70-E72 VanDerWaalsContact C-N 3.31Å; V70-E72 PolarHBondContact O-N 3.43Å; V70-D73 PolarHBondContact O-N 3.13Å; V70-V74 HydrophobicContact CG1-CG2 4.47Å; V70-V74 VanDerWaalsContact O-CB 3.27Å; V70-V74 WeakPolarHBondContact O-CB 3.25Å; V70-V74 WeakPolarHBondContact O-CG2 3.5Å; V70-V74 PolarHBondContact O-N 3.26Å; V70-S202 WeakPolarHBondContact CG1-OG 3.24Å
71	V	42.6	Very low	46.1	Very low	67 Å²	67	84.8 Å²	84.8	41%	0.406	43%	0.434	S	S	.	.	H	α-helix	trans	-61.2	-41.2	175.6	169.6	0	0	0	0	111.1	A67 P68 V74 R75 V198	A67-V71 WeakPolarHBondContact O-CB 3.28Å; A67-V71 VanDerWaalsContact O-CG2 3.25Å; A67-V71 WeakPolarHBondContact O-CG2 3.43Å; A67-V71 PolarHBondContact O-N 3.43Å; P68-V71 PolarHBondContact O-N 2.94Å; V71-V74 WeakPolarHBondContact O-CB 3.43Å; V71-V74 PolarHBondContact O-N 2.97Å; V71-R75 WeakPolarHBondContact O-CB 3.3Å; V71-R75 PolarHBondContact O-N 2.76Å; V71-V198 HydrophobicContact CG2-CG1 3.68Å
72	E	51.4	Low	46.1	Very low	86 Å²	86	84.9 Å²	84.9	40%	0.402	44%	0.438	S	S	.	.	H	α-helix	trans	-69.2	-41.8	177.9	-162.5	64.2	-163.8	0	0	111.9	P68 T69 V70 V74 R75 K76	P68-E72 WeakPolarHBondContact O-CB 3.27Å; P68-E72 PolarHBondContact O-N 3.23Å; T69-E72 PolarHBondContact O-N 3.11Å; V70-E72 VanDerWaalsContact C-N 3.31Å; V70-E72 PolarHBondContact O-N 3.43Å; E72-V74 VanDerWaalsContact C-N 3.27Å; E72-V74 PolarHBondContact O-N 3.41Å; E72-R75 PolarHBondContact O-N 2.74Å; E72-K76 WeakPolarHBondContact O-CG 3.27Å; E72-K76 PolarHBondContact O-N 2.91Å
73	D	51.8	Low	46	Very low	86 Å²	86	89.8 Å²	89.8	46%	0.46	46%	0.462	S	S	.	.	H	α-helix	trans	-61.7	-38.1	174.7	-125.7	37.5	0	0	0	111.6	T69 V70 K76 K77	T69-D73 WeakPolarHBondContact O-CB 3.28Å; T69-D73 PolarHBondContact O-N 3.42Å; V70-D73 PolarHBondContact O-N 3.13Å; D73-K76 PolarHBondContact O-N 3.02Å; D73-K77 WeakPolarHBondContact O-CG 3.46Å; D73-K77 PolarHBondContact O-N 3.13Å
74	V	40.9	Very low	46.3	Very low	20 Å²	20	87.1 Å²	87.1	12%	0.121	46%	0.461	C	S	.	.	H	α-helix	trans	-65.4	-47.7	174.6	158.1	0	0	0	0	111.3	V70 V71 E72 K76 K77 I78 S202 I205	V70-V74 HydrophobicContact CG1-CG2 4.47Å; V70-V74 VanDerWaalsContact O-CB 3.27Å; V70-V74 WeakPolarHBondContact O-CB 3.25Å; V70-V74 WeakPolarHBondContact O-CG2 3.5Å; V70-V74 PolarHBondContact O-N 3.26Å; V71-V74 WeakPolarHBondContact O-CB 3.43Å; V71-V74 PolarHBondContact O-N 2.97Å; E72-V74 VanDerWaalsContact C-N 3.27Å; E72-V74 PolarHBondContact O-N 3.41Å; V74-K76 VanDerWaalsContact C-N 3.28Å; V74-K76 PolarHBondContact O-N 3.18Å; V74-K77 PolarHBondContact O-N 3.29Å; V74-I78 HydrophobicContact CG1-CD1 4Å; V74-I78 WeakPolarHBondContact O-CG1 3.45Å; V74-I78 PolarHBondContact O-N 2.88Å; V74-S202 WeakPolarHBondContact CG2-O 3.28Å; V74-I205 HydrophobicContact CB-CD1 4.42Å; V74-I205 HydrophobicContact CG1-CB 4.37Å; V74-I205 HydrophobicContact CG1-CD1 3.25Å; V74-I205 HydrophobicContact CG1-CG1 4.37Å; V74-I205 HydrophobicContact CG1-CG2 4.34Å; V74-I205 HydrophobicContact CG2-CB 4.26Å; V74-I205 HydrophobicContact CG2-CD1 4.34Å
75	R	46.4	Very low	46.5	Very low	135 Å²	135	89.3 Å²	89.3	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-57.7	-45.6	176.9	-178.8	-176.7	169.3	-176	-0	110.2	V71 E72 I78 E79	V71-R75 WeakPolarHBondContact O-CB 3.3Å; V71-R75 PolarHBondContact O-N 2.76Å; E72-R75 PolarHBondContact O-N 2.74Å; R75-I78 PolarHBondContact O-N 2.93Å; R75-E79 HydrophobicContact CG-CG 4.49Å; R75-E79 WeakPolarHBondContact CG-OE1 3.47Å; R75-E79 IonicContact CZ-OE1 3.79Å; R75-E79 IonicContact NE-OE1 3.72Å; R75-E79 PolarHBondContact NE-OE1 3.17Å; R75-E79 IonicContact NH2-OE1 2.89Å; R75-E79 WeakPolarHBondContact O-CB 3.27Å; R75-E79 VanDerWaalsContact O-CG 3.31Å; R75-E79 WeakPolarHBondContact O-CG 3.47Å; R75-E79 PolarHBondContact O-N 3.46Å
76	K	52.1	Low	46.1	Very low	99 Å²	99	86.6 Å²	86.6	43%	0.43	46%	0.462	S	S	.	.	H	α-helix	trans	-59.5	-46.2	173.8	-74.4	179.2	-178.4	177.3	0	112.5	E72 D73 V74 I78 E79 E80	E72-K76 WeakPolarHBondContact O-CG 3.27Å; E72-K76 PolarHBondContact O-N 2.91Å; D73-K76 PolarHBondContact O-N 3.02Å; V74-K76 VanDerWaalsContact C-N 3.28Å; V74-K76 PolarHBondContact O-N 3.18Å; K76-I78 VanDerWaalsContact C-N 3.3Å; K76-I78 PolarHBondContact O-N 2.78Å; K76-E79 CarbonylContact O-C 3.57Å; K76-E79 PolarHBondContact O-N 3.28Å; K76-E79 VanDerWaalsContact O-N 3.14Å; K76-E80 VanDerWaalsContact O-CB 3.31Å; K76-E80 WeakPolarHBondContact O-CB 3.47Å; K76-E80 VanDerWaalsContact O-CG 3.27Å; K76-E80 WeakPolarHBondContact O-CG 2.85Å; K76-E80 PolarHBondContact O-N 3.24Å
77	K	47.6	Very low	46	Very low	75 Å²	75	87.4 Å²	87.4	33%	0.326	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-33.5	177.8	-77.6	174.8	-177.9	168.7	0	113.6	D73 V74 N82 I205	D73-K77 WeakPolarHBondContact O-CG 3.46Å; D73-K77 PolarHBondContact O-N 3.13Å; V74-K77 PolarHBondContact O-N 3.29Å; K77-N82 WeakPolarHBondContact O-CB 3.39Å; K77-N82 PolarHBondContact O-N 3.37Å; K77-I205 HydrophobicContact CB-CG2 4.31Å
78	I	42.3	Very low	46.4	Very low	108 Å²	108	95.5 Å²	95.5	55%	0.554	50%	0.501	S	S	*	.	H	α-helix	trans	-68.5	-46.4	172.1	-67.3	168.8	0	0	0	110	V74 R75 K76 G81 I205	V74-I78 HydrophobicContact CG1-CD1 4Å; V74-I78 WeakPolarHBondContact O-CG1 3.45Å; V74-I78 PolarHBondContact O-N 2.88Å; R75-I78 PolarHBondContact O-N 2.93Å; K76-I78 VanDerWaalsContact C-N 3.3Å; K76-I78 PolarHBondContact O-N 2.78Å; I78-G81 PolarHBondContact O-N 2.92Å; I78-I205 HydrophobicContact CD1-CD1 4.09Å; I78-I205 HydrophobicContact CG1-CG2 4.26Å
79	E	48.2	Very low	46.6	Very low	124 Å²	124	97 Å²	97	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-65	-38.1	179.7	-74.5	174.4	-178	0	0	112.2	R75 K76 G81	R75-E79 HydrophobicContact CG-CG 4.49Å; R75-E79 WeakPolarHBondContact CG-OE1 3.47Å; R75-E79 IonicContact CZ-OE1 3.79Å; R75-E79 IonicContact NE-OE1 3.72Å; R75-E79 PolarHBondContact NE-OE1 3.17Å; R75-E79 IonicContact NH2-OE1 2.89Å; R75-E79 WeakPolarHBondContact O-CB 3.27Å; R75-E79 VanDerWaalsContact O-CG 3.31Å; R75-E79 WeakPolarHBondContact O-CG 3.47Å; R75-E79 PolarHBondContact O-N 3.46Å; K76-E79 CarbonylContact O-C 3.57Å; K76-E79 PolarHBondContact O-N 3.28Å; K76-E79 VanDerWaalsContact O-N 3.14Å; E79-G81 PolarHBondContact O-N 2.77Å
80	E	55.7	Low	46.3	Very low	148 Å²	148	92.8 Å²	92.8	69%	0.692	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	4.2	176.1	-73.6	174.4	-179.1	0	0	113.1	K76 N82	K76-E80 VanDerWaalsContact O-CB 3.31Å; K76-E80 WeakPolarHBondContact O-CB 3.47Å; K76-E80 VanDerWaalsContact O-CG 3.27Å; K76-E80 WeakPolarHBondContact O-CG 2.85Å; K76-E80 PolarHBondContact O-N 3.24Å; E80-N82 PolarHBondContact O-N 3.24Å; E80-N82 VanDerWaalsContact O-N 3.17Å
81	G	41.2	Very low	46.2	Very low	50 Å²	50	92.5 Å²	92.5	52%	0.515	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	24.6	170.4	0	0	0	0	0	112.7	I78 E79 K83	I78-G81 PolarHBondContact O-N 2.92Å; E79-G81 PolarHBondContact O-N 2.77Å; G81-K83 VanDerWaalsContact C-N 3.29Å; G81-K83 PolarHBondContact O-N 2.78Å
82	N	44.2	Very low	46.5	Very low	115 Å²	115	95.3 Å²	95.3	62%	0.615	47%	0.471	S	S	*	.			trans	-62.7	100.4	173.4	-137.5	-12.9	0	0	0	106	K77 E80 S84	K77-N82 WeakPolarHBondContact O-CB 3.39Å; K77-N82 PolarHBondContact O-N 3.37Å; E80-N82 PolarHBondContact O-N 3.24Å; E80-N82 VanDerWaalsContact O-N 3.17Å; N82-S84 PolarHBondContact O-N 2.73Å
83	K	44.5	Very low	46.4	Very low	200 Å²	200	92.7 Å²	92.7	87%	0.87	46%	0.459	S	S	*	.			trans	-66.1	69.7	175.2	-71.1	178.6	-179.6	174.7	0	107	G81 S85	G81-K83 VanDerWaalsContact C-N 3.29Å; G81-K83 PolarHBondContact O-N 2.78Å; K83-S85 PolarHBondContact O-N 2.7Å
84	S	45.4	Very low	46.1	Very low	60 Å²	60	89.1 Å²	89.1	42%	0.42	44%	0.44	S	S	.	.			trans	-54.7	122.7	171.4	68.8	0	0	0	0	104.9	N82 V86	N82-S84 PolarHBondContact O-N 2.73Å; S84-V86 PolarHBondContact O-N 2.97Å
85	S	44.6	Very low	46.5	Very low	114 Å²	114	93.2 Å²	93.2	80%	0.797	46%	0.457	S	S	*	.			trans	-65	24.1	173.1	53.2	0	0	0	0	112.5	K83 D87	K83-S85 PolarHBondContact O-N 2.7Å; S85-D87 PolarHBondContact O-N 2.79Å
86	V	42	Very low	46.6	Very low	28 Å²	28	87.7 Å²	87.7	17%	0.17	44%	0.437	C	S	.	.			trans	-85	110.4	-174	178.4	0	0	0	0	106.1	S84 K88 V91	S84-V86 PolarHBondContact O-N 2.97Å; V86-K88 PolarHBondContact O-N 3.29Å; V86-V91 HydrophobicContact CG1-CB 4.42Å; V86-V91 HydrophobicContact CG1-CG2 3.11Å
87	D	44.4	Very low	46.5	Very low	74 Å²	74	84.3 Å²	84.3	40%	0.396	43%	0.425	S	S	.	.			trans	-55.3	115.9	169.9	-177.2	2.6	0	0	0	108.7	S85 R89 S90 V91 M209	S85-D87 PolarHBondContact O-N 2.79Å; D87-R89 PolarHBondContact O-N 3.43Å; D87-R89 VanDerWaalsContact O-N 3.09Å; D87-R89 VanDerWaalsContact OD1-CB 3.28Å; D87-R89 WeakPolarHBondContact OD1-CB 3.41Å; D87-R89 PolarHBondContact OD1-N 2.77Å; D87-S90 PolarHBondContact O-N 2.63Å; D87-V91 PolarHBondContact O-N 3.31Å; D87-M209 HydrophobicContact CB-CE 3.49Å; D87-M209 VanDerWaalsContact CB-CE 3.49Å
88	K	47.4	Very low	46.5	Very low	183 Å²	183	81.3 Å²	81.3	80%	0.796	41%	0.413	S	S	*	.	H	α-helix	trans	-54	-29.3	177.4	-68.8	-178.2	178	-179	0	111.1	V86 R92	V86-K88 PolarHBondContact O-N 3.29Å; K88-R92 VanDerWaalsContact O-CB 3.25Å; K88-R92 WeakPolarHBondContact O-CB 3.13Å; K88-R92 PolarHBondContact O-N 3.47Å; K88-R92 VanDerWaalsContact O-N 3.09Å
89	R	48.4	Very low	46.8	Very low	122 Å²	122	79.8 Å²	79.8	46%	0.46	41%	0.406	S	S	.	.	H	α-helix	trans	-64.9	-43.8	178.4	-166.6	175.4	-180	173.5	-3.1	111.7	D87 R92 L93 D270	D87-R89 PolarHBondContact O-N 3.43Å; D87-R89 VanDerWaalsContact O-N 3.09Å; D87-R89 VanDerWaalsContact OD1-CB 3.28Å; D87-R89 WeakPolarHBondContact OD1-CB 3.41Å; D87-R89 PolarHBondContact OD1-N 2.77Å; R89-R92 PolarHBondContact O-N 3.22Å; R89-L93 WeakPolarHBondContact O-CB 3.47Å; R89-L93 PolarHBondContact O-N 2.87Å; R89-D270 IonicContact CZ-OD1 3.2Å; R89-D270 IonicContact NH1-OD1 3.2Å; R89-D270 IonicContact NH2-OD1 3.07Å; R89-D270 PolarHBondContact NH2-OD1 3.18Å
90	S	45.1	Very low	47.1	Very low	5 Å²	5	75.1 Å²	75.1	4%	0.035	38%	0.383	C	S	.	.	H	α-helix	trans	-70.1	-44.5	-179	-60.5	0	0	0	0	112.3	D87 R92 L93 I94	D87-S90 PolarHBondContact O-N 2.63Å; S90-R92 VanDerWaalsContact C-N 3.29Å; S90-R92 PolarHBondContact O-N 3.29Å; S90-L93 PolarHBondContact O-N 3.34Å; S90-I94 VanDerWaalsContact O-CB 3.3Å; S90-I94 WeakPolarHBondContact O-CB 3.46Å; S90-I94 WeakPolarHBondContact O-CD1 3.04Å; S90-I94 WeakPolarHBondContact O-CG1 3.28Å; S90-I94 PolarHBondContact O-N 3.11Å
91	V	45.1	Very low	47	Very low	43 Å²	43	69.8 Å²	69.8	26%	0.261	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-41.4	175.6	173	0	0	0	0	111.2	V86 D87 I94 F95 F204	V86-V91 HydrophobicContact CG1-CB 4.42Å; V86-V91 HydrophobicContact CG1-CG2 3.11Å; D87-V91 PolarHBondContact O-N 3.31Å; V91-I94 WeakPolarHBondContact O-CB 3.39Å; V91-I94 PolarHBondContact O-N 3.47Å; V91-F95 WeakPolarHBondContact O-CB 3.22Å; V91-F95 PolarHBondContact O-N 2.96Å; V91-F204 HydrophobicContact CG2-CB 4.49Å; V91-F204 HydrophobicContact CG2-CD1 4.35Å
92	R	48.7	Very low	47.3	Very low	126 Å²	126	68.2 Å²	68.2	48%	0.475	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-47.5	176.2	-174.2	-178.6	-172	177.5	7	111.4	K88 R89 S90 I94 F95 E96 E157 R161	K88-R92 VanDerWaalsContact O-CB 3.25Å; K88-R92 WeakPolarHBondContact O-CB 3.13Å; K88-R92 PolarHBondContact O-N 3.47Å; K88-R92 VanDerWaalsContact O-N 3.09Å; R89-R92 PolarHBondContact O-N 3.22Å; S90-R92 VanDerWaalsContact C-N 3.29Å; S90-R92 PolarHBondContact O-N 3.29Å; R92-I94 VanDerWaalsContact C-N 3.27Å; R92-I94 PolarHBondContact O-N 3.2Å; R92-F95 PolarHBondContact O-N 2.85Å; R92-E96 IonicContact NE-OE1 2.87Å; R92-E96 WeakPolarHBondContact O-CB 3.25Å; R92-E96 VanDerWaalsContact O-CG 3.31Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 2.85Å; R92-E157 IonicContact CZ-OE1 3Å; R92-E157 IonicContact NH1-OE1 3.61Å; R92-E157 IonicContact NH2-OE1 3.52Å; R92-E157 PolarHBondContact NH2-OE1 2.93Å; R92-R161 VanDerWaalsContact NH2-CZ 3.3Å
93	L	48.2	Very low	47.6	Very low	32 Å²	32	63.8 Å²	63.8	17%	0.168	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-38.5	-179.5	-163.8	119	0	0	0	111.7	R89 S90 E96 C97 M260 F264	R89-L93 WeakPolarHBondContact O-CB 3.47Å; R89-L93 PolarHBondContact O-N 2.87Å; S90-L93 PolarHBondContact O-N 3.34Å; L93-E96 PolarHBondContact O-N 2.89Å; L93-C97 PolarHBondContact O-N 2.84Å; L93-C97 PolarHBondContact O-SG 2.9Å; L93-M260 HydrophobicContact CD2-CE 4.42Å; L93-M260 HydrophobicContact CD2-SD 4.34Å; L93-F264 HydrophobicContact CD1-CE2 4.39Å; L93-F264 HydrophobicContact CD1-CZ 3.98Å; L93-F264 HydrophobicContact CD2-CE2 3.74Å; L93-F264 HydrophobicContact CD2-CZ 4.17Å
94	I	46.9	Very low	48.1	Very low	11 Å²	11	55 Å²	55	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-48.8	175.7	-76.5	172.8	0	0	0	111.4	S90 V91 R92 E96 C97 C98 F204 F216 M257	S90-I94 VanDerWaalsContact O-CB 3.3Å; S90-I94 WeakPolarHBondContact O-CB 3.46Å; S90-I94 WeakPolarHBondContact O-CD1 3.04Å; S90-I94 WeakPolarHBondContact O-CG1 3.28Å; S90-I94 PolarHBondContact O-N 3.11Å; V91-I94 WeakPolarHBondContact O-CB 3.39Å; V91-I94 PolarHBondContact O-N 3.47Å; R92-I94 VanDerWaalsContact C-N 3.27Å; R92-I94 PolarHBondContact O-N 3.2Å; I94-E96 VanDerWaalsContact C-N 3.28Å; I94-E96 PolarHBondContact O-N 2.91Å; I94-C97 WeakPolarHBondContact O-CB 3.08Å; I94-C97 PolarHBondContact O-N 3.32Å; I94-C98 PolarHBondContact O-N 3.44Å; I94-F204 HydrophobicContact CB-CE1 4.43Å; I94-F204 HydrophobicContact CB-CZ 4.16Å; I94-F204 HydrophobicContact CD1-CD1 4.13Å; I94-F204 HydrophobicContact CD1-CE1 3.22Å; I94-F204 HydrophobicContact CD1-CZ 3.58Å; I94-F204 HydrophobicContact CG1-CE1 4.31Å; I94-F204 HydrophobicContact CG1-CZ 4.25Å; I94-F204 HydrophobicContact CG2-CD1 4.39Å; I94-F204 HydrophobicContact CG2-CD2 4.03Å; I94-F204 HydrophobicContact CG2-CE1 3.7Å; I94-F204 HydrophobicContact CG2-CE2 3.24Å; I94-F204 HydrophobicContact CG2-CZ 3.05Å; I94-F216 HydrophobicContact CB-CE1 4.08Å; I94-F216 HydrophobicContact CB-CZ 4.27Å; I94-F216 HydrophobicContact CD1-CD1 4.4Å; I94-F216 HydrophobicContact CG1-CD1 4.21Å; I94-F216 HydrophobicContact CG1-CE1 4Å; I94-F216 HydrophobicContact CG2-CD1 3.95Å; I94-F216 HydrophobicContact CG2-CD2 4.17Å; I94-F216 HydrophobicContact CG2-CE1 3.49Å; I94-F216 VanDerWaalsContact CG2-CE1 3.49Å; I94-F216 HydrophobicContact CG2-CE2 3.71Å; I94-F216 HydrophobicContact CG2-CG 4.25Å; I94-F216 HydrophobicContact CG2-CZ 3.33Å; I94-M257 HydrophobicContact CG1-CE 4.33Å
95	F	47.9	Very low	48.4	Very low	106 Å²	106	52.5 Å²	52.5	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-41.4	177.4	-174.2	-92.9	0	0	0	111	V91 R92 C98 L99 A201	V91-F95 WeakPolarHBondContact O-CB 3.22Å; V91-F95 PolarHBondContact O-N 2.96Å; R92-F95 PolarHBondContact O-N 2.85Å; F95-C98 PolarHBondContact O-N 3.41Å; F95-L99 WeakPolarHBondContact O-CB 3.41Å; F95-L99 PolarHBondContact O-N 3.4Å; F95-A201 HydrophobicContact CD2-CB 4.13Å; F95-A201 HydrophobicContact CE2-CB 4.45Å
96	E	48.8	Very low	48.7	Very low	19 Å²	19	50.9 Å²	50.9	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-51.2	172.4	-76.3	179.6	178.8	0	0	110.6	R92 L93 I94 C98 L99 W100 R161	R92-E96 IonicContact NE-OE1 2.87Å; R92-E96 WeakPolarHBondContact O-CB 3.25Å; R92-E96 VanDerWaalsContact O-CG 3.31Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 2.85Å; L93-E96 PolarHBondContact O-N 2.89Å; I94-E96 VanDerWaalsContact C-N 3.28Å; I94-E96 PolarHBondContact O-N 2.91Å; E96-C98 PolarHBondContact O-N 2.9Å; E96-L99 WeakPolarHBondContact O-CB 3.47Å; E96-L99 PolarHBondContact O-N 3.19Å; E96-L99 VanDerWaalsContact O-N 3.14Å; E96-W100 PolarHBondContact O-N 3.4Å; E96-W100 PolarHBondContact O-NE1 3.33Å; E96-R161 IonicContact OE1-CZ 3.48Å; E96-R161 IonicContact OE1-NE 2.69Å; E96-R161 PolarHBondContact OE1-NE 3.22Å; E96-R161 IonicContact OE1-NH2 3.62Å; E96-R161 PolarHBondContact OE1-NH2 2.89Å
97	C	49.3	Very low	49.2	Very low	28 Å²	28	49.7 Å²	49.7	19%	0.189	24%	0.236	C	C	.	.	H	α-helix	trans	-54.7	-45	175.1	-73	0	0	0	0	113.5	L93 I94 W100 Q101	L93-C97 PolarHBondContact O-N 2.84Å; L93-C97 PolarHBondContact O-SG 2.9Å; I94-C97 WeakPolarHBondContact O-CB 3.08Å; I94-C97 PolarHBondContact O-N 3.32Å; C97-W100 PolarHBondContact O-N 2.92Å; C97-Q101 WeakPolarHBondContact O-CB 3.29Å; C97-Q101 PolarHBondContact O-N 2.93Å
98	C	48	Very low	49.7	Very low	12 Å²	12	46.3 Å²	46.3	8%	0.081	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-46	175.4	-90.1	0	0	0	0	112.5	I94 F95 E96 W100 Q101 S102 A197 F216	I94-C98 PolarHBondContact O-N 3.44Å; F95-C98 PolarHBondContact O-N 3.41Å; E96-C98 PolarHBondContact O-N 2.9Å; C98-W100 VanDerWaalsContact C-N 3.28Å; C98-W100 PolarHBondContact O-N 2.86Å; C98-Q101 PolarHBondContact O-N 3.26Å; C98-S102 VanDerWaalsContact O-CB 3.31Å; C98-S102 WeakPolarHBondContact O-CB 3.45Å; C98-S102 PolarHBondContact O-N 3.48Å; C98-S102 PolarHBondContact O-OG 3.3Å; C98-A197 HydrophobicContact CB-CB 4.04Å; C98-F216 WeakPolarHBondContact SG-CE2 3.31Å; C98-F216 WeakPolarHBondContact SG-CZ 3.37Å
99	L	49.4	Very low	49.8	Very low	76 Å²	76	37.7 Å²	37.7	40%	0.398	18%	0.181	S	C	.	.	H	α-helix	trans	-61.3	-42.5	178.1	-171.9	70.7	0	0	0	109.9	F95 E96 S102 V103	F95-L99 WeakPolarHBondContact O-CB 3.41Å; F95-L99 PolarHBondContact O-N 3.4Å; E96-L99 WeakPolarHBondContact O-CB 3.47Å; E96-L99 PolarHBondContact O-N 3.19Å; E96-L99 VanDerWaalsContact O-N 3.14Å; L99-S102 WeakPolarHBondContact O-CB 3.23Å; L99-S102 PolarHBondContact O-N 3.12Å; L99-V103 VanDerWaalsContact O-CG2 3.27Å; L99-V103 WeakPolarHBondContact O-CG2 3.46Å; L99-V103 PolarHBondContact O-N 3.35Å
100	W	54.7	Low	50	Low	26 Å²	26	38.5 Å²	38.5	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-46.5	177.3	-59	140.4	0	0	0	112.7	E96 C97 C98 S102 V103 C104 R161 L164 L165 M168	E96-W100 PolarHBondContact O-N 3.4Å; E96-W100 PolarHBondContact O-NE1 3.33Å; C97-W100 PolarHBondContact O-N 2.92Å; C98-W100 VanDerWaalsContact C-N 3.28Å; C98-W100 PolarHBondContact O-N 2.86Å; W100-S102 VanDerWaalsContact C-N 3.31Å; W100-S102 PolarHBondContact O-N 2.9Å; W100-V103 PolarHBondContact O-N 3.48Å; W100-C104 WeakPolarHBondContact O-CB 3.2Å; W100-C104 PolarHBondContact O-N 3.49Å; W100-R161 HydrophobicContact CH2-CB 4.41Å; W100-R161 WeakPolarHBondContact CH2-O 3.26Å; W100-L164 HydrophobicContact CD2-CD2 3.52Å; W100-L164 HydrophobicContact CE3-CD2 4.09Å; W100-L164 HydrophobicContact CG-CD2 3.83Å; W100-L164 HydrophobicContact CH2-CD2 4.26Å; W100-L164 HydrophobicContact CZ2-CD2 3.69Å; W100-L164 HydrophobicContact CZ3-CD2 4.44Å; W100-L165 HydrophobicContact CE3-CB 4.43Å; W100-L165 HydrophobicContact CH2-CB 4.13Å; W100-L165 VanDerWaalsContact CZ3-CA 3.47Å; W100-L165 HydrophobicContact CZ3-CB 3.48Å; W100-L165 VanDerWaalsContact CZ3-CB 3.48Å; W100-L165 HydrophobicContact CZ3-CD1 3.84Å; W100-L165 HydrophobicContact CZ3-CG 3.85Å; W100-M168 HydrophobicContact CB-CG 4.19Å
101	Q	53.8	Low	50.5	Low	36 Å²	36	38.3 Å²	38.3	17%	0.168	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-39	178	-165.9	163.4	9.3	0	0	111.4	C97 C98 C104 M105 S220 F223 P224	C97-Q101 WeakPolarHBondContact O-CB 3.29Å; C97-Q101 PolarHBondContact O-N 2.93Å; C98-Q101 PolarHBondContact O-N 3.26Å; Q101-C104 PolarHBondContact O-N 3.43Å; Q101-M105 WeakPolarHBondContact O-CB 3.4Å; Q101-M105 VanDerWaalsContact O-CG 3.28Å; Q101-M105 WeakPolarHBondContact O-CG 3.28Å; Q101-M105 PolarHBondContact O-N 3.41Å; Q101-S220 PolarHBondContact NE2-O 2.92Å; Q101-S220 VanDerWaalsContact NE2-O 3.08Å; Q101-F223 HydrophobicContact CG-CD1 4.1Å; Q101-F223 HydrophobicContact CG-CE1 4.42Å; Q101-P224 VanDerWaalsContact NE2-CD 3.28Å
102	S	47.2	Very low	50.9	Low	17 Å²	17	36.2 Å²	36.2	12%	0.119	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-44.2	175.4	-60.3	0	0	0	0	112.1	C98 L99 W100 M105 L106 I193	C98-S102 VanDerWaalsContact O-CB 3.31Å; C98-S102 WeakPolarHBondContact O-CB 3.45Å; C98-S102 PolarHBondContact O-N 3.48Å; C98-S102 PolarHBondContact O-OG 3.3Å; L99-S102 WeakPolarHBondContact O-CB 3.23Å; L99-S102 PolarHBondContact O-N 3.12Å; W100-S102 VanDerWaalsContact C-N 3.31Å; W100-S102 PolarHBondContact O-N 2.9Å; S102-M105 PolarHBondContact O-N 2.91Å; S102-L106 WeakPolarHBondContact O-CB 3.39Å; S102-L106 PolarHBondContact O-N 3.26Å; S102-I193 VanDerWaalsContact CB-CG2 3.46Å
103	V	50.9	Low	51	Low	22 Å²	22	32.8 Å²	32.8	13%	0.133	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-43.9	176.2	169.7	0	0	0	0	110.9	L99 W100 M105 L106 A107 L165 M169	L99-V103 VanDerWaalsContact O-CG2 3.27Å; L99-V103 WeakPolarHBondContact O-CG2 3.46Å; L99-V103 PolarHBondContact O-N 3.35Å; W100-V103 PolarHBondContact O-N 3.48Å; V103-M105 PolarHBondContact O-N 3.27Å; V103-L106 PolarHBondContact O-N 2.84Å; V103-A107 WeakPolarHBondContact O-CB 3.13Å; V103-A107 PolarHBondContact O-N 2.96Å; V103-L165 HydrophobicContact CG1-CG 4.4Å; V103-M169 HydrophobicContact CG1-CB 4.03Å; V103-M169 HydrophobicContact CG1-CE 4.05Å
104	C	54.2	Low	51.3	Low	15 Å²	15	34.4 Å²	34.4	10%	0.101	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-47.7	176.4	-165.1	0	0	0	0	111.2	W100 Q101 L106 A107 F108 M168 G172	W100-C104 WeakPolarHBondContact O-CB 3.2Å; W100-C104 PolarHBondContact O-N 3.49Å; Q101-C104 PolarHBondContact O-N 3.43Å; C104-L106 PolarHBondContact O-N 2.91Å; C104-A107 PolarHBondContact O-N 3.28Å; C104-F108 VanDerWaalsContact O-CB 3.32Å; C104-F108 WeakPolarHBondContact O-CB 3.32Å; C104-F108 PolarHBondContact O-N 3.19Å; C104-M168 HydrophobicContact CB-CB 4.48Å; C104-M168 HydrophobicContact CB-CE 3.81Å; C104-G172 WeakPolarHBondContact O-CA 3.47Å
105	M	51.7	Low	51.6	Low	7 Å²	7	33.9 Å²	33.9	3%	0.034	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-38.6	178.9	-72.1	-62	-66.1	0	0	112.9	Q101 S102 V103 F108 A109 I193 F223 F227 W231	Q101-M105 WeakPolarHBondContact O-CB 3.4Å; Q101-M105 VanDerWaalsContact O-CG 3.28Å; Q101-M105 WeakPolarHBondContact O-CG 3.28Å; Q101-M105 PolarHBondContact O-N 3.41Å; S102-M105 PolarHBondContact O-N 2.91Å; V103-M105 PolarHBondContact O-N 3.27Å; M105-F108 WeakPolarHBondContact O-CB 3.11Å; M105-F108 PolarHBondContact O-N 3.32Å; M105-A109 PolarHBondContact O-N 2.89Å; M105-I193 HydrophobicContact CB-CD1 3.7Å; M105-I193 HydrophobicContact CB-CG1 4.39Å; M105-F223 HydrophobicContact CG-CE1 4.22Å; M105-F227 HydrophobicContact CE-CB 3.79Å; M105-F227 HydrophobicContact CE-CD1 4.12Å; M105-F227 HydrophobicContact CE-CG 4.12Å; M105-W231 HydrophobicContact CE-CE3 4.43Å; M105-W231 HydrophobicContact CE-CZ3 4.19Å
106	L	49.8	Very low	51.8	Low	81 Å²	81	32.2 Å²	32.2	42%	0.424	16%	0.16	S	C	.	.	H	α-helix	trans	-65.1	-44	175.3	-178	63.7	0	0	0	111.1	S102 V103 C104 F108 A109 W110	S102-L106 WeakPolarHBondContact O-CB 3.39Å; S102-L106 PolarHBondContact O-N 3.26Å; V103-L106 PolarHBondContact O-N 2.84Å; C104-L106 PolarHBondContact O-N 2.91Å; L106-F108 VanDerWaalsContact C-N 3.32Å; L106-F108 PolarHBondContact O-N 3.3Å; L106-A109 WeakPolarHBondContact O-CB 3.4Å; L106-A109 PolarHBondContact O-N 3.48Å; L106-W110 PolarHBondContact O-N 3.47Å
107	A	53.4	Low	52	Low	2 Å²	2	34 Å²	34	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-37.2	177.6	0	0	0	0	0	112	V103 C104 W110 G111 M169 F173	V103-A107 WeakPolarHBondContact O-CB 3.13Å; V103-A107 PolarHBondContact O-N 2.96Å; C104-A107 PolarHBondContact O-N 3.28Å; A107-W110 CarbonylContact O-C 3.58Å; A107-W110 WeakPolarHBondContact O-CB 3.06Å; A107-W110 PolarHBondContact O-N 3.21Å; A107-G111 PolarHBondContact O-N 3.44Å; A107-M169 HydrophobicContact CB-CB 4.22Å; A107-M169 HydrophobicContact CB-CG 3.68Å; A107-M169 WeakPolarHBondContact CB-O 3.24Å; A107-F173 HydrophobicContact CB-CB 4.38Å; A107-F173 WeakPolarHBondContact O-CA 3.33Å
108	F	54.7	Low	52.1	Low	3 Å²	3	37.1 Å²	37.1	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-48.2	170.8	176.8	-100.9	0	0	0	112	C104 M105 L106 W110 G111 V112 G172 E175 V179 W231	C104-F108 VanDerWaalsContact O-CB 3.32Å; C104-F108 WeakPolarHBondContact O-CB 3.32Å; C104-F108 PolarHBondContact O-N 3.19Å; M105-F108 WeakPolarHBondContact O-CB 3.11Å; M105-F108 PolarHBondContact O-N 3.32Å; L106-F108 VanDerWaalsContact C-N 3.32Å; L106-F108 PolarHBondContact O-N 3.3Å; F108-W110 VanDerWaalsContact C-N 3.3Å; F108-W110 PolarHBondContact O-N 2.92Å; F108-G111 PolarHBondContact O-N 2.94Å; F108-G111 VanDerWaalsContact O-N 3.11Å; F108-V112 HydrophobicContact CE1-CG2 4.39Å; F108-V112 HydrophobicContact CZ-CG2 4.3Å; F108-V112 WeakPolarHBondContact O-CG2 3.41Å; F108-V112 PolarHBondContact O-N 3.36Å; F108-G172 VanDerWaalsContact CA-C 3.49Å; F108-G172 WeakPolarHBondContact CA-O 3.4Å; F108-G172 WeakPolarHBondContact CB-O 3.45Å; F108-G172 PolarHBondContact N-O 2.83Å; F108-E175 HydrophobicContact CD2-CB 3.51Å; F108-E175 VanDerWaalsContact CE2-C 3.5Å; F108-E175 HydrophobicContact CE2-CB 3.83Å; F108-V179 HydrophobicContact CE2-CG2 3.78Å; F108-V179 HydrophobicContact CZ-CG2 3.74Å; F108-W231 HydrophobicContact CD1-CE3 4.01Å; F108-W231 AromaticContact CD1-CH2 3.04Å; F108-W231 HydrophobicContact CD1-CH2 3.04Å; F108-W231 AromaticContact CD1-CZ2 3.68Å; F108-W231 HydrophobicContact CD1-CZ2 3.68Å; F108-W231 AromaticContact CD1-CZ3 3.25Å; F108-W231 HydrophobicContact CD1-CZ3 3.25Å; F108-W231 AromaticContact CE1-CD2 3.76Å; F108-W231 HydrophobicContact CE1-CD2 3.76Å; F108-W231 AromaticContact CE1-CE2 3.63Å; F108-W231 AromaticContact CE1-CE3 3.56Å; F108-W231 HydrophobicContact CE1-CE3 3.56Å; F108-W231 AromaticContact CE1-CH2 3.1Å; F108-W231 HydrophobicContact CE1-CH2 3.1Å; F108-W231 AromaticContact CE1-CZ2 3.26Å; F108-W231 HydrophobicContact CE1-CZ2 3.26Å; F108-W231 AromaticContact CE1-CZ3 3.26Å; F108-W231 HydrophobicContact CE1-CZ3 3.26Å; F108-W231 HydrophobicContact CG-CH2 4.27Å; F108-W231 HydrophobicContact CZ-CH2 4.35Å; F108-W231 HydrophobicContact CZ-CZ2 4.2Å
109	A	49.3	Very low	52.5	Low	2 Å²	2	44.2 Å²	44.2	2%	0.017	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-40	173.9	0	0	0	0	0	113.2	M105 L106 T113 F185 P190 W231	M105-A109 PolarHBondContact O-N 2.89Å; L106-A109 WeakPolarHBondContact O-CB 3.4Å; L106-A109 PolarHBondContact O-N 3.48Å; A109-T113 VanDerWaalsContact O-CB 3.3Å; A109-T113 WeakPolarHBondContact O-CB 3.37Å; A109-T113 PolarHBondContact O-N 2.82Å; A109-T113 PolarHBondContact O-OG1 3.27Å; A109-F185 HydrophobicContact CB-CE1 4.07Å; A109-F185 HydrophobicContact CB-CZ 3.74Å; A109-P190 HydrophobicContact CB-CB 3.92Å; A109-P190 HydrophobicContact CB-CG 3.24Å; A109-W231 HydrophobicContact CB-CH2 3.94Å
110	W	52.8	Low	52.9	Low	140 Å²	140	42.9 Å²	42.9	53%	0.53	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-41.8	172	-82	1	0	0	0	112.7	L106 A107 F108 V112 T113 L114 F173	L106-W110 PolarHBondContact O-N 3.47Å; A107-W110 CarbonylContact O-C 3.58Å; A107-W110 WeakPolarHBondContact O-CB 3.06Å; A107-W110 PolarHBondContact O-N 3.21Å; F108-W110 VanDerWaalsContact C-N 3.3Å; F108-W110 PolarHBondContact O-N 2.92Å; W110-V112 VanDerWaalsContact C-N 3.33Å; W110-V112 PolarHBondContact O-N 3.42Å; W110-T113 PolarHBondContact O-N 3.23Å; W110-L114 HydrophobicContact CB-CD1 4.39Å; W110-L114 WeakPolarHBondContact O-CB 3.48Å; W110-L114 WeakPolarHBondContact O-CG 3.38Å; W110-L114 PolarHBondContact O-N 3.34Å; W110-F173 HydrophobicContact CB-CD2 4.5Å
111	G	56.4	Low	53.3	Low	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-45.8	175.9	0	0	0	0	0	111.9	A107 F108 G115 F173 L177	A107-G111 PolarHBondContact O-N 3.44Å; F108-G111 PolarHBondContact O-N 2.94Å; F108-G111 VanDerWaalsContact O-N 3.11Å; G111-G115 PolarHBondContact O-N 3.49Å; G111-F173 VanDerWaalsContact CA-CD2 3.46Å; G111-L177 WeakPolarHBondContact O-CD2 3.3Å
112	V	52.7	Low	54.2	Low	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-42.7	176.2	-179.3	0	0	0	0	111.8	F108 W110 G176 V179 F185 W231	F108-V112 HydrophobicContact CE1-CG2 4.39Å; F108-V112 HydrophobicContact CZ-CG2 4.3Å; F108-V112 WeakPolarHBondContact O-CG2 3.41Å; F108-V112 PolarHBondContact O-N 3.36Å; W110-V112 VanDerWaalsContact C-N 3.33Å; W110-V112 PolarHBondContact O-N 3.42Å; V112-G176 VanDerWaalsContact CG2-O 3.27Å; V112-G176 WeakPolarHBondContact CG2-O 3.4Å; V112-V179 HydrophobicContact CG2-CB 4.28Å; V112-V179 HydrophobicContact CG2-CG2 4.44Å; V112-F185 HydrophobicContact CB-CD2 4.24Å; V112-F185 HydrophobicContact CB-CE2 3.59Å; V112-F185 HydrophobicContact CB-CZ 4.39Å; V112-F185 HydrophobicContact CG1-CD2 3.65Å; V112-F185 HydrophobicContact CG1-CE2 3.4Å; V112-F185 VanDerWaalsContact CG1-CE2 3.4Å; V112-F185 HydrophobicContact CG2-CE2 4.43Å; V112-W231 HydrophobicContact CB-CZ2 4.28Å; V112-W231 HydrophobicContact CG2-CZ2 3.82Å
113	T	50.1	Low	55.1	Low	53 Å²	53	48.3 Å²	48.3	33%	0.325	27%	0.272	S	S	.	.	H	α-helix	trans	-69.6	-51.4	-177.2	-57.1	0	0	0	0	111.3	A109 W110 R116 F185	A109-T113 VanDerWaalsContact O-CB 3.3Å; A109-T113 WeakPolarHBondContact O-CB 3.37Å; A109-T113 PolarHBondContact O-N 2.82Å; A109-T113 PolarHBondContact O-OG1 3.27Å; W110-T113 PolarHBondContact O-N 3.23Å; T113-R116 WeakPolarHBondContact O-CB 3.32Å; T113-R116 PolarHBondContact O-N 3.49Å; T113-R116 VanDerWaalsContact O-N 3.11Å; T113-F185 WeakPolarHBondContact OG1-CD1 3.37Å; T113-F185 WeakPolarHBondContact OG1-CE1 3.45Å
114	L	55	Low	55.8	Low	66 Å²	66	48.9 Å²	48.9	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-68	-35.9	-178.6	-72.1	176.2	0	0	0	111.5	W110 R116 C117 L120 F173	W110-L114 HydrophobicContact CB-CD1 4.39Å; W110-L114 WeakPolarHBondContact O-CB 3.48Å; W110-L114 WeakPolarHBondContact O-CG 3.38Å; W110-L114 PolarHBondContact O-N 3.34Å; L114-R116 PolarHBondContact O-N 2.7Å; L114-C117 VanDerWaalsContact O-CB 3.31Å; L114-C117 WeakPolarHBondContact O-CB 3.24Å; L114-C117 PolarHBondContact O-N 3.27Å; L114-L120 HydrophobicContact CB-CD1 3.68Å; L114-L120 VanDerWaalsContact O-CB 3.3Å; L114-L120 WeakPolarHBondContact O-CB 3.48Å; L114-F173 HydrophobicContact CB-CE2 4.41Å; L114-F173 HydrophobicContact CD1-CE2 3.93Å
115	G	52.7	Low	56.5	Low	1 Å²	1	51.7 Å²	51.7	1%	0.01	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-9.8	172.2	0	0	0	0	0	114.4	G111 S121 R124	G111-G115 PolarHBondContact O-N 3.49Å; G115-S121 WeakPolarHBondContact O-CA 3.14Å; G115-R124 WeakPolarHBondContact O-CB 3.36Å; G115-R124 WeakPolarHBondContact O-CD 3.48Å
116	R	52	Low	57.5	Low	70 Å²	70	56.6 Å²	56.6	26%	0.264	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-14.4	172	-67.6	175.7	170.9	-178.3	-5.7	114	T113 L114 S181 I183 P184	T113-R116 WeakPolarHBondContact O-CB 3.32Å; T113-R116 PolarHBondContact O-N 3.49Å; T113-R116 VanDerWaalsContact O-N 3.11Å; L114-R116 PolarHBondContact O-N 2.7Å; R116-S181 PolarHBondContact NH2-O 3.38Å; R116-S181 PolarHBondContact NH2-OG 2.71Å; R116-I183 PolarHBondContact NH1-O 2.77Å; R116-I183 PolarHBondContact NH2-O 2.96Å; R116-P184 VanDerWaalsContact NH1-CA 3.3Å
117	C	53.9	Low	58.3	Low	58 Å²	58	52.7 Å²	52.7	39%	0.392	29%	0.287	S	S	.	.	S	Bend	trans	-65.9	140.7	171.8	-63.5	0	0	0	0	109.1	L114 L119 L120 S121	L114-C117 VanDerWaalsContact O-CB 3.31Å; L114-C117 WeakPolarHBondContact O-CB 3.24Å; L114-C117 PolarHBondContact O-N 3.27Å; C117-L119 PolarHBondContact O-N 3.44Å; C117-L120 CarbonylContact O-C 3.58Å; C117-L120 PolarHBondContact O-N 2.77Å; C117-S121 PolarHBondContact O-N 2.85Å
118	A	52.4	Low	58.9	Low	93 Å²	93	53.2 Å²	53.2	77%	0.769	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-29.9	-177.3	0	0	0	0	0	113.5	L120 S121	A118-L120 VanDerWaalsContact C-N 3.34Å; A118-L120 PolarHBondContact O-N 3.13Å; A118-S121 PolarHBondContact O-OG 2.89Å
119	L	56.1	Low	59.6	Low	160 Å²	160	59.8 Å²	59.8	84%	0.838	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.7	176.6	-111.2	109.4	0	0	0	113.9	C117	C117-L119 PolarHBondContact O-N 3.44Å
120	L	57.3	Low	60.4	Low	48 Å²	48	62.3 Å²	62.3	25%	0.251	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-0.6	-171.7	-68.3	169.1	0	0	0	112.6	L114 C117 A118 S122 L123 R124	L114-L120 HydrophobicContact CB-CD1 3.68Å; L114-L120 VanDerWaalsContact O-CB 3.3Å; L114-L120 WeakPolarHBondContact O-CB 3.48Å; C117-L120 CarbonylContact O-C 3.58Å; C117-L120 PolarHBondContact O-N 2.77Å; A118-L120 VanDerWaalsContact C-N 3.34Å; A118-L120 PolarHBondContact O-N 3.13Å; L120-S122 PolarHBondContact O-N 3.48Å; L120-L123 HydrophobicContact CD2-CB 4.39Å; L120-L123 HydrophobicContact CD2-CD2 3.86Å; L120-L123 WeakPolarHBondContact O-CB 3.37Å; L120-L123 PolarHBondContact O-N 3.09Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L120-R124 PolarHBondContact O-N 2.85Å
121	S	64	Low	60.7	Low	50 Å²	50	58.5 Å²	58.5	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-35.1	175.8	60.6	0	0	0	0	111.9	G115 C117 A118 R124 T125	G115-S121 WeakPolarHBondContact O-CA 3.14Å; C117-S121 PolarHBondContact O-N 2.85Å; A118-S121 PolarHBondContact O-OG 2.89Å; S121-R124 PolarHBondContact O-N 3.47Å; S121-T125 PolarHBondContact O-N 2.96Å; S121-T125 PolarHBondContact O-OG1 3.44Å
122	S	71	Confident	60.6	Low	82 Å²	82	65.1 Å²	65.1	57%	0.573	35%	0.348	S	S	*	.	H	α-helix	trans	-64.5	-46.1	172.9	55.1	0	0	0	0	112	L120 R124 T125 Y126	L120-S122 PolarHBondContact O-N 3.48Å; S122-R124 VanDerWaalsContact C-N 3.27Å; S122-R124 PolarHBondContact O-N 2.82Å; S122-T125 PolarHBondContact O-N 3.33Å; S122-Y126 WeakPolarHBondContact O-CB 3.49Å; S122-Y126 PolarHBondContact O-N 2.86Å
123	L	66.4	Low	61.4	Low	62 Å²	62	70.4 Å²	70.4	33%	0.325	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-40.5	175.6	-179	66.3	0	0	0	111	L120 Y126 A127 F134 L177	L120-L123 HydrophobicContact CD2-CB 4.39Å; L120-L123 HydrophobicContact CD2-CD2 3.86Å; L120-L123 WeakPolarHBondContact O-CB 3.37Å; L120-L123 PolarHBondContact O-N 3.09Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L123-Y126 PolarHBondContact O-N 3.31Å; L123-A127 WeakPolarHBondContact O-CB 3.26Å; L123-A127 PolarHBondContact O-N 3.18Å; L123-F134 HydrophobicContact CD1-CZ 4.49Å; L123-L177 HydrophobicContact CD2-CD1 3.81Å; L123-L177 HydrophobicContact CG-CD1 4.25Å
124	R	65.8	Low	62	Low	33 Å²	33	68.8 Å²	68.8	13%	0.125	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-48.8	176.2	-175.9	-177.2	175	-150.3	-4.9	111.8	G115 L120 S121 S122 Y126 A127 C128 L177 V179 K180 S181	G115-R124 WeakPolarHBondContact O-CB 3.36Å; G115-R124 WeakPolarHBondContact O-CD 3.48Å; L120-R124 PolarHBondContact O-N 2.85Å; S121-R124 PolarHBondContact O-N 3.47Å; S122-R124 VanDerWaalsContact C-N 3.27Å; S122-R124 PolarHBondContact O-N 2.82Å; R124-Y126 VanDerWaalsContact C-N 3.25Å; R124-Y126 PolarHBondContact O-N 2.89Å; R124-A127 PolarHBondContact O-N 3.42Å; R124-A127 VanDerWaalsContact O-N 3.1Å; R124-C128 WeakPolarHBondContact O-CB 3.45Å; R124-C128 PolarHBondContact O-N 3.33Å; R124-C128 PolarHBondContact O-SG 3.1Å; R124-C128 VanDerWaalsContact O-SG 3.34Å; R124-L177 HydrophobicContact CB-CD2 4.44Å; R124-L177 WeakPolarHBondContact CG-O 3.39Å; R124-V179 PolarHBondContact NE-O 3.31Å; R124-V179 PolarHBondContact NH2-O 3.29Å; R124-K180 PolarHBondContact NH2-O 2.77Å; R124-S181 VanDerWaalsContact NH2-N 3.18Å; R124-S181 PolarHBondContact NH2-O 2.84Å
125	T	68.8	Low	62.2	Low	75 Å²	75	69.6 Å²	69.6	46%	0.46	36%	0.36	S	S	.	.	H	α-helix	trans	-55.4	-46.9	175.8	-59.6	0	0	0	0	110.1	S121 S122 A127 C128 E129	S121-T125 PolarHBondContact O-N 2.96Å; S121-T125 PolarHBondContact O-OG1 3.44Å; S122-T125 PolarHBondContact O-N 3.33Å; T125-A127 PolarHBondContact O-N 2.96Å; T125-C128 PolarHBondContact O-N 3.47Å; T125-E129 WeakPolarHBondContact CG2-OE1 3.48Å; T125-E129 WeakPolarHBondContact O-CB 3.47Å; T125-E129 WeakPolarHBondContact O-CG 3.46Å; T125-E129 PolarHBondContact O-N 3.22Å
126	Y	73.7	Confident	62.4	Low	109 Å²	109	73.4 Å²	73.4	43%	0.427	39%	0.386	S	S	.	.	H	α-helix	trans	-59	-44.7	174.9	-178	-98.9	0	0	0	112.4	S122 L123 R124 E129 N130 F134	S122-Y126 WeakPolarHBondContact O-CB 3.49Å; S122-Y126 PolarHBondContact O-N 2.86Å; L123-Y126 PolarHBondContact O-N 3.31Å; R124-Y126 VanDerWaalsContact C-N 3.25Å; R124-Y126 PolarHBondContact O-N 2.89Å; Y126-E129 PolarHBondContact O-N 2.87Å; Y126-N130 WeakPolarHBondContact CD2-ND2 3.26Å; Y126-N130 HydrophobicContact CE1-CB 4.35Å; Y126-N130 WeakPolarHBondContact CE2-ND2 3.2Å; Y126-N130 WeakPolarHBondContact O-CA 3.33Å; Y126-N130 VanDerWaalsContact O-CB 3.23Å; Y126-N130 WeakPolarHBondContact O-CB 3.01Å; Y126-N130 PolarHBondContact O-N 3.47Å; Y126-N130 PolarHBondContact O-ND2 3.19Å; Y126-F134 AromaticContact CD1-CE2 3.85Å; Y126-F134 HydrophobicContact CD1-CE2 3.85Å; Y126-F134 HydrophobicContact CD1-CZ 4.23Å; Y126-F134 AromaticContact CE1-CE2 3.97Å; Y126-F134 HydrophobicContact CE1-CE2 3.97Å; Y126-F134 HydrophobicContact CE1-CZ 4.41Å
127	A	66.7	Low	62.9	Low	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-66.3	-36.2	177.7	0	0	0	0	0	113.2	L123 R124 T125 N130 Q131 F134 L177 T178	L123-A127 WeakPolarHBondContact O-CB 3.26Å; L123-A127 PolarHBondContact O-N 3.18Å; R124-A127 PolarHBondContact O-N 3.42Å; R124-A127 VanDerWaalsContact O-N 3.1Å; T125-A127 PolarHBondContact O-N 2.96Å; A127-N130 CarbonylContact O-C 3.58Å; A127-Q131 VanDerWaalsContact O-CA 3.28Å; A127-Q131 WeakPolarHBondContact O-CA 3.49Å; A127-Q131 VanDerWaalsContact O-CG 3.27Å; A127-Q131 WeakPolarHBondContact O-CG 3.18Å; A127-Q131 PolarHBondContact O-N 2.91Å; A127-F134 HydrophobicContact CB-CD2 3.74Å; A127-F134 HydrophobicContact CB-CE1 4.46Å; A127-F134 HydrophobicContact CB-CE2 3.49Å; A127-F134 VanDerWaalsContact CB-CE2 3.49Å; A127-F134 HydrophobicContact CB-CG 4.35Å; A127-F134 HydrophobicContact CB-CZ 3.87Å; A127-L177 HydrophobicContact CB-CB 4.15Å; A127-T178 HydrophobicContact CB-CG2 4.37Å
128	C	65.5	Low	63.2	Low	13 Å²	13	70.3 Å²	70.3	9%	0.088	37%	0.371	C	S	.	.	H	α-helix	trans	-72.7	-29.2	176.2	-74	0	0	0	0	113.1	R124 T125 Q131 K180	R124-C128 WeakPolarHBondContact O-CB 3.45Å; R124-C128 PolarHBondContact O-N 3.33Å; R124-C128 PolarHBondContact O-SG 3.1Å; R124-C128 VanDerWaalsContact O-SG 3.34Å; T125-C128 PolarHBondContact O-N 3.47Å; C128-Q131 WeakPolarHBondContact O-CG 3.29Å; C128-K180 HydrophobicContact CB-CD 4.45Å; C128-K180 HydrophobicContact CB-CG 3.76Å; C128-K180 WeakPolarHBondContact O-CE 3.3Å; C128-K180 PolarHBondContact O-NZ 2.83Å
129	E	68.2	Low	63.2	Low	141 Å²	141	68 Å²	68	66%	0.659	35%	0.352	S	S	*	.	H	α-helix	trans	-81.6	-35.9	173.2	-72.3	173.5	-178.7	0	0	111.5	T125 Y126	T125-E129 WeakPolarHBondContact CG2-OE1 3.48Å; T125-E129 WeakPolarHBondContact O-CB 3.47Å; T125-E129 WeakPolarHBondContact O-CG 3.46Å; T125-E129 PolarHBondContact O-N 3.22Å; Y126-E129 PolarHBondContact O-N 2.87Å
130	N	67.3	Low	63.2	Low	55 Å²	55	66.9 Å²	66.9	29%	0.294	34%	0.34	S	S	.	.			trans	-108.1	40	-177.4	-59.9	-86	0	0	0	111.9	Y126 A127 W132 F133 F134	Y126-N130 WeakPolarHBondContact CD2-ND2 3.26Å; Y126-N130 HydrophobicContact CE1-CB 4.35Å; Y126-N130 WeakPolarHBondContact CE2-ND2 3.2Å; Y126-N130 WeakPolarHBondContact O-CA 3.33Å; Y126-N130 VanDerWaalsContact O-CB 3.23Å; Y126-N130 WeakPolarHBondContact O-CB 3.01Å; Y126-N130 PolarHBondContact O-N 3.47Å; Y126-N130 PolarHBondContact O-ND2 3.19Å; A127-N130 CarbonylContact O-C 3.58Å; N130-W132 PolarHBondContact O-N 3.49Å; N130-F133 HydrophobicContact CB-CB 4.2Å; N130-F133 WeakPolarHBondContact O-CB 3.48Å; N130-F133 PolarHBondContact O-N 3.46Å; N130-F134 PolarHBondContact O-N 2.91Å
131	Q	59.4	Low	63.3	Low	59 Å²	59	67.6 Å²	67.6	28%	0.276	34%	0.342	S	S	.	.	H	α-helix	trans	-51.5	-36.2	-178.8	-71.5	177.1	-31.2	0	0	111.5	A127 C128 F133 F134 F135 T178	A127-Q131 VanDerWaalsContact O-CA 3.28Å; A127-Q131 WeakPolarHBondContact O-CA 3.49Å; A127-Q131 VanDerWaalsContact O-CG 3.27Å; A127-Q131 WeakPolarHBondContact O-CG 3.18Å; A127-Q131 PolarHBondContact O-N 2.91Å; C128-Q131 WeakPolarHBondContact O-CG 3.29Å; Q131-F133 PolarHBondContact O-N 2.96Å; Q131-F134 PolarHBondContact O-N 3.38Å; Q131-F135 HydrophobicContact CB-CD2 4.25Å; Q131-F135 HydrophobicContact CB-CE2 4.16Å; Q131-F135 WeakPolarHBondContact O-CD2 3.41Å; Q131-F135 PolarHBondContact O-N 2.98Å; Q131-T178 PolarHBondContact NE2-O 3.36Å
132	W	54.4	Low	62.9	Low	139 Å²	139	66.9 Å²	66.9	53%	0.527	33%	0.334	S	S	.	.	H	α-helix	trans	-56	-47.8	175	-66.1	110.5	0	0	0	114.3	N130 F134 F135 S136 F291	N130-W132 PolarHBondContact O-N 3.49Å; W132-F134 VanDerWaalsContact C-N 3.29Å; W132-F134 PolarHBondContact O-N 3.36Å; W132-F135 PolarHBondContact O-N 3.35Å; W132-S136 WeakPolarHBondContact O-CB 3.41Å; W132-S136 PolarHBondContact O-N 2.88Å; W132-S136 PolarHBondContact O-OG 3.32Å; W132-S136 VanDerWaalsContact O-OG 3.12Å; W132-F291 AromaticContact CE2-CZ 3.88Å; W132-F291 AromaticContact CH2-CD1 3.45Å; W132-F291 HydrophobicContact CH2-CD1 3.45Å; W132-F291 VanDerWaalsContact CH2-CD1 3.45Å; W132-F291 AromaticContact CH2-CD2 3.33Å; W132-F291 HydrophobicContact CH2-CD2 3.33Å; W132-F291 AromaticContact CH2-CE1 3.16Å; W132-F291 HydrophobicContact CH2-CE1 3.16Å; W132-F291 AromaticContact CH2-CE2 3.07Å; W132-F291 HydrophobicContact CH2-CE2 3.07Å; W132-F291 AromaticContact CH2-CG 3.54Å; W132-F291 HydrophobicContact CH2-CG 3.54Å; W132-F291 AromaticContact CH2-CZ 2.99Å; W132-F291 HydrophobicContact CH2-CZ 2.99Å; W132-F291 HydrophobicContact CZ2-CD1 4.25Å; W132-F291 AromaticContact CZ2-CD2 3.85Å; W132-F291 HydrophobicContact CZ2-CD2 3.85Å; W132-F291 AromaticContact CZ2-CE1 3.52Å; W132-F291 HydrophobicContact CZ2-CE1 3.52Å; W132-F291 AromaticContact CZ2-CE2 3.07Å; W132-F291 HydrophobicContact CZ2-CE2 3.07Å; W132-F291 HydrophobicContact CZ2-CG 4.39Å; W132-F291 AromaticContact CZ2-CZ 2.89Å; W132-F291 HydrophobicContact CZ2-CZ 2.89Å; W132-F291 AromaticContact CZ3-CD1 3.89Å; W132-F291 HydrophobicContact CZ3-CD1 3.89Å; W132-F291 HydrophobicContact CZ3-CD2 4.41Å; W132-F291 AromaticContact CZ3-CE1 3.74Å; W132-F291 HydrophobicContact CZ3-CE1 3.74Å; W132-F291 HydrophobicContact CZ3-CE2 4.31Å; W132-F291 HydrophobicContact CZ3-CG 4.24Å; W132-F291 AromaticContact CZ3-CZ 4Å; W132-F291 HydrophobicContact CZ3-CZ 4Å
133	F	69.3	Low	61.8	Low	112 Å²	112	66 Å²	66	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-43.9	179.2	173.1	-100.8	0	0	0	110.7	N130 Q131 S136 L137	N130-F133 HydrophobicContact CB-CB 4.2Å; N130-F133 WeakPolarHBondContact O-CB 3.48Å; N130-F133 PolarHBondContact O-N 3.46Å; Q131-F133 PolarHBondContact O-N 2.96Å; F133-S136 PolarHBondContact O-N 3.25Å; F133-L137 VanDerWaalsContact O-CB 3.28Å; F133-L137 WeakPolarHBondContact O-CB 3.41Å; F133-L137 PolarHBondContact O-N 2.92Å
134	F	62.7	Low	61.5	Low	18 Å²	18	67.4 Å²	67.4	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-71.2	-36.3	179.4	-76	-83	0	0	0	112.9	L123 Y126 A127 N130 Q131 W132 L137 M138 I174 T178	L123-F134 HydrophobicContact CD1-CZ 4.49Å; Y126-F134 AromaticContact CD1-CE2 3.85Å; Y126-F134 HydrophobicContact CD1-CE2 3.85Å; Y126-F134 HydrophobicContact CD1-CZ 4.23Å; Y126-F134 AromaticContact CE1-CE2 3.97Å; Y126-F134 HydrophobicContact CE1-CE2 3.97Å; Y126-F134 HydrophobicContact CE1-CZ 4.41Å; A127-F134 HydrophobicContact CB-CD2 3.74Å; A127-F134 HydrophobicContact CB-CE1 4.46Å; A127-F134 HydrophobicContact CB-CE2 3.49Å; A127-F134 VanDerWaalsContact CB-CE2 3.49Å; A127-F134 HydrophobicContact CB-CG 4.35Å; A127-F134 HydrophobicContact CB-CZ 3.87Å; N130-F134 PolarHBondContact O-N 2.91Å; Q131-F134 PolarHBondContact O-N 3.38Å; W132-F134 VanDerWaalsContact C-N 3.29Å; W132-F134 PolarHBondContact O-N 3.36Å; F134-L137 HydrophobicContact CD1-CD2 4.38Å; F134-L137 WeakPolarHBondContact O-CB 3.25Å; F134-L137 PolarHBondContact O-N 3.49Å; F134-M138 WeakPolarHBondContact O-CG 3.44Å; F134-M138 PolarHBondContact O-N 3.5Å; F134-I174 HydrophobicContact CB-CG2 3.74Å; F134-I174 HydrophobicContact CD1-CG1 4.35Å; F134-I174 HydrophobicContact CD1-CG2 3.69Å; F134-I174 HydrophobicContact CG-CG2 4.15Å; F134-T178 HydrophobicContact CB-CG2 3.74Å; F134-T178 HydrophobicContact CG-CG2 4.22Å
135	F	59.4	Low	61	Low	84 Å²	84	66.6 Å²	66.6	37%	0.368	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-44.8	171.4	-80.9	-59.9	0	0	0	112.2	Q131 W132 L137 M138 A139	Q131-F135 HydrophobicContact CB-CD2 4.25Å; Q131-F135 HydrophobicContact CB-CE2 4.16Å; Q131-F135 WeakPolarHBondContact O-CD2 3.41Å; Q131-F135 PolarHBondContact O-N 2.98Å; W132-F135 PolarHBondContact O-N 3.35Å; F135-L137 VanDerWaalsContact C-N 3.28Å; F135-L137 PolarHBondContact O-N 3.1Å; F135-M138 HydrophobicContact CD1-CE 3.26Å; F135-M138 HydrophobicContact CE1-CE 3.6Å; F135-M138 HydrophobicContact CG-CE 4.12Å; F135-M138 PolarHBondContact O-N 3.29Å; F135-A139 WeakPolarHBondContact O-CB 3.35Å; F135-A139 PolarHBondContact O-N 3.24Å
136	S	56.1	Low	60.2	Low	80 Å²	80	63.7 Å²	63.7	56%	0.559	31%	0.309	S	S	*	.	H	α-helix	trans	-61.8	-38	174.3	-63.2	0	0	0	0	111.9	W132 F133 A139 F140	W132-S136 WeakPolarHBondContact O-CB 3.41Å; W132-S136 PolarHBondContact O-N 2.88Å; W132-S136 PolarHBondContact O-OG 3.32Å; W132-S136 VanDerWaalsContact O-OG 3.12Å; F133-S136 PolarHBondContact O-N 3.25Å; S136-A139 WeakPolarHBondContact O-CB 3.09Å; S136-A139 PolarHBondContact O-N 3.4Å; S136-F140 PolarHBondContact O-N 2.94Å; S136-F140 VanDerWaalsContact O-N 3.1Å
137	L	63	Low	59.3	Low	54 Å²	54	65.7 Å²	65.7	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-43.4	175.6	-172.5	66.7	0	0	0	111.5	F133 F134 F135 F140 F141 I174	F133-L137 VanDerWaalsContact O-CB 3.28Å; F133-L137 WeakPolarHBondContact O-CB 3.41Å; F133-L137 PolarHBondContact O-N 2.92Å; F134-L137 HydrophobicContact CD1-CD2 4.38Å; F134-L137 WeakPolarHBondContact O-CB 3.25Å; F134-L137 PolarHBondContact O-N 3.49Å; F135-L137 VanDerWaalsContact C-N 3.28Å; F135-L137 PolarHBondContact O-N 3.1Å; L137-F140 WeakPolarHBondContact O-CB 3.45Å; L137-F140 PolarHBondContact O-N 3.15Å; L137-F141 HydrophobicContact CD1-CD2 4.17Å; L137-F141 HydrophobicContact CD1-CE2 3.73Å; L137-F141 HydrophobicContact CD2-CD2 4.48Å; L137-F141 HydrophobicContact CD2-CE2 3.91Å; L137-F141 HydrophobicContact CG-CD2 3.75Å; L137-F141 HydrophobicContact CG-CE2 3.52Å; L137-F141 VanDerWaalsContact O-CD2 3.27Å; L137-F141 WeakPolarHBondContact O-CD2 3.49Å; L137-F141 PolarHBondContact O-N 3.08Å; L137-I174 HydrophobicContact CD2-CD1 4.02Å; L137-I174 HydrophobicContact CG-CD1 4.48Å
138	M	59.2	Low	58.9	Low	9 Å²	9	67.3 Å²	67.3	4%	0.044	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-41.1	173.7	-71	-171.3	-66.7	0	0	112.4	F134 F135 F140 F141 I142 I171 I174 E175	F134-M138 WeakPolarHBondContact O-CG 3.44Å; F134-M138 PolarHBondContact O-N 3.5Å; F135-M138 HydrophobicContact CD1-CE 3.26Å; F135-M138 HydrophobicContact CE1-CE 3.6Å; F135-M138 HydrophobicContact CG-CE 4.12Å; F135-M138 PolarHBondContact O-N 3.29Å; M138-F140 PolarHBondContact O-N 3.36Å; M138-F141 PolarHBondContact O-N 3.37Å; M138-F141 VanDerWaalsContact O-N 3.13Å; M138-I142 WeakPolarHBondContact O-CG1 3.45Å; M138-I142 PolarHBondContact O-N 2.84Å; M138-I171 HydrophobicContact SD-CG2 4.13Å; M138-I174 HydrophobicContact CE-CG2 4.18Å; M138-I174 HydrophobicContact CG-CB 4.16Å; M138-I174 HydrophobicContact CG-CD1 4.22Å; M138-I174 HydrophobicContact CG-CG2 3.71Å; M138-I174 HydrophobicContact SD-CB 4.13Å; M138-I174 HydrophobicContact SD-CG2 3.72Å; M138-E175 HydrophobicContact CE-CG 4Å; M138-E175 HydrophobicContact SD-CG 3.48Å; M138-E175 WeakPolarHBondContact SD-CG 3.35Å
139	A	52.5	Low	58.3	Low	45 Å²	45	69 Å²	69	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-24.2	175.3	0	0	0	0	0	112.7	F135 S136 P143	F135-A139 WeakPolarHBondContact O-CB 3.35Å; F135-A139 PolarHBondContact O-N 3.24Å; S136-A139 WeakPolarHBondContact O-CB 3.09Å; S136-A139 PolarHBondContact O-N 3.4Å; A139-P143 WeakPolarHBondContact O-CD 3.48Å; A139-P143 WeakPolarHBondContact O-CG 3.5Å
140	F	57.9	Low	57.6	Low	136 Å²	136	64.1 Å²	64.1	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-85.5	-42.1	170.5	-176.2	-95.3	0	0	0	112.7	S136 L137 M138 I142 P143 F144	S136-F140 PolarHBondContact O-N 2.94Å; S136-F140 VanDerWaalsContact O-N 3.1Å; L137-F140 WeakPolarHBondContact O-CB 3.45Å; L137-F140 PolarHBondContact O-N 3.15Å; M138-F140 PolarHBondContact O-N 3.36Å; F140-I142 PolarHBondContact O-N 2.8Å; F140-P143 VanDerWaalsContact O-CD 3.3Å; F140-P143 WeakPolarHBondContact O-CD 3.27Å; F140-P143 WeakPolarHBondContact O-CG 3.29Å; F140-F144 HydrophobicContact CE1-CB 4.43Å; F140-F144 VanDerWaalsContact O-CB 3.3Å; F140-F144 WeakPolarHBondContact O-CB 3.32Å; F140-F144 PolarHBondContact O-N 3.44Å; F140-F144 VanDerWaalsContact O-N 3.16Å
141	F	59.3	Low	57.3	Low	63 Å²	63	62.3 Å²	62.3	28%	0.276	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-39.3	-179.6	-88.9	-63	0	0	0	113.2	L137 M138 F144 N145 I174	L137-F141 HydrophobicContact CD1-CD2 4.17Å; L137-F141 HydrophobicContact CD1-CE2 3.73Å; L137-F141 HydrophobicContact CD2-CD2 4.48Å; L137-F141 HydrophobicContact CD2-CE2 3.91Å; L137-F141 HydrophobicContact CG-CD2 3.75Å; L137-F141 HydrophobicContact CG-CE2 3.52Å; L137-F141 VanDerWaalsContact O-CD2 3.27Å; L137-F141 WeakPolarHBondContact O-CD2 3.49Å; L137-F141 PolarHBondContact O-N 3.08Å; M138-F141 PolarHBondContact O-N 3.37Å; M138-F141 VanDerWaalsContact O-N 3.13Å; F141-F144 PolarHBondContact O-N 3.43Å; F141-N145 WeakPolarHBondContact O-CB 3.35Å; F141-N145 PolarHBondContact O-N 2.82Å; F141-N145 PolarHBondContact O-ND2 3.4Å; F141-I174 HydrophobicContact CD2-CD1 4.13Å; F141-I174 HydrophobicContact CE2-CD1 4.13Å
142	I	55.4	Low	57.2	Low	36 Å²	36	64.3 Å²	64.3	19%	0.185	31%	0.305	C	S	.	.	H	α-helix	trans	-58.7	-59.7	-179.8	-67.7	165	0	0	0	111.2	M138 F140 F144 N145 L146 I171 N280	M138-I142 WeakPolarHBondContact O-CG1 3.45Å; M138-I142 PolarHBondContact O-N 2.84Å; F140-I142 PolarHBondContact O-N 2.8Å; I142-F144 VanDerWaalsContact C-N 3.3Å; I142-F144 PolarHBondContact O-N 3.31Å; I142-N145 PolarHBondContact O-N 2.88Å; I142-L146 HydrophobicContact CG2-CD1 3.97Å; I142-L146 VanDerWaalsContact O-CG 3.3Å; I142-L146 WeakPolarHBondContact O-CG 3.49Å; I142-L146 PolarHBondContact O-N 3.35Å; I142-I171 HydrophobicContact CD1-CD1 4.49Å; I142-I171 HydrophobicContact CG1-CD1 3.56Å; I142-I171 HydrophobicContact CG1-CG1 4.32Å; I142-N280 HydrophobicContact CG2-CB 4.33Å
143	P	46.9	Very low	57.1	Low	62 Å²	62	66.8 Å²	66.8	40%	0.403	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-33.6	179.6	23.4	-32.2	0	0	0	112.7	A139 F140 L146 Y147	A139-P143 WeakPolarHBondContact O-CD 3.48Å; A139-P143 WeakPolarHBondContact O-CG 3.5Å; F140-P143 VanDerWaalsContact O-CD 3.3Å; F140-P143 WeakPolarHBondContact O-CD 3.27Å; F140-P143 WeakPolarHBondContact O-CG 3.29Å; P143-L146 PolarHBondContact O-N 2.68Å; P143-Y147 WeakPolarHBondContact O-CB 3.35Å; P143-Y147 PolarHBondContact O-N 3.35Å
144	F	60.2	Low	56.8	Low	93 Å²	93	68 Å²	68	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-46.3	176.1	-179.8	-100.8	0	0	0	112.5	F140 F141 I142 Y147 I148	F140-F144 HydrophobicContact CE1-CB 4.43Å; F140-F144 VanDerWaalsContact O-CB 3.3Å; F140-F144 WeakPolarHBondContact O-CB 3.32Å; F140-F144 PolarHBondContact O-N 3.44Å; F140-F144 VanDerWaalsContact O-N 3.16Å; F141-F144 PolarHBondContact O-N 3.43Å; I142-F144 VanDerWaalsContact C-N 3.3Å; I142-F144 PolarHBondContact O-N 3.31Å; F144-Y147 WeakPolarHBondContact O-CB 3.27Å; F144-Y147 PolarHBondContact O-N 2.8Å; F144-I148 HydrophobicContact CD1-CD1 4.01Å; F144-I148 HydrophobicContact CE1-CD1 3.39Å; F144-I148 HydrophobicContact CE1-CG1 4.43Å; F144-I148 HydrophobicContact CE2-CD1 4.39Å; F144-I148 HydrophobicContact CZ-CD1 3.62Å; F144-I148 HydrophobicContact CZ-CG1 4.44Å; F144-I148 PolarHBondContact O-N 3.5Å
145	N	54.6	Low	56.4	Low	15 Å²	15	69 Å²	69	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-67.6	-37.3	177.4	-78.2	-71.9	0	0	0	112	F141 I142 Y147 I148 Y149 S163 G167	F141-N145 WeakPolarHBondContact O-CB 3.35Å; F141-N145 PolarHBondContact O-N 2.82Å; F141-N145 PolarHBondContact O-ND2 3.4Å; I142-N145 PolarHBondContact O-N 2.88Å; N145-Y147 VanDerWaalsContact C-N 3.34Å; N145-I148 PolarHBondContact O-N 3.4Å; N145-Y149 WeakPolarHBondContact O-CB 3.41Å; N145-Y149 PolarHBondContact O-N 3.47Å; N145-S163 PolarHBondContact OD1-O 2.85Å; N145-S163 VanDerWaalsContact OD1-O 3.05Å; N145-G167 VanDerWaalsContact CG-CA 3.49Å; N145-G167 WeakPolarHBondContact ND2-CA 3.3Å; N145-G167 WeakPolarHBondContact OD1-CA 3.29Å
146	L	52.8	Low	56.8	Low	15 Å²	15	68 Å²	68	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-42.9	171.9	-69.7	172.4	0	0	0	111.3	I142 P143 I148 Y149 Y150 M276	I142-L146 HydrophobicContact CG2-CD1 3.97Å; I142-L146 VanDerWaalsContact O-CG 3.3Å; I142-L146 WeakPolarHBondContact O-CG 3.49Å; I142-L146 PolarHBondContact O-N 3.35Å; P143-L146 PolarHBondContact O-N 2.68Å; L146-I148 PolarHBondContact O-N 2.7Å; L146-Y149 PolarHBondContact O-N 3.31Å; L146-Y150 HydrophobicContact CB-CD2 4.37Å; L146-Y150 HydrophobicContact CB-CE2 4.34Å; L146-Y150 HydrophobicContact CD2-CE2 4.11Å; L146-Y150 WeakPolarHBondContact O-CD2 3.26Å; L146-Y150 PolarHBondContact O-N 3.06Å; L146-M276 HydrophobicContact CD2-CE 3.91Å
147	Y	54.3	Low	56.9	Low	151 Å²	151	68.2 Å²	68.2	59%	0.592	34%	0.336	S	S	*	.	H	α-helix	trans	-59	-45.9	176.7	172.3	-98.8	0	0	0	112.2	P143 F144 N145 Y150 S151	P143-Y147 WeakPolarHBondContact O-CB 3.35Å; P143-Y147 PolarHBondContact O-N 3.35Å; F144-Y147 WeakPolarHBondContact O-CB 3.27Å; F144-Y147 PolarHBondContact O-N 2.8Å; N145-Y147 VanDerWaalsContact C-N 3.34Å; Y147-Y150 PolarHBondContact O-N 2.91Å; Y147-S151 WeakPolarHBondContact O-CB 3.49Å; Y147-S151 PolarHBondContact O-N 3.17Å; Y147-S151 PolarHBondContact O-OG 2.79Å
148	I	57.9	Low	56.6	Low	33 Å²	33	73.2 Å²	73.2	17%	0.169	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-45.9	176.3	-66.2	172.9	0	0	0	110.6	F144 N145 L146 Y150 S151 R160 S163	F144-I148 HydrophobicContact CD1-CD1 4.01Å; F144-I148 HydrophobicContact CE1-CD1 3.39Å; F144-I148 HydrophobicContact CE1-CG1 4.43Å; F144-I148 HydrophobicContact CE2-CD1 4.39Å; F144-I148 HydrophobicContact CZ-CD1 3.62Å; F144-I148 HydrophobicContact CZ-CG1 4.44Å; F144-I148 PolarHBondContact O-N 3.5Å; N145-I148 PolarHBondContact O-N 3.4Å; L146-I148 PolarHBondContact O-N 2.7Å; I148-Y150 PolarHBondContact O-N 3.26Å; I148-S151 PolarHBondContact O-N 3.26Å; I148-S151 VanDerWaalsContact O-N 3.13Å; I148-R160 WeakPolarHBondContact O-CG 3.31Å; I148-S163 WeakPolarHBondContact CD1-OG 3.29Å
149	Y	54.2	Low	56.4	Low	50 Å²	50	75.8 Å²	75.8	20%	0.196	38%	0.376	C	S	.	.	H	α-helix	trans	-60.3	-33.3	-179.8	-179	-104	0	0	0	113	N145 L146 R160 L164	N145-Y149 WeakPolarHBondContact O-CB 3.41Å; N145-Y149 PolarHBondContact O-N 3.47Å; L146-Y149 PolarHBondContact O-N 3.31Å; Y149-R160 HydrophobicContact CD2-CB 4.22Å; Y149-R160 VanDerWaalsContact O-CD 3.23Å; Y149-R160 WeakPolarHBondContact O-CD 3.28Å; Y149-R160 PolarHBondContact O-NE 3.49Å; Y149-L164 HydrophobicContact CD1-CD1 4.38Å; Y149-L164 HydrophobicContact CD2-CB 4.33Å; Y149-L164 HydrophobicContact CD2-CD1 3.93Å; Y149-L164 HydrophobicContact CG-CD1 3.72Å
150	Y	52.7	Low	56.5	Low	38 Å²	38	75.1 Å²	75.1	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-92.6	-6.8	177.9	-66	-54.8	0	0	0	114.8	L146 Y147 I148 K152 I273	L146-Y150 HydrophobicContact CB-CD2 4.37Å; L146-Y150 HydrophobicContact CB-CE2 4.34Å; L146-Y150 HydrophobicContact CD2-CE2 4.11Å; L146-Y150 WeakPolarHBondContact O-CD2 3.26Å; L146-Y150 PolarHBondContact O-N 3.06Å; Y147-Y150 PolarHBondContact O-N 2.91Å; I148-Y150 PolarHBondContact O-N 3.26Å; Y150-K152 PolarHBondContact O-N 3.36Å; Y150-I273 HydrophobicContact CD1-CD1 3.36Å; Y150-I273 HydrophobicContact CD1-CG1 3.51Å; Y150-I273 HydrophobicContact CD2-CB 4.39Å; Y150-I273 HydrophobicContact CD2-CD1 4.09Å; Y150-I273 HydrophobicContact CD2-CG1 4.13Å; Y150-I273 HydrophobicContact CD2-CG2 3.79Å; Y150-I273 HydrophobicContact CE1-CB 4.3Å; Y150-I273 HydrophobicContact CE1-CD1 3.86Å; Y150-I273 HydrophobicContact CE1-CG1 3.41Å; Y150-I273 VanDerWaalsContact CE1-CG1 3.41Å; Y150-I273 HydrophobicContact CE2-CB 4.08Å; Y150-I273 HydrophobicContact CE2-CD1 4.47Å; Y150-I273 HydrophobicContact CE2-CG1 4.01Å; Y150-I273 HydrophobicContact CE2-CG2 3.74Å; Y150-I273 HydrophobicContact CG-CD1 3.51Å; Y150-I273 HydrophobicContact CG-CG1 3.89Å; Y150-I273 HydrophobicContact CG-CG2 4.27Å
151	S	60.9	Low	56.5	Low	17 Å²	17	71.9 Å²	71.9	12%	0.119	35%	0.348	C	S	.	.			trans	-74.1	56.9	173.6	-67.7	0	0	0	0	111.8	Y147 I148 H153 I154 V155	Y147-S151 WeakPolarHBondContact O-CB 3.49Å; Y147-S151 PolarHBondContact O-N 3.17Å; Y147-S151 PolarHBondContact O-OG 2.79Å; I148-S151 PolarHBondContact O-N 3.26Å; I148-S151 VanDerWaalsContact O-N 3.13Å; S151-H153 PolarHBondContact O-N 3.1Å; S151-H153 VanDerWaalsContact O-N 3.13Å; S151-I154 PolarHBondContact O-N 3.36Å; S151-I154 VanDerWaalsContact O-N 3.15Å; S151-V155 PolarHBondContact O-N 3.43Å; S151-V155 VanDerWaalsContact O-N 3.13Å
152	K	58	Low	56.5	Low	101 Å²	101	75.5 Å²	75.5	44%	0.439	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28	-172.4	-67.4	-176.5	-176.6	173.4	0	113.5	Y150 R160	Y150-K152 PolarHBondContact O-N 3.36Å; K152-R160 VanDerWaalsContact CA-NH1 3.29Å; K152-R160 PolarHBondContact O-NH1 3.35Å
153	H	52.7	Low	56.6	Low	190 Å²	190	74.9 Å²	74.9	88%	0.88	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-17	-175.6	-50.9	-68.1	0	0	0	113.4	S151	S151-H153 PolarHBondContact O-N 3.1Å; S151-H153 VanDerWaalsContact O-N 3.13Å
154	I	61.7	Low	57	Low	137 Å²	137	72.8 Å²	72.8	70%	0.703	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-34.4	-171.9	-54.4	173.4	0	0	0	110.7	S151	S151-I154 PolarHBondContact O-N 3.36Å; S151-I154 VanDerWaalsContact O-N 3.15Å
155	V	55.1	Low	56.7	Low	39 Å²	39	70.9 Å²	70.9	24%	0.236	34%	0.342	C	S	.	.	S	Bend	trans	-120.2	134.5	-169.9	-172.1	0	0	0	0	110.5	S151 R160	S151-V155 PolarHBondContact O-N 3.43Å; S151-V155 VanDerWaalsContact O-N 3.13Å; V155-R160 HydrophobicContact CB-CG 3.71Å; V155-R160 HydrophobicContact CG1-CG 3.65Å; V155-R160 WeakPolarHBondContact O-CD 3.2Å; V155-R160 PolarHBondContact O-NH1 2.67Å
156	S	68.6	Low	57	Low	65 Å²	65	72.7 Å²	72.7	46%	0.455	36%	0.355	S	S	.	.			trans	-59.4	152.7	176.5	72.6	0	0	0	0	111.5	E158 S159 R160	S156-E158 PolarHBondContact O-N 3.4Å; S156-S159 PolarHBondContact O-N 3.05Å; S156-S159 WeakPolarHBondContact OG-CB 3.48Å; S156-S159 PolarHBondContact OG-N 3.34Å; S156-S159 PolarHBondContact OG-OG 3.13Å; S156-S159 VanDerWaalsContact OG-OG 3.05Å; S156-R160 VanDerWaalsContact O-CG 3.29Å; S156-R160 WeakPolarHBondContact O-CG 3.46Å; S156-R160 PolarHBondContact O-N 3.16Å
157	E	56.2	Low	57.3	Low	83 Å²	83	72.1 Å²	72.1	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-55.6	-38.9	179.3	-174.7	178.1	149.4	0	0	112.4	R92 R160 R161	R92-E157 IonicContact CZ-OE1 3Å; R92-E157 IonicContact NH1-OE1 3.61Å; R92-E157 IonicContact NH2-OE1 3.52Å; R92-E157 PolarHBondContact NH2-OE1 2.93Å; E157-R160 PolarHBondContact O-N 3.43Å; E157-R161 WeakPolarHBondContact O-CG 3.33Å; E157-R161 PolarHBondContact O-N 2.94Å; E157-R161 IonicContact OE1-CZ 3.94Å; E157-R161 IonicContact OE1-NH1 2.91Å; E157-R161 PolarHBondContact OE1-NH1 2.89Å; E157-R161 IonicContact OE1-NH2 3.63Å; E157-R161 PolarHBondContact OE1-NH2 2.76Å
158	E	57.7	Low	57.6	Low	160 Å²	160	67.4 Å²	67.4	75%	0.748	34%	0.337	S	S	*	.	H	α-helix	trans	-65.7	-47.9	178	-170.5	172.8	-170.9	0	0	112	S156 R160 R161 F162	S156-E158 PolarHBondContact O-N 3.4Å; E158-R160 VanDerWaalsContact C-N 3.31Å; E158-R160 PolarHBondContact O-N 3.15Å; E158-R161 PolarHBondContact O-N 2.89Å; E158-F162 WeakPolarHBondContact O-CB 3.34Å; E158-F162 PolarHBondContact O-N 3.48Å
159	S	55.6	Low	57.4	Low	62 Å²	62	69.3 Å²	69.3	43%	0.434	35%	0.346	S	S	.	.	H	α-helix	trans	-65.7	-33.5	177.6	-62.7	0	0	0	0	112.4	S156 F162 S163	S156-S159 PolarHBondContact O-N 3.05Å; S156-S159 WeakPolarHBondContact OG-CB 3.48Å; S156-S159 PolarHBondContact OG-N 3.34Å; S156-S159 PolarHBondContact OG-OG 3.13Å; S156-S159 VanDerWaalsContact OG-OG 3.05Å; S159-F162 PolarHBondContact O-N 2.91Å; S159-S163 WeakPolarHBondContact O-CB 3.41Å; S159-S163 PolarHBondContact O-N 3.22Å
160	R	54.4	Low	57.8	Low	32 Å²	32	68.3 Å²	68.3	12%	0.121	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-45.2	173.5	-68.9	-174.5	-36.5	-120.7	4.5	111.6	I148 Y149 K152 V155 S156 E157 E158 S163 L164	I148-R160 WeakPolarHBondContact O-CG 3.31Å; Y149-R160 HydrophobicContact CD2-CB 4.22Å; Y149-R160 VanDerWaalsContact O-CD 3.23Å; Y149-R160 WeakPolarHBondContact O-CD 3.28Å; Y149-R160 PolarHBondContact O-NE 3.49Å; K152-R160 VanDerWaalsContact CA-NH1 3.29Å; K152-R160 PolarHBondContact O-NH1 3.35Å; V155-R160 HydrophobicContact CB-CG 3.71Å; V155-R160 HydrophobicContact CG1-CG 3.65Å; V155-R160 WeakPolarHBondContact O-CD 3.2Å; V155-R160 PolarHBondContact O-NH1 2.67Å; S156-R160 VanDerWaalsContact O-CG 3.29Å; S156-R160 WeakPolarHBondContact O-CG 3.46Å; S156-R160 PolarHBondContact O-N 3.16Å; E157-R160 PolarHBondContact O-N 3.43Å; E158-R160 VanDerWaalsContact C-N 3.31Å; E158-R160 PolarHBondContact O-N 3.15Å; R160-S163 PolarHBondContact O-N 3.42Å; R160-L164 PolarHBondContact O-N 3.05Å
161	R	56.9	Low	58.3	Low	67 Å²	67	67.1 Å²	67.1	25%	0.253	35%	0.345	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.7	-79.9	-173.2	171.7	113.7	24.5	111.8	R92 E96 W100 E157 E158 L164 L165	R92-R161 VanDerWaalsContact NH2-CZ 3.3Å; E96-R161 IonicContact OE1-CZ 3.48Å; E96-R161 IonicContact OE1-NE 2.69Å; E96-R161 PolarHBondContact OE1-NE 3.22Å; E96-R161 IonicContact OE1-NH2 3.62Å; E96-R161 PolarHBondContact OE1-NH2 2.89Å; W100-R161 HydrophobicContact CH2-CB 4.41Å; W100-R161 WeakPolarHBondContact CH2-O 3.26Å; E157-R161 WeakPolarHBondContact O-CG 3.33Å; E157-R161 PolarHBondContact O-N 2.94Å; E157-R161 IonicContact OE1-CZ 3.94Å; E157-R161 IonicContact OE1-NH1 2.91Å; E157-R161 PolarHBondContact OE1-NH1 2.89Å; E157-R161 IonicContact OE1-NH2 3.63Å; E157-R161 PolarHBondContact OE1-NH2 2.76Å; E158-R161 PolarHBondContact O-N 2.89Å; R161-L164 PolarHBondContact O-N 2.86Å; R161-L165 WeakPolarHBondContact O-CB 3.29Å; R161-L165 PolarHBondContact O-N 3.24Å
162	F	59.1	Low	58	Low	139 Å²	139	66.3 Å²	66.3	61%	0.61	34%	0.339	S	S	*	.	H	α-helix	trans	-62.6	-44.6	178.9	-176.3	-102.2	0	0	0	111.7	E158 S159 L164 L165 C166	E158-F162 WeakPolarHBondContact O-CB 3.34Å; E158-F162 PolarHBondContact O-N 3.48Å; S159-F162 PolarHBondContact O-N 2.91Å; F162-L164 VanDerWaalsContact C-N 3.32Å; F162-L164 PolarHBondContact O-N 2.78Å; F162-L165 WeakPolarHBondContact O-CB 3.22Å; F162-L165 PolarHBondContact O-N 3.43Å; F162-C166 PolarHBondContact O-N 2.76Å; F162-C166 PolarHBondContact O-SG 3.3Å
163	S	57.9	Low	58.1	Low	24 Å²	24	64.2 Å²	64.2	17%	0.168	33%	0.33	C	S	.	.	H	α-helix	trans	-59.9	-43.6	175.2	-172.8	0	0	0	0	111.7	N145 I148 S159 R160 L165 C166 G167	N145-S163 PolarHBondContact OD1-O 2.85Å; N145-S163 VanDerWaalsContact OD1-O 3.05Å; I148-S163 WeakPolarHBondContact CD1-OG 3.29Å; S159-S163 WeakPolarHBondContact O-CB 3.41Å; S159-S163 PolarHBondContact O-N 3.22Å; R160-S163 PolarHBondContact O-N 3.42Å; S163-L165 VanDerWaalsContact C-N 3.34Å; S163-C166 PolarHBondContact O-N 2.76Å; S163-G167 PolarHBondContact O-N 3.29Å
164	L	54.8	Low	58.7	Low	17 Å²	17	55.9 Å²	55.9	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-40.4	178.1	-160	107.8	0	0	0	111.4	W100 Y149 R160 R161 F162 C166 G167 M168	W100-L164 HydrophobicContact CD2-CD2 3.52Å; W100-L164 HydrophobicContact CE3-CD2 4.09Å; W100-L164 HydrophobicContact CG-CD2 3.83Å; W100-L164 HydrophobicContact CH2-CD2 4.26Å; W100-L164 HydrophobicContact CZ2-CD2 3.69Å; W100-L164 HydrophobicContact CZ3-CD2 4.44Å; Y149-L164 HydrophobicContact CD1-CD1 4.38Å; Y149-L164 HydrophobicContact CD2-CB 4.33Å; Y149-L164 HydrophobicContact CD2-CD1 3.93Å; Y149-L164 HydrophobicContact CG-CD1 3.72Å; R160-L164 PolarHBondContact O-N 3.05Å; R161-L164 PolarHBondContact O-N 2.86Å; F162-L164 VanDerWaalsContact C-N 3.32Å; F162-L164 PolarHBondContact O-N 2.78Å; L164-C166 PolarHBondContact O-N 3.48Å; L164-G167 PolarHBondContact O-N 2.75Å; L164-M168 WeakPolarHBondContact O-CG 2.94Å; L164-M168 PolarHBondContact O-N 3.33Å
165	L	55.6	Low	58.7	Low	53 Å²	53	50.5 Å²	50.5	28%	0.277	26%	0.263	S	S	.	.	H	α-helix	trans	-57	-50	174	-165.3	140	0	0	0	111.2	W100 V103 R161 F162 S163 G167 M168 M169	W100-L165 HydrophobicContact CE3-CB 4.43Å; W100-L165 HydrophobicContact CH2-CB 4.13Å; W100-L165 VanDerWaalsContact CZ3-CA 3.47Å; W100-L165 HydrophobicContact CZ3-CB 3.48Å; W100-L165 VanDerWaalsContact CZ3-CB 3.48Å; W100-L165 HydrophobicContact CZ3-CD1 3.84Å; W100-L165 HydrophobicContact CZ3-CG 3.85Å; V103-L165 HydrophobicContact CG1-CG 4.4Å; R161-L165 WeakPolarHBondContact O-CB 3.29Å; R161-L165 PolarHBondContact O-N 3.24Å; F162-L165 WeakPolarHBondContact O-CB 3.22Å; F162-L165 PolarHBondContact O-N 3.43Å; S163-L165 VanDerWaalsContact C-N 3.34Å; L165-G167 VanDerWaalsContact C-N 3.32Å; L165-G167 PolarHBondContact O-N 2.85Å; L165-M168 PolarHBondContact O-N 3.46Å; L165-M169 HydrophobicContact CD2-CE 4.06Å; L165-M169 VanDerWaalsContact O-CB 3.32Å; L165-M169 WeakPolarHBondContact O-CB 2.99Å; L165-M169 PolarHBondContact O-N 3.41Å
166	C	59.6	Low	58.8	Low	53 Å²	53	48.6 Å²	48.6	36%	0.358	25%	0.252	S	S	.	.	H	α-helix	trans	-61.8	-40.4	176.9	-69	0	0	0	0	111.8	F162 S163 L164 M169 A170	F162-C166 PolarHBondContact O-N 2.76Å; F162-C166 PolarHBondContact O-SG 3.3Å; S163-C166 PolarHBondContact O-N 2.76Å; L164-C166 PolarHBondContact O-N 3.48Å; C166-M169 PolarHBondContact O-N 2.89Å; C166-A170 WeakPolarHBondContact O-CB 2.69Å; C166-A170 PolarHBondContact O-N 3.46Å
167	G	59.6	Low	58.4	Low	3 Å²	3	45.7 Å²	45.7	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-48.9	176.5	0	0	0	0	0	113.2	N145 S163 L164 L165 M169 A170 I171	N145-G167 VanDerWaalsContact CG-CA 3.49Å; N145-G167 WeakPolarHBondContact ND2-CA 3.3Å; N145-G167 WeakPolarHBondContact OD1-CA 3.29Å; S163-G167 PolarHBondContact O-N 3.29Å; L164-G167 PolarHBondContact O-N 2.75Å; L165-G167 VanDerWaalsContact C-N 3.32Å; L165-G167 PolarHBondContact O-N 2.85Å; G167-M169 VanDerWaalsContact C-N 3.33Å; G167-M169 PolarHBondContact O-N 3.38Å; G167-A170 PolarHBondContact O-N 3.31Å; G167-I171 VanDerWaalsContact O-CG1 3.29Å; G167-I171 WeakPolarHBondContact O-CG1 3.17Å; G167-I171 PolarHBondContact O-N 3.14Å
168	M	59.5	Low	58.6	Low	52 Å²	52	42.2 Å²	42.2	26%	0.256	22%	0.216	S	C	.	.	H	α-helix	trans	-65.5	-38.2	178	-66	-57.4	-59.2	0	0	111.8	W100 C104 L164 L165 I171 G172	W100-M168 HydrophobicContact CB-CG 4.19Å; C104-M168 HydrophobicContact CB-CB 4.48Å; C104-M168 HydrophobicContact CB-CE 3.81Å; L164-M168 WeakPolarHBondContact O-CG 2.94Å; L164-M168 PolarHBondContact O-N 3.33Å; L165-M168 PolarHBondContact O-N 3.46Å; M168-I171 PolarHBondContact O-N 2.91Å; M168-I171 HydrophobicContact SD-CD1 4.28Å; M168-G172 PolarHBondContact O-N 3.3Å
169	M	55.1	Low	58.6	Low	73 Å²	73	35.3 Å²	35.3	36%	0.36	19%	0.185	S	C	.	.	H	α-helix	trans	-62.9	-43.3	173.3	-172.1	175.7	-70.3	0	0	111.2	V103 A107 L165 C166 G167 F173	V103-M169 HydrophobicContact CG1-CB 4.03Å; V103-M169 HydrophobicContact CG1-CE 4.05Å; A107-M169 HydrophobicContact CB-CB 4.22Å; A107-M169 HydrophobicContact CB-CG 3.68Å; A107-M169 WeakPolarHBondContact CB-O 3.24Å; L165-M169 HydrophobicContact CD2-CE 4.06Å; L165-M169 VanDerWaalsContact O-CB 3.32Å; L165-M169 WeakPolarHBondContact O-CB 2.99Å; L165-M169 PolarHBondContact O-N 3.41Å; C166-M169 PolarHBondContact O-N 2.89Å; G167-M169 VanDerWaalsContact C-N 3.33Å; G167-M169 PolarHBondContact O-N 3.38Å; M169-F173 VanDerWaalsContact O-CB 3.23Å; M169-F173 WeakPolarHBondContact O-CB 3.24Å; M169-F173 PolarHBondContact O-N 2.93Å
170	A	61.9	Low	58.4	Low	30 Å²	30	38.4 Å²	38.4	25%	0.248	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-44.3	177.2	0	0	0	0	0	112.2	C166 G167 F173 I174	C166-A170 WeakPolarHBondContact O-CB 2.69Å; C166-A170 PolarHBondContact O-N 3.46Å; G167-A170 PolarHBondContact O-N 3.31Å; A170-F173 PolarHBondContact O-N 2.85Å; A170-I174 WeakPolarHBondContact O-CB 3.32Å; A170-I174 WeakPolarHBondContact O-CD1 3.27Å; A170-I174 WeakPolarHBondContact O-CG1 3.37Å; A170-I174 PolarHBondContact O-N 3.43Å
171	I	63	Low	58.2	Low	13 Å²	13	36.9 Å²	36.9	7%	0.067	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-54.8	176.9	-69.4	161.3	0	0	0	110	M138 I142 G167 M168 F173 I174 E175	M138-I171 HydrophobicContact SD-CG2 4.13Å; I142-I171 HydrophobicContact CD1-CD1 4.49Å; I142-I171 HydrophobicContact CG1-CD1 3.56Å; I142-I171 HydrophobicContact CG1-CG1 4.32Å; G167-I171 VanDerWaalsContact O-CG1 3.29Å; G167-I171 WeakPolarHBondContact O-CG1 3.17Å; G167-I171 PolarHBondContact O-N 3.14Å; M168-I171 PolarHBondContact O-N 2.91Å; M168-I171 HydrophobicContact SD-CD1 4.28Å; I171-F173 VanDerWaalsContact C-N 3.32Å; I171-F173 PolarHBondContact O-N 2.78Å; I171-I174 PolarHBondContact O-N 3.12Å; I171-E175 HydrophobicContact CG2-CG 4.47Å; I171-E175 WeakPolarHBondContact O-CG 3.4Å; I171-E175 PolarHBondContact O-N 3.49Å
172	G	55.6	Low	57.4	Low	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.5	-47.6	178.8	0	0	0	0	0	111.7	C104 F108 M168 I174 E175 G176	C104-G172 WeakPolarHBondContact O-CA 3.47Å; F108-G172 VanDerWaalsContact CA-C 3.49Å; F108-G172 WeakPolarHBondContact CA-O 3.4Å; F108-G172 WeakPolarHBondContact CB-O 3.45Å; F108-G172 PolarHBondContact N-O 2.83Å; M168-G172 PolarHBondContact O-N 3.3Å; G172-I174 PolarHBondContact O-N 3.48Å; G172-E175 PolarHBondContact O-N 3.46Å; G172-G176 PolarHBondContact O-N 3.08Å
173	F	60.3	Low	56.4	Low	57 Å²	57	34 Å²	34	25%	0.25	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-43.6	178.6	-173.3	-100.3	0	0	0	113.1	A107 W110 G111 L114 M169 A170 I171 G176 L177	A107-F173 HydrophobicContact CB-CB 4.38Å; A107-F173 WeakPolarHBondContact O-CA 3.33Å; W110-F173 HydrophobicContact CB-CD2 4.5Å; G111-F173 VanDerWaalsContact CA-CD2 3.46Å; L114-F173 HydrophobicContact CB-CE2 4.41Å; L114-F173 HydrophobicContact CD1-CE2 3.93Å; M169-F173 VanDerWaalsContact O-CB 3.23Å; M169-F173 WeakPolarHBondContact O-CB 3.24Å; M169-F173 PolarHBondContact O-N 2.93Å; A170-F173 PolarHBondContact O-N 2.85Å; I171-F173 VanDerWaalsContact C-N 3.32Å; I171-F173 PolarHBondContact O-N 2.78Å; F173-G176 PolarHBondContact O-N 2.84Å; F173-L177 HydrophobicContact CD1-CD1 3.84Å; F173-L177 HydrophobicContact CD1-CG 4.34Å; F173-L177 HydrophobicContact CE1-CD1 3.37Å; F173-L177 HydrophobicContact CE1-CG 3.99Å; F173-L177 HydrophobicContact CZ-CD1 4.01Å; F173-L177 HydrophobicContact CZ-CD2 4.42Å; F173-L177 HydrophobicContact CZ-CG 4.25Å; F173-L177 PolarHBondContact O-N 3.38Å
174	I	63.8	Low	55.5	Low	14 Å²	14	36.6 Å²	36.6	7%	0.072	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-49	176.2	-71.5	164.9	0	0	0	110.4	F134 L137 M138 F141 A170 I171 G172 G176 L177 T178	F134-I174 HydrophobicContact CB-CG2 3.74Å; F134-I174 HydrophobicContact CD1-CG1 4.35Å; F134-I174 HydrophobicContact CD1-CG2 3.69Å; F134-I174 HydrophobicContact CG-CG2 4.15Å; L137-I174 HydrophobicContact CD2-CD1 4.02Å; L137-I174 HydrophobicContact CG-CD1 4.48Å; M138-I174 HydrophobicContact CE-CG2 4.18Å; M138-I174 HydrophobicContact CG-CB 4.16Å; M138-I174 HydrophobicContact CG-CD1 4.22Å; M138-I174 HydrophobicContact CG-CG2 3.71Å; M138-I174 HydrophobicContact SD-CB 4.13Å; M138-I174 HydrophobicContact SD-CG2 3.72Å; F141-I174 HydrophobicContact CD2-CD1 4.13Å; F141-I174 HydrophobicContact CE2-CD1 4.13Å; A170-I174 WeakPolarHBondContact O-CB 3.32Å; A170-I174 WeakPolarHBondContact O-CD1 3.27Å; A170-I174 WeakPolarHBondContact O-CG1 3.37Å; A170-I174 PolarHBondContact O-N 3.43Å; I171-I174 PolarHBondContact O-N 3.12Å; G172-I174 PolarHBondContact O-N 3.48Å; I174-G176 PolarHBondContact O-N 2.84Å; I174-L177 PolarHBondContact O-N 3.39Å; I174-T178 WeakPolarHBondContact O-CG2 3.41Å; I174-T178 PolarHBondContact O-N 3.46Å; I174-T178 VanDerWaalsContact O-N 3.13Å
175	E	61.8	Low	54.6	Low	24 Å²	24	37.7 Å²	37.7	11%	0.112	21%	0.214	C	C	.	.	H	α-helix	trans	-54	-45.3	175.5	-73.3	179.7	163.5	0	0	110	F108 M138 I171 G172 L177 T178	F108-E175 HydrophobicContact CD2-CB 3.51Å; F108-E175 VanDerWaalsContact CE2-C 3.5Å; F108-E175 HydrophobicContact CE2-CB 3.83Å; M138-E175 HydrophobicContact CE-CG 4Å; M138-E175 HydrophobicContact SD-CG 3.48Å; M138-E175 WeakPolarHBondContact SD-CG 3.35Å; I171-E175 HydrophobicContact CG2-CG 4.47Å; I171-E175 WeakPolarHBondContact O-CG 3.4Å; I171-E175 PolarHBondContact O-N 3.49Å; G172-E175 PolarHBondContact O-N 3.46Å; E175-L177 PolarHBondContact O-N 3.31Å; E175-T178 PolarHBondContact O-N 3.34Å; E175-T178 VanDerWaalsContact O-N 3.13Å; E175-T178 PolarHBondContact O-OG1 3.48Å
176	G	56.9	Low	53.7	Low	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-39.7	-179.1	0	0	0	0	0	113.2	V112 G172 F173 I174 T178 V179	V112-G176 VanDerWaalsContact CG2-O 3.27Å; V112-G176 WeakPolarHBondContact CG2-O 3.4Å; G172-G176 PolarHBondContact O-N 3.08Å; F173-G176 PolarHBondContact O-N 2.84Å; I174-G176 PolarHBondContact O-N 2.84Å; G176-T178 VanDerWaalsContact C-N 3.29Å; G176-T178 PolarHBondContact O-N 2.86Å; G176-V179 PolarHBondContact O-N 2.92Å
177	L	61	Low	52.6	Low	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-31.6	175.5	-76.1	176.8	0	0	0	112.9	G111 L123 R124 A127 F173 I174 E175 V179	G111-L177 WeakPolarHBondContact O-CD2 3.3Å; L123-L177 HydrophobicContact CD2-CD1 3.81Å; L123-L177 HydrophobicContact CG-CD1 4.25Å; R124-L177 HydrophobicContact CB-CD2 4.44Å; R124-L177 WeakPolarHBondContact CG-O 3.39Å; A127-L177 HydrophobicContact CB-CB 4.15Å; F173-L177 HydrophobicContact CD1-CD1 3.84Å; F173-L177 HydrophobicContact CD1-CG 4.34Å; F173-L177 HydrophobicContact CE1-CD1 3.37Å; F173-L177 HydrophobicContact CE1-CG 3.99Å; F173-L177 HydrophobicContact CZ-CD1 4.01Å; F173-L177 HydrophobicContact CZ-CD2 4.42Å; F173-L177 HydrophobicContact CZ-CG 4.25Å; F173-L177 PolarHBondContact O-N 3.38Å; I174-L177 PolarHBondContact O-N 3.39Å; E175-L177 PolarHBondContact O-N 3.31Å; L177-V179 VanDerWaalsContact C-N 3.25Å; L177-V179 PolarHBondContact O-N 2.81Å
178	T	61.5	Low	51.6	Low	10 Å²	10	52 Å²	52	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-77.1	-10.1	-177.2	62.4	0	0	0	0	113.9	A127 Q131 F134 I174 E175 G176 K180	A127-T178 HydrophobicContact CB-CG2 4.37Å; Q131-T178 PolarHBondContact NE2-O 3.36Å; F134-T178 HydrophobicContact CB-CG2 3.74Å; F134-T178 HydrophobicContact CG-CG2 4.22Å; I174-T178 WeakPolarHBondContact O-CG2 3.41Å; I174-T178 PolarHBondContact O-N 3.46Å; I174-T178 VanDerWaalsContact O-N 3.13Å; E175-T178 PolarHBondContact O-N 3.34Å; E175-T178 VanDerWaalsContact O-N 3.13Å; E175-T178 PolarHBondContact O-OG1 3.48Å; G176-T178 VanDerWaalsContact C-N 3.29Å; G176-T178 PolarHBondContact O-N 2.86Å; T178-K180 PolarHBondContact O-N 2.77Å
179	V	55.9	Low	50.3	Low	15 Å²	15	53.7 Å²	53.7	9%	0.091	29%	0.288	C	S	.	.			trans	-75.9	119.9	-179.5	174.6	0	0	0	0	111.6	F108 V112 R124 G176 L177 S181 L235	F108-V179 HydrophobicContact CE2-CG2 3.78Å; F108-V179 HydrophobicContact CZ-CG2 3.74Å; V112-V179 HydrophobicContact CG2-CB 4.28Å; V112-V179 HydrophobicContact CG2-CG2 4.44Å; R124-V179 PolarHBondContact NE-O 3.31Å; R124-V179 PolarHBondContact NH2-O 3.29Å; G176-V179 PolarHBondContact O-N 2.92Å; L177-V179 VanDerWaalsContact C-N 3.25Å; L177-V179 PolarHBondContact O-N 2.81Å; V179-S181 VanDerWaalsContact C-N 3.3Å; V179-S181 PolarHBondContact O-N 2.69Å; V179-L235 HydrophobicContact CG1-CD1 3.49Å; V179-L235 VanDerWaalsContact CG1-CD1 3.49Å
180	K	52.8	Low	49.5	Very low	126 Å²	126	51.9 Å²	51.9	55%	0.548	28%	0.282	S	S	.	.			trans	-74.5	-1.7	-176.6	-76.1	-176.8	178.9	177.7	0	116.4	R124 C128 T178	R124-K180 PolarHBondContact NH2-O 2.77Å; C128-K180 HydrophobicContact CB-CD 4.45Å; C128-K180 HydrophobicContact CB-CG 3.76Å; C128-K180 WeakPolarHBondContact O-CE 3.3Å; C128-K180 PolarHBondContact O-NZ 2.83Å; T178-K180 PolarHBondContact O-N 2.77Å
181	S	48.7	Very low	48.2	Very low	1 Å²	1	54.3 Å²	54.3	1%	0.007	30%	0.301	C	S	.	.			trans	-50.4	135.7	-169.2	166.5	0	0	0	0	117.6	R116 R124 V179 I183 L235	R116-S181 PolarHBondContact NH2-O 3.38Å; R116-S181 PolarHBondContact NH2-OG 2.71Å; R124-S181 VanDerWaalsContact NH2-N 3.18Å; R124-S181 PolarHBondContact NH2-O 2.84Å; V179-S181 VanDerWaalsContact C-N 3.3Å; V179-S181 PolarHBondContact O-N 2.69Å; S181-I183 PolarHBondContact OG-N 2.76Å; S181-L235 WeakPolarHBondContact OG-CD2 3.35Å
182	A	41.7	Very low	47.1	Very low	97 Å²	97	54.8 Å²	54.8	80%	0.802	31%	0.307	S	S	*	.			trans	-92.3	-8.2	169.2	0	0	0	0	0	114.9
183	I	37.9	Very low	46.2	Very low	49 Å²	49	55.2 Å²	55.2	25%	0.251	31%	0.31	S	S	.	.	S	Bend	trans	-87.3	124.9	-170.5	-64.5	175.9	0	0	0	112.3	R116 S181 F185 A234 S236	R116-I183 PolarHBondContact NH1-O 2.77Å; R116-I183 PolarHBondContact NH2-O 2.96Å; S181-I183 PolarHBondContact OG-N 2.76Å; I183-F185 PolarHBondContact O-N 3.26Å; I183-A234 WeakPolarHBondContact CB-O 3.36Å; I183-A234 WeakPolarHBondContact CD1-O 3.46Å; I183-A234 WeakPolarHBondContact CG2-O 3.37Å; I183-S236 VanDerWaalsContact CD1-OG 3.32Å; I183-S236 WeakPolarHBondContact CD1-OG 3.34Å
184	P	38.4	Very low	44.9	Very low	77 Å²	77	56.6 Å²	56.6	50%	0.5	32%	0.324	S	S	.	.			trans	-52.6	132.1	-177.8	-25	32.1	0	0	0	114.1	R116 S186 R187	R116-P184 VanDerWaalsContact NH1-CA 3.3Å; P184-S186 PolarHBondContact O-N 3.45Å; P184-S186 VanDerWaalsContact O-N 3.15Å; P184-R187 PolarHBondContact O-N 3.12Å
185	F	34.9	Very low	43.6	Very low	40 Å²	40	57.2 Å²	57.2	18%	0.175	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-63.6	-19.7	-178.5	-139.7	-99.2	0	0	0	113	A109 V112 T113 I183 R187 Y188 P190 W231	A109-F185 HydrophobicContact CB-CE1 4.07Å; A109-F185 HydrophobicContact CB-CZ 3.74Å; V112-F185 HydrophobicContact CB-CD2 4.24Å; V112-F185 HydrophobicContact CB-CE2 3.59Å; V112-F185 HydrophobicContact CB-CZ 4.39Å; V112-F185 HydrophobicContact CG1-CD2 3.65Å; V112-F185 HydrophobicContact CG1-CE2 3.4Å; V112-F185 VanDerWaalsContact CG1-CE2 3.4Å; V112-F185 HydrophobicContact CG2-CE2 4.43Å; T113-F185 WeakPolarHBondContact OG1-CD1 3.37Å; T113-F185 WeakPolarHBondContact OG1-CE1 3.45Å; I183-F185 PolarHBondContact O-N 3.26Å; F185-R187 PolarHBondContact O-N 3.39Å; F185-Y188 PolarHBondContact O-N 2.98Å; F185-P190 HydrophobicContact CE1-CG 3.74Å; F185-P190 HydrophobicContact CZ-CG 4.3Å; F185-W231 HydrophobicContact CE2-CH2 4.19Å; F185-W231 AromaticContact CE2-CZ2 3.48Å; F185-W231 HydrophobicContact CE2-CZ2 3.48Å; F185-W231 VanDerWaalsContact CE2-CZ2 3.48Å; F185-W231 AromaticContact CZ-CH2 3.78Å; F185-W231 HydrophobicContact CZ-CH2 3.78Å; F185-W231 AromaticContact CZ-CZ2 3.55Å; F185-W231 HydrophobicContact CZ-CZ2 3.55Å
186	S	36.9	Very low	42.4	Very low	106 Å²	106	58.1 Å²	58.1	74%	0.741	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-59.9	-16.7	179.9	54.1	0	0	0	0	113.9	P184	P184-S186 PolarHBondContact O-N 3.45Å; P184-S186 VanDerWaalsContact O-N 3.15Å
187	R	38.3	Very low	41.5	Very low	187 Å²	187	58.8 Å²	58.8	71%	0.706	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-84.2	-21.4	178.3	-75.1	-170.9	175.8	-179.3	-0.9	114.9	P184 F185	P184-R187 PolarHBondContact O-N 3.12Å; F185-R187 PolarHBondContact O-N 3.39Å
188	Y	37.2	Very low	40.3	Very low	116 Å²	116	61.4 Å²	61.4	46%	0.455	36%	0.356	S	S	.	.	S	Bend	trans	-144.7	78.7	-174.9	-58.5	-81.4	0	0	0	110.7	F185 I230 A234	F185-Y188 PolarHBondContact O-N 2.98Å; Y188-I230 HydrophobicContact CD1-CG2 4.2Å; Y188-A234 HydrophobicContact CD2-CB 3.41Å; Y188-A234 VanDerWaalsContact CD2-CB 3.41Å; Y188-A234 HydrophobicContact CE2-CB 3.34Å; Y188-A234 HydrophobicContact CG-CB 4.13Å
189	P	33.6	Very low	39.2	Very low	88 Å²	88	62.1 Å²	62.1	57%	0.571	36%	0.362	S	S	*	.			trans	-66	146.7	179.4	26.4	-32.5	0	0	0	111	A191	P189-A191 HydrophobicContact CB-CB 4.39Å; P189-A191 PolarHBondContact O-N 3.27Å
190	P	37.5	Very low	38.4	Very low	36 Å²	36	61.8 Å²	61.8	23%	0.234	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-73	17.1	176.9	-5.8	22.9	0	0	0	113.3	A109 F185 A192 I193	A109-P190 HydrophobicContact CB-CB 3.92Å; A109-P190 HydrophobicContact CB-CG 3.24Å; F185-P190 HydrophobicContact CE1-CG 3.74Å; F185-P190 HydrophobicContact CZ-CG 4.3Å; P190-A192 PolarHBondContact O-N 2.86Å; P190-I193 HydrophobicContact CB-CD1 3.74Å; P190-I193 HydrophobicContact CB-CG1 4.48Å; P190-I193 WeakPolarHBondContact O-CG1 3.38Å; P190-I193 PolarHBondContact O-N 2.99Å
191	A	35.2	Very low	37.6	Very low	80 Å²	80	57 Å²	57	66%	0.661	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-62.1	-10.8	-171.1	0	0	0	0	0	113.5	P189	P189-A191 HydrophobicContact CB-CB 4.39Å; P189-A191 PolarHBondContact O-N 3.27Å
192	A	38.4	Very low	37.2	Very low	24 Å²	24	57.6 Å²	57.6	20%	0.198	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-83.8	-3.8	179.4	0	0	0	0	0	115.3	F60 P190 F227	F60-A192 HydrophobicContact CD1-CB 4Å; F60-A192 HydrophobicContact CE1-CB 3.26Å; F60-A192 HydrophobicContact CE2-CB 4.5Å; F60-A192 HydrophobicContact CZ-CB 3.57Å; F60-A192 WeakPolarHBondContact CZ-O 2.95Å; P190-A192 PolarHBondContact O-N 2.86Å; A192-F227 HydrophobicContact CB-CE1 4.26Å; A192-F227 HydrophobicContact CB-CZ 3.81Å
193	I	38	Very low	36.9	Very low	9 Å²	9	57.9 Å²	57.9	5%	0.046	33%	0.33	C	S	.	.	H	α-helix	trans	-69.3	-48.5	-171	-64.3	166.5	0	0	0	113.8	S102 M105 P190 F223 F227	S102-I193 VanDerWaalsContact CB-CG2 3.46Å; M105-I193 HydrophobicContact CB-CD1 3.7Å; M105-I193 HydrophobicContact CB-CG1 4.39Å; P190-I193 HydrophobicContact CB-CD1 3.74Å; P190-I193 HydrophobicContact CB-CG1 4.48Å; P190-I193 WeakPolarHBondContact O-CG1 3.38Å; P190-I193 PolarHBondContact O-N 2.99Å; I193-F223 HydrophobicContact CG2-CZ 4.31Å; I193-F227 HydrophobicContact CG1-CE1 4.16Å; I193-F227 HydrophobicContact CG1-CZ 4.32Å
194	P	33.3	Very low	36.8	Very low	85 Å²	85	56 Å²	56	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-40.3	-173.1	-20.6	30.5	0	0	0	115.5	L196 A197 V198	P194-L196 PolarHBondContact O-N 2.89Å; P194-A197 PolarHBondContact O-N 2.61Å; P194-V198 WeakPolarHBondContact O-CG2 3.29Å; P194-V198 PolarHBondContact O-N 3.2Å
195	P	34.8	Very low	36.9	Very low	28 Å²	28	54.9 Å²	54.9	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-73.1	-31.3	-169.4	-27.6	41.5	0	0	0	114.7	F60 L64 A197 V198 S199	F60-P195 HydrophobicContact CZ-CB 4.19Å; F60-P195 HydrophobicContact CZ-CG 4.45Å; L64-P195 HydrophobicContact CD1-CB 3.59Å; L64-P195 HydrophobicContact CD1-CG 3.41Å; L64-P195 VanDerWaalsContact CD1-CG 3.41Å; L64-P195 HydrophobicContact CG-CB 3.71Å; L64-P195 HydrophobicContact CG-CG 3.8Å; P195-A197 PolarHBondContact O-N 2.91Å; P195-V198 CarbonylContact O-C 3.52Å; P195-V198 WeakPolarHBondContact O-CA 3.38Å; P195-V198 WeakPolarHBondContact O-CB 3.1Å; P195-V198 PolarHBondContact O-N 3.05Å; P195-V198 VanDerWaalsContact O-N 3.12Å; P195-S199 PolarHBondContact O-N 3.21Å; P195-S199 PolarHBondContact O-OG 3.25Å
196	L	38.1	Very low	37.1	Very low	42 Å²	42	55.1 Å²	55.1	22%	0.22	32%	0.323	C	S	.	.	H	α-helix	trans	-67.1	-37.4	178.1	-111.1	157.9	0	0	0	112	F60 P194 V198 S199 A200 L219 F223 F227	F60-L196 HydrophobicContact CD2-CD1 3.32Å; F60-L196 HydrophobicContact CD2-CG 3.59Å; F60-L196 HydrophobicContact CE2-CB 3.85Å; F60-L196 HydrophobicContact CE2-CD1 3.31Å; F60-L196 HydrophobicContact CE2-CG 3.36Å; F60-L196 HydrophobicContact CG-CD1 4.49Å; F60-L196 HydrophobicContact CZ-CD1 4.45Å; P194-L196 PolarHBondContact O-N 2.89Å; L196-V198 PolarHBondContact O-N 3.19Å; L196-S199 PolarHBondContact O-N 2.86Å; L196-A200 VanDerWaalsContact O-CB 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.14Å; L196-A200 PolarHBondContact O-N 2.86Å; L196-L219 HydrophobicContact CD2-CD2 4.49Å; L196-F223 HydrophobicContact CB-CD2 4.06Å; L196-F223 HydrophobicContact CB-CE2 3.6Å; L196-F223 HydrophobicContact CD1-CD2 3.86Å; L196-F223 HydrophobicContact CD1-CE2 3.69Å; L196-F223 HydrophobicContact CG-CD2 4.36Å; L196-F223 HydrophobicContact CG-CE2 4.21Å; L196-F227 HydrophobicContact CD1-CE2 4.28Å
197	A	37.3	Very low	37	Very low	15 Å²	15	52.3 Å²	52.3	12%	0.124	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-38.9	172.2	0	0	0	0	0	110.9	C98 P194 P195 A201	C98-A197 HydrophobicContact CB-CB 4.04Å; P194-A197 PolarHBondContact O-N 2.61Å; P195-A197 PolarHBondContact O-N 2.91Å; A197-A201 WeakPolarHBondContact O-CB 3.26Å; A197-A201 PolarHBondContact O-N 2.69Å
198	V	35.7	Very low	37.2	Very low	58 Å²	58	46.4 Å²	46.4	35%	0.352	29%	0.287	S	S	.	.	H	α-helix	trans	-69.2	-44	174.8	179	0	0	0	0	111.3	V71 P194 P195 L196 A200 A201 S202	V71-V198 HydrophobicContact CG2-CG1 3.68Å; P194-V198 WeakPolarHBondContact O-CG2 3.29Å; P194-V198 PolarHBondContact O-N 3.2Å; P195-V198 CarbonylContact O-C 3.52Å; P195-V198 WeakPolarHBondContact O-CA 3.38Å; P195-V198 WeakPolarHBondContact O-CB 3.1Å; P195-V198 PolarHBondContact O-N 3.05Å; P195-V198 VanDerWaalsContact O-N 3.12Å; L196-V198 PolarHBondContact O-N 3.19Å; V198-A200 VanDerWaalsContact C-N 3.35Å; V198-A200 PolarHBondContact O-N 3.4Å; V198-A201 CarbonylContact O-C 3.6Å; V198-A201 WeakPolarHBondContact O-CB 3.27Å; V198-A201 PolarHBondContact O-N 3.47Å; V198-S202 VanDerWaalsContact O-CB 3.27Å; V198-S202 WeakPolarHBondContact O-CB 3.2Å; V198-S202 PolarHBondContact O-N 3.46Å; V198-S202 PolarHBondContact O-OG 3.42Å
199	S	38.3	Very low	37.3	Very low	26 Å²	26	43.6 Å²	43.6	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-45.8	176.3	-51	0	0	0	0	111	P195 L196 S202 Y203	P195-S199 PolarHBondContact O-N 3.21Å; P195-S199 PolarHBondContact O-OG 3.25Å; L196-S199 PolarHBondContact O-N 2.86Å; S199-S202 WeakPolarHBondContact CA-OG 3.11Å; S199-S202 PolarHBondContact O-N 2.98Å; S199-S202 PolarHBondContact O-OG 3.46Å; S199-Y203 PolarHBondContact O-N 3.06Å
200	A	38.8	Very low	37.5	Very low	8 Å²	8	42 Å²	42	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-53.4	174.6	0	0	0	0	0	110.4	L196 V198 S202 Y203 F204 F216	L196-A200 VanDerWaalsContact O-CB 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.14Å; L196-A200 PolarHBondContact O-N 2.86Å; V198-A200 VanDerWaalsContact C-N 3.35Å; V198-A200 PolarHBondContact O-N 3.4Å; A200-S202 VanDerWaalsContact C-N 3.26Å; A200-S202 PolarHBondContact O-N 3.27Å; A200-Y203 WeakPolarHBondContact O-CB 3.38Å; A200-Y203 PolarHBondContact O-N 3.25Å; A200-Y203 VanDerWaalsContact O-N 3.12Å; A200-F204 WeakPolarHBondContact O-CD2 3.47Å; A200-F204 WeakPolarHBondContact O-CE2 3.45Å; A200-F204 PolarHBondContact O-N 2.94Å; A200-F216 HydrophobicContact CB-CD2 3.96Å; A200-F216 HydrophobicContact CB-CE2 3.81Å
201	A	36.9	Very low	37.4	Very low	25 Å²	25	44.8 Å²	44.8	21%	0.207	28%	0.279	C	S	.	.	H	α-helix	trans	-52	-41.7	175.4	0	0	0	0	0	112.6	F95 A197 V198 F204	F95-A201 HydrophobicContact CD2-CB 4.13Å; F95-A201 HydrophobicContact CE2-CB 4.45Å; A197-A201 WeakPolarHBondContact O-CB 3.26Å; A197-A201 PolarHBondContact O-N 2.69Å; V198-A201 CarbonylContact O-C 3.6Å; V198-A201 WeakPolarHBondContact O-CB 3.27Å; V198-A201 PolarHBondContact O-N 3.47Å; A201-F204 VanDerWaalsContact O-CB 3.3Å; A201-F204 WeakPolarHBondContact O-CB 3.47Å; A201-F204 PolarHBondContact O-N 2.84Å
202	S	39.5	Very low	37.5	Very low	14 Å²	14	41.2 Å²	41.2	10%	0.098	25%	0.249	C	C	.	.	H	α-helix	trans	-72.8	-33.8	-178.6	69.9	0	0	0	0	112.8	V70 V74 V198 S199 A200 F204 I205	V70-S202 WeakPolarHBondContact CG1-OG 3.24Å; V74-S202 WeakPolarHBondContact CG2-O 3.28Å; V198-S202 VanDerWaalsContact O-CB 3.27Å; V198-S202 WeakPolarHBondContact O-CB 3.2Å; V198-S202 PolarHBondContact O-N 3.46Å; V198-S202 PolarHBondContact O-OG 3.42Å; S199-S202 WeakPolarHBondContact CA-OG 3.11Å; S199-S202 PolarHBondContact O-N 2.98Å; S199-S202 PolarHBondContact O-OG 3.46Å; A200-S202 VanDerWaalsContact C-N 3.26Å; A200-S202 PolarHBondContact O-N 3.27Å; S202-F204 PolarHBondContact O-N 3.36Å; S202-I205 PolarHBondContact O-N 3.45Å
203	Y	36.5	Very low	37.5	Very low	103 Å²	103	40.4 Å²	40.4	40%	0.404	24%	0.243	S	C	.	.	H	α-helix	trans	-66.6	-20.9	173.3	-159.4	-94.1	0	0	0	112.4	S199 A200 I205 N207 K215	S199-Y203 PolarHBondContact O-N 3.06Å; A200-Y203 WeakPolarHBondContact O-CB 3.38Å; A200-Y203 PolarHBondContact O-N 3.25Å; A200-Y203 VanDerWaalsContact O-N 3.12Å; Y203-I205 VanDerWaalsContact C-N 3.3Å; Y203-I205 PolarHBondContact O-N 3.45Å; Y203-N207 WeakPolarHBondContact CE1-ND2 2.99Å; Y203-K215 HydrophobicContact CE1-CD 3.78Å; Y203-K215 PolarHBondContact OH-NZ 3.48Å
204	F	36.3	Very low	37.4	Very low	10 Å²	10	43.3 Å²	43.3	4%	0.044	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-30.8	178.5	-83.2	-83.9	0	0	0	114.9	V91 I94 A200 A201 S202 G206 T212 F216	V91-F204 HydrophobicContact CG2-CB 4.49Å; V91-F204 HydrophobicContact CG2-CD1 4.35Å; I94-F204 HydrophobicContact CB-CE1 4.43Å; I94-F204 HydrophobicContact CB-CZ 4.16Å; I94-F204 HydrophobicContact CD1-CD1 4.13Å; I94-F204 HydrophobicContact CD1-CE1 3.22Å; I94-F204 HydrophobicContact CD1-CZ 3.58Å; I94-F204 HydrophobicContact CG1-CE1 4.31Å; I94-F204 HydrophobicContact CG1-CZ 4.25Å; I94-F204 HydrophobicContact CG2-CD1 4.39Å; I94-F204 HydrophobicContact CG2-CD2 4.03Å; I94-F204 HydrophobicContact CG2-CE1 3.7Å; I94-F204 HydrophobicContact CG2-CE2 3.24Å; I94-F204 HydrophobicContact CG2-CZ 3.05Å; A200-F204 WeakPolarHBondContact O-CD2 3.47Å; A200-F204 WeakPolarHBondContact O-CE2 3.45Å; A200-F204 PolarHBondContact O-N 2.94Å; A201-F204 VanDerWaalsContact O-CB 3.3Å; A201-F204 WeakPolarHBondContact O-CB 3.47Å; A201-F204 PolarHBondContact O-N 2.84Å; S202-F204 PolarHBondContact O-N 3.36Å; F204-G206 VanDerWaalsContact C-N 3.31Å; F204-T212 HydrophobicContact CB-CG2 4.25Å; F204-T212 HydrophobicContact CD1-CG2 3.16Å; F204-T212 HydrophobicContact CE1-CG2 3.33Å; F204-T212 HydrophobicContact CG-CG2 3.79Å; F204-T212 HydrophobicContact CZ-CG2 4.11Å; F204-F216 HydrophobicContact CE1-CB 4.16Å; F204-F216 HydrophobicContact CE1-CG 4.34Å; F204-F216 HydrophobicContact CE2-CB 4.08Å; F204-F216 AromaticContact CE2-CD2 3.27Å; F204-F216 HydrophobicContact CE2-CD2 3.27Å; F204-F216 AromaticContact CE2-CE2 3.64Å; F204-F216 HydrophobicContact CE2-CE2 3.64Å; F204-F216 AromaticContact CE2-CG 3.74Å; F204-F216 HydrophobicContact CE2-CG 3.74Å; F204-F216 HydrophobicContact CE2-CZ 4.41Å; F204-F216 HydrophobicContact CZ-CB 3.35Å; F204-F216 AromaticContact CZ-CD1 3.81Å; F204-F216 HydrophobicContact CZ-CD1 3.81Å; F204-F216 AromaticContact CZ-CD2 3.31Å; F204-F216 HydrophobicContact CZ-CD2 3.31Å; F204-F216 HydrophobicContact CZ-CE1 4.37Å; F204-F216 AromaticContact CZ-CE2 3.91Å; F204-F216 HydrophobicContact CZ-CE2 3.91Å; F204-F216 AromaticContact CZ-CG 3.22Å; F204-F216 HydrophobicContact CZ-CG 3.22Å; F204-F216 HydrophobicContact CZ-CZ 4.39Å
205	I	39.8	Very low	37.7	Very low	52 Å²	52	42.9 Å²	42.9	27%	0.267	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-14.8	-168.3	-68.1	162.1	0	0	0	110.7	V74 K77 I78 S202 Y203	V74-I205 HydrophobicContact CB-CD1 4.42Å; V74-I205 HydrophobicContact CG1-CB 4.37Å; V74-I205 HydrophobicContact CG1-CD1 3.25Å; V74-I205 HydrophobicContact CG1-CG1 4.37Å; V74-I205 HydrophobicContact CG1-CG2 4.34Å; V74-I205 HydrophobicContact CG2-CB 4.26Å; V74-I205 HydrophobicContact CG2-CD1 4.34Å; K77-I205 HydrophobicContact CB-CG2 4.31Å; I78-I205 HydrophobicContact CD1-CD1 4.09Å; I78-I205 HydrophobicContact CG1-CG2 4.26Å; S202-I205 PolarHBondContact O-N 3.45Å; Y203-I205 VanDerWaalsContact C-N 3.3Å; Y203-I205 PolarHBondContact O-N 3.45Å
206	G	38.6	Very low	37.9	Very low	45 Å²	45	41.8 Å²	41.8	46%	0.464	24%	0.242	S	C	.	.	S	Bend	trans	-100.8	-9.5	-177.5	0	0	0	0	0	117.2	F204	F204-G206 VanDerWaalsContact C-N 3.31Å
207	N	34.2	Very low	37.8	Very low	48 Å²	48	39.8 Å²	39.8	26%	0.257	23%	0.232	S	C	.	.	S	Bend	trans	-128.8	156.5	-168.1	-77.9	-63.6	0	0	0	114.4	Y203 T212	Y203-N207 WeakPolarHBondContact CE1-ND2 2.99Å; N207-T212 VanDerWaalsContact C-OG1 3.29Å; N207-T212 WeakPolarHBondContact CB-OG1 3.38Å; N207-T212 PolarHBondContact O-OG1 3.02Å; N207-T212 VanDerWaalsContact O-OG1 3.12Å
208	S	42.8	Very low	37.8	Very low	63 Å²	63	44.4 Å²	44.4	44%	0.441	25%	0.249	S	C	.	.			trans	-64.2	136.4	175.8	65.6	0	0	0	0	111.9	S210 Q211 T212	S208-S210 PolarHBondContact O-N 2.86Å; S208-Q211 PolarHBondContact O-N 3.01Å; S208-T212 PolarHBondContact O-N 2.78Å; S208-T212 PolarHBondContact O-OG1 3.3Å
209	M	39.2	Very low	38	Very low	57 Å²	57	45 Å²	45	28%	0.281	25%	0.251	S	S	.	.	H	α-helix	trans	-38.7	-47.5	-178.3	-100.8	-97.5	-162.5	0	0	114.3	D87 T212 A213	D87-M209 HydrophobicContact CB-CE 3.49Å; D87-M209 VanDerWaalsContact CB-CE 3.49Å; M209-T212 PolarHBondContact O-N 3.26Å; M209-A213 WeakPolarHBondContact O-CB 3.22Å; M209-A213 PolarHBondContact O-N 3.49Å
210	S	37.7	Very low	38	Very low	53 Å²	53	44.2 Å²	44.2	37%	0.371	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-43.2	-176.6	57.4	0	0	0	0	113	S208 V214	S208-S210 PolarHBondContact O-N 2.86Å; S210-V214 WeakPolarHBondContact O-CG2 3.22Å; S210-V214 PolarHBondContact O-N 3.31Å
211	Q	36.7	Very low	38.1	Very low	95 Å²	95	44.2 Å²	44.2	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-71.9	-39.3	176.5	-71	-165.5	9	0	0	110.9	S208 V214 K215	S208-Q211 PolarHBondContact O-N 3.01Å; Q211-V214 PolarHBondContact O-N 3.35Å; Q211-K215 HydrophobicContact CB-CD 4.49Å; Q211-K215 WeakPolarHBondContact O-CB 3.28Å; Q211-K215 WeakPolarHBondContact O-CG 3.39Å; Q211-K215 PolarHBondContact O-N 3Å; Q211-K215 VanDerWaalsContact OE1-NZ 3.13Å
212	T	35.9	Very low	38.2	Very low	5 Å²	5	46.3 Å²	46.3	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-43.5	-177.2	-46.4	0	0	0	0	111.6	F204 N207 S208 M209 F216	F204-T212 HydrophobicContact CB-CG2 4.25Å; F204-T212 HydrophobicContact CD1-CG2 3.16Å; F204-T212 HydrophobicContact CE1-CG2 3.33Å; F204-T212 HydrophobicContact CG-CG2 3.79Å; F204-T212 HydrophobicContact CZ-CG2 4.11Å; N207-T212 VanDerWaalsContact C-OG1 3.29Å; N207-T212 WeakPolarHBondContact CB-OG1 3.38Å; N207-T212 PolarHBondContact O-OG1 3.02Å; N207-T212 VanDerWaalsContact O-OG1 3.12Å; S208-T212 PolarHBondContact O-N 2.78Å; S208-T212 PolarHBondContact O-OG1 3.3Å; M209-T212 PolarHBondContact O-N 3.26Å; T212-F216 WeakPolarHBondContact O-CA 3.28Å; T212-F216 WeakPolarHBondContact O-CB 3.35Å; T212-F216 PolarHBondContact O-N 3.44Å
213	A	38.4	Very low	38.4	Very low	8 Å²	8	46.7 Å²	46.7	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-52.9	-53.8	172.8	0	0	0	0	0	113.4	M209 S217 T261	M209-A213 WeakPolarHBondContact O-CB 3.22Å; M209-A213 PolarHBondContact O-N 3.49Å; A213-S217 VanDerWaalsContact O-CB 3.28Å; A213-S217 WeakPolarHBondContact O-CB 3.18Å; A213-S217 PolarHBondContact O-N 3.35Å; A213-S217 PolarHBondContact O-OG 2.91Å; A213-T261 HydrophobicContact CB-CG2 3.07Å
214	V	37.4	Very low	38.7	Very low	70 Å²	70	42 Å²	42	42%	0.424	23%	0.234	S	C	.	.	H	α-helix	trans	-69.5	-48.1	-175.8	174.1	0	0	0	0	109.8	S210 Q211 F216 S217 F218	S210-V214 WeakPolarHBondContact O-CG2 3.22Å; S210-V214 PolarHBondContact O-N 3.31Å; Q211-V214 PolarHBondContact O-N 3.35Å; V214-F216 VanDerWaalsContact C-N 3.29Å; V214-F216 PolarHBondContact O-N 3.49Å; V214-S217 PolarHBondContact O-N 3.35Å; V214-F218 VanDerWaalsContact O-CB 3.29Å; V214-F218 WeakPolarHBondContact O-CB 3.37Å; V214-F218 PolarHBondContact O-N 3.19Å
215	K	38	Very low	38.9	Very low	76 Å²	76	42.5 Å²	42.5	33%	0.33	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-35.5	178.2	-70.5	172.3	178.7	174.2	0	111.9	Y203 Q211 F218 L219	Y203-K215 HydrophobicContact CE1-CD 3.78Å; Y203-K215 PolarHBondContact OH-NZ 3.48Å; Q211-K215 HydrophobicContact CB-CD 4.49Å; Q211-K215 WeakPolarHBondContact O-CB 3.28Å; Q211-K215 WeakPolarHBondContact O-CG 3.39Å; Q211-K215 PolarHBondContact O-N 3Å; Q211-K215 VanDerWaalsContact OE1-NZ 3.13Å; K215-F218 WeakPolarHBondContact O-CB 3.26Å; K215-F218 PolarHBondContact O-N 2.88Å; K215-L219 WeakPolarHBondContact O-CB 3.36Å; K215-L219 PolarHBondContact O-N 2.88Å
216	F	38.7	Very low	39	Very low	4 Å²	4	41.1 Å²	41.1	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-75.3	-43	176.1	177.1	-106.5	0	0	0	113.4	I94 C98 A200 F204 T212 V214 F218 L219 S220 M257	I94-F216 HydrophobicContact CB-CE1 4.08Å; I94-F216 HydrophobicContact CB-CZ 4.27Å; I94-F216 HydrophobicContact CD1-CD1 4.4Å; I94-F216 HydrophobicContact CG1-CD1 4.21Å; I94-F216 HydrophobicContact CG1-CE1 4Å; I94-F216 HydrophobicContact CG2-CD1 3.95Å; I94-F216 HydrophobicContact CG2-CD2 4.17Å; I94-F216 HydrophobicContact CG2-CE1 3.49Å; I94-F216 VanDerWaalsContact CG2-CE1 3.49Å; I94-F216 HydrophobicContact CG2-CE2 3.71Å; I94-F216 HydrophobicContact CG2-CG 4.25Å; I94-F216 HydrophobicContact CG2-CZ 3.33Å; C98-F216 WeakPolarHBondContact SG-CE2 3.31Å; C98-F216 WeakPolarHBondContact SG-CZ 3.37Å; A200-F216 HydrophobicContact CB-CD2 3.96Å; A200-F216 HydrophobicContact CB-CE2 3.81Å; F204-F216 HydrophobicContact CE1-CB 4.16Å; F204-F216 HydrophobicContact CE1-CG 4.34Å; F204-F216 HydrophobicContact CE2-CB 4.08Å; F204-F216 AromaticContact CE2-CD2 3.27Å; F204-F216 HydrophobicContact CE2-CD2 3.27Å; F204-F216 AromaticContact CE2-CE2 3.64Å; F204-F216 HydrophobicContact CE2-CE2 3.64Å; F204-F216 AromaticContact CE2-CG 3.74Å; F204-F216 HydrophobicContact CE2-CG 3.74Å; F204-F216 HydrophobicContact CE2-CZ 4.41Å; F204-F216 HydrophobicContact CZ-CB 3.35Å; F204-F216 AromaticContact CZ-CD1 3.81Å; F204-F216 HydrophobicContact CZ-CD1 3.81Å; F204-F216 AromaticContact CZ-CD2 3.31Å; F204-F216 HydrophobicContact CZ-CD2 3.31Å; F204-F216 HydrophobicContact CZ-CE1 4.37Å; F204-F216 AromaticContact CZ-CE2 3.91Å; F204-F216 HydrophobicContact CZ-CE2 3.91Å; F204-F216 AromaticContact CZ-CG 3.22Å; F204-F216 HydrophobicContact CZ-CG 3.22Å; F204-F216 HydrophobicContact CZ-CZ 4.39Å; T212-F216 WeakPolarHBondContact O-CA 3.28Å; T212-F216 WeakPolarHBondContact O-CB 3.35Å; T212-F216 PolarHBondContact O-N 3.44Å; V214-F216 VanDerWaalsContact C-N 3.29Å; V214-F216 PolarHBondContact O-N 3.49Å; F216-F218 PolarHBondContact O-N 3.43Å; F216-L219 CarbonylContact O-C 3.59Å; F216-L219 PolarHBondContact O-N 3.27Å; F216-L219 VanDerWaalsContact O-N 3.16Å; F216-S220 WeakPolarHBondContact CD1-OG 3.09Å; F216-S220 WeakPolarHBondContact CE1-OG 3.47Å; F216-S220 VanDerWaalsContact CE2-OG 3.23Å; F216-S220 WeakPolarHBondContact CE2-OG 3.19Å; F216-S220 WeakPolarHBondContact CZ-OG 3.14Å; F216-S220 WeakPolarHBondContact O-CB 3.46Å; F216-S220 PolarHBondContact O-N 3.25Å; F216-S220 PolarHBondContact O-OG 2.94Å; F216-M257 HydrophobicContact CD1-CE 3.68Å; F216-M257 HydrophobicContact CE1-CE 3.44Å; F216-M257 VanDerWaalsContact CE1-CE 3.44Å
217	S	37.1	Very low	39.3	Very low	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-51.5	-45.2	170.8	-58.8	0	0	0	0	107.2	A213 V214 S220 A221 F254 M257 I258	A213-S217 VanDerWaalsContact O-CB 3.28Å; A213-S217 WeakPolarHBondContact O-CB 3.18Å; A213-S217 PolarHBondContact O-N 3.35Å; A213-S217 PolarHBondContact O-OG 2.91Å; V214-S217 PolarHBondContact O-N 3.35Å; S217-S220 PolarHBondContact O-N 2.76Å; S217-A221 WeakPolarHBondContact O-CB 3.28Å; S217-A221 PolarHBondContact O-N 3.46Å; S217-F254 WeakPolarHBondContact O-CD2 3.39Å; S217-M257 WeakPolarHBondContact OG-CB 3.34Å; S217-I258 PolarHBondContact OG-N 3.49Å; S217-I258 VanDerWaalsContact OG-N 3.17Å
218	F	37.9	Very low	39.8	Very low	112 Å²	112	39 Å²	39	49%	0.491	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-46.3	-179.1	-160.9	-103.2	0	0	0	111.3	V214 K215 F216 L222 F254	V214-F218 VanDerWaalsContact O-CB 3.29Å; V214-F218 WeakPolarHBondContact O-CB 3.37Å; V214-F218 PolarHBondContact O-N 3.19Å; K215-F218 WeakPolarHBondContact O-CB 3.26Å; K215-F218 PolarHBondContact O-N 2.88Å; F216-F218 PolarHBondContact O-N 3.43Å; F218-L222 HydrophobicContact CD1-CD1 3.44Å; F218-L222 VanDerWaalsContact CD1-CD1 3.44Å; F218-L222 HydrophobicContact CD1-CG 4.24Å; F218-L222 HydrophobicContact CE1-CD1 3.15Å; F218-L222 HydrophobicContact CE1-CG 4.16Å; F218-L222 HydrophobicContact CG-CD1 4.27Å; F218-L222 HydrophobicContact CZ-CD1 3.76Å; F218-L222 HydrophobicContact CZ-CG 4.47Å; F218-L222 WeakPolarHBondContact O-CA 3.49Å; F218-L222 WeakPolarHBondContact O-CB 3.41Å; F218-L222 VanDerWaalsContact O-CG 3.26Å; F218-L222 WeakPolarHBondContact O-CG 3.05Å; F218-L222 PolarHBondContact O-N 3.48Å; F218-F254 HydrophobicContact CB-CD2 4.34Å; F218-F254 HydrophobicContact CB-CE2 3.64Å; F218-F254 HydrophobicContact CB-CZ 4.36Å; F218-F254 HydrophobicContact CD2-CD2 4.46Å; F218-F254 AromaticContact CD2-CE2 3.74Å; F218-F254 HydrophobicContact CD2-CE2 3.74Å; F218-F254 AromaticContact CD2-CZ 3.74Å; F218-F254 HydrophobicContact CD2-CZ 3.74Å; F218-F254 HydrophobicContact CG-CE2 4.2Å
219	L	39.2	Very low	39.8	Very low	72 Å²	72	37.2 Å²	37.2	38%	0.377	19%	0.193	S	C	.	.	H	α-helix	trans	-64.9	-39.9	176.3	-86.4	159.4	0	0	0	113.1	L196 K215 F216 L222 F223	L196-L219 HydrophobicContact CD2-CD2 4.49Å; K215-L219 WeakPolarHBondContact O-CB 3.36Å; K215-L219 PolarHBondContact O-N 2.88Å; F216-L219 CarbonylContact O-C 3.59Å; F216-L219 PolarHBondContact O-N 3.27Å; F216-L219 VanDerWaalsContact O-N 3.16Å; L219-L222 CarbonylContact O-C 3.6Å; L219-F223 WeakPolarHBondContact O-CA 3.43Å; L219-F223 WeakPolarHBondContact O-CB 3.33Å; L219-F223 PolarHBondContact O-N 2.87Å
220	S	39	Very low	40	Very low	9 Å²	9	36.5 Å²	36.5	6%	0.063	19%	0.19	C	C	.	.	H	α-helix	trans	-76.4	-32.3	-178.8	-55.8	0	0	0	0	112.3	Q101 F216 S217 P224	Q101-S220 PolarHBondContact NE2-O 2.92Å; Q101-S220 VanDerWaalsContact NE2-O 3.08Å; F216-S220 WeakPolarHBondContact CD1-OG 3.09Å; F216-S220 WeakPolarHBondContact CE1-OG 3.47Å; F216-S220 VanDerWaalsContact CE2-OG 3.23Å; F216-S220 WeakPolarHBondContact CE2-OG 3.19Å; F216-S220 WeakPolarHBondContact CZ-OG 3.14Å; F216-S220 WeakPolarHBondContact O-CB 3.46Å; F216-S220 PolarHBondContact O-N 3.25Å; F216-S220 PolarHBondContact O-OG 2.94Å; S217-S220 PolarHBondContact O-N 2.76Å; S220-P224 WeakPolarHBondContact O-CD 3.4Å
221	A	39.2	Very low	40.1	Very low	7 Å²	7	35.4 Å²	35.4	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-73.7	-41.5	171.2	0	0	0	0	0	112	S217 F223 P224 S250 F254	S217-A221 WeakPolarHBondContact O-CB 3.28Å; S217-A221 PolarHBondContact O-N 3.46Å; A221-F223 VanDerWaalsContact C-N 3.34Å; A221-P224 WeakPolarHBondContact O-CD 3.38Å; A221-P224 VanDerWaalsContact O-CG 3.29Å; A221-P224 WeakPolarHBondContact O-CG 3.47Å; A221-S250 VanDerWaalsContact CB-O 3.22Å; A221-S250 WeakPolarHBondContact CB-O 3.38Å; A221-S250 WeakPolarHBondContact O-CB 3.33Å; A221-F254 HydrophobicContact CB-CB 3.32Å; A221-F254 HydrophobicContact CB-CD2 3.88Å; A221-F254 HydrophobicContact CB-CG 3.97Å
222	L	40.5	Very low	40.2	Very low	70 Å²	70	31.2 Å²	31.2	37%	0.366	16%	0.16	S	C	.	.	H	α-helix	trans	-71.9	-31.3	173.3	-76	179.3	0	0	0	110.7	F218 L219 P224 V225 P226	F218-L222 HydrophobicContact CD1-CD1 3.44Å; F218-L222 VanDerWaalsContact CD1-CD1 3.44Å; F218-L222 HydrophobicContact CD1-CG 4.24Å; F218-L222 HydrophobicContact CE1-CD1 3.15Å; F218-L222 HydrophobicContact CE1-CG 4.16Å; F218-L222 HydrophobicContact CG-CD1 4.27Å; F218-L222 HydrophobicContact CZ-CD1 3.76Å; F218-L222 HydrophobicContact CZ-CG 4.47Å; F218-L222 WeakPolarHBondContact O-CA 3.49Å; F218-L222 WeakPolarHBondContact O-CB 3.41Å; F218-L222 VanDerWaalsContact O-CG 3.26Å; F218-L222 WeakPolarHBondContact O-CG 3.05Å; F218-L222 PolarHBondContact O-N 3.48Å; L219-L222 CarbonylContact O-C 3.6Å; L222-P224 VanDerWaalsContact C-CD 3.5Å; L222-P224 VanDerWaalsContact C-N 3.32Å; L222-P224 VanDerWaalsContact O-N 3.13Å; L222-V225 HydrophobicContact CD2-CB 4.34Å; L222-V225 HydrophobicContact CD2-CG2 4.42Å; L222-V225 WeakPolarHBondContact O-CA 3.36Å; L222-V225 VanDerWaalsContact O-CB 3.32Å; L222-V225 WeakPolarHBondContact O-CB 3.42Å; L222-V225 PolarHBondContact O-N 3.31Å; L222-P226 WeakPolarHBondContact O-CD 3.3Å
223	F	42.3	Very low	40.4	Very low	21 Å²	21	31.7 Å²	31.7	9%	0.092	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-49.6	-178.8	-175.1	-100.1	0	0	0	113.5	Q101 M105 I193 L196 L219 A221 V225 F227	Q101-F223 HydrophobicContact CG-CD1 4.1Å; Q101-F223 HydrophobicContact CG-CE1 4.42Å; M105-F223 HydrophobicContact CG-CE1 4.22Å; I193-F223 HydrophobicContact CG2-CZ 4.31Å; L196-F223 HydrophobicContact CB-CD2 4.06Å; L196-F223 HydrophobicContact CB-CE2 3.6Å; L196-F223 HydrophobicContact CD1-CD2 3.86Å; L196-F223 HydrophobicContact CD1-CE2 3.69Å; L196-F223 HydrophobicContact CG-CD2 4.36Å; L196-F223 HydrophobicContact CG-CE2 4.21Å; L219-F223 WeakPolarHBondContact O-CA 3.43Å; L219-F223 WeakPolarHBondContact O-CB 3.33Å; L219-F223 PolarHBondContact O-N 2.87Å; A221-F223 VanDerWaalsContact C-N 3.34Å; F223-V225 VanDerWaalsContact C-N 3.3Å; F223-V225 PolarHBondContact O-N 3.29Å; F223-F227 HydrophobicContact CD2-CE2 4.32Å; F223-F227 HydrophobicContact CE2-CD2 4.42Å; F223-F227 AromaticContact CE2-CE2 3.8Å; F223-F227 HydrophobicContact CE2-CE2 3.8Å; F223-F227 HydrophobicContact CZ-CD2 4.45Å; F223-F227 AromaticContact CZ-CE2 3.96Å; F223-F227 HydrophobicContact CZ-CE2 3.96Å; F223-F227 HydrophobicContact CZ-CZ 4.41Å; F223-F227 VanDerWaalsContact O-CD2 3.24Å; F223-F227 WeakPolarHBondContact O-CD2 3.38Å
224	P	42.7	Very low	40.3	Very low	4 Å²	4	31.8 Å²	31.8	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-31.2	175.5	16.7	-23.1	0	0	0	112.5	Q101 S220 A221 L222 F227 Y228 S250	Q101-P224 VanDerWaalsContact NE2-CD 3.28Å; S220-P224 WeakPolarHBondContact O-CD 3.4Å; A221-P224 WeakPolarHBondContact O-CD 3.38Å; A221-P224 VanDerWaalsContact O-CG 3.29Å; A221-P224 WeakPolarHBondContact O-CG 3.47Å; L222-P224 VanDerWaalsContact C-CD 3.5Å; L222-P224 VanDerWaalsContact C-N 3.32Å; L222-P224 VanDerWaalsContact O-N 3.13Å; P224-F227 CarbonylContact O-C 3.54Å; P224-F227 PolarHBondContact O-N 2.88Å; P224-Y228 VanDerWaalsContact C-CD2 3.49Å; P224-Y228 HydrophobicContact CB-CD2 3.43Å; P224-Y228 VanDerWaalsContact CB-CD2 3.43Å; P224-Y228 HydrophobicContact CB-CE2 3.28Å; P224-Y228 VanDerWaalsContact O-CB 3.26Å; P224-Y228 WeakPolarHBondContact O-CB 3.47Å; P224-Y228 WeakPolarHBondContact O-CD2 3.42Å; P224-Y228 PolarHBondContact O-N 2.98Å; P224-S250 WeakPolarHBondContact CG-OG 3.4Å
225	V	42.1	Very low	40.3	Very low	22 Å²	22	29.4 Å²	29.4	13%	0.133	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-58.6	-171.5	179.2	0	0	0	0	113.7	L222 F223 F227 Y228 L229 S250	L222-V225 HydrophobicContact CD2-CB 4.34Å; L222-V225 HydrophobicContact CD2-CG2 4.42Å; L222-V225 WeakPolarHBondContact O-CA 3.36Å; L222-V225 VanDerWaalsContact O-CB 3.32Å; L222-V225 WeakPolarHBondContact O-CB 3.42Å; L222-V225 PolarHBondContact O-N 3.31Å; F223-V225 VanDerWaalsContact C-N 3.3Å; F223-V225 PolarHBondContact O-N 3.29Å; V225-F227 VanDerWaalsContact C-N 3.26Å; V225-F227 PolarHBondContact O-N 3.41Å; V225-Y228 PolarHBondContact O-N 2.72Å; V225-L229 HydrophobicContact CG1-CD1 3.58Å; V225-L229 HydrophobicContact CG1-CG 4.21Å; V225-L229 WeakPolarHBondContact O-CB 3.2Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.18Å; V225-S250 VanDerWaalsContact CG2-CB 3.46Å; V225-S250 VanDerWaalsContact CG2-OG 3.29Å; V225-S250 WeakPolarHBondContact CG2-OG 3.29Å
226	P	41.2	Very low	40.5	Very low	23 Å²	23	29.8 Å²	29.8	15%	0.149	16%	0.161	C	C	.	.	H	α-helix	trans	-51.8	-45.3	168.7	-33.6	42.3	0	0	0	112	L56 L222 Y228 L229 I230	L56-P226 HydrophobicContact CD1-CB 3.77Å; L56-P226 HydrophobicContact CD1-CG 3.75Å; L56-P226 HydrophobicContact CD2-CG 4.16Å; L222-P226 WeakPolarHBondContact O-CD 3.3Å; P226-Y228 PolarHBondContact O-N 3.38Å; P226-L229 PolarHBondContact O-N 2.92Å; P226-I230 HydrophobicContact CB-CD1 4.17Å; P226-I230 WeakPolarHBondContact O-CA 3.46Å; P226-I230 WeakPolarHBondContact O-CB 3.26Å; P226-I230 WeakPolarHBondContact O-CD1 3.21Å; P226-I230 WeakPolarHBondContact O-CG1 3.22Å; P226-I230 PolarHBondContact O-N 2.99Å
227	F	45.1	Very low	40.6	Very low	30 Å²	30	33.3 Å²	33.3	13%	0.132	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-48.7	-177.5	-87.2	-91.6	0	0	0	111.5	M105 A192 I193 L196 F223 P224 V225 L229 W231	M105-F227 HydrophobicContact CE-CB 3.79Å; M105-F227 HydrophobicContact CE-CD1 4.12Å; M105-F227 HydrophobicContact CE-CG 4.12Å; A192-F227 HydrophobicContact CB-CE1 4.26Å; A192-F227 HydrophobicContact CB-CZ 3.81Å; I193-F227 HydrophobicContact CG1-CE1 4.16Å; I193-F227 HydrophobicContact CG1-CZ 4.32Å; L196-F227 HydrophobicContact CD1-CE2 4.28Å; F223-F227 HydrophobicContact CD2-CE2 4.32Å; F223-F227 HydrophobicContact CE2-CD2 4.42Å; F223-F227 AromaticContact CE2-CE2 3.8Å; F223-F227 HydrophobicContact CE2-CE2 3.8Å; F223-F227 HydrophobicContact CZ-CD2 4.45Å; F223-F227 AromaticContact CZ-CE2 3.96Å; F223-F227 HydrophobicContact CZ-CE2 3.96Å; F223-F227 HydrophobicContact CZ-CZ 4.41Å; F223-F227 VanDerWaalsContact O-CD2 3.24Å; F223-F227 WeakPolarHBondContact O-CD2 3.38Å; P224-F227 CarbonylContact O-C 3.54Å; P224-F227 PolarHBondContact O-N 2.88Å; V225-F227 VanDerWaalsContact C-N 3.26Å; V225-F227 PolarHBondContact O-N 3.41Å; F227-L229 VanDerWaalsContact C-N 3.33Å; F227-L229 PolarHBondContact O-N 3.12Å; F227-W231 WeakPolarHBondContact O-CA 3.38Å; F227-W231 WeakPolarHBondContact O-CB 3.21Å; F227-W231 PolarHBondContact O-N 3.27Å
228	Y	43.6	Very low	40.8	Very low	18 Å²	18	35.1 Å²	35.1	7%	0.071	19%	0.192	C	C	.	.	H	α-helix	trans	-71.7	-25.2	177.2	-72.7	-60	0	0	0	113.3	P224 V225 P226 G232 V246	P224-Y228 VanDerWaalsContact C-CD2 3.49Å; P224-Y228 HydrophobicContact CB-CD2 3.43Å; P224-Y228 VanDerWaalsContact CB-CD2 3.43Å; P224-Y228 HydrophobicContact CB-CE2 3.28Å; P224-Y228 VanDerWaalsContact O-CB 3.26Å; P224-Y228 WeakPolarHBondContact O-CB 3.47Å; P224-Y228 WeakPolarHBondContact O-CD2 3.42Å; P224-Y228 PolarHBondContact O-N 2.98Å; V225-Y228 PolarHBondContact O-N 2.72Å; P226-Y228 PolarHBondContact O-N 3.38Å; Y228-G232 VanDerWaalsContact O-CA 3.28Å; Y228-G232 WeakPolarHBondContact O-CA 3.46Å; Y228-G232 PolarHBondContact O-N 2.77Å; Y228-V246 VanDerWaalsContact CB-CG1 3.45Å; Y228-V246 HydrophobicContact CD1-CG2 3.89Å; Y228-V246 HydrophobicContact CD2-CB 4.12Å; Y228-V246 HydrophobicContact CD2-CG1 3.24Å; Y228-V246 HydrophobicContact CD2-CG2 3.81Å; Y228-V246 HydrophobicContact CE1-CG2 4.29Å; Y228-V246 HydrophobicContact CE2-CG1 4.1Å; Y228-V246 HydrophobicContact CE2-CG2 4.19Å; Y228-V246 HydrophobicContact CG-CB 4.25Å; Y228-V246 HydrophobicContact CG-CG1 3.55Å; Y228-V246 HydrophobicContact CG-CG2 3.66Å
229	L	43.8	Very low	41	Very low	25 Å²	25	32.7 Å²	32.7	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-73.4	-59.8	171.3	-78.3	170	0	0	0	110	T49 V225 P226 F227 W231 G232 V233 L243	T49-L229 HydrophobicContact CG2-CB 4.11Å; T49-L229 HydrophobicContact CG2-CD2 3.95Å; T49-L229 HydrophobicContact CG2-CG 4.49Å; V225-L229 HydrophobicContact CG1-CD1 3.58Å; V225-L229 HydrophobicContact CG1-CG 4.21Å; V225-L229 WeakPolarHBondContact O-CB 3.2Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.18Å; P226-L229 PolarHBondContact O-N 2.92Å; F227-L229 VanDerWaalsContact C-N 3.33Å; F227-L229 PolarHBondContact O-N 3.12Å; L229-W231 PolarHBondContact O-N 3.3Å; L229-G232 PolarHBondContact O-N 3.28Å; L229-V233 WeakPolarHBondContact O-CB 3.31Å; L229-V233 WeakPolarHBondContact O-CG2 3.24Å; L229-V233 PolarHBondContact O-N 3.31Å; L229-L243 HydrophobicContact CD2-CD1 3.42Å; L229-L243 VanDerWaalsContact CD2-CD1 3.42Å; L229-L243 HydrophobicContact CD2-CD2 4.09Å; L229-L243 HydrophobicContact CD2-CG 4.39Å; L229-L243 HydrophobicContact CG-CD1 4.15Å
230	I	42.6	Very low	41.1	Very low	43 Å²	43	33 Å²	33	22%	0.221	20%	0.195	C	C	.	.	H	α-helix	trans	-46.2	-48.7	172.7	-66.1	162.8	0	0	0	108.8	C53 Y188 P226 A234	C53-I230 HydrophobicContact CB-CB 4.43Å; C53-I230 HydrophobicContact CB-CG1 3.54Å; C53-I230 WeakPolarHBondContact SG-CA 3.41Å; C53-I230 WeakPolarHBondContact SG-CG1 2.98Å; Y188-I230 HydrophobicContact CD1-CG2 4.2Å; P226-I230 HydrophobicContact CB-CD1 4.17Å; P226-I230 WeakPolarHBondContact O-CA 3.46Å; P226-I230 WeakPolarHBondContact O-CB 3.26Å; P226-I230 WeakPolarHBondContact O-CD1 3.21Å; P226-I230 WeakPolarHBondContact O-CG1 3.22Å; P226-I230 PolarHBondContact O-N 2.99Å; I230-A234 WeakPolarHBondContact O-CB 3.34Å; I230-A234 PolarHBondContact O-N 2.74Å
231	W	39.9	Very low	41.3	Very low	30 Å²	30	34.2 Å²	34.2	11%	0.114	20%	0.202	C	C	.	.	H	α-helix	trans	-73.2	-53.2	-177.4	-161.5	-11.9	0	0	0	111.2	M105 F108 A109 V112 F185 F227 L229 V233 A234 L235	M105-W231 HydrophobicContact CE-CE3 4.43Å; M105-W231 HydrophobicContact CE-CZ3 4.19Å; F108-W231 HydrophobicContact CD1-CE3 4.01Å; F108-W231 AromaticContact CD1-CH2 3.04Å; F108-W231 HydrophobicContact CD1-CH2 3.04Å; F108-W231 AromaticContact CD1-CZ2 3.68Å; F108-W231 HydrophobicContact CD1-CZ2 3.68Å; F108-W231 AromaticContact CD1-CZ3 3.25Å; F108-W231 HydrophobicContact CD1-CZ3 3.25Å; F108-W231 AromaticContact CE1-CD2 3.76Å; F108-W231 HydrophobicContact CE1-CD2 3.76Å; F108-W231 AromaticContact CE1-CE2 3.63Å; F108-W231 AromaticContact CE1-CE3 3.56Å; F108-W231 HydrophobicContact CE1-CE3 3.56Å; F108-W231 AromaticContact CE1-CH2 3.1Å; F108-W231 HydrophobicContact CE1-CH2 3.1Å; F108-W231 AromaticContact CE1-CZ2 3.26Å; F108-W231 HydrophobicContact CE1-CZ2 3.26Å; F108-W231 AromaticContact CE1-CZ3 3.26Å; F108-W231 HydrophobicContact CE1-CZ3 3.26Å; F108-W231 HydrophobicContact CG-CH2 4.27Å; F108-W231 HydrophobicContact CZ-CH2 4.35Å; F108-W231 HydrophobicContact CZ-CZ2 4.2Å; A109-W231 HydrophobicContact CB-CH2 3.94Å; V112-W231 HydrophobicContact CB-CZ2 4.28Å; V112-W231 HydrophobicContact CG2-CZ2 3.82Å; F185-W231 HydrophobicContact CE2-CH2 4.19Å; F185-W231 AromaticContact CE2-CZ2 3.48Å; F185-W231 HydrophobicContact CE2-CZ2 3.48Å; F185-W231 VanDerWaalsContact CE2-CZ2 3.48Å; F185-W231 AromaticContact CZ-CH2 3.78Å; F185-W231 HydrophobicContact CZ-CH2 3.78Å; F185-W231 AromaticContact CZ-CZ2 3.55Å; F185-W231 HydrophobicContact CZ-CZ2 3.55Å; F227-W231 WeakPolarHBondContact O-CA 3.38Å; F227-W231 WeakPolarHBondContact O-CB 3.21Å; F227-W231 PolarHBondContact O-N 3.27Å; L229-W231 PolarHBondContact O-N 3.3Å; W231-V233 PolarHBondContact O-N 3.46Å; W231-A234 CarbonylContact O-C 3.6Å; W231-A234 VanDerWaalsContact O-C 3.29Å; W231-A234 VanDerWaalsContact O-CA 3.3Å; W231-A234 WeakPolarHBondContact O-CA 2.98Å; W231-A234 WeakPolarHBondContact O-CB 3.23Å; W231-A234 PolarHBondContact O-N 3.39Å; W231-L235 VanDerWaalsContact CD1-CD1 3.48Å; W231-L235 VanDerWaalsContact CD1-CD2 3.48Å; W231-L235 HydrophobicContact CG-CD1 4.37Å; W231-L235 HydrophobicContact CG-CG 4.49Å; W231-L235 VanDerWaalsContact O-CG 3.25Å; W231-L235 WeakPolarHBondContact O-CG 3.49Å; W231-L235 PolarHBondContact O-N 3.16Å
232	G	39.2	Very low	41.6	Very low	6 Å²	6	37.4 Å²	37.4	6%	0.062	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-28.8	-177.5	0	0	0	0	0	114	Y228 L229 S236 V237 L238	Y228-G232 VanDerWaalsContact O-CA 3.28Å; Y228-G232 WeakPolarHBondContact O-CA 3.46Å; Y228-G232 PolarHBondContact O-N 2.77Å; L229-G232 PolarHBondContact O-N 3.28Å; G232-S236 PolarHBondContact O-N 2.88Å; G232-S236 VanDerWaalsContact O-N 3.17Å; G232-V237 PolarHBondContact O-N 3.36Å; G232-L238 VanDerWaalsContact C-CD1 3.48Å
233	V	39.7	Very low	41.8	Very low	15 Å²	15	36.1 Å²	36.1	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-51.3	164.1	169.7	0	0	0	0	110.4	L46 T49 I50 L229 W231 L235 S236	L46-V233 HydrophobicContact CD1-CB 4.18Å; L46-V233 HydrophobicContact CD1-CG1 3.88Å; L46-V233 HydrophobicContact CD1-CG2 3.95Å; L46-V233 HydrophobicContact CG-CG1 4.18Å; T49-V233 HydrophobicContact CG2-CG2 3.45Å; T49-V233 VanDerWaalsContact CG2-CG2 3.45Å; I50-V233 HydrophobicContact CD1-CG1 4Å; I50-V233 HydrophobicContact CG1-CG1 3.29Å; L229-V233 WeakPolarHBondContact O-CB 3.31Å; L229-V233 WeakPolarHBondContact O-CG2 3.24Å; L229-V233 PolarHBondContact O-N 3.31Å; W231-V233 PolarHBondContact O-N 3.46Å; V233-L235 PolarHBondContact O-N 2.83Å; V233-S236 PolarHBondContact O-N 3.41Å
234	A	37.1	Very low	41.9	Very low	10 Å²	10	39.2 Å²	39.2	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-19	175.7	0	0	0	0	0	113.9	I183 Y188 I230 W231	I183-A234 WeakPolarHBondContact CB-O 3.36Å; I183-A234 WeakPolarHBondContact CD1-O 3.46Å; I183-A234 WeakPolarHBondContact CG2-O 3.37Å; Y188-A234 HydrophobicContact CD2-CB 3.41Å; Y188-A234 VanDerWaalsContact CD2-CB 3.41Å; Y188-A234 HydrophobicContact CE2-CB 3.34Å; Y188-A234 HydrophobicContact CG-CB 4.13Å; I230-A234 WeakPolarHBondContact O-CB 3.34Å; I230-A234 PolarHBondContact O-N 2.74Å; W231-A234 CarbonylContact O-C 3.6Å; W231-A234 VanDerWaalsContact O-C 3.29Å; W231-A234 VanDerWaalsContact O-CA 3.3Å; W231-A234 WeakPolarHBondContact O-CA 2.98Å; W231-A234 WeakPolarHBondContact O-CB 3.23Å; W231-A234 PolarHBondContact O-N 3.39Å
235	L	37.7	Very low	42	Very low	20 Å²	20	40.4 Å²	40.4	11%	0.105	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-10.6	172.8	-57.1	177.3	0	0	0	112.5	V179 S181 W231 V233 V237	V179-L235 HydrophobicContact CG1-CD1 3.49Å; V179-L235 VanDerWaalsContact CG1-CD1 3.49Å; S181-L235 WeakPolarHBondContact OG-CD2 3.35Å; W231-L235 VanDerWaalsContact CD1-CD1 3.48Å; W231-L235 VanDerWaalsContact CD1-CD2 3.48Å; W231-L235 HydrophobicContact CG-CD1 4.37Å; W231-L235 HydrophobicContact CG-CG 4.49Å; W231-L235 VanDerWaalsContact O-CG 3.25Å; W231-L235 WeakPolarHBondContact O-CG 3.49Å; W231-L235 PolarHBondContact O-N 3.16Å; V233-L235 PolarHBondContact O-N 2.83Å; L235-V237 HydrophobicContact CB-CB 4.3Å; L235-V237 WeakPolarHBondContact O-CB 3.1Å; L235-V237 WeakPolarHBondContact O-CG2 3.31Å; L235-V237 PolarHBondContact O-N 3.24Å
236	S	42.2	Very low	42.2	Very low	85 Å²	85	39.5 Å²	39.5	59%	0.594	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	19.4	-173.6	-45.9	0	0	0	0	113.7	I183 G232 V233	I183-S236 VanDerWaalsContact CD1-OG 3.32Å; I183-S236 WeakPolarHBondContact CD1-OG 3.34Å; G232-S236 PolarHBondContact O-N 2.88Å; G232-S236 VanDerWaalsContact O-N 3.17Å; V233-S236 PolarHBondContact O-N 3.41Å
237	V	40.9	Very low	42.4	Very low	78 Å²	78	41.5 Å²	41.5	47%	0.473	23%	0.233	S	C	.	.			trans	-135.1	27.9	-164.6	176.2	0	0	0	0	110.6	G232 L235 S239	G232-V237 PolarHBondContact O-N 3.36Å; L235-V237 HydrophobicContact CB-CB 4.3Å; L235-V237 WeakPolarHBondContact O-CB 3.1Å; L235-V237 WeakPolarHBondContact O-CG2 3.31Å; L235-V237 PolarHBondContact O-N 3.24Å; V237-S239 VanDerWaalsContact C-N 3.31Å; V237-S239 PolarHBondContact O-N 2.81Å
238	L	40.8	Very low	42.3	Very low	37 Å²	37	40.7 Å²	40.7	19%	0.194	23%	0.231	C	C	.	.			trans	-73.8	98.1	156.5	-79.1	158.5	0	0	0	107.2	G232 Y242 L243	G232-L238 VanDerWaalsContact C-CD1 3.48Å; L238-Y242 HydrophobicContact CD2-CD1 3.36Å; L238-Y242 HydrophobicContact CD2-CE1 4.2Å; L238-Y242 HydrophobicContact CD2-CG 4.11Å; L238-Y242 HydrophobicContact CG-CD1 4.44Å; L238-L243 HydrophobicContact CB-CB 4.38Å; L238-L243 HydrophobicContact CD1-CB 4.28Å; L238-L243 HydrophobicContact CD1-CD1 4.01Å; L238-L243 HydrophobicContact CD2-CB 3.68Å; L238-L243 HydrophobicContact CD2-CD1 4.27Å; L238-L243 VanDerWaalsContact CD2-N 3.31Å; L238-L243 HydrophobicContact CG-CB 4.35Å
239	S	41.4	Very low	42.5	Very low	62 Å²	62	42.3 Å²	42.3	43%	0.434	24%	0.24	S	C	.	.			trans	-47	129.6	143.4	170.6	0	0	0	0	106	V237 V241 Y242 L243	V237-S239 VanDerWaalsContact C-N 3.31Å; V237-S239 PolarHBondContact O-N 2.81Å; S239-V241 CarbonylContact O-C 3.29Å; S239-V241 PolarHBondContact O-N 2.91Å; S239-V241 WeakPolarHBondContact OG-CB 3.42Å; S239-V241 PolarHBondContact OG-N 3.45Å; S239-Y242 PolarHBondContact O-N 3.36Å; S239-L243 PolarHBondContact O-N 3.35Å
240	P	42.6	Very low	42.6	Very low	78 Å²	78	41.3 Å²	41.3	51%	0.506	24%	0.235	S	C	.	.	H	α-helix	trans	-48.6	-28.7	176.1	-28.7	34.7	0	0	0	112.3	L243 L244	P240-L243 PolarHBondContact O-N 3.45Å; P240-L244 WeakPolarHBondContact O-CB 3.24Å; P240-L244 WeakPolarHBondContact O-CD1 3.46Å; P240-L244 VanDerWaalsContact O-CG 3.29Å; P240-L244 WeakPolarHBondContact O-CG 3.27Å; P240-L244 PolarHBondContact O-N 3.13Å
241	V	43.1	Very low	42.6	Very low	35 Å²	35	42.3 Å²	42.3	21%	0.212	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-47.1	172.9	-176.9	0	0	0	0	112.2	S239 L243 L244 L245 A294	S239-V241 CarbonylContact O-C 3.29Å; S239-V241 PolarHBondContact O-N 2.91Å; S239-V241 WeakPolarHBondContact OG-CB 3.42Å; S239-V241 PolarHBondContact OG-N 3.45Å; V241-L243 VanDerWaalsContact C-N 3.3Å; V241-L243 PolarHBondContact O-N 2.87Å; V241-L244 WeakPolarHBondContact O-CB 3.25Å; V241-L244 PolarHBondContact O-N 2.88Å; V241-L245 HydrophobicContact CG1-CD1 4.09Å; V241-L245 HydrophobicContact CG1-CG 4.39Å; V241-L245 WeakPolarHBondContact O-CB 3.4Å; V241-L245 VanDerWaalsContact O-CG 3.24Å; V241-L245 WeakPolarHBondContact O-CG 3.21Å; V241-L245 PolarHBondContact O-N 3.13Å; V241-A294 HydrophobicContact CB-CB 4.22Å; V241-A294 HydrophobicContact CG1-CB 3.61Å; V241-A294 HydrophobicContact CG2-CB 3.7Å
242	Y	44.3	Very low	42.8	Very low	73 Å²	73	41.2 Å²	41.2	29%	0.286	24%	0.242	S	C	.	.	H	α-helix	trans	-66	-35.5	179.3	-171.8	-114.2	0	0	0	111.4	L238 S239 L245 V246	L238-Y242 HydrophobicContact CD2-CD1 3.36Å; L238-Y242 HydrophobicContact CD2-CE1 4.2Å; L238-Y242 HydrophobicContact CD2-CG 4.11Å; L238-Y242 HydrophobicContact CG-CD1 4.44Å; S239-Y242 PolarHBondContact O-N 3.36Å; Y242-L245 HydrophobicContact CD2-CD1 4.46Å; Y242-L245 PolarHBondContact O-N 2.74Å; Y242-V246 HydrophobicContact CE1-CG2 4.16Å; Y242-V246 WeakPolarHBondContact O-CB 3.45Å; Y242-V246 WeakPolarHBondContact O-CG2 3.48Å; Y242-V246 PolarHBondContact O-N 3.23Å
243	L	44.9	Very low	43.2	Very low	44 Å²	44	43.8 Å²	43.8	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-44.5	173.1	-175.4	56.7	0	0	0	111.6	L229 L238 S239 P240 V241 L245 V246 I247	L229-L243 HydrophobicContact CD2-CD1 3.42Å; L229-L243 VanDerWaalsContact CD2-CD1 3.42Å; L229-L243 HydrophobicContact CD2-CD2 4.09Å; L229-L243 HydrophobicContact CD2-CG 4.39Å; L229-L243 HydrophobicContact CG-CD1 4.15Å; L238-L243 HydrophobicContact CB-CB 4.38Å; L238-L243 HydrophobicContact CD1-CB 4.28Å; L238-L243 HydrophobicContact CD1-CD1 4.01Å; L238-L243 HydrophobicContact CD2-CB 3.68Å; L238-L243 HydrophobicContact CD2-CD1 4.27Å; L238-L243 VanDerWaalsContact CD2-N 3.31Å; L238-L243 HydrophobicContact CG-CB 4.35Å; S239-L243 PolarHBondContact O-N 3.35Å; P240-L243 PolarHBondContact O-N 3.45Å; V241-L243 VanDerWaalsContact C-N 3.3Å; V241-L243 PolarHBondContact O-N 2.87Å; L243-L245 VanDerWaalsContact C-N 3.34Å; L243-L245 PolarHBondContact O-N 2.95Å; L243-V246 PolarHBondContact O-N 3.35Å; L243-I247 HydrophobicContact CD1-CD1 4.08Å; L243-I247 HydrophobicContact CD1-CG1 4.29Å; L243-I247 HydrophobicContact CG-CD1 3.86Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 WeakPolarHBondContact O-CB 3.4Å; L243-I247 VanDerWaalsContact O-CG1 3.27Å; L243-I247 WeakPolarHBondContact O-CG1 3.45Å; L243-I247 PolarHBondContact O-N 2.73Å
244	L	43.9	Very low	43.5	Very low	85 Å²	85	45.1 Å²	45.1	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-40.6	175.8	-76.3	163.3	0	0	0	112.1	P240 V241 I247 A248 M290	P240-L244 WeakPolarHBondContact O-CB 3.24Å; P240-L244 WeakPolarHBondContact O-CD1 3.46Å; P240-L244 VanDerWaalsContact O-CG 3.29Å; P240-L244 WeakPolarHBondContact O-CG 3.27Å; P240-L244 PolarHBondContact O-N 3.13Å; V241-L244 WeakPolarHBondContact O-CB 3.25Å; V241-L244 PolarHBondContact O-N 2.88Å; L244-I247 PolarHBondContact O-N 2.87Å; L244-A248 WeakPolarHBondContact O-CB 3.45Å; L244-A248 PolarHBondContact O-N 2.7Å; L244-M290 HydrophobicContact CB-CE 3.64Å; L244-M290 HydrophobicContact CD1-CE 3.66Å; L244-M290 HydrophobicContact CD2-CE 4.47Å; L244-M290 HydrophobicContact CG-CE 4.12Å
245	L	45.5	Very low	43.7	Very low	30 Å²	30	49.4 Å²	49.4	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-48.5	175.2	-74.5	168.3	0	0	0	110.8	V241 Y242 L243 A248 Q249 N287 M290	V241-L245 HydrophobicContact CG1-CD1 4.09Å; V241-L245 HydrophobicContact CG1-CG 4.39Å; V241-L245 WeakPolarHBondContact O-CB 3.4Å; V241-L245 VanDerWaalsContact O-CG 3.24Å; V241-L245 WeakPolarHBondContact O-CG 3.21Å; V241-L245 PolarHBondContact O-N 3.13Å; Y242-L245 HydrophobicContact CD2-CD1 4.46Å; Y242-L245 PolarHBondContact O-N 2.74Å; L243-L245 VanDerWaalsContact C-N 3.34Å; L243-L245 PolarHBondContact O-N 2.95Å; L245-A248 PolarHBondContact O-N 3Å; L245-Q249 VanDerWaalsContact O-CB 3.3Å; L245-Q249 WeakPolarHBondContact O-CB 3.25Å; L245-Q249 PolarHBondContact O-N 3.26Å; L245-N287 HydrophobicContact CD2-CB 4.03Å; L245-N287 WeakPolarHBondContact CD2-OD1 3.38Å; L245-M290 HydrophobicContact CD2-CB 3.73Å; L245-M290 HydrophobicContact CD2-CG 4.42Å; L245-M290 HydrophobicContact CG-CB 4.38Å
246	V	45.8	Very low	44.1	Very low	2 Å²	2	49.3 Å²	49.3	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-49.9	176.1	158.1	0	0	0	0	111.7	Y228 Y242 L243 A248 Q249 S250	Y228-V246 VanDerWaalsContact CB-CG1 3.45Å; Y228-V246 HydrophobicContact CD1-CG2 3.89Å; Y228-V246 HydrophobicContact CD2-CB 4.12Å; Y228-V246 HydrophobicContact CD2-CG1 3.24Å; Y228-V246 HydrophobicContact CD2-CG2 3.81Å; Y228-V246 HydrophobicContact CE1-CG2 4.29Å; Y228-V246 HydrophobicContact CE2-CG1 4.1Å; Y228-V246 HydrophobicContact CE2-CG2 4.19Å; Y228-V246 HydrophobicContact CG-CB 4.25Å; Y228-V246 HydrophobicContact CG-CG1 3.55Å; Y228-V246 HydrophobicContact CG-CG2 3.66Å; Y242-V246 HydrophobicContact CE1-CG2 4.16Å; Y242-V246 WeakPolarHBondContact O-CB 3.45Å; Y242-V246 WeakPolarHBondContact O-CG2 3.48Å; Y242-V246 PolarHBondContact O-N 3.23Å; L243-V246 PolarHBondContact O-N 3.35Å; V246-A248 VanDerWaalsContact C-N 3.28Å; V246-A248 PolarHBondContact O-N 3.3Å; V246-Q249 PolarHBondContact O-N 2.95Å; V246-S250 WeakPolarHBondContact O-CB 2.95Å; V246-S250 PolarHBondContact O-N 2.73Å; V246-S250 PolarHBondContact O-OG 3.46Å
247	I	46.3	Very low	44.2	Very low	66 Å²	66	46.1 Å²	46.1	34%	0.338	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-42.4	-179.9	-70.5	168.8	0	0	0	109.4	L243 L244 S250 C251	L243-I247 HydrophobicContact CD1-CD1 4.08Å; L243-I247 HydrophobicContact CD1-CG1 4.29Å; L243-I247 HydrophobicContact CG-CD1 3.86Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 WeakPolarHBondContact O-CB 3.4Å; L243-I247 VanDerWaalsContact O-CG1 3.27Å; L243-I247 WeakPolarHBondContact O-CG1 3.45Å; L243-I247 PolarHBondContact O-N 2.73Å; L244-I247 PolarHBondContact O-N 2.87Å; I247-S250 WeakPolarHBondContact O-CB 3.42Å; I247-S250 PolarHBondContact O-N 3.41Å; I247-C251 WeakPolarHBondContact O-CB 3.47Å; I247-C251 PolarHBondContact O-N 3.29Å; I247-C251 PolarHBondContact O-SG 3.09Å
248	A	43.6	Very low	44.3	Very low	12 Å²	12	43.9 Å²	43.9	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-43.6	178.4	0	0	0	0	0	112.6	L244 L245 V246 S250 C251 A252 F286	L244-A248 WeakPolarHBondContact O-CB 3.45Å; L244-A248 PolarHBondContact O-N 2.7Å; L245-A248 PolarHBondContact O-N 3Å; V246-A248 VanDerWaalsContact C-N 3.28Å; V246-A248 PolarHBondContact O-N 3.3Å; A248-S250 VanDerWaalsContact C-N 3.29Å; A248-S250 PolarHBondContact O-N 2.87Å; A248-C251 PolarHBondContact O-N 3.39Å; A248-A252 VanDerWaalsContact O-CB 3.28Å; A248-A252 WeakPolarHBondContact O-CB 3.5Å; A248-A252 PolarHBondContact O-N 3.02Å; A248-F286 HydrophobicContact CB-CD1 3.18Å; A248-F286 HydrophobicContact CB-CE1 3.2Å; A248-F286 HydrophobicContact CB-CG 4Å; A248-F286 HydrophobicContact CB-CZ 4.03Å
249	Q	47.3	Very low	44.4	Very low	52 Å²	52	44 Å²	44	24%	0.243	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-40.7	175.1	-174	175.5	-2.1	0	0	110.8	L245 V246 A252 L253	L245-Q249 VanDerWaalsContact O-CB 3.3Å; L245-Q249 WeakPolarHBondContact O-CB 3.25Å; L245-Q249 PolarHBondContact O-N 3.26Å; V246-Q249 PolarHBondContact O-N 2.95Å; Q249-A252 PolarHBondContact O-N 3.32Å; Q249-L253 HydrophobicContact CG-CD1 4.4Å; Q249-L253 WeakPolarHBondContact O-CB 3.04Å; Q249-L253 VanDerWaalsContact O-CG 3.26Å; Q249-L253 WeakPolarHBondContact O-CG 3.37Å; Q249-L253 PolarHBondContact O-N 2.86Å
250	S	46.1	Very low	44.5	Very low	4 Å²	4	41.4 Å²	41.4	3%	0.028	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-47.5	174.5	-61.6	0	0	0	0	111.8	A221 P224 V225 V246 I247 A248 L253 F254	A221-S250 VanDerWaalsContact CB-O 3.22Å; A221-S250 WeakPolarHBondContact CB-O 3.38Å; A221-S250 WeakPolarHBondContact O-CB 3.33Å; P224-S250 WeakPolarHBondContact CG-OG 3.4Å; V225-S250 VanDerWaalsContact CG2-CB 3.46Å; V225-S250 VanDerWaalsContact CG2-OG 3.29Å; V225-S250 WeakPolarHBondContact CG2-OG 3.29Å; V246-S250 WeakPolarHBondContact O-CB 2.95Å; V246-S250 PolarHBondContact O-N 2.73Å; V246-S250 PolarHBondContact O-OG 3.46Å; I247-S250 WeakPolarHBondContact O-CB 3.42Å; I247-S250 PolarHBondContact O-N 3.41Å; A248-S250 VanDerWaalsContact C-N 3.29Å; A248-S250 PolarHBondContact O-N 2.87Å; S250-L253 PolarHBondContact O-N 3.35Å; S250-F254 PolarHBondContact O-N 3.47Å
251	C	43	Very low	44.5	Very low	65 Å²	65	38.2 Å²	38.2	44%	0.439	21%	0.206	S	C	.	.	H	α-helix	trans	-64.7	-37.4	174.6	-73.4	0	0	0	0	112.5	I247 A248 F254 L255	I247-C251 WeakPolarHBondContact O-CB 3.47Å; I247-C251 PolarHBondContact O-N 3.29Å; I247-C251 PolarHBondContact O-SG 3.09Å; A248-C251 PolarHBondContact O-N 3.39Å; C251-F254 VanDerWaalsContact O-CB 3.25Å; C251-F254 WeakPolarHBondContact O-CB 3.23Å; C251-F254 PolarHBondContact O-N 2.95Å; C251-L255 WeakPolarHBondContact O-CB 3.5Å; C251-L255 VanDerWaalsContact O-CG 3.24Å; C251-L255 WeakPolarHBondContact O-CG 3.25Å; C251-L255 PolarHBondContact O-N 3.24Å
252	A	44.2	Very low	44.5	Very low	7 Å²	7	42.3 Å²	42.3	6%	0.058	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-41.6	176.9	0	0	0	0	0	110.8	A248 Q249 F254 L255 C256 V282 C283	A248-A252 VanDerWaalsContact O-CB 3.28Å; A248-A252 WeakPolarHBondContact O-CB 3.5Å; A248-A252 PolarHBondContact O-N 3.02Å; Q249-A252 PolarHBondContact O-N 3.32Å; A252-F254 VanDerWaalsContact C-N 3.32Å; A252-F254 PolarHBondContact O-N 3.39Å; A252-L255 PolarHBondContact O-N 2.76Å; A252-C256 VanDerWaalsContact O-CB 3.3Å; A252-C256 WeakPolarHBondContact O-CB 3.43Å; A252-C256 PolarHBondContact O-N 3.49Å; A252-C256 PolarHBondContact O-SG 3.46Å; A252-V282 HydrophobicContact CB-CG1 4.35Å; A252-C283 WeakPolarHBondContact CB-SG 3.07Å
253	L	47.7	Very low	44.3	Very low	60 Å²	60	40.6 Å²	40.6	31%	0.314	22%	0.217	S	C	.	.	H	α-helix	trans	-59.1	-42.8	169.6	-74.1	167.8	0	0	0	111.4	Q249 S250 C256 M257	Q249-L253 HydrophobicContact CG-CD1 4.4Å; Q249-L253 WeakPolarHBondContact O-CB 3.04Å; Q249-L253 VanDerWaalsContact O-CG 3.26Å; Q249-L253 WeakPolarHBondContact O-CG 3.37Å; Q249-L253 PolarHBondContact O-N 2.86Å; S250-L253 PolarHBondContact O-N 3.35Å; L253-C256 PolarHBondContact O-N 3.4Å; L253-M257 WeakPolarHBondContact O-CB 3.31Å; L253-M257 VanDerWaalsContact O-CG 3.31Å; L253-M257 WeakPolarHBondContact O-CG 3.3Å; L253-M257 PolarHBondContact O-N 2.88Å
254	F	44.1	Very low	44.2	Very low	43 Å²	43	40.2 Å²	40.2	19%	0.189	21%	0.213	C	C	.	.	H	α-helix	trans	-54.5	-57.2	174.4	-177.4	-125.6	0	0	0	111.9	S217 F218 A221 S250 C251 A252 C256 M257 I258	S217-F254 WeakPolarHBondContact O-CD2 3.39Å; F218-F254 HydrophobicContact CB-CD2 4.34Å; F218-F254 HydrophobicContact CB-CE2 3.64Å; F218-F254 HydrophobicContact CB-CZ 4.36Å; F218-F254 HydrophobicContact CD2-CD2 4.46Å; F218-F254 AromaticContact CD2-CE2 3.74Å; F218-F254 HydrophobicContact CD2-CE2 3.74Å; F218-F254 AromaticContact CD2-CZ 3.74Å; F218-F254 HydrophobicContact CD2-CZ 3.74Å; F218-F254 HydrophobicContact CG-CE2 4.2Å; A221-F254 HydrophobicContact CB-CB 3.32Å; A221-F254 HydrophobicContact CB-CD2 3.88Å; A221-F254 HydrophobicContact CB-CG 3.97Å; S250-F254 PolarHBondContact O-N 3.47Å; C251-F254 VanDerWaalsContact O-CB 3.25Å; C251-F254 WeakPolarHBondContact O-CB 3.23Å; C251-F254 PolarHBondContact O-N 2.95Å; A252-F254 VanDerWaalsContact C-N 3.32Å; A252-F254 PolarHBondContact O-N 3.39Å; F254-C256 PolarHBondContact O-N 2.99Å; F254-M257 PolarHBondContact O-N 2.83Å; F254-I258 HydrophobicContact CD1-CD1 4.03Å; F254-I258 HydrophobicContact CD2-CD1 4.19Å; F254-I258 HydrophobicContact CD2-CG1 4.37Å; F254-I258 HydrophobicContact CE1-CD1 3.43Å; F254-I258 VanDerWaalsContact CE1-CD1 3.43Å; F254-I258 HydrophobicContact CE2-CD1 3.58Å; F254-I258 HydrophobicContact CE2-CG1 4.03Å; F254-I258 HydrophobicContact CG-CD1 4.41Å; F254-I258 HydrophobicContact CZ-CD1 3.19Å; F254-I258 HydrophobicContact CZ-CG1 4.15Å; F254-I258 PolarHBondContact O-N 2.67Å
255	L	42.9	Very low	44	Very low	100 Å²	100	44.5 Å²	44.5	52%	0.524	22%	0.224	S	C	.	.	H	α-helix	trans	-60.6	-33.2	-176.3	-71.7	171.1	0	0	0	110.7	C251 A252 S259	C251-L255 WeakPolarHBondContact O-CB 3.5Å; C251-L255 VanDerWaalsContact O-CG 3.24Å; C251-L255 WeakPolarHBondContact O-CG 3.25Å; C251-L255 PolarHBondContact O-N 3.24Å; A252-L255 PolarHBondContact O-N 2.76Å; L255-S259 VanDerWaalsContact O-CB 3.28Å; L255-S259 WeakPolarHBondContact O-CB 3.16Å; L255-S259 PolarHBondContact O-N 3.21Å; L255-S259 PolarHBondContact O-OG 2.68Å
256	C	44.4	Very low	44.1	Very low	18 Å²	18	49.4 Å²	49.4	12%	0.122	25%	0.25	C	C	.	.	H	α-helix	trans	-81.3	-33.2	-178.6	-65.6	0	0	0	0	112.9	A252 L253 F254 S259 M260 A279	A252-C256 VanDerWaalsContact O-CB 3.3Å; A252-C256 WeakPolarHBondContact O-CB 3.43Å; A252-C256 PolarHBondContact O-N 3.49Å; A252-C256 PolarHBondContact O-SG 3.46Å; L253-C256 PolarHBondContact O-N 3.4Å; F254-C256 PolarHBondContact O-N 2.99Å; C256-S259 PolarHBondContact O-N 2.81Å; C256-M260 VanDerWaalsContact O-CB 3.29Å; C256-M260 WeakPolarHBondContact O-CB 3.5Å; C256-M260 WeakPolarHBondContact O-CG 3.44Å; C256-M260 PolarHBondContact O-N 3.06Å; C256-A279 HydrophobicContact CB-CB 3.28Å; C256-A279 WeakPolarHBondContact SG-CA 3.28Å; C256-A279 WeakPolarHBondContact SG-CB 2.95Å
257	M	45.7	Very low	43.9	Very low	17 Å²	17	50.7 Å²	50.7	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-41.1	168.6	-73.2	-61.5	-53.4	0	0	111.3	I94 F216 S217 L253 F254 M260 T261	I94-M257 HydrophobicContact CG1-CE 4.33Å; F216-M257 HydrophobicContact CD1-CE 3.68Å; F216-M257 HydrophobicContact CE1-CE 3.44Å; F216-M257 VanDerWaalsContact CE1-CE 3.44Å; S217-M257 WeakPolarHBondContact OG-CB 3.34Å; L253-M257 WeakPolarHBondContact O-CB 3.31Å; L253-M257 VanDerWaalsContact O-CG 3.31Å; L253-M257 WeakPolarHBondContact O-CG 3.3Å; L253-M257 PolarHBondContact O-N 2.88Å; F254-M257 PolarHBondContact O-N 2.83Å; M257-M260 PolarHBondContact O-N 2.87Å; M257-M260 HydrophobicContact SD-CE 4.4Å; M257-T261 WeakPolarHBondContact O-CB 3.29Å; M257-T261 PolarHBondContact O-N 3.17Å; M257-T261 PolarHBondContact O-OG1 2.92Å
258	I	43.1	Very low	43.8	Very low	32 Å²	32	53.7 Å²	53.7	16%	0.164	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-52.1	171.8	-72.6	-175.3	0	0	0	110.1	S217 F254 M260 T261 E262	S217-I258 PolarHBondContact OG-N 3.49Å; S217-I258 VanDerWaalsContact OG-N 3.17Å; F254-I258 HydrophobicContact CD1-CD1 4.03Å; F254-I258 HydrophobicContact CD2-CD1 4.19Å; F254-I258 HydrophobicContact CD2-CG1 4.37Å; F254-I258 HydrophobicContact CE1-CD1 3.43Å; F254-I258 VanDerWaalsContact CE1-CD1 3.43Å; F254-I258 HydrophobicContact CE2-CD1 3.58Å; F254-I258 HydrophobicContact CE2-CG1 4.03Å; F254-I258 HydrophobicContact CG-CD1 4.41Å; F254-I258 HydrophobicContact CZ-CD1 3.19Å; F254-I258 HydrophobicContact CZ-CG1 4.15Å; F254-I258 PolarHBondContact O-N 2.67Å; I258-M260 VanDerWaalsContact C-N 3.3Å; I258-M260 PolarHBondContact O-N 2.87Å; I258-T261 PolarHBondContact O-N 3.25Å; I258-E262 HydrophobicContact CG2-CG 4.38Å; I258-E262 PolarHBondContact O-N 3.42Å
259	S	42.4	Very low	43.6	Very low	39 Å²	39	57.2 Å²	57.2	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-43.3	-178	-59.8	0	0	0	0	111.2	L255 C256 T261 F263	L255-S259 VanDerWaalsContact O-CB 3.28Å; L255-S259 WeakPolarHBondContact O-CB 3.16Å; L255-S259 PolarHBondContact O-N 3.21Å; L255-S259 PolarHBondContact O-OG 2.68Å; C256-S259 PolarHBondContact O-N 2.81Å; S259-T261 VanDerWaalsContact C-N 3.33Å; S259-T261 PolarHBondContact O-N 2.93Å; S259-F263 WeakPolarHBondContact O-CB 3.3Å; S259-F263 PolarHBondContact O-N 3.22Å
260	M	43.5	Very low	43.3	Very low	8 Å²	8	59.4 Å²	59.4	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-42.3	174.8	-80.9	-142.1	-91.1	0	0	111.2	L93 C256 M257 I258 F263 F264 P272 M276	L93-M260 HydrophobicContact CD2-CE 4.42Å; L93-M260 HydrophobicContact CD2-SD 4.34Å; C256-M260 VanDerWaalsContact O-CB 3.29Å; C256-M260 WeakPolarHBondContact O-CB 3.5Å; C256-M260 WeakPolarHBondContact O-CG 3.44Å; C256-M260 PolarHBondContact O-N 3.06Å; M257-M260 PolarHBondContact O-N 2.87Å; M257-M260 HydrophobicContact SD-CE 4.4Å; I258-M260 VanDerWaalsContact C-N 3.3Å; I258-M260 PolarHBondContact O-N 2.87Å; M260-F263 PolarHBondContact O-N 2.88Å; M260-F264 HydrophobicContact CB-CD2 4.32Å; M260-F264 HydrophobicContact CB-CE2 4.16Å; M260-F264 WeakPolarHBondContact O-CB 3.21Å; M260-F264 WeakPolarHBondContact O-CD2 3.45Å; M260-F264 WeakPolarHBondContact O-CG 3.28Å; M260-F264 PolarHBondContact O-N 3.28Å; M260-F264 HydrophobicContact SD-CE2 4.18Å; M260-P272 HydrophobicContact SD-CB 3.77Å; M260-M276 HydrophobicContact CE-CG 3.24Å; M260-M276 HydrophobicContact CE-SD 3.67Å; M260-M276 HydrophobicContact SD-CG 3.78Å; M260-M276 HydrophobicContact SD-SD 4.34Å
261	T	42.8	Very low	43.1	Very low	11 Å²	11	60.8 Å²	60.8	7%	0.067	33%	0.329	C	S	.	.	H	α-helix	trans	-74.6	-35.8	-176.7	-36.8	0	0	0	0	113.3	A213 M257 I258 S259 F263 R265	A213-T261 HydrophobicContact CB-CG2 3.07Å; M257-T261 WeakPolarHBondContact O-CB 3.29Å; M257-T261 PolarHBondContact O-N 3.17Å; M257-T261 PolarHBondContact O-OG1 2.92Å; I258-T261 PolarHBondContact O-N 3.25Å; S259-T261 VanDerWaalsContact C-N 3.33Å; S259-T261 PolarHBondContact O-N 2.93Å; T261-F263 VanDerWaalsContact C-N 3.32Å; T261-R265 WeakPolarHBondContact O-CB 3.15Å; T261-R265 PolarHBondContact O-N 3.18Å
262	E	42	Very low	42.8	Very low	120 Å²	120	58.4 Å²	58.4	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-65.2	-36.7	169.5	-74.9	-168.4	155.1	0	0	111.8	I258 R265 N266	I258-E262 HydrophobicContact CG2-CG 4.38Å; I258-E262 PolarHBondContact O-N 3.42Å; E262-R265 WeakPolarHBondContact O-CB 3.31Å; E262-R265 PolarHBondContact O-N 3.27Å; E262-N266 PolarHBondContact O-N 2.66Å
263	F	41	Very low	42.5	Very low	37 Å²	37	60.3 Å²	60.3	16%	0.162	32%	0.322	C	S	.	.	H	α-helix	trans	-68.3	-44	176.5	-178.2	-97.1	0	0	0	112.7	S259 M260 T261 R265 N266 S267 T269 Y275	S259-F263 WeakPolarHBondContact O-CB 3.3Å; S259-F263 PolarHBondContact O-N 3.22Å; M260-F263 PolarHBondContact O-N 2.88Å; T261-F263 VanDerWaalsContact C-N 3.32Å; F263-R265 PolarHBondContact O-N 3.43Å; F263-N266 PolarHBondContact O-N 3.4Å; F263-S267 VanDerWaalsContact CE1-OG 3.24Å; F263-S267 WeakPolarHBondContact CE1-OG 3.42Å; F263-S267 WeakPolarHBondContact CE2-OG 3.36Å; F263-S267 WeakPolarHBondContact CZ-OG 3.2Å; F263-S267 WeakPolarHBondContact O-CB 3.49Å; F263-S267 PolarHBondContact O-N 3.27Å; F263-S267 PolarHBondContact O-OG 3.38Å; F263-T269 VanDerWaalsContact CE1-O 3.28Å; F263-T269 WeakPolarHBondContact CE1-O 3.37Å; F263-Y275 HydrophobicContact CB-CE2 4.38Å; F263-Y275 HydrophobicContact CD2-CD2 4.19Å; F263-Y275 AromaticContact CD2-CE2 3.45Å; F263-Y275 HydrophobicContact CD2-CE2 3.45Å; F263-Y275 VanDerWaalsContact CD2-CE2 3.45Å; F263-Y275 HydrophobicContact CE2-CD2 4.5Å; F263-Y275 AromaticContact CE2-CE2 3.77Å; F263-Y275 HydrophobicContact CE2-CE2 3.77Å; F263-Y275 HydrophobicContact CG-CD2 4.22Å; F263-Y275 AromaticContact CG-CE2 3.91Å; F263-Y275 HydrophobicContact CG-CE2 3.91Å; F263-Y275 HydrophobicContact CZ-CE2 4.46Å
264	F	42.9	Very low	42.1	Very low	36 Å²	36	62.4 Å²	62.4	16%	0.158	33%	0.333	C	S	.	.	H	α-helix	trans	-63.7	-30.4	172.9	-76.7	-61.2	0	0	0	111.9	L93 M260 P272	L93-F264 HydrophobicContact CD1-CE2 4.39Å; L93-F264 HydrophobicContact CD1-CZ 3.98Å; L93-F264 HydrophobicContact CD2-CE2 3.74Å; L93-F264 HydrophobicContact CD2-CZ 4.17Å; M260-F264 HydrophobicContact CB-CD2 4.32Å; M260-F264 HydrophobicContact CB-CE2 4.16Å; M260-F264 WeakPolarHBondContact O-CB 3.21Å; M260-F264 WeakPolarHBondContact O-CD2 3.45Å; M260-F264 WeakPolarHBondContact O-CG 3.28Å; M260-F264 PolarHBondContact O-N 3.28Å; M260-F264 HydrophobicContact SD-CE2 4.18Å; F264-P272 HydrophobicContact CE1-CG 4.41Å; F264-P272 HydrophobicContact CE2-CB 4.32Å; F264-P272 HydrophobicContact CZ-CB 3.72Å; F264-P272 HydrophobicContact CZ-CG 3.93Å
265	R	40.7	Very low	41.8	Very low	176 Å²	176	65 Å²	65	66%	0.664	34%	0.342	S	S	*	.	H	α-helix	trans	-69.3	-36.9	174.9	178.8	-178.8	154.7	169.5	-2.7	112.5	T261 E262 F263	T261-R265 WeakPolarHBondContact O-CB 3.15Å; T261-R265 PolarHBondContact O-N 3.18Å; E262-R265 WeakPolarHBondContact O-CB 3.31Å; E262-R265 PolarHBondContact O-N 3.27Å; F263-R265 PolarHBondContact O-N 3.43Å
266	N	47.4	Very low	41.7	Very low	132 Å²	132	62.6 Å²	62.6	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-103.6	-9.3	-170.7	-75	-13	0	0	0	114.9	E262 F263	E262-N266 PolarHBondContact O-N 2.66Å; F263-N266 PolarHBondContact O-N 3.4Å
267	S	40	Very low	41.4	Very low	30 Å²	30	65 Å²	65	21%	0.21	34%	0.341	C	S	.	.			trans	-139.1	129.9	-167.8	106.4	0	0	0	0	113.1	F263 T269	F263-S267 VanDerWaalsContact CE1-OG 3.24Å; F263-S267 WeakPolarHBondContact CE1-OG 3.42Å; F263-S267 WeakPolarHBondContact CE2-OG 3.36Å; F263-S267 WeakPolarHBondContact CZ-OG 3.2Å; F263-S267 WeakPolarHBondContact O-CB 3.49Å; F263-S267 PolarHBondContact O-N 3.27Å; F263-S267 PolarHBondContact O-OG 3.38Å; S267-T269 WeakPolarHBondContact CB-OG1 3.27Å; S267-T269 PolarHBondContact O-N 2.81Å; S267-T269 PolarHBondContact OG-N 3.42Å; S267-T269 PolarHBondContact OG-OG1 3.48Å
268	S	44.6	Very low	41.1	Very low	129 Å²	129	68.1 Å²	68.1	90%	0.902	36%	0.36	S	S	*	.			trans	-74.3	8.2	161.7	48.4	0	0	0	0	112.2
269	T	40.2	Very low	41	Very low	85 Å²	85	66.8 Å²	66.8	52%	0.521	35%	0.354	S	S	.	.			trans	-86.2	129.9	-170.9	-1.5	0	0	0	0	111.8	F263 S267 S271	F263-T269 VanDerWaalsContact CE1-O 3.28Å; F263-T269 WeakPolarHBondContact CE1-O 3.37Å; S267-T269 WeakPolarHBondContact CB-OG1 3.27Å; S267-T269 PolarHBondContact O-N 2.81Å; S267-T269 PolarHBondContact OG-N 3.42Å; S267-T269 PolarHBondContact OG-OG1 3.48Å; T269-S271 PolarHBondContact O-N 2.84Å
270	D	40.5	Very low	40.9	Very low	99 Å²	99	66.6 Å²	66.6	53%	0.529	35%	0.35	S	S	.	.			trans	-79.3	26	-163.8	-110.6	-25.2	0	0	0	116.4	R89 P272	R89-D270 IonicContact CZ-OD1 3.2Å; R89-D270 IonicContact NH1-OD1 3.2Å; R89-D270 IonicContact NH2-OD1 3.07Å; R89-D270 PolarHBondContact NH2-OD1 3.18Å; D270-P272 WeakPolarHBondContact O-CD 3.3Å
271	S	42.1	Very low	40.8	Very low	32 Å²	32	70.8 Å²	70.8	22%	0.224	37%	0.372	C	S	.	.			trans	-125.8	61.1	-169.9	173.2	0	0	0	0	115.3	T269 I273 N274	T269-S271 PolarHBondContact O-N 2.84Å; S271-I273 PolarHBondContact O-N 3.4Å; S271-I273 VanDerWaalsContact O-N 3.09Å; S271-N274 PolarHBondContact O-N 3.21Å; S271-N274 PolarHBondContact OG-ND2 3.5Å
272	P	36.9	Very low	40.6	Very low	16 Å²	16	73.6 Å²	73.6	10%	0.104	39%	0.389	C	S	.	.	H	α-helix	trans	-56.5	-17.3	159.1	22.9	-29.6	0	0	0	112.6	M260 F264 D270 Y275 M276	M260-P272 HydrophobicContact SD-CB 3.77Å; F264-P272 HydrophobicContact CE1-CG 4.41Å; F264-P272 HydrophobicContact CE2-CB 4.32Å; F264-P272 HydrophobicContact CZ-CB 3.72Å; F264-P272 HydrophobicContact CZ-CG 3.93Å; D270-P272 WeakPolarHBondContact O-CD 3.3Å; P272-Y275 PolarHBondContact O-N 2.89Å; P272-M276 PolarHBondContact O-N 3.15Å
273	I	37.6	Very low	40.6	Very low	47 Å²	47	68.3 Å²	68.3	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-49.9	-58.5	175.1	-46.3	-163	0	0	0	112	Y150 S271 Y275 M276 L277	Y150-I273 HydrophobicContact CD1-CD1 3.36Å; Y150-I273 HydrophobicContact CD1-CG1 3.51Å; Y150-I273 HydrophobicContact CD2-CB 4.39Å; Y150-I273 HydrophobicContact CD2-CD1 4.09Å; Y150-I273 HydrophobicContact CD2-CG1 4.13Å; Y150-I273 HydrophobicContact CD2-CG2 3.79Å; Y150-I273 HydrophobicContact CE1-CB 4.3Å; Y150-I273 HydrophobicContact CE1-CD1 3.86Å; Y150-I273 HydrophobicContact CE1-CG1 3.41Å; Y150-I273 VanDerWaalsContact CE1-CG1 3.41Å; Y150-I273 HydrophobicContact CE2-CB 4.08Å; Y150-I273 HydrophobicContact CE2-CD1 4.47Å; Y150-I273 HydrophobicContact CE2-CG1 4.01Å; Y150-I273 HydrophobicContact CE2-CG2 3.74Å; Y150-I273 HydrophobicContact CG-CD1 3.51Å; Y150-I273 HydrophobicContact CG-CG1 3.89Å; Y150-I273 HydrophobicContact CG-CG2 4.27Å; S271-I273 PolarHBondContact O-N 3.4Å; S271-I273 VanDerWaalsContact O-N 3.09Å; I273-Y275 VanDerWaalsContact C-N 3.28Å; I273-Y275 PolarHBondContact O-N 2.91Å; I273-M276 PolarHBondContact O-N 3.13Å; I273-L277 HydrophobicContact CG2-CD1 3.95Å; I273-L277 WeakPolarHBondContact O-CB 3.06Å; I273-L277 PolarHBondContact O-N 2.92Å
274	N	38.4	Very low	40.5	Very low	103 Å²	103	69.2 Å²	69.2	55%	0.551	37%	0.371	S	S	*	.	H	α-helix	trans	-63.4	-37.1	-172.7	-71.9	-13.3	0	0	0	111.5	S271 L277 V278	S271-N274 PolarHBondContact O-N 3.21Å; S271-N274 PolarHBondContact OG-ND2 3.5Å; N274-L277 PolarHBondContact O-N 2.76Å; N274-V278 WeakPolarHBondContact O-CB 3.03Å; N274-V278 WeakPolarHBondContact O-CG2 3.29Å; N274-V278 PolarHBondContact O-N 3.32Å
275	Y	39.3	Very low	40.3	Very low	98 Å²	98	70.2 Å²	70.2	38%	0.384	39%	0.386	S	S	.	.	H	α-helix	trans	-73.1	-41.9	178.4	-77.2	-83.1	0	0	0	112.6	F263 P272 I273 L277 V278 A279	F263-Y275 HydrophobicContact CB-CE2 4.38Å; F263-Y275 HydrophobicContact CD2-CD2 4.19Å; F263-Y275 AromaticContact CD2-CE2 3.45Å; F263-Y275 HydrophobicContact CD2-CE2 3.45Å; F263-Y275 VanDerWaalsContact CD2-CE2 3.45Å; F263-Y275 HydrophobicContact CE2-CD2 4.5Å; F263-Y275 AromaticContact CE2-CE2 3.77Å; F263-Y275 HydrophobicContact CE2-CE2 3.77Å; F263-Y275 HydrophobicContact CG-CD2 4.22Å; F263-Y275 AromaticContact CG-CE2 3.91Å; F263-Y275 HydrophobicContact CG-CE2 3.91Å; F263-Y275 HydrophobicContact CZ-CE2 4.46Å; P272-Y275 PolarHBondContact O-N 2.89Å; I273-Y275 VanDerWaalsContact C-N 3.28Å; I273-Y275 PolarHBondContact O-N 2.91Å; Y275-L277 VanDerWaalsContact C-N 3.29Å; Y275-L277 PolarHBondContact O-N 3.47Å; Y275-V278 PolarHBondContact O-N 2.95Å; Y275-A279 VanDerWaalsContact O-CB 3.26Å; Y275-A279 WeakPolarHBondContact O-CB 3.48Å; Y275-A279 PolarHBondContact O-N 3.05Å
276	M	39.4	Very low	40.2	Very low	49 Å²	49	65.9 Å²	65.9	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-64.3	-34.7	172.4	-80.2	-169.6	65.2	0	0	112.5	L146 M260 P272 I273 A279 N280	L146-M276 HydrophobicContact CD2-CE 3.91Å; M260-M276 HydrophobicContact CE-CG 3.24Å; M260-M276 HydrophobicContact CE-SD 3.67Å; M260-M276 HydrophobicContact SD-CG 3.78Å; M260-M276 HydrophobicContact SD-SD 4.34Å; P272-M276 PolarHBondContact O-N 3.15Å; I273-M276 PolarHBondContact O-N 3.13Å; M276-A279 WeakPolarHBondContact O-CB 3.28Å; M276-A279 PolarHBondContact O-N 3.34Å; M276-N280 WeakPolarHBondContact O-CB 3.33Å; M276-N280 PolarHBondContact O-N 3.02Å; M276-N280 PolarHBondContact O-ND2 2.84Å
277	L	38.5	Very low	39.8	Very low	70 Å²	70	61.9 Å²	61.9	37%	0.366	35%	0.351	S	S	.	.	H	α-helix	trans	-67	-47	174.3	-114	142.6	0	0	0	110.8	I273 N274 Y275 A279 N280 L281	I273-L277 HydrophobicContact CG2-CD1 3.95Å; I273-L277 WeakPolarHBondContact O-CB 3.06Å; I273-L277 PolarHBondContact O-N 2.92Å; N274-L277 PolarHBondContact O-N 2.76Å; Y275-L277 VanDerWaalsContact C-N 3.29Å; Y275-L277 PolarHBondContact O-N 3.47Å; L277-A279 VanDerWaalsContact C-N 3.3Å; L277-A279 PolarHBondContact O-N 3.09Å; L277-N280 PolarHBondContact O-N 2.83Å; L277-L281 HydrophobicContact CD2-CD1 4.09Å; L277-L281 VanDerWaalsContact O-CB 3.24Å; L277-L281 WeakPolarHBondContact O-CB 3.41Å; L277-L281 WeakPolarHBondContact O-CG 3.37Å; L277-L281 PolarHBondContact O-N 3.36Å
278	V	40.7	Very low	39.6	Very low	81 Å²	81	64.4 Å²	64.4	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-41.2	174.4	171	0	0	0	0	110.5	N274 Y275 N280 L281 V282	N274-V278 WeakPolarHBondContact O-CB 3.03Å; N274-V278 WeakPolarHBondContact O-CG2 3.29Å; N274-V278 PolarHBondContact O-N 3.32Å; Y275-V278 PolarHBondContact O-N 2.95Å; V278-N280 PolarHBondContact O-N 3.47Å; V278-L281 PolarHBondContact O-N 2.9Å; V278-V282 HydrophobicContact CG1-CG2 4.19Å; V278-V282 WeakPolarHBondContact O-CB 3.17Å; V278-V282 WeakPolarHBondContact O-CG2 3.22Å; V278-V282 PolarHBondContact O-N 3.09Å
279	A	40.3	Very low	39.1	Very low	5 Å²	5	63 Å²	63	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-53.9	-55.7	175	0	0	0	0	0	112.3	C256 Y275 M276 L277 L281 V282 C283	C256-A279 HydrophobicContact CB-CB 3.28Å; C256-A279 WeakPolarHBondContact SG-CA 3.28Å; C256-A279 WeakPolarHBondContact SG-CB 2.95Å; Y275-A279 VanDerWaalsContact O-CB 3.26Å; Y275-A279 WeakPolarHBondContact O-CB 3.48Å; Y275-A279 PolarHBondContact O-N 3.05Å; M276-A279 WeakPolarHBondContact O-CB 3.28Å; M276-A279 PolarHBondContact O-N 3.34Å; L277-A279 VanDerWaalsContact C-N 3.3Å; L277-A279 PolarHBondContact O-N 3.09Å; A279-L281 VanDerWaalsContact C-N 3.33Å; A279-V282 PolarHBondContact O-N 3.37Å; A279-C283 PolarHBondContact O-N 2.75Å; A279-C283 PolarHBondContact O-SG 3.14Å
280	N	39.9	Very low	38.9	Very low	35 Å²	35	60.3 Å²	60.3	19%	0.187	33%	0.329	C	S	.	.	H	α-helix	trans	-68.2	-37.6	-178.3	-76.8	-56.8	0	0	0	110.6	I142 M276 L277 V278 V282 C283 I284	I142-N280 HydrophobicContact CG2-CB 4.33Å; M276-N280 WeakPolarHBondContact O-CB 3.33Å; M276-N280 PolarHBondContact O-N 3.02Å; M276-N280 PolarHBondContact O-ND2 2.84Å; L277-N280 PolarHBondContact O-N 2.83Å; V278-N280 PolarHBondContact O-N 3.47Å; N280-V282 VanDerWaalsContact C-N 3.33Å; N280-V282 PolarHBondContact O-N 3.01Å; N280-C283 WeakPolarHBondContact O-CB 3.49Å; N280-C283 PolarHBondContact O-N 3.31Å; N280-I284 VanDerWaalsContact O-CB 3.29Å; N280-I284 WeakPolarHBondContact O-CB 3.27Å; N280-I284 WeakPolarHBondContact O-CD1 3.17Å; N280-I284 WeakPolarHBondContact O-CG1 3.31Å; N280-I284 PolarHBondContact O-N 3.21Å
281	L	41.1	Very low	38.6	Very low	96 Å²	96	59.9 Å²	59.9	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-63.8	-38.3	173.9	-77.2	167.3	0	0	0	111.8	L277 V278 A279 I284 A285	L277-L281 HydrophobicContact CD2-CD1 4.09Å; L277-L281 VanDerWaalsContact O-CB 3.24Å; L277-L281 WeakPolarHBondContact O-CB 3.41Å; L277-L281 WeakPolarHBondContact O-CG 3.37Å; L277-L281 PolarHBondContact O-N 3.36Å; V278-L281 PolarHBondContact O-N 2.9Å; A279-L281 VanDerWaalsContact C-N 3.33Å; L281-I284 PolarHBondContact O-N 3.35Å; L281-A285 WeakPolarHBondContact O-CB 3.33Å; L281-A285 PolarHBondContact O-N 2.87Å
282	V	40	Very low	38.2	Very low	70 Å²	70	68.8 Å²	68.8	42%	0.424	35%	0.351	S	S	.	.	H	α-helix	trans	-67.2	-46.3	173.7	170.5	0	0	0	0	109.8	A252 V278 A279 N280 I284 A285 F286	A252-V282 HydrophobicContact CB-CG1 4.35Å; V278-V282 HydrophobicContact CG1-CG2 4.19Å; V278-V282 WeakPolarHBondContact O-CB 3.17Å; V278-V282 WeakPolarHBondContact O-CG2 3.22Å; V278-V282 PolarHBondContact O-N 3.09Å; A279-V282 PolarHBondContact O-N 3.37Å; N280-V282 VanDerWaalsContact C-N 3.33Å; N280-V282 PolarHBondContact O-N 3.01Å; V282-I284 VanDerWaalsContact C-N 3.32Å; V282-I284 PolarHBondContact O-N 3.47Å; V282-A285 PolarHBondContact O-N 2.97Å; V282-F286 WeakPolarHBondContact O-CB 3.39Å; V282-F286 PolarHBondContact O-N 3Å
283	C	40.9	Very low	37.9	Very low	8 Å²	8	74.4 Å²	74.4	5%	0.054	38%	0.379	C	S	.	.	H	α-helix	trans	-55.5	-48	173	-69.7	0	0	0	0	111.3	A252 A279 N280 F286 N287	A252-C283 WeakPolarHBondContact CB-SG 3.07Å; A279-C283 PolarHBondContact O-N 2.75Å; A279-C283 PolarHBondContact O-SG 3.14Å; N280-C283 WeakPolarHBondContact O-CB 3.49Å; N280-C283 PolarHBondContact O-N 3.31Å; C283-F286 PolarHBondContact O-N 2.89Å; C283-N287 VanDerWaalsContact O-CB 3.26Å; C283-N287 WeakPolarHBondContact O-CB 3.1Å; C283-N287 PolarHBondContact O-N 2.98Å; C283-N287 PolarHBondContact O-ND2 2.93Å; C283-N287 PolarHBondContact O-OD1 3.22Å
284	I	40.2	Very low	37.7	Very low	56 Å²	56	76.7 Å²	76.7	29%	0.287	41%	0.405	S	S	.	.	H	α-helix	trans	-63.9	-48.9	179.5	-69.8	163.1	0	0	0	110.1	N280 L281 V282 F286 N287 V288	N280-I284 VanDerWaalsContact O-CB 3.29Å; N280-I284 WeakPolarHBondContact O-CB 3.27Å; N280-I284 WeakPolarHBondContact O-CD1 3.17Å; N280-I284 WeakPolarHBondContact O-CG1 3.31Å; N280-I284 PolarHBondContact O-N 3.21Å; L281-I284 PolarHBondContact O-N 3.35Å; V282-I284 VanDerWaalsContact C-N 3.32Å; V282-I284 PolarHBondContact O-N 3.47Å; I284-F286 VanDerWaalsContact C-N 3.32Å; I284-F286 PolarHBondContact O-N 3.01Å; I284-N287 PolarHBondContact O-N 3.37Å; I284-V288 HydrophobicContact CG2-CG2 4.46Å; I284-V288 WeakPolarHBondContact O-CB 3.24Å; I284-V288 VanDerWaalsContact O-CG2 3.26Å; I284-V288 WeakPolarHBondContact O-CG2 3.38Å; I284-V288 PolarHBondContact O-N 3.12Å
285	A	37.3	Very low	37.6	Very low	58 Å²	58	75.4 Å²	75.4	48%	0.479	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-39.7	179.7	0	0	0	0	0	111.5	L281 V282 V288 L289	L281-A285 WeakPolarHBondContact O-CB 3.33Å; L281-A285 PolarHBondContact O-N 2.87Å; V282-A285 PolarHBondContact O-N 2.97Å; A285-V288 PolarHBondContact O-N 3.37Å; A285-L289 VanDerWaalsContact O-CB 3.24Å; A285-L289 WeakPolarHBondContact O-CB 3.11Å; A285-L289 PolarHBondContact O-N 3.4Å
286	F	39.1	Very low	37.5	Very low	84 Å²	84	74.2 Å²	74.2	37%	0.368	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-41	176	-150.3	-80.3	0	0	0	111	A248 V282 C283 I284 V288 L289 M290	A248-F286 HydrophobicContact CB-CD1 3.18Å; A248-F286 HydrophobicContact CB-CE1 3.2Å; A248-F286 HydrophobicContact CB-CG 4Å; A248-F286 HydrophobicContact CB-CZ 4.03Å; V282-F286 WeakPolarHBondContact O-CB 3.39Å; V282-F286 PolarHBondContact O-N 3Å; C283-F286 PolarHBondContact O-N 2.89Å; I284-F286 VanDerWaalsContact C-N 3.32Å; I284-F286 PolarHBondContact O-N 3.01Å; F286-V288 VanDerWaalsContact C-N 3.31Å; F286-V288 PolarHBondContact O-N 3.05Å; F286-L289 PolarHBondContact O-N 3.31Å; F286-M290 HydrophobicContact CD1-CG 3.42Å; F286-M290 VanDerWaalsContact CD1-CG 3.42Å; F286-M290 HydrophobicContact CD1-SD 4.4Å; F286-M290 HydrophobicContact CE1-CG 3.33Å; F286-M290 HydrophobicContact CE1-SD 3.74Å; F286-M290 HydrophobicContact CZ-CG 4.39Å; F286-M290 HydrophobicContact CZ-SD 4.35Å; F286-M290 WeakPolarHBondContact O-CB 3.28Å; F286-M290 WeakPolarHBondContact O-CG 3.5Å; F286-M290 PolarHBondContact O-N 3.06Å
287	N	38.4	Very low	37.4	Very low	49 Å²	49	75.6 Å²	75.6	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-60.2	-42.2	173.3	-73.3	-16.1	0	0	0	111.4	L245 C283 I284 F291	L245-N287 HydrophobicContact CD2-CB 4.03Å; L245-N287 WeakPolarHBondContact CD2-OD1 3.38Å; C283-N287 VanDerWaalsContact O-CB 3.26Å; C283-N287 WeakPolarHBondContact O-CB 3.1Å; C283-N287 PolarHBondContact O-N 2.98Å; C283-N287 PolarHBondContact O-ND2 2.93Å; C283-N287 PolarHBondContact O-OD1 3.22Å; I284-N287 PolarHBondContact O-N 3.37Å; N287-F291 WeakPolarHBondContact O-CB 3.43Å; N287-F291 PolarHBondContact O-N 3.28Å; N287-F291 VanDerWaalsContact O-N 3.1Å
288	V	36.3	Very low	37.4	Very low	82 Å²	82	75.9 Å²	75.9	50%	0.497	41%	0.41	S	S	.	.	H	α-helix	trans	-67.4	-40.6	175	171.8	0	0	0	0	112	I284 A285 F286 F291 R292	I284-V288 HydrophobicContact CG2-CG2 4.46Å; I284-V288 WeakPolarHBondContact O-CB 3.24Å; I284-V288 VanDerWaalsContact O-CG2 3.26Å; I284-V288 WeakPolarHBondContact O-CG2 3.38Å; I284-V288 PolarHBondContact O-N 3.12Å; A285-V288 PolarHBondContact O-N 3.37Å; F286-V288 VanDerWaalsContact C-N 3.31Å; F286-V288 PolarHBondContact O-N 3.05Å; V288-F291 WeakPolarHBondContact O-CB 3.01Å; V288-F291 PolarHBondContact O-N 2.78Å; V288-R292 PolarHBondContact O-N 3.3Å; V288-R292 VanDerWaalsContact O-N 3.08Å
289	L	34	Very low	37.2	Very low	101 Å²	101	75.6 Å²	75.6	53%	0.529	41%	0.405	S	S	.	.	H	α-helix	trans	-69.1	-48.8	-178.3	-174.6	73.3	0	0	0	111.7	A285 F286 F291 R292 L293	A285-L289 VanDerWaalsContact O-CB 3.24Å; A285-L289 WeakPolarHBondContact O-CB 3.11Å; A285-L289 PolarHBondContact O-N 3.4Å; F286-L289 PolarHBondContact O-N 3.31Å; L289-F291 PolarHBondContact O-N 2.67Å; L289-R292 PolarHBondContact O-N 3.26Å; L289-R292 VanDerWaalsContact O-N 3.15Å; L289-L293 PolarHBondContact O-N 2.77Å
290	M	35.5	Very low	37	Very low	28 Å²	28	80.3 Å²	80.3	14%	0.138	43%	0.429	C	S	.	.	H	α-helix	trans	-62.9	-28	174.9	-69.7	-55.1	-70.8	0	0	111.5	L244 L245 F286 L293 A294	L244-M290 HydrophobicContact CB-CE 3.64Å; L244-M290 HydrophobicContact CD1-CE 3.66Å; L244-M290 HydrophobicContact CD2-CE 4.47Å; L244-M290 HydrophobicContact CG-CE 4.12Å; L245-M290 HydrophobicContact CD2-CB 3.73Å; L245-M290 HydrophobicContact CD2-CG 4.42Å; L245-M290 HydrophobicContact CG-CB 4.38Å; F286-M290 HydrophobicContact CD1-CG 3.42Å; F286-M290 VanDerWaalsContact CD1-CG 3.42Å; F286-M290 HydrophobicContact CD1-SD 4.4Å; F286-M290 HydrophobicContact CE1-CG 3.33Å; F286-M290 HydrophobicContact CE1-SD 3.74Å; F286-M290 HydrophobicContact CZ-CG 4.39Å; F286-M290 HydrophobicContact CZ-SD 4.35Å; F286-M290 WeakPolarHBondContact O-CB 3.28Å; F286-M290 WeakPolarHBondContact O-CG 3.5Å; F286-M290 PolarHBondContact O-N 3.06Å; M290-L293 PolarHBondContact O-N 3.01Å; M290-L293 HydrophobicContact SD-CD1 4.18Å; M290-A294 PolarHBondContact O-N 3.17Å
291	F	34.7	Very low	36.7	Very low	90 Å²	90	83.5 Å²	83.5	40%	0.395	45%	0.446	S	S	.	.	H	α-helix	trans	-72.4	-35.2	174.2	-177.7	-108.9	0	0	0	113.8	W132 N287 V288 L289 L293 A294	W132-F291 AromaticContact CE2-CZ 3.88Å; W132-F291 AromaticContact CH2-CD1 3.45Å; W132-F291 HydrophobicContact CH2-CD1 3.45Å; W132-F291 VanDerWaalsContact CH2-CD1 3.45Å; W132-F291 AromaticContact CH2-CD2 3.33Å; W132-F291 HydrophobicContact CH2-CD2 3.33Å; W132-F291 AromaticContact CH2-CE1 3.16Å; W132-F291 HydrophobicContact CH2-CE1 3.16Å; W132-F291 AromaticContact CH2-CE2 3.07Å; W132-F291 HydrophobicContact CH2-CE2 3.07Å; W132-F291 AromaticContact CH2-CG 3.54Å; W132-F291 HydrophobicContact CH2-CG 3.54Å; W132-F291 AromaticContact CH2-CZ 2.99Å; W132-F291 HydrophobicContact CH2-CZ 2.99Å; W132-F291 HydrophobicContact CZ2-CD1 4.25Å; W132-F291 AromaticContact CZ2-CD2 3.85Å; W132-F291 HydrophobicContact CZ2-CD2 3.85Å; W132-F291 AromaticContact CZ2-CE1 3.52Å; W132-F291 HydrophobicContact CZ2-CE1 3.52Å; W132-F291 AromaticContact CZ2-CE2 3.07Å; W132-F291 HydrophobicContact CZ2-CE2 3.07Å; W132-F291 HydrophobicContact CZ2-CG 4.39Å; W132-F291 AromaticContact CZ2-CZ 2.89Å; W132-F291 HydrophobicContact CZ2-CZ 2.89Å; W132-F291 AromaticContact CZ3-CD1 3.89Å; W132-F291 HydrophobicContact CZ3-CD1 3.89Å; W132-F291 HydrophobicContact CZ3-CD2 4.41Å; W132-F291 AromaticContact CZ3-CE1 3.74Å; W132-F291 HydrophobicContact CZ3-CE1 3.74Å; W132-F291 HydrophobicContact CZ3-CE2 4.31Å; W132-F291 HydrophobicContact CZ3-CG 4.24Å; W132-F291 AromaticContact CZ3-CZ 4Å; W132-F291 HydrophobicContact CZ3-CZ 4Å; N287-F291 WeakPolarHBondContact O-CB 3.43Å; N287-F291 PolarHBondContact O-N 3.28Å; N287-F291 VanDerWaalsContact O-N 3.1Å; V288-F291 WeakPolarHBondContact O-CB 3.01Å; V288-F291 PolarHBondContact O-N 2.78Å; L289-F291 PolarHBondContact O-N 2.67Å; F291-L293 PolarHBondContact O-N 3.07Å; F291-A294 PolarHBondContact O-N 2.76Å
292	R	33.4	Very low	36.4	Very low	218 Å²	218	82.5 Å²	82.5	82%	0.823	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-17.5	170.7	-78.4	-166.7	176.2	-174	0.2	113.4	V288 L289	V288-R292 PolarHBondContact O-N 3.3Å; V288-R292 VanDerWaalsContact O-N 3.08Å; L289-R292 PolarHBondContact O-N 3.26Å; L289-R292 VanDerWaalsContact O-N 3.15Å
293	L	31.8	Very low	36.1	Very low	134 Å²	134	83.6 Å²	83.6	70%	0.702	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-11.8	-179.6	-67	169.7	0	0	0	113.5	L289 M290 F291	L289-L293 PolarHBondContact O-N 2.77Å; M290-L293 PolarHBondContact O-N 3.01Å; M290-L293 HydrophobicContact SD-CD1 4.18Å; F291-L293 PolarHBondContact O-N 3.07Å
294	A	31.8	Very low	35.7	Very low	95 Å²	95	90.5 Å²	90.5	79%	0.785	48%	0.479	S	S	*	.			trans	-92.6	0	-179.3	0	0	0	0	0	111.9	V241 M290 F291	V241-A294 HydrophobicContact CB-CB 4.22Å; V241-A294 HydrophobicContact CG1-CB 3.61Å; V241-A294 HydrophobicContact CG2-CB 3.7Å; M290-A294 PolarHBondContact O-N 3.17Å; F291-A294 PolarHBondContact O-N 2.76Å

Retrieved 294 of 294 residues in 849.8 ms (Link to these results)

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