A0A096NB84_PAPAN Loading...

Melatonin receptor 1B

AlphaFold DB , UniProt , Accession A0A096NB84, Species PAPAN (Papio anubis, Olive baboon), Gene MTNR1B, Length 362 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	34.6	Very low	33	Very low	252 Å²	252	144.9 Å²	144.9	100%	1.241	86%	0.862	S	S	*	*				0	121.4	0	-94.3	160.7	126.3	0	0	107.2
2	S	31.8	Very low	32.8	Very low	112 Å²	112	149.2 Å²	149.2	78%	0.783	87%	0.867	S	S	*	*			trans	-90.7	178.3	-171.4	-53.4	0	0	0	0	111.7
3	E	34.3	Very low	33.3	Very low	172 Å²	172	146.2 Å²	146.2	80%	0.804	87%	0.87	S	S	*	*			trans	84.6	138	163.8	-60.6	-171	141.6	0	0	115.5
4	N	30.3	Very low	33.4	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	87%	0.869	S	S	*	*			cis	-157.1	143	5.1	-96.5	-26.9	0	0	0	105.1
5	G	33.6	Very low	33	Very low	76 Å²	76	137.3 Å²	137.3	78%	0.784	86%	0.863	S	S	*	*				77	78.3	59.6	0	0	0	0	0	111.1
6	S	29.8	Very low	32.8	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	87%	0.87	S	S	*	*			trans	-146.7	102.7	162.1	-164.8	0	0	0	0	111.2
7	F	33.6	Very low	32.6	Very low	216 Å²	216	142.1 Å²	142.1	95%	0.947	87%	0.867	S	S	*	*			trans	-87.1	117.5	160	-98.3	-96.8	0	0	0	107.4
8	A	32.1	Very low	32.9	Very low	91 Å²	91	141.9 Å²	141.9	75%	0.752	87%	0.865	S	S	*	*			trans	-152.5	125.7	158.8	0	0	0	0	0	110.2
9	N	35.8	Very low	32.9	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	87%	0.865	S	S	*	*			trans	-56.8	151.5	178.3	-69.9	-36.9	0	0	0	113.6
10	C	29.8	Very low	33.1	Very low	129 Å²	129	145.6 Å²	145.6	87%	0.872	86%	0.864	S	S	*	*				-164.7	135.1	125.6	-100.3	0	0	0	0	110.5	E12	C10-E12 PolarHBondContact O-N 3.45Å
11	C	37.1	Very low	33	Very low	133 Å²	133	142 Å²	142	90%	0.899	86%	0.857	S	S	*	*			trans	-60.2	126.6	-177.3	-57.9	0	0	0	0	112.5
12	E	31.2	Very low	32.7	Very low	196 Å²	196	142.3 Å²	142.3	92%	0.916	85%	0.845	S	S	*	*			trans	-121.6	129.1	157.6	-84.8	-171	143.8	0	0	110.4	C10	C10-E12 PolarHBondContact O-N 3.45Å
13	A	39.7	Very low	33	Very low	111 Å²	111	145.9 Å²	145.9	92%	0.917	85%	0.854	S	S	*	*			trans	-72	128.4	174.5	0	0	0	0	0	109.9
14	G	33.6	Very low	32.8	Very low	83 Å²	83	140.8 Å²	140.8	86%	0.856	85%	0.847	S	S	*	*			trans	163.4	119.3	168.4	0	0	0	0	0	114
15	G	28.2	Very low	33.4	Very low	75 Å²	75	141.7 Å²	141.7	77%	0.773	86%	0.858	S	S	*	*			trans	112.5	87	159.6	0	0	0	0	0	114.8	A17	G15-A17 PolarHBondContact O-N 3.45Å
16	W	29.6	Very low	33.7	Very low	259 Å²	259	141.6 Å²	141.6	98%	0.981	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-64.2	120.5	155.3	-73.8	82.4	0	0	0	108.2	V18	W16-V18 PolarHBondContact O-N 3.4Å
17	A	29.9	Very low	34.1	Very low	98 Å²	98	141.6 Å²	141.6	81%	0.81	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-57	118.4	-179.3	0	0	0	0	0	111.5	G15 R19	G15-A17 PolarHBondContact O-N 3.45Å; A17-R19 PolarHBondContact O-N 3.47Å
18	V	36.9	Very low	34.5	Very low	138 Å²	138	135.3 Å²	135.3	84%	0.836	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-69.5	119	168.2	175.3	0	0	0	0	108.1	W16	W16-V18 PolarHBondContact O-N 3.4Å
19	R	33.1	Very low	34.8	Very low	229 Å²	229	138.9 Å²	138.9	86%	0.864	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-71.8	145.6	168.3	-79.9	-172.2	179.5	-158.6	0.6	109.9	A17 G21	A17-R19 PolarHBondContact O-N 3.47Å; R19-G21 PolarHBondContact O-N 3.48Å
20	P	36.5	Very low	35.2	Very low	129 Å²	129	137 Å²	137	84%	0.838	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-66	133.1	-175.3	-13.8	28.1	0	0	0	111.6
21	G	30.9	Very low	36	Very low	70 Å²	70	133 Å²	133	72%	0.722	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76	147.2	-172.9	0	0	0	0	0	114.6	R19	R19-G21 PolarHBondContact O-N 3.48Å
22	W	29.9	Very low	36.6	Very low	259 Å²	259	138 Å²	138	98%	0.981	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.7	121.8	154.5	-78.6	81	0	0	0	108	G24	W22-G24 PolarHBondContact O-N 3.36Å
23	L	36.2	Very low	38	Very low	186 Å²	186	133 Å²	133	97%	0.974	80%	0.799	S	S	*	*			trans	-69	97.6	168.8	-91.9	91.5	0	0	0	109
24	G	31.8	Very low	39.5	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	79%	0.794	S	S	*	*			trans	-127	113.4	161.8	0	0	0	0	0	108.2	W22 G26	W22-G24 PolarHBondContact O-N 3.36Å; G24-G26 PolarHBondContact O-N 3.4Å
25	T	41.2	Very low	41.9	Very low	157 Å²	157	131.8 Å²	131.8	96%	0.963	76%	0.761	S	S	*	*	S	Bend	trans	-60.8	117.4	177	42.2	0	0	0	0	110.9
26	G	40.1	Very low	44.8	Very low	74 Å²	74	130 Å²	130	76%	0.763	74%	0.736	S	S	*	*			trans	143.7	43	173.7	0	0	0	0	0	114.8	G24 A28	G24-G26 PolarHBondContact O-N 3.4Å; G26-A28 PolarHBondContact O-N 3.4Å; G26-A28 VanDerWaalsContact O-N 3.13Å
27	S	38	Very low	47.7	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	73%	0.728	S	S	*	*			trans	-75.3	101.6	172.8	57.9	0	0	0	0	109.8	Q29	S27-Q29 PolarHBondContact O-N 3.49Å
28	A	42.5	Very low	50.8	Low	83 Å²	83	123.9 Å²	123.9	69%	0.686	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-54.6	129.4	163.4	0	0	0	0	0	109	G26	G26-A28 PolarHBondContact O-N 3.4Å; G26-A28 VanDerWaalsContact O-N 3.13Å
29	Q	39.8	Very low	53.5	Low	167 Å²	167	117.3 Å²	117.3	78%	0.78	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-59.8	134.1	175.3	-91.7	-166.8	-29.4	0	0	110	S27 S31	S27-Q29 PolarHBondContact O-N 3.49Å; Q29-S31 PolarHBondContact O-N 3.21Å
30	P	44	Very low	56.4	Low	117 Å²	117	107.7 Å²	107.7	76%	0.76	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-62.8	133.6	174	23.6	-30.1	0	0	0	110	R32	P30-R32 PolarHBondContact O-N 3.43Å
31	S	45.5	Very low	59.3	Low	46 Å²	46	104.9 Å²	104.9	32%	0.322	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-54.5	120.8	177.2	52.1	0	0	0	0	110.5	Q29 T33	Q29-S31 PolarHBondContact O-N 3.21Å; S31-T33 PolarHBondContact O-N 3.28Å; S31-T33 VanDerWaalsContact O-N 3.1Å
32	R	49.9	Very low	62.4	Low	239 Å²	239	103 Å²	103	90%	0.902	60%	0.597	S	S	*	*	S	Bend	trans	-65	-9.2	-176.9	-80.8	-179.3	176.2	167.2	-1	114.9	P30	P30-R32 PolarHBondContact O-N 3.43Å
33	T	61.5	Low	65.6	Low	90 Å²	90	90.7 Å²	90.7	55%	0.552	55%	0.551	S	S	*	*	S	Bend	trans	-109.6	124.3	174.8	49.8	0	0	0	0	110.1	S31 R35	S31-T33 PolarHBondContact O-N 3.28Å; S31-T33 VanDerWaalsContact O-N 3.1Å; T33-R35 PolarHBondContact O-N 3.4Å
34	P	70.4	Confident	68.5	Low	126 Å²	126	82.5 Å²	82.5	82%	0.818	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-64.6	125	175	24.3	-29.9	0	0	0	109.6
35	R	83.8	Confident	71.6	Confident	42 Å²	42	83.8 Å²	83.8	16%	0.158	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-65.5	150.8	177.8	-60.3	174.5	-139.4	147	26	109.4	T33 D104 P185 Y188	T33-R35 PolarHBondContact O-N 3.4Å; R35-D104 IonicContact CZ-OD1 3.33Å; R35-D104 VanDerWaalsContact CZ-OD1 3.31Å; R35-D104 IonicContact NH1-OD1 3.82Å; R35-D104 PolarHBondContact NH1-OD1 3.05Å; R35-D104 IonicContact NH2-OD1 2.67Å; R35-D104 PolarHBondContact NH2-OD1 2.97Å; R35-P185 WeakPolarHBondContact CD-O 3.42Å; R35-P185 PolarHBondContact NE-O 3.33Å; R35-P185 VanDerWaalsContact NE-O 3.12Å; R35-P185 PolarHBondContact NH1-O 3.48Å; R35-Y188 VanDerWaalsContact NH1-CD1 3.32Å; R35-Y188 PolarHBondContact NH1-OH 3.13Å
36	P	89.3	Confident	74.3	Confident	39 Å²	39	78.1 Å²	78.1	25%	0.253	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-58.1	137.2	174.7	-21.4	31.3	0	0	0	110.9	W38 V39	P36-W38 HydrophobicContact CB-CG 4.39Å; P36-W38 VanDerWaalsContact CB-NE1 3.29Å; P36-W38 PolarHBondContact O-N 3.41Å; P36-V39 HydrophobicContact CB-CG2 4.06Å; P36-V39 HydrophobicContact CG-CG2 4.19Å; P36-V39 PolarHBondContact O-N 3.47Å; P36-V39 VanDerWaalsContact O-N 3.08Å
37	P	90.8	Very high	77	Confident	124 Å²	124	74.6 Å²	74.6	81%	0.805	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.5	-171	25.6	-35.3	0	0	0	113.7	P41	P37-P41 VanDerWaalsContact O-CD 3.26Å; P37-P41 WeakPolarHBondContact O-CD 3.23Å
38	W	94.1	Very high	79.9	Confident	103 Å²	103	73.2 Å²	73.2	39%	0.39	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-19.2	178.9	67.1	-98.3	0	0	0	113.6	P36 P41 A42 V291 L295	P36-W38 HydrophobicContact CB-CG 4.39Å; P36-W38 VanDerWaalsContact CB-NE1 3.29Å; P36-W38 PolarHBondContact O-N 3.41Å; W38-P41 WeakPolarHBondContact O-CD 3.46Å; W38-P41 WeakPolarHBondContact O-CG 3.15Å; W38-A42 HydrophobicContact CE3-CB 3.88Å; W38-A42 HydrophobicContact CZ3-CB 4.26Å; W38-A42 WeakPolarHBondContact O-CB 3.15Å; W38-A42 PolarHBondContact O-N 2.86Å; W38-V291 HydrophobicContact CH2-CB 4.01Å; W38-V291 HydrophobicContact CH2-CG1 3.73Å; W38-V291 HydrophobicContact CZ3-CG1 3.84Å; W38-L295 HydrophobicContact CZ3-CD1 4.13Å
39	V	94.4	Very high	82.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.7	-50.9	-171.5	171.8	0	0	0	0	111.5	P36 A42 L43 Y188 V291	P36-V39 HydrophobicContact CB-CG2 4.06Å; P36-V39 HydrophobicContact CG-CG2 4.19Å; P36-V39 PolarHBondContact O-N 3.47Å; P36-V39 VanDerWaalsContact O-N 3.08Å; V39-A42 PolarHBondContact O-N 3.16Å; V39-L43 HydrophobicContact CG1-CD1 3.55Å; V39-L43 HydrophobicContact CG1-CG 4.37Å; V39-L43 WeakPolarHBondContact O-CB 3.27Å; V39-L43 WeakPolarHBondContact O-CG 3.3Å; V39-L43 PolarHBondContact O-N 3.05Å; V39-Y188 HydrophobicContact CG1-CE2 4.13Å; V39-V291 HydrophobicContact CG1-CG1 3.91Å; V39-V291 HydrophobicContact CG1-CG2 4.08Å; V39-V291 HydrophobicContact CG2-CG1 4.2Å; V39-V291 HydrophobicContact CG2-CG2 4.18Å
40	A	94.7	Very high	85.3	Confident	27 Å²	27	64.6 Å²	64.6	22%	0.223	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-52.5	-179.7	0	0	0	0	0	113.6	S44 I101 Y188	A40-S44 WeakPolarHBondContact O-CB 3.45Å; A40-S44 PolarHBondContact O-N 3.3Å; A40-S44 PolarHBondContact O-OG 3.48Å; A40-I101 HydrophobicContact CB-CG2 3.91Å; A40-Y188 HydrophobicContact CB-CE2 4.35Å
41	P	96.6	Very high	87.8	Confident	71 Å²	71	60.4 Å²	60.4	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-66.2	-38.2	178.6	24.3	-33.2	0	0	0	112.5	P37 W38 S44 V45	P37-P41 VanDerWaalsContact O-CD 3.26Å; P37-P41 WeakPolarHBondContact O-CD 3.23Å; W38-P41 WeakPolarHBondContact O-CD 3.46Å; W38-P41 WeakPolarHBondContact O-CG 3.15Å; P41-S44 PolarHBondContact O-N 3.4Å; P41-V45 WeakPolarHBondContact O-CB 3.43Å; P41-V45 VanDerWaalsContact O-CG2 3.31Å; P41-V45 WeakPolarHBondContact O-CG2 3.31Å; P41-V45 PolarHBondContact O-N 3.49Å
42	A	96.6	Very high	90.3	Very high	31 Å²	31	60.9 Å²	60.9	26%	0.256	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-48.3	178.3	0	0	0	0	0	112.1	W38 V39 S44 V45 V46 L295	W38-A42 HydrophobicContact CE3-CB 3.88Å; W38-A42 HydrophobicContact CZ3-CB 4.26Å; W38-A42 WeakPolarHBondContact O-CB 3.15Å; W38-A42 PolarHBondContact O-N 2.86Å; V39-A42 PolarHBondContact O-N 3.16Å; A42-S44 VanDerWaalsContact C-N 3.34Å; A42-S44 PolarHBondContact O-N 3.49Å; A42-V45 PolarHBondContact O-N 3.36Å; A42-V46 WeakPolarHBondContact O-CB 3.41Å; A42-V46 WeakPolarHBondContact O-CG2 3.13Å; A42-V46 PolarHBondContact O-N 2.96Å; A42-L295 HydrophobicContact CB-CD1 4.41Å
43	L	96.1	Very high	92.6	Very high	0 Å²	0	52 Å²	52	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-44.4	175.5	-77.3	167.6	0	0	0	111.4	V39 V46 L47 I101 Y188 V291 L295 Y298	V39-L43 HydrophobicContact CG1-CD1 3.55Å; V39-L43 HydrophobicContact CG1-CG 4.37Å; V39-L43 WeakPolarHBondContact O-CB 3.27Å; V39-L43 WeakPolarHBondContact O-CG 3.3Å; V39-L43 PolarHBondContact O-N 3.05Å; L43-V46 PolarHBondContact O-N 3.25Å; L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 VanDerWaalsContact O-CG 3.25Å; L43-L47 WeakPolarHBondContact O-CG 3.46Å; L43-L47 PolarHBondContact O-N 3.38Å; L43-I101 HydrophobicContact CB-CD1 3.76Å; L43-Y188 HydrophobicContact CD1-CD2 3.95Å; L43-Y188 HydrophobicContact CD1-CE2 4.49Å; L43-V291 HydrophobicContact CD1-CG1 4.48Å; L43-V291 HydrophobicContact CG-CG1 4.45Å; L43-L295 HydrophobicContact CB-CD2 4.48Å; L43-L295 HydrophobicContact CD2-CD2 3.51Å; L43-L295 HydrophobicContact CD2-CG 4.03Å; L43-L295 HydrophobicContact CG-CD2 4.04Å; L43-Y298 HydrophobicContact CD2-CD2 4.42Å; L43-Y298 HydrophobicContact CD2-CE2 4.3Å
44	S	97.1	Very high	94.3	Very high	14 Å²	14	47.7 Å²	47.7	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-49.9	179.6	-59	0	0	0	0	111.9	A40 P41 A42 L47 I48 I101	A40-S44 WeakPolarHBondContact O-CB 3.45Å; A40-S44 PolarHBondContact O-N 3.3Å; A40-S44 PolarHBondContact O-OG 3.48Å; P41-S44 PolarHBondContact O-N 3.4Å; A42-S44 VanDerWaalsContact C-N 3.34Å; A42-S44 PolarHBondContact O-N 3.49Å; S44-L47 PolarHBondContact O-N 2.9Å; S44-I48 WeakPolarHBondContact O-CB 3.26Å; S44-I48 WeakPolarHBondContact O-CD1 3.43Å; S44-I48 WeakPolarHBondContact O-CG1 3.43Å; S44-I48 PolarHBondContact O-N 2.88Å; S44-I101 WeakPolarHBondContact OG-CG2 3.34Å
45	V	97.6	Very high	95.6	Very high	91 Å²	91	44 Å²	44	55%	0.552	26%	0.264	S	S	*	.	H	α-helix	trans	-62.4	-47.1	179.9	170.4	0	0	0	0	110.9	P41 A42 I48 V49	P41-V45 WeakPolarHBondContact O-CB 3.43Å; P41-V45 VanDerWaalsContact O-CG2 3.31Å; P41-V45 WeakPolarHBondContact O-CG2 3.31Å; P41-V45 PolarHBondContact O-N 3.49Å; A42-V45 PolarHBondContact O-N 3.36Å; V45-I48 PolarHBondContact O-N 2.95Å; V45-V49 HydrophobicContact CG1-CG2 4.42Å; V45-V49 WeakPolarHBondContact O-CB 3.45Å; V45-V49 VanDerWaalsContact O-CG2 3.31Å; V45-V49 WeakPolarHBondContact O-CG2 3.24Å; V45-V49 PolarHBondContact O-N 3.41Å
46	V	97.1	Very high	96.2	Very high	38 Å²	38	46.2 Å²	46.2	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-45.7	-179.9	168.9	0	0	0	0	110.9	A42 L43 V49 T50 L295 F299	A42-V46 WeakPolarHBondContact O-CB 3.41Å; A42-V46 WeakPolarHBondContact O-CG2 3.13Å; A42-V46 PolarHBondContact O-N 2.96Å; L43-V46 PolarHBondContact O-N 3.25Å; V46-V49 PolarHBondContact O-N 3.08Å; V46-T50 WeakPolarHBondContact O-CB 3.38Å; V46-T50 PolarHBondContact O-N 3.47Å; V46-T50 PolarHBondContact O-OG1 2.93Å; V46-L295 HydrophobicContact CB-CD2 3.77Å; V46-L295 HydrophobicContact CG1-CD2 4Å; V46-L295 HydrophobicContact CG2-CD2 3.85Å; V46-F299 HydrophobicContact CG1-CB 4.36Å
47	L	97.5	Very high	96.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-41.6	178.5	-72.4	170.1	0	0	0	112.4	L43 S44 T50 T51 Y94 I97 L98 I101 Y298	L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 VanDerWaalsContact O-CG 3.25Å; L43-L47 WeakPolarHBondContact O-CG 3.46Å; L43-L47 PolarHBondContact O-N 3.38Å; S44-L47 PolarHBondContact O-N 2.9Å; L47-T50 PolarHBondContact O-N 3.19Å; L47-T51 VanDerWaalsContact O-CB 3.24Å; L47-T51 WeakPolarHBondContact O-CB 3.48Å; L47-T51 PolarHBondContact O-N 3.38Å; L47-T51 PolarHBondContact O-OG1 3.31Å; L47-Y94 HydrophobicContact CD2-CD1 3.86Å; L47-Y94 HydrophobicContact CD2-CD2 4.42Å; L47-Y94 HydrophobicContact CD2-CE1 4.29Å; L47-Y94 HydrophobicContact CD2-CG 3.93Å; L47-I97 HydrophobicContact CD1-CB 4.03Å; L47-I97 HydrophobicContact CD1-CG2 3.47Å; L47-I97 VanDerWaalsContact CD1-CG2 3.47Å; L47-L98 HydrophobicContact CB-CD1 4.43Å; L47-L98 HydrophobicContact CB-CD2 3.9Å; L47-L98 HydrophobicContact CB-CG 4.08Å; L47-L98 HydrophobicContact CD1-CD2 4.32Å; L47-L98 HydrophobicContact CD1-CG 4.37Å; L47-I101 HydrophobicContact CD1-CD1 3.95Å; L47-Y298 HydrophobicContact CD2-CD2 4.01Å; L47-Y298 HydrophobicContact CD2-CG 4.11Å
48	I	98.1	Very high	96.9	Very high	90 Å²	90	39 Å²	39	46%	0.462	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-49	176.9	-70.8	164.7	0	0	0	110.6	S44 V45 A52 L98	S44-I48 WeakPolarHBondContact O-CB 3.26Å; S44-I48 WeakPolarHBondContact O-CD1 3.43Å; S44-I48 WeakPolarHBondContact O-CG1 3.43Å; S44-I48 PolarHBondContact O-N 2.88Å; V45-I48 PolarHBondContact O-N 2.95Å; I48-A52 WeakPolarHBondContact O-CB 3.27Å; I48-A52 PolarHBondContact O-N 2.83Å; I48-L98 HydrophobicContact CD1-CD2 4.4Å; I48-L98 HydrophobicContact CG1-CD1 3.99Å; I48-L98 HydrophobicContact CG1-CD2 3.94Å
49	V	97.6	Very high	97	Very high	69 Å²	69	38.2 Å²	38.2	42%	0.418	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-45.4	179.3	171.8	0	0	0	0	110.5	V45 V46 A52 V53	V45-V49 HydrophobicContact CG1-CG2 4.42Å; V45-V49 WeakPolarHBondContact O-CB 3.45Å; V45-V49 VanDerWaalsContact O-CG2 3.31Å; V45-V49 WeakPolarHBondContact O-CG2 3.24Å; V45-V49 PolarHBondContact O-N 3.41Å; V46-V49 PolarHBondContact O-N 3.08Å; V49-A52 PolarHBondContact O-N 3Å; V49-V53 HydrophobicContact CG1-CG2 4.34Å; V49-V53 WeakPolarHBondContact O-CB 3.39Å; V49-V53 VanDerWaalsContact O-CG2 3.27Å; V49-V53 WeakPolarHBondContact O-CG2 3.26Å; V49-V53 PolarHBondContact O-N 3.08Å
50	T	97.4	Very high	97.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-53.6	179.8	-58.7	0	0	0	0	110	V46 L47 A52 V53 D54 Y94 Y298 S301 C302	V46-T50 WeakPolarHBondContact O-CB 3.38Å; V46-T50 PolarHBondContact O-N 3.47Å; V46-T50 PolarHBondContact O-OG1 2.93Å; L47-T50 PolarHBondContact O-N 3.19Å; T50-A52 VanDerWaalsContact C-N 3.34Å; T50-A52 PolarHBondContact O-N 3.08Å; T50-V53 PolarHBondContact O-N 2.62Å; T50-D54 WeakPolarHBondContact O-CB 3.45Å; T50-D54 PolarHBondContact O-N 3.19Å; T50-Y94 HydrophobicContact CG2-CD2 4.44Å; T50-Y94 HydrophobicContact CG2-CE2 3.81Å; T50-Y298 VanDerWaalsContact CG2-O 3.29Å; T50-Y298 WeakPolarHBondContact CG2-O 3.19Å; T50-S301 WeakPolarHBondContact CG2-OG 3.38Å; T50-C302 HydrophobicContact CG2-CB 4.08Å
51	T	98	Very high	97.2	Very high	28 Å²	28	37.9 Å²	37.9	17%	0.172	24%	0.235	C	C	.	.	H	α-helix	trans	-56.2	-45.7	179.3	-63.7	0	0	0	0	112	L47 V55 A90 Y94	L47-T51 VanDerWaalsContact O-CB 3.24Å; L47-T51 WeakPolarHBondContact O-CB 3.48Å; L47-T51 PolarHBondContact O-N 3.38Å; L47-T51 PolarHBondContact O-OG1 3.31Å; T51-V55 WeakPolarHBondContact O-CB 3.34Å; T51-V55 VanDerWaalsContact O-CG2 3.3Å; T51-V55 WeakPolarHBondContact O-CG2 3.37Å; T51-V55 PolarHBondContact O-N 3.11Å; T51-A90 HydrophobicContact CG2-CB 4.35Å; T51-Y94 WeakPolarHBondContact OG1-CB 3.32Å; T51-Y94 WeakPolarHBondContact OG1-CD2 3.46Å
52	A	97.7	Very high	97.2	Very high	56 Å²	56	35.4 Å²	35.4	46%	0.463	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-46.7	-179.7	0	0	0	0	0	112.2	I48 V49 T50 V56	I48-A52 WeakPolarHBondContact O-CB 3.27Å; I48-A52 PolarHBondContact O-N 2.83Å; V49-A52 PolarHBondContact O-N 3Å; T50-A52 VanDerWaalsContact C-N 3.34Å; T50-A52 PolarHBondContact O-N 3.08Å; A52-V56 WeakPolarHBondContact O-CG2 3.41Å; A52-V56 PolarHBondContact O-N 3.08Å
53	V	97.6	Very high	97.2	Very high	52 Å²	52	37.3 Å²	37.3	32%	0.315	22%	0.223	S	C	.	.	H	α-helix	trans	-71.7	-37	-179	178.5	0	0	0	0	111.5	V49 T50 G57 C302 I306	V49-V53 HydrophobicContact CG1-CG2 4.34Å; V49-V53 WeakPolarHBondContact O-CB 3.39Å; V49-V53 VanDerWaalsContact O-CG2 3.27Å; V49-V53 WeakPolarHBondContact O-CG2 3.26Å; V49-V53 PolarHBondContact O-N 3.08Å; T50-V53 PolarHBondContact O-N 2.62Å; V53-G57 WeakPolarHBondContact O-CA 3.31Å; V53-G57 PolarHBondContact O-N 2.69Å; V53-C302 HydrophobicContact CB-CB 4.01Å; V53-C302 HydrophobicContact CG1-CB 3.96Å; V53-I306 HydrophobicContact CG1-CD1 4.02Å; V53-I306 HydrophobicContact CG1-CG1 4.13Å
54	D	97.6	Very high	97.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-56	177.8	-168	-31	0	0	0	110.5	T50 V56 G57 N58 A90 S301 C302	T50-D54 WeakPolarHBondContact O-CB 3.45Å; T50-D54 PolarHBondContact O-N 3.19Å; D54-V56 VanDerWaalsContact C-N 3.35Å; D54-V56 PolarHBondContact O-N 3.12Å; D54-G57 PolarHBondContact O-N 3.26Å; D54-N58 VanDerWaalsContact O-CB 3.31Å; D54-N58 WeakPolarHBondContact O-CB 3.47Å; D54-N58 PolarHBondContact O-N 2.84Å; D54-N58 PolarHBondContact OD1-ND2 3.08Å; D54-A90 HydrophobicContact CB-CB 3.94Å; D54-S301 WeakPolarHBondContact OD2-CB 3.07Å; D54-S301 PolarHBondContact OD2-OG 3.44Å; D54-C302 HydrophobicContact CB-CB 3.98Å
55	V	97.9	Very high	97	Very high	48 Å²	48	36.7 Å²	36.7	29%	0.291	22%	0.219	S	C	.	.	H	α-helix	trans	-55.9	-49.2	-179.2	171.6	0	0	0	0	111.4	T51 L59 A90 L91	T51-V55 WeakPolarHBondContact O-CB 3.34Å; T51-V55 VanDerWaalsContact O-CG2 3.3Å; T51-V55 WeakPolarHBondContact O-CG2 3.37Å; T51-V55 PolarHBondContact O-N 3.11Å; V55-L59 WeakPolarHBondContact O-CB 3.47Å; V55-L59 PolarHBondContact O-N 2.98Å; V55-A90 HydrophobicContact CG2-CB 3.97Å; V55-L91 HydrophobicContact CG2-CD2 4.2Å
56	V	97	Very high	96.7	Very high	90 Å²	90	37.1 Å²	37.1	55%	0.545	22%	0.217	S	C	.	.	H	α-helix	trans	-69	-49.2	-179.3	175.9	0	0	0	0	111.1	A52 D54 L60	A52-V56 WeakPolarHBondContact O-CG2 3.41Å; A52-V56 PolarHBondContact O-N 3.08Å; D54-V56 VanDerWaalsContact C-N 3.35Å; D54-V56 PolarHBondContact O-N 3.12Å; V56-L60 HydrophobicContact CG1-CD1 4.13Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.33Å; V56-L60 PolarHBondContact O-N 2.91Å
57	G	96.4	Very high	96.4	Very high	10 Å²	10	41.3 Å²	41.3	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-50.6	-172.9	0	0	0	0	0	112.6	V53 D54 L60 V61 A305	V53-G57 WeakPolarHBondContact O-CA 3.31Å; V53-G57 PolarHBondContact O-N 2.69Å; D54-G57 PolarHBondContact O-N 3.26Å; G57-L60 WeakPolarHBondContact O-CB 3.34Å; G57-L60 PolarHBondContact O-N 3.16Å; G57-V61 WeakPolarHBondContact O-CG2 3.3Å; G57-V61 PolarHBondContact O-N 3.19Å; G57-A305 VanDerWaalsContact CA-CB 3.5Å
58	N	97.6	Very high	96.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-71.2	-31.3	-178.4	-76	-50.6	0	0	0	111.8	D54 L60 V61 I62 A83 D86 L87 S301	D54-N58 VanDerWaalsContact O-CB 3.31Å; D54-N58 WeakPolarHBondContact O-CB 3.47Å; D54-N58 PolarHBondContact O-N 2.84Å; D54-N58 PolarHBondContact OD1-ND2 3.08Å; N58-L60 PolarHBondContact O-N 3.15Å; N58-V61 WeakPolarHBondContact O-CB 3.37Å; N58-V61 PolarHBondContact O-N 3.49Å; N58-I62 WeakPolarHBondContact O-CG1 3.31Å; N58-I62 PolarHBondContact O-N 2.82Å; N58-A83 HydrophobicContact CB-CB 4Å; N58-D86 VanDerWaalsContact ND2-CB 3.34Å; N58-D86 WeakPolarHBondContact ND2-CB 3.39Å; N58-L87 HydrophobicContact CB-CD1 4.19Å; N58-L87 HydrophobicContact CB-CD2 3.91Å; N58-L87 HydrophobicContact CB-CG 3.69Å; N58-S301 PolarHBondContact ND2-O 3.31Å
59	L	97.2	Very high	95.6	Very high	87 Å²	87	48.3 Å²	48.3	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-40.3	169.5	-168.6	64.6	0	0	0	111.8	V55 V61 I62 L63	V55-L59 WeakPolarHBondContact O-CB 3.47Å; V55-L59 PolarHBondContact O-N 2.98Å; L59-V61 VanDerWaalsContact C-N 3.33Å; L59-V61 PolarHBondContact O-N 3.06Å; L59-I62 PolarHBondContact O-N 3.2Å; L59-L63 HydrophobicContact CG-CD1 4.13Å; L59-L63 HydrophobicContact CG-CG 4.45Å; L59-L63 WeakPolarHBondContact O-CB 3.47Å; L59-L63 VanDerWaalsContact O-CG 3.27Å; L59-L63 WeakPolarHBondContact O-CG 3.04Å; L59-L63 PolarHBondContact O-N 3.5Å
60	L	96.4	Very high	94.9	Very high	20 Å²	20	53.8 Å²	53.8	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-38	172.9	-73.4	171	0	0	0	112.3	V56 G57 N58 S64 Y319 I322 L323	V56-L60 HydrophobicContact CG1-CD1 4.13Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.33Å; V56-L60 PolarHBondContact O-N 2.91Å; G57-L60 WeakPolarHBondContact O-CB 3.34Å; G57-L60 PolarHBondContact O-N 3.16Å; N58-L60 PolarHBondContact O-N 3.15Å; L60-S64 VanDerWaalsContact O-CB 3.24Å; L60-S64 WeakPolarHBondContact O-CB 3.5Å; L60-S64 PolarHBondContact O-N 2.94Å; L60-S64 PolarHBondContact O-OG 2.66Å; L60-Y319 HydrophobicContact CB-CD1 3.84Å; L60-Y319 HydrophobicContact CB-CE1 3.69Å; L60-I322 HydrophobicContact CD2-CB 4.05Å; L60-I322 HydrophobicContact CD2-CD1 4.42Å; L60-I322 HydrophobicContact CD2-CG2 3.66Å; L60-L323 HydrophobicContact CD1-CD2 4.48Å; L60-L323 HydrophobicContact CD2-CD2 4.4Å; L60-L323 HydrophobicContact CD2-CG 4.46Å
61	V	95.9	Very high	94.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-53.5	173.2	174.6	0	0	0	0	110.2	G57 N58 L59 L63 S64 V65 A83 A305 Y308 F315 Y319	G57-V61 WeakPolarHBondContact O-CG2 3.3Å; G57-V61 PolarHBondContact O-N 3.19Å; N58-V61 WeakPolarHBondContact O-CB 3.37Å; N58-V61 PolarHBondContact O-N 3.49Å; L59-V61 VanDerWaalsContact C-N 3.33Å; L59-V61 PolarHBondContact O-N 3.06Å; V61-L63 PolarHBondContact O-N 2.97Å; V61-S64 PolarHBondContact O-N 3.31Å; V61-V65 PolarHBondContact O-N 3.49Å; V61-A83 HydrophobicContact CB-CB 4.22Å; V61-A83 HydrophobicContact CG1-CB 4.05Å; V61-A305 HydrophobicContact CG2-CB 4.02Å; V61-Y308 HydrophobicContact CG1-CD2 4.42Å; V61-Y308 HydrophobicContact CG2-CD2 3.68Å; V61-Y308 HydrophobicContact CG2-CE2 4.26Å; V61-F315 HydrophobicContact CG1-CE1 4.2Å; V61-Y319 WeakPolarHBondContact CG2-OH 3.47Å
62	I	96.7	Very high	93.9	Very high	19 Å²	19	59.7 Å²	59.7	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-58.5	-52.9	-178.4	-65.4	173.9	0	0	0	110	N58 L59 S64 V65 L66 V80 A83 L84 L87	N58-I62 WeakPolarHBondContact O-CG1 3.31Å; N58-I62 PolarHBondContact O-N 2.82Å; L59-I62 PolarHBondContact O-N 3.2Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 3.49Å; I62-V65 PolarHBondContact O-N 3.05Å; I62-L66 HydrophobicContact CG2-CD1 3.63Å; I62-L66 HydrophobicContact CG2-CG 4.2Å; I62-L66 VanDerWaalsContact O-CG 3.31Å; I62-L66 WeakPolarHBondContact O-CG 3.1Å; I62-L66 PolarHBondContact O-N 2.91Å; I62-V80 HydrophobicContact CG1-CG1 4.25Å; I62-V80 HydrophobicContact CG2-CG1 4.46Å; I62-A83 HydrophobicContact CD1-CB 4.27Å; I62-A83 HydrophobicContact CG1-CB 3.91Å; I62-L84 HydrophobicContact CD1-CD2 3.79Å; I62-L84 HydrophobicContact CD1-CG 4.09Å; I62-L87 HydrophobicContact CD1-CD1 3.49Å; I62-L87 VanDerWaalsContact CD1-CD1 3.49Å
63	L	95.6	Very high	93.3	Very high	72 Å²	72	60.1 Å²	60.1	38%	0.377	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-38.5	-179.7	-69.8	174.3	0	0	0	112.5	L59 V61 V65 L66 R67 I322	L59-L63 HydrophobicContact CG-CD1 4.13Å; L59-L63 HydrophobicContact CG-CG 4.45Å; L59-L63 WeakPolarHBondContact O-CB 3.47Å; L59-L63 VanDerWaalsContact O-CG 3.27Å; L59-L63 WeakPolarHBondContact O-CG 3.04Å; L59-L63 PolarHBondContact O-N 3.5Å; V61-L63 PolarHBondContact O-N 2.97Å; L63-V65 PolarHBondContact O-N 3.18Å; L63-L66 PolarHBondContact O-N 3.23Å; L63-R67 WeakPolarHBondContact O-CB 3.49Å; L63-R67 PolarHBondContact O-N 3.31Å; L63-I322 HydrophobicContact CB-CD1 3.84Å; L63-I322 HydrophobicContact CD1-CG2 4.31Å
64	S	94.5	Very high	92.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-42.3	179	-63.3	0	0	0	0	112.4	L60 V61 I62 N68 E318 Y319 I322	L60-S64 VanDerWaalsContact O-CB 3.24Å; L60-S64 WeakPolarHBondContact O-CB 3.5Å; L60-S64 PolarHBondContact O-N 2.94Å; L60-S64 PolarHBondContact O-OG 2.66Å; V61-S64 PolarHBondContact O-N 3.31Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 3.49Å; S64-N68 WeakPolarHBondContact O-CB 3.46Å; S64-N68 PolarHBondContact O-N 3.27Å; S64-E318 WeakPolarHBondContact OG-CB 3.47Å; S64-Y319 WeakPolarHBondContact OG-CD1 3.3Å; S64-Y319 WeakPolarHBondContact OG-CE1 3.44Å; S64-I322 WeakPolarHBondContact OG-CD1 3.1Å
65	V	94.4	Very high	91.7	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-73.8	-40.4	179.3	179.2	0	0	0	0	111.2	V61 I62 L63 N76 V80 F315	V61-V65 PolarHBondContact O-N 3.49Å; I62-V65 PolarHBondContact O-N 3.05Å; L63-V65 PolarHBondContact O-N 3.18Å; V65-N76 HydrophobicContact CG1-CB 4.37Å; V65-N76 HydrophobicContact CG2-CB 4.36Å; V65-V80 HydrophobicContact CB-CG2 3.67Å; V65-V80 HydrophobicContact CG1-CG2 3.7Å; V65-V80 HydrophobicContact CG2-CG2 3.96Å; V65-F315 HydrophobicContact CG2-CE1 3.78Å; V65-F315 HydrophobicContact CG2-CZ 3.78Å
66	L	92.7	Very high	91.4	Very high	99 Å²	99	56.7 Å²	56.7	52%	0.518	27%	0.266	S	S	.	.	H	α-helix	trans	-69.6	-39.4	-179.6	-66.3	-178.5	0	0	0	112.3	I62 L63	I62-L66 HydrophobicContact CG2-CD1 3.63Å; I62-L66 HydrophobicContact CG2-CG 4.2Å; I62-L66 VanDerWaalsContact O-CG 3.31Å; I62-L66 WeakPolarHBondContact O-CG 3.1Å; I62-L66 PolarHBondContact O-N 2.91Å; L63-L66 PolarHBondContact O-N 3.23Å
67	R	91.5	Very high	91.2	Very high	127 Å²	127	55.1 Å²	55.1	48%	0.479	25%	0.254	S	S	.	.	H	α-helix	trans	-73.6	-42.9	-179.5	-172.3	178.3	-177.9	177.4	1.4	112.4	L63	L63-R67 WeakPolarHBondContact O-CB 3.49Å; L63-R67 PolarHBondContact O-N 3.31Å
68	N	89.6	Confident	91.1	Very high	33 Å²	33	54.7 Å²	54.7	18%	0.176	25%	0.249	C	C	.	.			trans	-95.5	105.5	-174.8	-173.9	-12.4	0	0	0	112.1	S64 K70 L71 R72 E318	S64-N68 WeakPolarHBondContact O-CB 3.46Å; S64-N68 PolarHBondContact O-N 3.27Å; N68-K70 PolarHBondContact O-N 2.84Å; N68-K70 VanDerWaalsContact O-N 3.08Å; N68-K70 WeakPolarHBondContact OD1-CA 3.35Å; N68-K70 VanDerWaalsContact OD1-CB 3.26Å; N68-K70 WeakPolarHBondContact OD1-CB 3.39Å; N68-K70 PolarHBondContact OD1-N 2.9Å; N68-L71 HydrophobicContact CB-CB 4.17Å; N68-L71 HydrophobicContact CB-CD1 4.1Å; N68-L71 HydrophobicContact CB-CG 4.15Å; N68-L71 WeakPolarHBondContact O-CA 3.41Å; N68-L71 PolarHBondContact O-N 2.63Å; N68-R72 PolarHBondContact O-N 3.48Å; N68-R72 VanDerWaalsContact O-N 3.11Å; N68-E318 HydrophobicContact CB-CG 4.26Å; N68-E318 PolarHBondContact ND2-OE1 3.19Å
69	R	87.4	Confident	90.9	Very high	204 Å²	204	54.9 Å²	54.9	77%	0.77	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.9	175.9	-67.5	-172.3	179.3	-172.1	1.4	114	R72	R69-R72 PolarHBondContact O-N 2.89Å
70	K	84.4	Confident	90.9	Very high	184 Å²	184	51.4 Å²	51.4	80%	0.8	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-29.2	175.7	-59.2	-176.1	178.1	-178.4	0	112.4	N68	N68-K70 PolarHBondContact O-N 2.84Å; N68-K70 VanDerWaalsContact O-N 3.08Å; N68-K70 WeakPolarHBondContact OD1-CA 3.35Å; N68-K70 VanDerWaalsContact OD1-CB 3.26Å; N68-K70 WeakPolarHBondContact OD1-CB 3.39Å; N68-K70 PolarHBondContact OD1-N 2.9Å
71	L	84.9	Confident	90.9	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-18.6	174.4	-68.7	179.3	0	0	0	112.5	N68 N73 N76 N314 E318	N68-L71 HydrophobicContact CB-CB 4.17Å; N68-L71 HydrophobicContact CB-CD1 4.1Å; N68-L71 HydrophobicContact CB-CG 4.15Å; N68-L71 WeakPolarHBondContact O-CA 3.41Å; N68-L71 PolarHBondContact O-N 2.63Å; L71-N73 PolarHBondContact O-N 3.31Å; L71-N76 WeakPolarHBondContact O-CB 3.5Å; L71-N76 PolarHBondContact O-ND2 3.36Å; L71-N314 HydrophobicContact CD2-CB 3.77Å; L71-E318 HydrophobicContact CD1-CG 3.64Å
72	R	87.9	Confident	90.9	Very high	142 Å²	142	50.8 Å²	50.8	54%	0.536	23%	0.23	S	C	.	.			trans	-76.6	67.5	177.4	-163.8	171.4	65.1	-176.1	3.8	112.5	N68 R69	N68-R72 PolarHBondContact O-N 3.48Å; N68-R72 VanDerWaalsContact O-N 3.11Å; R69-R72 PolarHBondContact O-N 2.89Å
73	N	85.4	Confident	91	Very high	66 Å²	66	50 Å²	50	35%	0.353	23%	0.226	S	C	.	.	S	Bend	trans	-113.9	168	172.1	63.6	58.7	0	0	0	110.7	L71 G75 N76 L77	L71-N73 PolarHBondContact O-N 3.31Å; N73-G75 VanDerWaalsContact C-N 3.33Å; N73-G75 PolarHBondContact O-N 2.78Å; N73-G75 PolarHBondContact OD1-N 2.92Å; N73-N76 PolarHBondContact ND2-ND2 3.36Å; N73-N76 PolarHBondContact O-N 3.37Å; N73-N76 VanDerWaalsContact O-N 3.11Å; N73-N76 PolarHBondContact OD1-N 3.49Å; N73-N76 VanDerWaalsContact OD1-N 3.08Å; N73-L77 PolarHBondContact O-N 3.47Å
74	A	81.3	Confident	91.1	Very high	20 Å²	20	50.9 Å²	50.9	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-52.2	-46.5	-176.2	0	0	0	0	0	113.9	N76 L77 F78 Y152 T157	A74-N76 VanDerWaalsContact C-N 3.3Å; A74-N76 PolarHBondContact O-N 3.18Å; A74-L77 PolarHBondContact O-N 3.04Å; A74-F78 WeakPolarHBondContact O-CD2 3.43Å; A74-Y152 HydrophobicContact CB-CE1 3.51Å; A74-Y152 WeakPolarHBondContact CB-OH 3.2Å; A74-T157 HydrophobicContact CB-CG2 4.1Å; A74-T157 WeakPolarHBondContact CB-OG1 3.32Å; A74-T157 VanDerWaalsContact O-CG2 3.3Å; A74-T157 WeakPolarHBondContact O-CG2 3.26Å
75	G	81.9	Confident	91.2	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-66.4	-32.5	-178.6	0	0	0	0	0	113.3	N73	N73-G75 VanDerWaalsContact C-N 3.33Å; N73-G75 PolarHBondContact O-N 2.78Å; N73-G75 PolarHBondContact OD1-N 2.92Å
76	N	89.8	Confident	91.3	Very high	6 Å²	6	51 Å²	51	3%	0.032	23%	0.231	C	C	.	.	H	α-helix	trans	-84.2	-17.5	179.7	-68.3	-7.3	0	0	0	112.9	V65 L71 N73 A74 F78 L79 V80	V65-N76 HydrophobicContact CG1-CB 4.37Å; V65-N76 HydrophobicContact CG2-CB 4.36Å; L71-N76 WeakPolarHBondContact O-CB 3.5Å; L71-N76 PolarHBondContact O-ND2 3.36Å; N73-N76 PolarHBondContact ND2-ND2 3.36Å; N73-N76 PolarHBondContact O-N 3.37Å; N73-N76 VanDerWaalsContact O-N 3.11Å; N73-N76 PolarHBondContact OD1-N 3.49Å; N73-N76 VanDerWaalsContact OD1-N 3.08Å; A74-N76 VanDerWaalsContact C-N 3.3Å; A74-N76 PolarHBondContact O-N 3.18Å; N76-F78 VanDerWaalsContact C-N 3.34Å; N76-L79 HydrophobicContact CB-CD1 4.38Å; N76-L79 WeakPolarHBondContact O-CB 3.4Å; N76-L79 PolarHBondContact O-N 3.03Å; N76-V80 PolarHBondContact O-N 2.84Å
77	L	93.2	Very high	91.6	Very high	57 Å²	57	47.1 Å²	47.1	30%	0.298	21%	0.211	S	C	.	.	H	α-helix	trans	-69.9	-34	173.5	-164.5	66	0	0	0	111.6	N73 A74 L79 V80 S81 T157 I161	N73-L77 PolarHBondContact O-N 3.47Å; A74-L77 PolarHBondContact O-N 3.04Å; L77-L79 PolarHBondContact O-N 2.85Å; L77-V80 WeakPolarHBondContact O-CB 3.31Å; L77-V80 PolarHBondContact O-N 3.25Å; L77-V80 VanDerWaalsContact O-N 3.16Å; L77-S81 PolarHBondContact O-N 3.3Å; L77-S81 VanDerWaalsContact O-N 3.09Å; L77-T157 HydrophobicContact CB-CG2 4Å; L77-T157 HydrophobicContact CD2-CG2 3.91Å; L77-T157 HydrophobicContact CG-CG2 4.48Å; L77-I161 HydrophobicContact CB-CD1 4.23Å; L77-I161 HydrophobicContact CD2-CD1 3.82Å; L77-I161 HydrophobicContact CG-CD1 3.67Å
78	F	94.4	Very high	91.8	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-30.2	169.4	-69.2	-71.7	0	0	0	112.6	A74 N76 V80 S81 L82 A133 I134 N137 T157 H160 I161	A74-F78 WeakPolarHBondContact O-CD2 3.43Å; N76-F78 VanDerWaalsContact C-N 3.34Å; F78-V80 VanDerWaalsContact C-N 3.3Å; F78-S81 WeakPolarHBondContact O-CB 3.45Å; F78-S81 PolarHBondContact O-N 3.31Å; F78-L82 WeakPolarHBondContact O-CB 3.46Å; F78-L82 PolarHBondContact O-N 2.99Å; F78-A133 HydrophobicContact CD1-CB 4.01Å; F78-A133 HydrophobicContact CE1-CB 3.69Å; F78-A133 HydrophobicContact CZ-CB 4.11Å; F78-I134 HydrophobicContact CB-CD1 3.9Å; F78-I134 HydrophobicContact CB-CG1 3.41Å; F78-I134 VanDerWaalsContact CB-CG1 3.41Å; F78-I134 HydrophobicContact CG-CG1 4.1Å; F78-N137 HydrophobicContact CE2-CB 4.35Å; F78-T157 HydrophobicContact CD2-CG2 4.16Å; F78-T157 HydrophobicContact CE2-CG2 3.74Å; F78-T157 HydrophobicContact CZ-CG2 4.06Å; F78-H160 HydrophobicContact CE1-CB 4.14Å; F78-H160 HydrophobicContact CZ-CB 3.9Å; F78-I161 HydrophobicContact CD1-CD1 4.26Å; F78-I161 HydrophobicContact CD1-CG1 3.62Å; F78-I161 HydrophobicContact CE1-CD1 4.46Å; F78-I161 HydrophobicContact CE1-CG1 3.57Å; F78-I161 HydrophobicContact CG-CG1 4.49Å; F78-I161 HydrophobicContact CZ-CG1 4.43Å
79	L	94.1	Very high	92.2	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-33.6	174	-56.4	179	0	0	0	111.9	N76 L77 A83 I134 M253 Y308 F315	N76-L79 HydrophobicContact CB-CD1 4.38Å; N76-L79 WeakPolarHBondContact O-CB 3.4Å; N76-L79 PolarHBondContact O-N 3.03Å; L77-L79 PolarHBondContact O-N 2.85Å; L79-A83 VanDerWaalsContact O-CB 3.29Å; L79-A83 WeakPolarHBondContact O-CB 3.45Å; L79-A83 PolarHBondContact O-N 2.96Å; L79-I134 HydrophobicContact CD2-CD1 3.82Å; L79-M253 HydrophobicContact CD1-CE 4.15Å; L79-M253 HydrophobicContact CD2-CE 3.91Å; L79-M253 HydrophobicContact CG-CE 4.16Å; L79-Y308 HydrophobicContact CD2-CE1 4.06Å; L79-Y308 HydrophobicContact CD2-CE2 4.45Å; L79-Y308 WeakPolarHBondContact CD2-OH 3.19Å; L79-F315 HydrophobicContact CD1-CE2 3.8Å; L79-F315 HydrophobicContact CD1-CZ 3.75Å
80	V	96.5	Very high	92.7	Very high	15 Å²	15	32.6 Å²	32.6	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-44.3	172.8	175.2	0	0	0	0	110.3	I62 V65 N76 L77 F78 L82 A83 L84	I62-V80 HydrophobicContact CG1-CG1 4.25Å; I62-V80 HydrophobicContact CG2-CG1 4.46Å; V65-V80 HydrophobicContact CB-CG2 3.67Å; V65-V80 HydrophobicContact CG1-CG2 3.7Å; V65-V80 HydrophobicContact CG2-CG2 3.96Å; N76-V80 PolarHBondContact O-N 2.84Å; L77-V80 WeakPolarHBondContact O-CB 3.31Å; L77-V80 PolarHBondContact O-N 3.25Å; L77-V80 VanDerWaalsContact O-N 3.16Å; F78-V80 VanDerWaalsContact C-N 3.3Å; V80-L82 VanDerWaalsContact C-N 3.35Å; V80-L82 PolarHBondContact O-N 3.22Å; V80-A83 PolarHBondContact O-N 3.02Å; V80-L84 HydrophobicContact CG1-CD1 4.41Å; V80-L84 WeakPolarHBondContact O-CG 3.4Å; V80-L84 PolarHBondContact O-N 3.09Å
81	S	97.2	Very high	93.3	Very high	5 Å²	5	29.4 Å²	29.4	4%	0.035	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-44	175.1	-179.8	0	0	0	0	111.9	L77 F78 L84 A85 N130 W165	L77-S81 PolarHBondContact O-N 3.3Å; L77-S81 VanDerWaalsContact O-N 3.09Å; F78-S81 WeakPolarHBondContact O-CB 3.45Å; F78-S81 PolarHBondContact O-N 3.31Å; S81-L84 PolarHBondContact O-N 3.21Å; S81-A85 PolarHBondContact O-N 3.18Å; S81-A85 VanDerWaalsContact O-N 3.16Å; S81-N130 VanDerWaalsContact CB-OD1 3.22Å; S81-N130 WeakPolarHBondContact CB-OD1 3.27Å; S81-N130 PolarHBondContact OG-ND2 3.29Å; S81-N130 PolarHBondContact OG-OD1 3.04Å; S81-W165 PolarHBondContact OG-NE1 2.83Å
82	L	96.3	Very high	93.9	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-46	174.8	-174.2	65.4	0	0	0	112	F78 V80 L84 A85 D86 S127 N130 I131	F78-L82 WeakPolarHBondContact O-CB 3.46Å; F78-L82 PolarHBondContact O-N 2.99Å; V80-L82 VanDerWaalsContact C-N 3.35Å; V80-L82 PolarHBondContact O-N 3.22Å; L82-L84 PolarHBondContact O-N 3.46Å; L82-A85 WeakPolarHBondContact O-CA 3.07Å; L82-A85 VanDerWaalsContact O-CB 3.3Å; L82-A85 WeakPolarHBondContact O-CB 3.26Å; L82-A85 PolarHBondContact O-N 2.83Å; L82-D86 PolarHBondContact O-N 3.44Å; L82-S127 VanDerWaalsContact CD1-OG 3.28Å; L82-S127 WeakPolarHBondContact CD1-OG 3.5Å; L82-N130 HydrophobicContact CB-CB 4.27Å; L82-N130 HydrophobicContact CD1-CB 4.04Å; L82-I131 HydrophobicContact CD1-CG1 4.4Å; L82-I131 HydrophobicContact CD2-CG1 4.29Å
83	A	97.3	Very high	94.4	Very high	2 Å²	2	25.5 Å²	25.5	2%	0.017	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-32.1	176.9	0	0	0	0	0	112.9	N58 V61 I62 L79 V80 L87	N58-A83 HydrophobicContact CB-CB 4Å; V61-A83 HydrophobicContact CB-CB 4.22Å; V61-A83 HydrophobicContact CG1-CB 4.05Å; I62-A83 HydrophobicContact CD1-CB 4.27Å; I62-A83 HydrophobicContact CG1-CB 3.91Å; L79-A83 VanDerWaalsContact O-CB 3.29Å; L79-A83 WeakPolarHBondContact O-CB 3.45Å; L79-A83 PolarHBondContact O-N 2.96Å; V80-A83 PolarHBondContact O-N 3.02Å; A83-L87 WeakPolarHBondContact O-CB 3.29Å; A83-L87 VanDerWaalsContact O-CG 3.26Å; A83-L87 WeakPolarHBondContact O-CG 3.5Å; A83-L87 PolarHBondContact O-N 3.04Å
84	L	97.7	Very high	95	Very high	91 Å²	91	22.8 Å²	22.8	48%	0.476	12%	0.121	S	C	.	.	H	α-helix	trans	-69.4	-37	172.8	-72.3	168.9	0	0	0	112.2	I62 V80 S81 L82 D86 L87 V88	I62-L84 HydrophobicContact CD1-CD2 3.79Å; I62-L84 HydrophobicContact CD1-CG 4.09Å; V80-L84 HydrophobicContact CG1-CD1 4.41Å; V80-L84 WeakPolarHBondContact O-CG 3.4Å; V80-L84 PolarHBondContact O-N 3.09Å; S81-L84 PolarHBondContact O-N 3.21Å; L82-L84 PolarHBondContact O-N 3.46Å; L84-D86 VanDerWaalsContact C-N 3.33Å; L84-L87 PolarHBondContact O-N 2.79Å; L84-V88 PolarHBondContact O-N 2.87Å
85	A	97.2	Very high	95.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.1	-38.1	174.1	0	0	0	0	0	111.7	S81 L82 V88 S123 W165	S81-A85 PolarHBondContact O-N 3.18Å; S81-A85 VanDerWaalsContact O-N 3.16Å; L82-A85 WeakPolarHBondContact O-CA 3.07Å; L82-A85 VanDerWaalsContact O-CB 3.3Å; L82-A85 WeakPolarHBondContact O-CB 3.26Å; L82-A85 PolarHBondContact O-N 2.83Å; A85-V88 WeakPolarHBondContact O-CG1 3.36Å; A85-S123 WeakPolarHBondContact O-CB 3.32Å; A85-S123 PolarHBondContact O-OG 2.99Å; A85-W165 HydrophobicContact CB-CH2 3.68Å; A85-W165 HydrophobicContact CB-CZ2 4.14Å
86	D	97.3	Very high	96.5	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.011	14%	0.136	C	C	.	.	H	α-helix	trans	-73.3	-41.9	176.4	-63.4	-29.5	0	0	0	111.4	N58 L82 L84 V88 V89 N304	N58-D86 VanDerWaalsContact ND2-CB 3.34Å; N58-D86 WeakPolarHBondContact ND2-CB 3.39Å; L82-D86 PolarHBondContact O-N 3.44Å; L84-D86 VanDerWaalsContact C-N 3.33Å; D86-V88 VanDerWaalsContact C-N 3.34Å; D86-V88 PolarHBondContact O-N 3.18Å; D86-V89 WeakPolarHBondContact O-CG2 3.43Å; D86-V89 PolarHBondContact O-N 2.98Å; D86-N304 PolarHBondContact OD2-ND2 2.83Å
87	L	97.8	Very high	96.9	Very high	18 Å²	18	25.2 Å²	25.2	9%	0.094	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-37.8	179.7	-79.1	172	0	0	0	113.7	N58 I62 A83 L84 V89 A90 L91	N58-L87 HydrophobicContact CB-CD1 4.19Å; N58-L87 HydrophobicContact CB-CD2 3.91Å; N58-L87 HydrophobicContact CB-CG 3.69Å; I62-L87 HydrophobicContact CD1-CD1 3.49Å; I62-L87 VanDerWaalsContact CD1-CD1 3.49Å; A83-L87 WeakPolarHBondContact O-CB 3.29Å; A83-L87 VanDerWaalsContact O-CG 3.26Å; A83-L87 WeakPolarHBondContact O-CG 3.5Å; A83-L87 PolarHBondContact O-N 3.04Å; L84-L87 PolarHBondContact O-N 2.79Å; L87-V89 VanDerWaalsContact C-N 3.26Å; L87-V89 PolarHBondContact O-N 3.22Å; L87-A90 PolarHBondContact O-N 2.9Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 3.31Å
88	V	97.3	Very high	97.1	Very high	56 Å²	56	23.8 Å²	23.8	34%	0.339	13%	0.127	S	C	.	.	H	α-helix	trans	-64.9	-31.5	-175.3	75.5	0	0	0	0	112.1	L84 A85 D86 Y92 P93 V119	L84-V88 PolarHBondContact O-N 2.87Å; A85-V88 WeakPolarHBondContact O-CG1 3.36Å; D86-V88 VanDerWaalsContact C-N 3.34Å; D86-V88 PolarHBondContact O-N 3.18Å; V88-Y92 PolarHBondContact O-N 3.19Å; V88-P93 WeakPolarHBondContact O-CD 3.07Å; V88-V119 HydrophobicContact CB-CG1 4.41Å; V88-V119 HydrophobicContact CG1-CG1 3.99Å; V88-V119 HydrophobicContact CG2-CG1 3.75Å
89	V	97.5	Very high	97.2	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-73.3	-36.6	176.5	-72.2	0	0	0	0	112.6	D86 L87 L91 P93 Y94 S123	D86-V89 WeakPolarHBondContact O-CG2 3.43Å; D86-V89 PolarHBondContact O-N 2.98Å; L87-V89 VanDerWaalsContact C-N 3.26Å; L87-V89 PolarHBondContact O-N 3.22Å; V89-L91 VanDerWaalsContact C-N 3.31Å; V89-L91 PolarHBondContact O-N 3.16Å; V89-P93 HydrophobicContact CG1-CG 4.31Å; V89-P93 VanDerWaalsContact O-CD 3.3Å; V89-P93 WeakPolarHBondContact O-CD 3.49Å; V89-Y94 HydrophobicContact CB-CD1 4.45Å; V89-Y94 HydrophobicContact CB-CE1 3.98Å; V89-Y94 HydrophobicContact CB-CE2 4.24Å; V89-Y94 HydrophobicContact CG2-CE1 4.33Å; V89-Y94 HydrophobicContact CG2-CE2 3.92Å; V89-Y94 PolarHBondContact O-N 3.3Å; V89-S123 WeakPolarHBondContact CG1-OG 3.41Å
90	A	97.6	Very high	97.3	Very high	2 Å²	2	26.4 Å²	26.4	2%	0.017	14%	0.143	C	C	.	.	H	α-helix	trans	-68.9	-29.3	176.5	0	0	0	0	0	113	T51 D54 V55 L87 Y94 P95	T51-A90 HydrophobicContact CG2-CB 4.35Å; D54-A90 HydrophobicContact CB-CB 3.94Å; V55-A90 HydrophobicContact CG2-CB 3.97Å; L87-A90 PolarHBondContact O-N 2.9Å; A90-Y94 HydrophobicContact CB-CD2 4.26Å; A90-P95 VanDerWaalsContact O-CD 3.29Å; A90-P95 WeakPolarHBondContact O-CD 3.11Å
91	L	97.6	Very high	97.3	Very high	118 Å²	118	26.3 Å²	26.3	62%	0.618	14%	0.142	S	C	*	.	H	α-helix	trans	-87.1	-25.1	-177.2	-67.5	175.2	0	0	0	114.3	V55 L87 V89	V55-L91 HydrophobicContact CG2-CD2 4.2Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 3.31Å; V89-L91 VanDerWaalsContact C-N 3.31Å; V89-L91 PolarHBondContact O-N 3.16Å
92	Y	97.7	Very high	97.1	Very high	69 Å²	69	33.5 Å²	33.5	27%	0.271	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-72.9	-175	179.6	-107.4	0	0	0	113.5	V88 Y94 P95 L96 H112 A115 V119	V88-Y92 PolarHBondContact O-N 3.19Å; Y92-Y94 PolarHBondContact O-N 3.11Å; Y92-P95 WeakPolarHBondContact O-CD 3.42Å; Y92-L96 HydrophobicContact CD2-CD1 4.42Å; Y92-L96 HydrophobicContact CE1-CD1 4.35Å; Y92-L96 HydrophobicContact CE2-CD1 3.89Å; Y92-L96 WeakPolarHBondContact O-CG 3.34Å; Y92-L96 PolarHBondContact O-N 3.08Å; Y92-H112 AromaticContact CZ-ND1 3.97Å; Y92-H112 PolarHBondContact OH-ND1 2.79Å; Y92-A115 HydrophobicContact CE1-CB 4.18Å; Y92-V119 HydrophobicContact CD1-CB 4.27Å; Y92-V119 HydrophobicContact CD1-CG1 4.42Å; Y92-V119 HydrophobicContact CD1-CG2 4.02Å; Y92-V119 HydrophobicContact CE1-CG2 4.37Å
93	P	97.9	Very high	97.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.7	-48.6	-179.5	-26.4	33.2	0	0	0	115.4	V88 V89 L96 I97 S116 V119	V88-P93 WeakPolarHBondContact O-CD 3.07Å; V89-P93 HydrophobicContact CG1-CG 4.31Å; V89-P93 VanDerWaalsContact O-CD 3.3Å; V89-P93 WeakPolarHBondContact O-CD 3.49Å; P93-L96 PolarHBondContact O-N 3.28Å; P93-L96 VanDerWaalsContact O-N 3.07Å; P93-I97 VanDerWaalsContact O-CG1 3.3Å; P93-I97 WeakPolarHBondContact O-CG1 3.4Å; P93-I97 PolarHBondContact O-N 3.07Å; P93-S116 WeakPolarHBondContact CA-OG 3.39Å; P93-S116 WeakPolarHBondContact CB-OG 3.39Å; P93-V119 HydrophobicContact CG-CB 3.97Å; P93-V119 HydrophobicContact CG-CG1 3.68Å
94	Y	97.6	Very high	96.9	Very high	9 Å²	9	46.1 Å²	46.1	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-44.3	-172.2	-65.1	-9.5	0	0	0	113.6	L47 T50 T51 V89 A90 Y92 L96 I97 L98 Y298	L47-Y94 HydrophobicContact CD2-CD1 3.86Å; L47-Y94 HydrophobicContact CD2-CD2 4.42Å; L47-Y94 HydrophobicContact CD2-CE1 4.29Å; L47-Y94 HydrophobicContact CD2-CG 3.93Å; T50-Y94 HydrophobicContact CG2-CD2 4.44Å; T50-Y94 HydrophobicContact CG2-CE2 3.81Å; T51-Y94 WeakPolarHBondContact OG1-CB 3.32Å; T51-Y94 WeakPolarHBondContact OG1-CD2 3.46Å; V89-Y94 HydrophobicContact CB-CD1 4.45Å; V89-Y94 HydrophobicContact CB-CE1 3.98Å; V89-Y94 HydrophobicContact CB-CE2 4.24Å; V89-Y94 HydrophobicContact CG2-CE1 4.33Å; V89-Y94 HydrophobicContact CG2-CE2 3.92Å; V89-Y94 PolarHBondContact O-N 3.3Å; A90-Y94 HydrophobicContact CB-CD2 4.26Å; Y92-Y94 PolarHBondContact O-N 3.11Å; Y94-L96 VanDerWaalsContact C-N 3.31Å; Y94-L96 PolarHBondContact O-N 3.26Å; Y94-I97 HydrophobicContact CD1-CD1 4.23Å; Y94-I97 PolarHBondContact O-N 3.38Å; Y94-L98 WeakPolarHBondContact O-CG 2.98Å; Y94-L98 PolarHBondContact O-N 3.2Å; Y94-Y298 AromaticContact CE1-CD1 3.81Å; Y94-Y298 HydrophobicContact CE1-CD1 3.81Å; Y94-Y298 HydrophobicContact CE1-CE1 4.35Å; Y94-Y298 HydrophobicContact CE1-CG 4.39Å; Y94-Y298 PolarHBondContact OH-O 3.31Å
95	P	97.4	Very high	96.6	Very high	50 Å²	50	42.7 Å²	42.7	33%	0.325	21%	0.214	S	C	.	.	H	α-helix	trans	-56.3	-40.4	169.9	-28.2	34	0	0	0	114	A90 Y92 L98 V99	A90-P95 VanDerWaalsContact O-CD 3.29Å; A90-P95 WeakPolarHBondContact O-CD 3.11Å; Y92-P95 WeakPolarHBondContact O-CD 3.42Å; P95-L98 WeakPolarHBondContact O-CB 3.42Å; P95-L98 PolarHBondContact O-N 3.13Å; P95-V99 WeakPolarHBondContact O-CG2 3.3Å; P95-V99 PolarHBondContact O-N 3.46Å
96	L	97.8	Very high	96.4	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-69	-38.4	-180	-57.2	-168.9	0	0	0	112	Y92 P93 Y94 L98 V99 A100 W106 L108 H112	Y92-L96 HydrophobicContact CD2-CD1 4.42Å; Y92-L96 HydrophobicContact CE1-CD1 4.35Å; Y92-L96 HydrophobicContact CE2-CD1 3.89Å; Y92-L96 WeakPolarHBondContact O-CG 3.34Å; Y92-L96 PolarHBondContact O-N 3.08Å; P93-L96 PolarHBondContact O-N 3.28Å; P93-L96 VanDerWaalsContact O-N 3.07Å; Y94-L96 VanDerWaalsContact C-N 3.31Å; Y94-L96 PolarHBondContact O-N 3.26Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L96-V99 PolarHBondContact O-N 3.42Å; L96-A100 PolarHBondContact O-N 3.44Å; L96-W106 HydrophobicContact CB-CH2 3.83Å; L96-W106 HydrophobicContact CB-CZ3 4.29Å; L96-W106 HydrophobicContact CD1-CH2 4.1Å; L96-W106 HydrophobicContact CD1-CZ2 4.38Å; L96-L108 HydrophobicContact CB-CD1 3.99Å; L96-L108 HydrophobicContact CD1-CD1 3.83Å; L96-L108 HydrophobicContact CD2-CD1 3.6Å; L96-L108 HydrophobicContact CG-CD1 3.96Å; L96-H112 HydrophobicContact CD1-CB 4.46Å
97	I	97.3	Very high	96.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-41.8	174.6	-61.6	164.6	0	0	0	110	L47 P93 Y94 V99 A100 I101 M120 S189	L47-I97 HydrophobicContact CD1-CB 4.03Å; L47-I97 HydrophobicContact CD1-CG2 3.47Å; L47-I97 VanDerWaalsContact CD1-CG2 3.47Å; P93-I97 VanDerWaalsContact O-CG1 3.3Å; P93-I97 WeakPolarHBondContact O-CG1 3.4Å; P93-I97 PolarHBondContact O-N 3.07Å; Y94-I97 HydrophobicContact CD1-CD1 4.23Å; Y94-I97 PolarHBondContact O-N 3.38Å; I97-V99 VanDerWaalsContact C-N 3.34Å; I97-V99 PolarHBondContact O-N 3.05Å; I97-A100 WeakPolarHBondContact O-CB 3.47Å; I97-A100 PolarHBondContact O-N 2.81Å; I97-A100 VanDerWaalsContact O-N 3.13Å; I97-I101 HydrophobicContact CG2-CD1 4.15Å; I97-I101 HydrophobicContact CG2-CG1 4.5Å; I97-I101 VanDerWaalsContact O-CG1 3.31Å; I97-I101 WeakPolarHBondContact O-CG1 3.33Å; I97-I101 PolarHBondContact O-N 3.21Å; I97-M120 HydrophobicContact CD1-CE 4.49Å; I97-S189 VanDerWaalsContact CD1-OG 3.23Å; I97-S189 WeakPolarHBondContact CD1-OG 3.26Å; I97-S189 WeakPolarHBondContact CG1-OG 3.28Å
98	L	97.3	Very high	95.9	Very high	27 Å²	27	49.7 Å²	49.7	14%	0.141	26%	0.257	C	S	.	.	H	α-helix	trans	-58.5	-45.5	174.5	-76	169.2	0	0	0	111.6	L47 I48 Y94 P95 L96 A100 I101 F102	L47-L98 HydrophobicContact CB-CD1 4.43Å; L47-L98 HydrophobicContact CB-CD2 3.9Å; L47-L98 HydrophobicContact CB-CG 4.08Å; L47-L98 HydrophobicContact CD1-CD2 4.32Å; L47-L98 HydrophobicContact CD1-CG 4.37Å; I48-L98 HydrophobicContact CD1-CD2 4.4Å; I48-L98 HydrophobicContact CG1-CD1 3.99Å; I48-L98 HydrophobicContact CG1-CD2 3.94Å; Y94-L98 WeakPolarHBondContact O-CG 2.98Å; Y94-L98 PolarHBondContact O-N 3.2Å; P95-L98 WeakPolarHBondContact O-CB 3.42Å; P95-L98 PolarHBondContact O-N 3.13Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L98-A100 VanDerWaalsContact C-N 3.33Å; L98-A100 PolarHBondContact O-N 3.44Å; L98-I101 PolarHBondContact O-N 3.11Å; L98-F102 WeakPolarHBondContact O-CD2 3.38Å; L98-F102 PolarHBondContact O-N 2.98Å; L98-F102 VanDerWaalsContact O-N 3.12Å
99	V	96.9	Very high	95.7	Very high	58 Å²	58	49.1 Å²	49.1	35%	0.352	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-45.6	173.8	173.5	0	0	0	0	110.7	P95 L96 I97 I101 F102 Y103	P95-V99 WeakPolarHBondContact O-CG2 3.3Å; P95-V99 PolarHBondContact O-N 3.46Å; L96-V99 PolarHBondContact O-N 3.42Å; I97-V99 VanDerWaalsContact C-N 3.34Å; I97-V99 PolarHBondContact O-N 3.05Å; V99-I101 VanDerWaalsContact C-N 3.27Å; V99-I101 PolarHBondContact O-N 3.34Å; V99-F102 PolarHBondContact O-N 2.84Å; V99-Y103 HydrophobicContact CG1-CD2 3.76Å; V99-Y103 HydrophobicContact CG1-CE2 4.03Å; V99-Y103 WeakPolarHBondContact O-CD2 3.29Å; V99-Y103 PolarHBondContact O-N 2.77Å
100	A	96.4	Very high	95.6	Very high	2 Å²	2	54.9 Å²	54.9	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-33.9	179	0	0	0	0	0	113	L96 I97 L98 D104 G105 W106 Y188	L96-A100 PolarHBondContact O-N 3.44Å; I97-A100 WeakPolarHBondContact O-CB 3.47Å; I97-A100 PolarHBondContact O-N 2.81Å; I97-A100 VanDerWaalsContact O-N 3.13Å; L98-A100 VanDerWaalsContact C-N 3.33Å; L98-A100 PolarHBondContact O-N 3.44Å; A100-D104 WeakPolarHBondContact O-CA 3.33Å; A100-D104 PolarHBondContact O-N 3.24Å; A100-D104 VanDerWaalsContact O-N 3.08Å; A100-G105 VanDerWaalsContact CA-O 3.26Å; A100-G105 WeakPolarHBondContact CA-O 3.22Å; A100-G105 PolarHBondContact O-N 3Å; A100-W106 HydrophobicContact CB-CE3 4Å; A100-W106 HydrophobicContact CB-CZ3 4.43Å; A100-Y188 VanDerWaalsContact CB-O 3.31Å; A100-Y188 WeakPolarHBondContact CB-O 3.41Å; A100-Y188 WeakPolarHBondContact O-CD1 3.43Å
101	I	95.6	Very high	95.4	Very high	13 Å²	13	61.9 Å²	61.9	7%	0.067	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-47.1	173.8	-63	161.9	0	0	0	111	A40 L43 S44 L47 I97 L98 V99 Y103 D104 Y188	A40-I101 HydrophobicContact CB-CG2 3.91Å; L43-I101 HydrophobicContact CB-CD1 3.76Å; S44-I101 WeakPolarHBondContact OG-CG2 3.34Å; L47-I101 HydrophobicContact CD1-CD1 3.95Å; I97-I101 HydrophobicContact CG2-CD1 4.15Å; I97-I101 HydrophobicContact CG2-CG1 4.5Å; I97-I101 VanDerWaalsContact O-CG1 3.31Å; I97-I101 WeakPolarHBondContact O-CG1 3.33Å; I97-I101 PolarHBondContact O-N 3.21Å; L98-I101 PolarHBondContact O-N 3.11Å; V99-I101 VanDerWaalsContact C-N 3.27Å; V99-I101 PolarHBondContact O-N 3.34Å; I101-Y103 VanDerWaalsContact C-N 3.32Å; I101-Y103 PolarHBondContact O-N 3.27Å; I101-D104 PolarHBondContact O-N 3.39Å; I101-Y188 HydrophobicContact CB-CD1 4.29Å; I101-Y188 HydrophobicContact CB-CG 4.33Å; I101-Y188 HydrophobicContact CG1-CD1 4.07Å; I101-Y188 HydrophobicContact CG1-CD2 3.93Å; I101-Y188 HydrophobicContact CG1-CG 3.61Å
102	F	94.4	Very high	95.4	Very high	155 Å²	155	60.1 Å²	60.1	68%	0.68	31%	0.311	S	S	*	.	H	α-helix	trans	-69.3	-27.9	-178.9	-74.7	-68.9	0	0	0	113.8	L98 V99	L98-F102 WeakPolarHBondContact O-CD2 3.38Å; L98-F102 PolarHBondContact O-N 2.98Å; L98-F102 VanDerWaalsContact O-N 3.12Å; V99-F102 PolarHBondContact O-N 2.84Å
103	Y	94.6	Very high	95.3	Very high	172 Å²	172	57.3 Å²	57.3	68%	0.675	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.1	176.9	-80.2	-98.1	0	0	0	113.7	V99 I101 G105 A107	V99-Y103 HydrophobicContact CG1-CD2 3.76Å; V99-Y103 HydrophobicContact CG1-CE2 4.03Å; V99-Y103 WeakPolarHBondContact O-CD2 3.29Å; V99-Y103 PolarHBondContact O-N 2.77Å; I101-Y103 VanDerWaalsContact C-N 3.32Å; I101-Y103 PolarHBondContact O-N 3.27Å; Y103-G105 VanDerWaalsContact C-N 3.28Å; Y103-G105 PolarHBondContact O-N 3.42Å; Y103-A107 HydrophobicContact CD1-CB 4.35Å; Y103-A107 HydrophobicContact CG-CB 4.24Å
104	D	93.1	Very high	95.3	Very high	98 Å²	98	61 Å²	61	52%	0.524	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	46.8	-172.4	-169.4	24.2	0	0	0	114.4	R35 A100 I101 Y188	R35-D104 IonicContact CZ-OD1 3.33Å; R35-D104 VanDerWaalsContact CZ-OD1 3.31Å; R35-D104 IonicContact NH1-OD1 3.82Å; R35-D104 PolarHBondContact NH1-OD1 3.05Å; R35-D104 IonicContact NH2-OD1 2.67Å; R35-D104 PolarHBondContact NH2-OD1 2.97Å; A100-D104 WeakPolarHBondContact O-CA 3.33Å; A100-D104 PolarHBondContact O-N 3.24Å; A100-D104 VanDerWaalsContact O-N 3.08Å; I101-D104 PolarHBondContact O-N 3.39Å; D104-Y188 VanDerWaalsContact OD1-CE1 3.29Å; D104-Y188 WeakPolarHBondContact OD1-CE1 3.37Å
105	G	91.4	Very high	95.3	Very high	18 Å²	18	62.3 Å²	62.3	19%	0.186	33%	0.33	C	S	.	.	S	Bend	trans	164.1	162.6	-176.4	0	0	0	0	0	112.6	A100 Y103 A107 Y183	A100-G105 VanDerWaalsContact CA-O 3.26Å; A100-G105 WeakPolarHBondContact CA-O 3.22Å; A100-G105 PolarHBondContact O-N 3Å; Y103-G105 VanDerWaalsContact C-N 3.28Å; Y103-G105 PolarHBondContact O-N 3.42Å; G105-A107 PolarHBondContact O-N 3.44Å; G105-Y183 WeakPolarHBondContact CA-OH 3.48Å
106	W	94.9	Very high	95.3	Very high	43 Å²	43	59.9 Å²	59.9	16%	0.163	31%	0.314	C	S	.	.			trans	-75.1	97.1	173.8	-166.8	-101.1	0	0	0	110.2	L96 A100 L108 G109 H112 C113 Y183 C190	L96-W106 HydrophobicContact CB-CH2 3.83Å; L96-W106 HydrophobicContact CB-CZ3 4.29Å; L96-W106 HydrophobicContact CD1-CH2 4.1Å; L96-W106 HydrophobicContact CD1-CZ2 4.38Å; A100-W106 HydrophobicContact CB-CE3 4Å; A100-W106 HydrophobicContact CB-CZ3 4.43Å; W106-L108 VanDerWaalsContact C-N 3.28Å; W106-L108 HydrophobicContact CH2-CD1 4.39Å; W106-L108 HydrophobicContact CZ2-CB 4.11Å; W106-L108 HydrophobicContact CZ2-CD1 4.06Å; W106-L108 PolarHBondContact NE1-O 3.01Å; W106-L108 PolarHBondContact O-N 3.12Å; W106-G109 PolarHBondContact NE1-O 3.26Å; W106-H112 HydrophobicContact CZ2-CB 4.1Å; W106-C113 HydrophobicContact CD2-CB 4.48Å; W106-C113 VanDerWaalsContact CZ2-CA 3.46Å; W106-C113 HydrophobicContact CZ2-CB 4.08Å; W106-Y183 HydrophobicContact CB-CD1 4.3Å; W106-Y183 HydrophobicContact CB-CD2 3.66Å; W106-Y183 HydrophobicContact CB-CE2 3.88Å; W106-Y183 HydrophobicContact CB-CG 3.87Å; W106-Y183 HydrophobicContact CD2-CD2 4.35Å; W106-Y183 HydrophobicContact CE3-CD2 4.03Å; W106-Y183 HydrophobicContact CE3-CE2 4.28Å; W106-Y183 HydrophobicContact CG-CD2 4.23Å; W106-C190 VanDerWaalsContact CE3-SG 3.59Å; W106-C190 HydrophobicContact CH2-CB 4.4Å; W106-C190 HydrophobicContact CZ3-CB 4.38Å
107	A	90.4	Very high	95.3	Very high	65 Å²	65	58.8 Å²	58.8	54%	0.537	31%	0.309	S	S	.	.			trans	-79.6	-8.5	-178.2	0	0	0	0	0	114	Y103 G105	Y103-A107 HydrophobicContact CD1-CB 4.35Å; Y103-A107 HydrophobicContact CG-CB 4.24Å; G105-A107 PolarHBondContact O-N 3.44Å
108	L	92.8	Very high	95.3	Very high	59 Å²	59	60.8 Å²	60.8	31%	0.309	32%	0.318	S	S	.	.	S	Bend	trans	-96.9	162.6	-177.2	-62.9	159.4	0	0	0	110.5	L96 W106 H112	L96-L108 HydrophobicContact CB-CD1 3.99Å; L96-L108 HydrophobicContact CD1-CD1 3.83Å; L96-L108 HydrophobicContact CD2-CD1 3.6Å; L96-L108 HydrophobicContact CG-CD1 3.96Å; W106-L108 VanDerWaalsContact C-N 3.28Å; W106-L108 HydrophobicContact CH2-CD1 4.39Å; W106-L108 HydrophobicContact CZ2-CB 4.11Å; W106-L108 HydrophobicContact CZ2-CD1 4.06Å; W106-L108 PolarHBondContact NE1-O 3.01Å; W106-L108 PolarHBondContact O-N 3.12Å; L108-H112 HydrophobicContact CB-CB 3.89Å; L108-H112 HydrophobicContact CD1-CB 4.49Å
109	G	93.4	Very high	95.4	Very high	44 Å²	44	60.7 Å²	60.7	45%	0.454	32%	0.318	S	S	.	.			trans	-62.6	165.2	176.2	0	0	0	0	0	113.6	W106 E111 H112 C113	W106-G109 PolarHBondContact NE1-O 3.26Å; G109-E111 PolarHBondContact O-N 2.58Å; G109-H112 PolarHBondContact O-N 2.72Å; G109-H112 VanDerWaalsContact O-N 3.15Å; G109-C113 PolarHBondContact O-N 3.25Å
110	E	94.3	Very high	95.4	Very high	122 Å²	122	58.5 Å²	58.5	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-58.1	-34.8	177	-172	178.3	167.4	0	0	112.4	H112 C113 K114	E110-H112 VanDerWaalsContact C-N 3.34Å; E110-H112 PolarHBondContact O-N 3.18Å; E110-C113 VanDerWaalsContact O-CB 3.27Å; E110-C113 WeakPolarHBondContact O-CB 3.3Å; E110-C113 PolarHBondContact O-N 3.47Å; E110-K114 HydrophobicContact CG-CD 4.42Å; E110-K114 PolarHBondContact O-N 3.37Å; E110-K114 WeakPolarHBondContact OE1-CE 3.34Å; E110-K114 IonicContact OE1-NZ 3.34Å; E110-K114 PolarHBondContact OE1-NZ 3.37Å
111	E	94.8	Very high	95.4	Very high	149 Å²	149	59.2 Å²	59.2	70%	0.696	31%	0.312	S	S	*	.	H	α-helix	trans	-55.6	-47.5	175.2	-60.6	-55.1	144.6	0	0	111.9	G109 C113 A115	G109-E111 PolarHBondContact O-N 2.58Å; E111-C113 VanDerWaalsContact C-N 3.3Å; E111-C113 PolarHBondContact O-N 2.93Å; E111-A115 WeakPolarHBondContact O-CB 3.34Å; E111-A115 PolarHBondContact O-N 3.13Å
112	H	96.5	Very high	95.5	Very high	82 Å²	82	60 Å²	60	38%	0.38	32%	0.316	S	S	.	.	H	α-helix	trans	-68	-32.4	177.1	-75.6	-69	0	0	0	112	Y92 L96 W106 L108 G109 E110 S116	Y92-H112 AromaticContact CZ-ND1 3.97Å; Y92-H112 PolarHBondContact OH-ND1 2.79Å; L96-H112 HydrophobicContact CD1-CB 4.46Å; W106-H112 HydrophobicContact CZ2-CB 4.1Å; L108-H112 HydrophobicContact CB-CB 3.89Å; L108-H112 HydrophobicContact CD1-CB 4.49Å; G109-H112 PolarHBondContact O-N 2.72Å; G109-H112 VanDerWaalsContact O-N 3.15Å; E110-H112 VanDerWaalsContact C-N 3.34Å; E110-H112 PolarHBondContact O-N 3.18Å; H112-S116 WeakPolarHBondContact O-CB 3.35Å; H112-S116 PolarHBondContact O-N 3.07Å
113	C	97.3	Very high	95.7	Very high	10 Å²	10	53 Å²	53	7%	0.068	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-55.4	177.6	-173.9	0	0	0	0	110.9	W106 G109 E110 E111 A115 S116 A117 C190	W106-C113 HydrophobicContact CD2-CB 4.48Å; W106-C113 VanDerWaalsContact CZ2-CA 3.46Å; W106-C113 HydrophobicContact CZ2-CB 4.08Å; G109-C113 PolarHBondContact O-N 3.25Å; E110-C113 VanDerWaalsContact O-CB 3.27Å; E110-C113 WeakPolarHBondContact O-CB 3.3Å; E110-C113 PolarHBondContact O-N 3.47Å; E111-C113 VanDerWaalsContact C-N 3.3Å; E111-C113 PolarHBondContact O-N 2.93Å; C113-A115 PolarHBondContact O-N 2.9Å; C113-S116 PolarHBondContact O-N 3.38Å; C113-A117 PolarHBondContact O-N 3.47Å; C113-C190 WeakPolarHBondContact CA-SG 3.34Å; C113-C190 HydrophobicContact CB-CB 3.94Å; C113-C190 WeakPolarHBondContact CB-SG 3.31Å; C113-C190 WeakPolarHBondContact O-CB 3.44Å; C113-C190 WeakPolarHBondContact SG-CB 3.26Å; C113-C190 CovalentContact SG-SG 2.02Å; C113-C190 PolarHBondContact SG-SG 2.89Å
114	K	96.3	Very high	95.8	Very high	76 Å²	76	46.3 Å²	46.3	33%	0.33	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-41.3	179.3	-68.2	-180	-176.8	167.8	0	111.6	E110 A117 F118 L181	E110-K114 HydrophobicContact CG-CD 4.42Å; E110-K114 PolarHBondContact O-N 3.37Å; E110-K114 WeakPolarHBondContact OE1-CE 3.34Å; E110-K114 IonicContact OE1-NZ 3.34Å; E110-K114 PolarHBondContact OE1-NZ 3.37Å; K114-A117 PolarHBondContact O-N 3.24Å; K114-F118 VanDerWaalsContact O-CB 3.3Å; K114-F118 WeakPolarHBondContact O-CB 3.4Å; K114-F118 PolarHBondContact O-N 3.31Å; K114-L181 HydrophobicContact CG-CB 4.49Å
115	A	97.4	Very high	95.9	Very high	37 Å²	37	42.3 Å²	42.3	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-43.4	176.2	0	0	0	0	0	112.3	Y92 E111 C113 F118 V119	Y92-A115 HydrophobicContact CE1-CB 4.18Å; E111-A115 WeakPolarHBondContact O-CB 3.34Å; E111-A115 PolarHBondContact O-N 3.13Å; C113-A115 PolarHBondContact O-N 2.9Å; A115-F118 PolarHBondContact O-N 3.42Å; A115-V119 VanDerWaalsContact O-CG2 3.31Å; A115-V119 WeakPolarHBondContact O-CG2 3.46Å; A115-V119 PolarHBondContact O-N 2.92Å
116	S	97.9	Very high	96.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-47.4	177.2	-179	0	0	0	0	111.2	P93 H112 C113 F118 V119 M120	P93-S116 WeakPolarHBondContact CA-OG 3.39Å; P93-S116 WeakPolarHBondContact CB-OG 3.39Å; H112-S116 WeakPolarHBondContact O-CB 3.35Å; H112-S116 PolarHBondContact O-N 3.07Å; C113-S116 PolarHBondContact O-N 3.38Å; S116-F118 VanDerWaalsContact C-N 3.34Å; S116-F118 PolarHBondContact O-N 3.19Å; S116-V119 PolarHBondContact O-N 3.3Å; S116-M120 WeakPolarHBondContact O-CB 3.42Å; S116-M120 PolarHBondContact O-N 3.07Å
117	A	97.9	Very high	96.3	Very high	5 Å²	5	39.5 Å²	39.5	4%	0.041	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-40.3	177.2	0	0	0	0	0	112.1	C113 K114 M120 G121 L181 C190	C113-A117 PolarHBondContact O-N 3.47Å; K114-A117 PolarHBondContact O-N 3.24Å; A117-M120 WeakPolarHBondContact O-CB 3.43Å; A117-M120 PolarHBondContact O-N 3.49Å; A117-G121 PolarHBondContact O-N 3.01Å; A117-L181 HydrophobicContact CB-CB 3.96Å; A117-L181 HydrophobicContact CB-CD1 4.35Å; A117-L181 HydrophobicContact CB-CD2 3.97Å; A117-L181 HydrophobicContact CB-CG 4.28Å; A117-C190 HydrophobicContact CB-CB 4.29Å
118	F	97.9	Very high	96.6	Very high	42 Å²	42	36.9 Å²	36.9	18%	0.184	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-44.7	176.9	-178.3	-102	0	0	0	112.6	K114 A115 S116 M120 G121 L122 L172 F176 L181	K114-F118 VanDerWaalsContact O-CB 3.3Å; K114-F118 WeakPolarHBondContact O-CB 3.4Å; K114-F118 PolarHBondContact O-N 3.31Å; A115-F118 PolarHBondContact O-N 3.42Å; S116-F118 VanDerWaalsContact C-N 3.34Å; S116-F118 PolarHBondContact O-N 3.19Å; F118-M120 VanDerWaalsContact C-N 3.3Å; F118-M120 PolarHBondContact O-N 3.34Å; F118-G121 PolarHBondContact O-N 3.27Å; F118-G121 VanDerWaalsContact O-N 3.16Å; F118-L122 HydrophobicContact CD1-CD1 3.86Å; F118-L122 HydrophobicContact CD1-CG 4.23Å; F118-L122 HydrophobicContact CE1-CD1 3.47Å; F118-L122 VanDerWaalsContact CE1-CD1 3.47Å; F118-L122 HydrophobicContact CE1-CD2 4.3Å; F118-L122 HydrophobicContact CE1-CG 3.88Å; F118-L122 HydrophobicContact CZ-CD1 4.2Å; F118-L122 HydrophobicContact CZ-CD2 4.21Å; F118-L122 HydrophobicContact CZ-CG 4.17Å; F118-L122 PolarHBondContact O-N 3.29Å; F118-L172 HydrophobicContact CD2-CB 4.09Å; F118-L172 HydrophobicContact CE2-CB 3.6Å; F118-L172 HydrophobicContact CE2-CD1 4.14Å; F118-L172 HydrophobicContact CE2-CG 4.42Å; F118-F176 HydrophobicContact CB-CZ 4.46Å; F118-F176 AromaticContact CD2-CE2 3.66Å; F118-F176 HydrophobicContact CD2-CE2 3.66Å; F118-F176 AromaticContact CD2-CZ 3.62Å; F118-F176 HydrophobicContact CD2-CZ 3.62Å; F118-F176 AromaticContact CE2-CE2 3.68Å; F118-F176 HydrophobicContact CE2-CE2 3.68Å; F118-F176 HydrophobicContact CE2-CZ 4.03Å; F118-F176 HydrophobicContact CG-CZ 4.09Å; F118-L181 HydrophobicContact CB-CD1 4.32Å
119	V	98.2	Very high	96.9	Very high	24 Å²	24	35.1 Å²	35.1	15%	0.145	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-39.3	176.2	170.4	0	0	0	0	111.2	V88 Y92 P93 A115 S116 L122 S123	V88-V119 HydrophobicContact CB-CG1 4.41Å; V88-V119 HydrophobicContact CG1-CG1 3.99Å; V88-V119 HydrophobicContact CG2-CG1 3.75Å; Y92-V119 HydrophobicContact CD1-CB 4.27Å; Y92-V119 HydrophobicContact CD1-CG1 4.42Å; Y92-V119 HydrophobicContact CD1-CG2 4.02Å; Y92-V119 HydrophobicContact CE1-CG2 4.37Å; P93-V119 HydrophobicContact CG-CB 3.97Å; P93-V119 HydrophobicContact CG-CG1 3.68Å; A115-V119 VanDerWaalsContact O-CG2 3.31Å; A115-V119 WeakPolarHBondContact O-CG2 3.46Å; A115-V119 PolarHBondContact O-N 2.92Å; S116-V119 PolarHBondContact O-N 3.3Å; V119-L122 PolarHBondContact O-N 3.19Å; V119-S123 PolarHBondContact O-N 2.96Å; V119-S123 VanDerWaalsContact O-N 3.08Å
120	M	97.6	Very high	97	Very high	13 Å²	13	33 Å²	33	6%	0.064	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-47.5	172.3	-161.6	-171.6	-34.6	0	0	110.9	I97 S116 A117 F118 L122 S123 V124 S189 C190 Y298	I97-M120 HydrophobicContact CD1-CE 4.49Å; S116-M120 WeakPolarHBondContact O-CB 3.42Å; S116-M120 PolarHBondContact O-N 3.07Å; A117-M120 WeakPolarHBondContact O-CB 3.43Å; A117-M120 PolarHBondContact O-N 3.49Å; F118-M120 VanDerWaalsContact C-N 3.3Å; F118-M120 PolarHBondContact O-N 3.34Å; M120-L122 VanDerWaalsContact C-N 3.35Å; M120-L122 PolarHBondContact O-N 3.32Å; M120-S123 WeakPolarHBondContact O-CB 3.05Å; M120-S123 PolarHBondContact O-N 2.91Å; M120-V124 VanDerWaalsContact O-CG2 3.25Å; M120-V124 WeakPolarHBondContact O-CG2 3.43Å; M120-V124 PolarHBondContact O-N 3.49Å; M120-S189 WeakPolarHBondContact CE-OG 3.34Å; M120-C190 WeakPolarHBondContact CE-O 3.45Å; M120-Y298 HydrophobicContact SD-CE1 3.8Å
121	G	97.1	Very high	97.1	Very high	16 Å²	16	27.6 Å²	27.6	17%	0.165	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-42.6	175.1	0	0	0	0	0	113.8	A117 F118 S123 V124 I125	A117-G121 PolarHBondContact O-N 3.01Å; F118-G121 PolarHBondContact O-N 3.27Å; F118-G121 VanDerWaalsContact O-N 3.16Å; G121-S123 VanDerWaalsContact C-N 3.34Å; G121-S123 PolarHBondContact O-N 3.16Å; G121-V124 PolarHBondContact O-N 2.86Å; G121-I125 WeakPolarHBondContact O-CB 3.48Å; G121-I125 PolarHBondContact O-N 3.02Å
122	L	97.6	Very high	97.2	Very high	31 Å²	31	21.4 Å²	21.4	16%	0.162	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-45.2	175.6	-78.4	173.8	0	0	0	111.7	F118 V119 M120 G126 T168 V169 L172	F118-L122 HydrophobicContact CD1-CD1 3.86Å; F118-L122 HydrophobicContact CD1-CG 4.23Å; F118-L122 HydrophobicContact CE1-CD1 3.47Å; F118-L122 VanDerWaalsContact CE1-CD1 3.47Å; F118-L122 HydrophobicContact CE1-CD2 4.3Å; F118-L122 HydrophobicContact CE1-CG 3.88Å; F118-L122 HydrophobicContact CZ-CD1 4.2Å; F118-L122 HydrophobicContact CZ-CD2 4.21Å; F118-L122 HydrophobicContact CZ-CG 4.17Å; F118-L122 PolarHBondContact O-N 3.29Å; V119-L122 PolarHBondContact O-N 3.19Å; M120-L122 VanDerWaalsContact C-N 3.35Å; M120-L122 PolarHBondContact O-N 3.32Å; L122-G126 VanDerWaalsContact O-CA 3.27Å; L122-G126 WeakPolarHBondContact O-CA 3.49Å; L122-G126 PolarHBondContact O-N 3.06Å; L122-T168 HydrophobicContact CD2-CG2 3.98Å; L122-V169 HydrophobicContact CD2-CG2 3.85Å; L122-L172 HydrophobicContact CB-CD1 4.25Å; L122-L172 HydrophobicContact CD2-CD1 3.53Å; L122-L172 HydrophobicContact CG-CD1 3.73Å
123	S	97.6	Very high	97.2	Very high	7 Å²	7	18.4 Å²	18.4	5%	0.049	11%	0.108	C	C	.	.	H	α-helix	trans	-63.4	-51.7	177.6	175.3	0	0	0	0	111.4	A85 V89 V119 M120 G121 S127	A85-S123 WeakPolarHBondContact O-CB 3.32Å; A85-S123 PolarHBondContact O-OG 2.99Å; V89-S123 WeakPolarHBondContact CG1-OG 3.41Å; V119-S123 PolarHBondContact O-N 2.96Å; V119-S123 VanDerWaalsContact O-N 3.08Å; M120-S123 WeakPolarHBondContact O-CB 3.05Å; M120-S123 PolarHBondContact O-N 2.91Å; G121-S123 VanDerWaalsContact C-N 3.34Å; G121-S123 PolarHBondContact O-N 3.16Å; S123-S127 WeakPolarHBondContact O-CB 3.31Å; S123-S127 PolarHBondContact O-N 3.33Å; S123-S127 PolarHBondContact O-OG 2.69Å
124	V	96.8	Very high	97	Very high	31 Å²	31	18.2 Å²	18.2	19%	0.188	11%	0.106	C	C	.	.	H	α-helix	trans	-64.7	-54.7	-174.8	178.4	0	0	0	0	111.9	M120 G121 S127 V128 W264	M120-V124 VanDerWaalsContact O-CG2 3.25Å; M120-V124 WeakPolarHBondContact O-CG2 3.43Å; M120-V124 PolarHBondContact O-N 3.49Å; G121-V124 PolarHBondContact O-N 2.86Å; V124-S127 PolarHBondContact O-N 3.06Å; V124-V128 WeakPolarHBondContact O-CG2 3.45Å; V124-V128 PolarHBondContact O-N 2.78Å; V124-V128 VanDerWaalsContact O-N 3.14Å; V124-W264 HydrophobicContact CB-CH2 3.94Å; V124-W264 HydrophobicContact CB-CZ2 4.16Å; V124-W264 HydrophobicContact CB-CZ3 4.39Å; V124-W264 HydrophobicContact CG1-CD2 4.15Å; V124-W264 HydrophobicContact CG1-CE3 3.88Å; V124-W264 HydrophobicContact CG1-CH2 3.49Å; V124-W264 VanDerWaalsContact CG1-CH2 3.49Å; V124-W264 HydrophobicContact CG1-CZ2 3.73Å; V124-W264 HydrophobicContact CG1-CZ3 3.53Å; V124-W264 HydrophobicContact CG2-CH2 3.1Å; V124-W264 HydrophobicContact CG2-CZ2 3.43Å; V124-W264 VanDerWaalsContact CG2-CZ2 3.43Å; V124-W264 HydrophobicContact CG2-CZ3 3.92Å
125	I	96.8	Very high	96.9	Very high	14 Å²	14	14.6 Å²	14.6	7%	0.072	9%	0.09	C	C	.	.	H	α-helix	trans	-68.5	-40.1	-177.7	-62.7	177.9	0	0	0	109.9	G121 S127 V128 F129 T168 A171 L172	G121-I125 WeakPolarHBondContact O-CB 3.48Å; G121-I125 PolarHBondContact O-N 3.02Å; I125-S127 VanDerWaalsContact C-N 3.31Å; I125-S127 PolarHBondContact O-N 3.09Å; I125-V128 PolarHBondContact O-N 3.24Å; I125-F129 HydrophobicContact CG2-CD2 3.98Å; I125-F129 HydrophobicContact CG2-CE2 3.6Å; I125-F129 HydrophobicContact CG2-CZ 4.1Å; I125-F129 PolarHBondContact O-N 3.43Å; I125-F129 VanDerWaalsContact O-N 3.09Å; I125-T168 HydrophobicContact CB-CG2 3.94Å; I125-T168 HydrophobicContact CG2-CG2 3.95Å; I125-A171 HydrophobicContact CD1-CB 4.42Å; I125-A171 HydrophobicContact CG2-CB 4.26Å; I125-L172 HydrophobicContact CD1-CD2 3.78Å; I125-L172 HydrophobicContact CD1-CG 3.98Å
126	G	97.4	Very high	96.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.3	-40.7	175.2	0	0	0	0	0	112	L122 F129 N130 T168	L122-G126 VanDerWaalsContact O-CA 3.27Å; L122-G126 WeakPolarHBondContact O-CA 3.49Å; L122-G126 PolarHBondContact O-N 3.06Å; G126-F129 PolarHBondContact O-N 3.31Å; G126-N130 WeakPolarHBondContact O-CB 3.36Å; G126-N130 PolarHBondContact O-N 2.97Å; G126-N130 PolarHBondContact O-ND2 3.11Å; G126-T168 WeakPolarHBondContact CA-OG1 3.35Å
127	S	97.3	Very high	96.5	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.014	10%	0.096	C	C	.	.	H	α-helix	trans	-63.6	-44.1	176.6	-74.8	0	0	0	0	112.1	L82 S123 V124 I125 F129 N130 I131	L82-S127 VanDerWaalsContact CD1-OG 3.28Å; L82-S127 WeakPolarHBondContact CD1-OG 3.5Å; S123-S127 WeakPolarHBondContact O-CB 3.31Å; S123-S127 PolarHBondContact O-N 3.33Å; S123-S127 PolarHBondContact O-OG 2.69Å; V124-S127 PolarHBondContact O-N 3.06Å; I125-S127 VanDerWaalsContact C-N 3.31Å; I125-S127 PolarHBondContact O-N 3.09Å; S127-F129 PolarHBondContact O-N 3.4Å; S127-N130 PolarHBondContact O-N 3.39Å; S127-I131 WeakPolarHBondContact O-CB 3.1Å; S127-I131 VanDerWaalsContact O-CG1 3.26Å; S127-I131 WeakPolarHBondContact O-CG1 3.49Å; S127-I131 PolarHBondContact O-N 2.94Å
128	V	96.8	Very high	96.2	Very high	10 Å²	10	17.9 Å²	17.9	6%	0.061	10%	0.099	C	C	.	.	H	α-helix	trans	-58	-48.3	175	179.2	0	0	0	0	111.6	V124 I125 I131 T132 H208 P212 F260	V124-V128 WeakPolarHBondContact O-CG2 3.45Å; V124-V128 PolarHBondContact O-N 2.78Å; V124-V128 VanDerWaalsContact O-N 3.14Å; I125-V128 PolarHBondContact O-N 3.24Å; V128-I131 PolarHBondContact O-N 3.22Å; V128-T132 WeakPolarHBondContact O-CB 3.19Å; V128-T132 PolarHBondContact O-N 2.99Å; V128-T132 PolarHBondContact O-OG1 3.37Å; V128-H208 WeakPolarHBondContact CG1-O 3.42Å; V128-P212 HydrophobicContact CG1-CB 3.28Å; V128-P212 HydrophobicContact CG1-CG 3.53Å; V128-F260 HydrophobicContact CB-CZ 4.36Å; V128-F260 HydrophobicContact CG2-CE1 3.52Å; V128-F260 HydrophobicContact CG2-CE2 4.17Å; V128-F260 HydrophobicContact CG2-CZ 3.19Å
129	F	97.3	Very high	95.9	Very high	23 Å²	23	17.6 Å²	17.6	10%	0.101	10%	0.097	C	C	.	.	H	α-helix	trans	-68.5	-36.2	-179	-70.2	-22.8	0	0	0	112.4	I125 G126 S127 T132 A133 V164 L167 H208	I125-F129 HydrophobicContact CG2-CD2 3.98Å; I125-F129 HydrophobicContact CG2-CE2 3.6Å; I125-F129 HydrophobicContact CG2-CZ 4.1Å; I125-F129 PolarHBondContact O-N 3.43Å; I125-F129 VanDerWaalsContact O-N 3.09Å; G126-F129 PolarHBondContact O-N 3.31Å; S127-F129 PolarHBondContact O-N 3.4Å; F129-T132 PolarHBondContact O-N 2.83Å; F129-A133 WeakPolarHBondContact O-CB 3.16Å; F129-A133 PolarHBondContact O-N 3.49Å; F129-V164 HydrophobicContact CB-CB 4.47Å; F129-V164 HydrophobicContact CB-CG1 3.67Å; F129-V164 HydrophobicContact CB-CG2 4.29Å; F129-L167 HydrophobicContact CD2-CB 4.38Å; F129-L167 HydrophobicContact CD2-CD2 3.97Å; F129-L167 HydrophobicContact CD2-CG 4.15Å; F129-L167 HydrophobicContact CE1-CD2 4.17Å; F129-L167 HydrophobicContact CE2-CB 4.12Å; F129-L167 HydrophobicContact CE2-CD2 3.57Å; F129-L167 HydrophobicContact CE2-CG 3.51Å; F129-L167 HydrophobicContact CG-CD2 4.45Å; F129-L167 HydrophobicContact CZ-CD2 3.65Å; F129-L167 HydrophobicContact CZ-CG 3.91Å; F129-H208 AromaticContact CZ-CD2 3.51Å
130	N	96.7	Very high	95.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.9	-46	171.4	-83.8	-75	0	0	0	111.6	S81 L82 G126 S127 T132 A133 I134	S81-N130 VanDerWaalsContact CB-OD1 3.22Å; S81-N130 WeakPolarHBondContact CB-OD1 3.27Å; S81-N130 PolarHBondContact OG-ND2 3.29Å; S81-N130 PolarHBondContact OG-OD1 3.04Å; L82-N130 HydrophobicContact CB-CB 4.27Å; L82-N130 HydrophobicContact CD1-CB 4.04Å; G126-N130 WeakPolarHBondContact O-CB 3.36Å; G126-N130 PolarHBondContact O-N 2.97Å; G126-N130 PolarHBondContact O-ND2 3.11Å; S127-N130 PolarHBondContact O-N 3.39Å; N130-T132 VanDerWaalsContact C-N 3.28Å; N130-T132 PolarHBondContact O-N 3.37Å; N130-A133 PolarHBondContact O-N 2.85Å; N130-I134 WeakPolarHBondContact O-CB 3.35Å; N130-I134 WeakPolarHBondContact O-CD1 3.42Å; N130-I134 WeakPolarHBondContact O-CG1 3.43Å; N130-I134 PolarHBondContact O-N 3.19Å
131	I	95.8	Very high	95.2	Very high	7 Å²	7	20.4 Å²	20.4	4%	0.036	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-41.2	176.6	-70	167.2	0	0	0	110.6	L82 S127 V128 I134 A135 F257 F260	L82-I131 HydrophobicContact CD1-CG1 4.4Å; L82-I131 HydrophobicContact CD2-CG1 4.29Å; S127-I131 WeakPolarHBondContact O-CB 3.1Å; S127-I131 VanDerWaalsContact O-CG1 3.26Å; S127-I131 WeakPolarHBondContact O-CG1 3.49Å; S127-I131 PolarHBondContact O-N 2.94Å; V128-I131 PolarHBondContact O-N 3.22Å; I131-I134 WeakPolarHBondContact O-CB 3.29Å; I131-I134 PolarHBondContact O-N 3.21Å; I131-A135 PolarHBondContact O-N 3.38Å; I131-F257 HydrophobicContact CG2-CB 4.1Å; I131-F257 HydrophobicContact CG2-CD2 4.13Å; I131-F260 HydrophobicContact CD1-CB 3.79Å; I131-F260 HydrophobicContact CD1-CD1 4.26Å; I131-F260 HydrophobicContact CD1-CD2 3.52Å; I131-F260 HydrophobicContact CD1-CE2 4.24Å; I131-F260 HydrophobicContact CD1-CG 3.56Å
132	T	96.9	Very high	94.7	Very high	19 Å²	19	20.6 Å²	20.6	12%	0.117	11%	0.108	C	C	.	.	H	α-helix	trans	-64	-46.7	176.6	-54.2	0	0	0	0	111.6	V128 F129 N130 I134 A135 I136 V215 V216	V128-T132 WeakPolarHBondContact O-CB 3.19Å; V128-T132 PolarHBondContact O-N 2.99Å; V128-T132 PolarHBondContact O-OG1 3.37Å; F129-T132 PolarHBondContact O-N 2.83Å; N130-T132 VanDerWaalsContact C-N 3.28Å; N130-T132 PolarHBondContact O-N 3.37Å; T132-I134 VanDerWaalsContact C-N 3.31Å; T132-I134 PolarHBondContact O-N 2.87Å; T132-A135 PolarHBondContact O-N 3.31Å; T132-I136 HydrophobicContact CG2-CD1 4Å; T132-I136 WeakPolarHBondContact O-CG1 3.49Å; T132-I136 PolarHBondContact O-N 3.35Å; T132-V215 HydrophobicContact CG2-CG1 4.06Å; T132-V216 HydrophobicContact CG2-CG2 4.21Å
133	A	95.8	Very high	94.2	Very high	19 Å²	19	20.7 Å²	20.7	16%	0.157	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-39.2	176.3	0	0	0	0	0	112	F78 F129 N130 N137 V164	F78-A133 HydrophobicContact CD1-CB 4.01Å; F78-A133 HydrophobicContact CE1-CB 3.69Å; F78-A133 HydrophobicContact CZ-CB 4.11Å; F129-A133 WeakPolarHBondContact O-CB 3.16Å; F129-A133 PolarHBondContact O-N 3.49Å; N130-A133 PolarHBondContact O-N 2.85Å; A133-N137 WeakPolarHBondContact O-CB 3.24Å; A133-N137 PolarHBondContact O-N 2.95Å; A133-V164 HydrophobicContact CB-CG2 4.27Å
134	I	94.4	Very high	93.7	Very high	7 Å²	7	24.6 Å²	24.6	4%	0.036	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-49	173.3	-70.8	161.6	0	0	0	110.5	F78 L79 N130 I131 T132 N137 R138 M253	F78-I134 HydrophobicContact CB-CD1 3.9Å; F78-I134 HydrophobicContact CB-CG1 3.41Å; F78-I134 VanDerWaalsContact CB-CG1 3.41Å; F78-I134 HydrophobicContact CG-CG1 4.1Å; L79-I134 HydrophobicContact CD2-CD1 3.82Å; N130-I134 WeakPolarHBondContact O-CB 3.35Å; N130-I134 WeakPolarHBondContact O-CD1 3.42Å; N130-I134 WeakPolarHBondContact O-CG1 3.43Å; N130-I134 PolarHBondContact O-N 3.19Å; I131-I134 WeakPolarHBondContact O-CB 3.29Å; I131-I134 PolarHBondContact O-N 3.21Å; T132-I134 VanDerWaalsContact C-N 3.31Å; T132-I134 PolarHBondContact O-N 2.87Å; I134-N137 PolarHBondContact O-N 3.31Å; I134-R138 HydrophobicContact CG2-CG 4.45Å; I134-R138 WeakPolarHBondContact O-CG 3.23Å; I134-R138 PolarHBondContact O-N 3.22Å; I134-M253 HydrophobicContact CG2-CB 4.21Å; I134-M253 HydrophobicContact CG2-CE 3.54Å; I134-M253 HydrophobicContact CG2-CG 4Å; I134-M253 HydrophobicContact CG2-SD 3.43Å; I134-M253 WeakPolarHBondContact CG2-SD 3.2Å
135	A	94.8	Very high	93.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-46.3	-179	0	0	0	0	0	111.9	I131 T132 R138 Y139 V216 C219 Y220	I131-A135 PolarHBondContact O-N 3.38Å; T132-A135 PolarHBondContact O-N 3.31Å; A135-R138 PolarHBondContact O-N 2.98Å; A135-Y139 WeakPolarHBondContact O-CB 3.32Å; A135-Y139 PolarHBondContact O-N 3.18Å; A135-V216 HydrophobicContact CB-CB 4.24Å; A135-V216 HydrophobicContact CB-CG1 3.81Å; A135-V216 HydrophobicContact CB-CG2 3.91Å; A135-C219 HydrophobicContact CB-CB 4.21Å; A135-Y220 HydrophobicContact CB-CD2 4.37Å; A135-Y220 HydrophobicContact CB-CE2 3.78Å
136	I	94.3	Very high	92.8	Very high	74 Å²	74	31 Å²	31	38%	0.379	17%	0.17	S	C	.	.	H	α-helix	trans	-62.5	-46.9	176.4	-66.6	169.2	0	0	0	110.4	T132 R138 Y139 C140 V215	T132-I136 HydrophobicContact CG2-CD1 4Å; T132-I136 WeakPolarHBondContact O-CG1 3.49Å; T132-I136 PolarHBondContact O-N 3.35Å; I136-R138 VanDerWaalsContact C-N 3.29Å; I136-R138 PolarHBondContact O-N 3.45Å; I136-Y139 PolarHBondContact O-N 2.79Å; I136-C140 PolarHBondContact O-N 3.35Å; I136-C140 PolarHBondContact O-SG 2.96Å; I136-C140 VanDerWaalsContact O-SG 3.33Å; I136-V215 HydrophobicContact CD1-CG1 4.27Å; I136-V215 HydrophobicContact CG1-CG1 4.34Å
137	N	92.1	Very high	92.4	Very high	9 Å²	9	32.8 Å²	32.8	5%	0.048	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-41.1	178.3	176.4	76.1	0	0	0	111.7	F78 A133 I134 Y141 Y148	F78-N137 HydrophobicContact CE2-CB 4.35Å; A133-N137 WeakPolarHBondContact O-CB 3.24Å; A133-N137 PolarHBondContact O-N 2.95Å; I134-N137 PolarHBondContact O-N 3.31Å; N137-Y141 VanDerWaalsContact O-CB 3.26Å; N137-Y141 WeakPolarHBondContact O-CB 3.3Å; N137-Y141 PolarHBondContact O-N 2.98Å; N137-Y148 PolarHBondContact OD1-OH 3.47Å
138	R	91	Very high	91.9	Very high	27 Å²	27	34.1 Å²	34.1	10%	0.102	19%	0.19	C	C	.	.	H	α-helix	trans	-69.4	-40.6	176.3	-69.8	-59.1	179.9	-156.4	-0.4	112.7	I134 A135 I136 Y141 I142 I223 M253	I134-R138 HydrophobicContact CG2-CG 4.45Å; I134-R138 WeakPolarHBondContact O-CG 3.23Å; I134-R138 PolarHBondContact O-N 3.22Å; A135-R138 PolarHBondContact O-N 2.98Å; I136-R138 VanDerWaalsContact C-N 3.29Å; I136-R138 PolarHBondContact O-N 3.45Å; R138-Y141 PolarHBondContact O-N 3.44Å; R138-I142 WeakPolarHBondContact O-CB 3.36Å; R138-I142 WeakPolarHBondContact O-CG1 3.44Å; R138-I142 PolarHBondContact O-N 3.12Å; R138-I223 HydrophobicContact CB-CD1 4.38Å; R138-M253 HydrophobicContact CG-SD 3.64Å; R138-M253 PolarHBondContact NE-SD 3.3Å; R138-M253 VanDerWaalsContact NH2-CE 3.31Å
139	Y	91.8	Very high	91.4	Very high	37 Å²	37	39.8 Å²	39.8	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-50.3	174.7	168.1	-102.6	0	0	0	111.4	A135 I136 Y141 I142 C143 H144 C219 R222 I223	A135-Y139 WeakPolarHBondContact O-CB 3.32Å; A135-Y139 PolarHBondContact O-N 3.18Å; I136-Y139 PolarHBondContact O-N 2.79Å; Y139-Y141 PolarHBondContact O-N 3.41Å; Y139-I142 PolarHBondContact O-N 3.23Å; Y139-C143 HydrophobicContact CD2-CB 4.04Å; Y139-C143 HydrophobicContact CE2-CB 3.81Å; Y139-C143 VanDerWaalsContact O-CB 3.29Å; Y139-C143 WeakPolarHBondContact O-CB 3.34Å; Y139-C143 PolarHBondContact O-N 2.92Å; Y139-H144 AromaticContact CE1-CD2 3.74Å; Y139-H144 AromaticContact CE1-NE2 3.7Å; Y139-H144 AromaticContact CZ-CD2 3.84Å; Y139-H144 AromaticContact CZ-NE2 3.45Å; Y139-H144 PolarHBondContact OH-NE2 3.46Å; Y139-C219 HydrophobicContact CG-CB 4.38Å; Y139-R222 HydrophobicContact CD2-CB 4.03Å; Y139-R222 HydrophobicContact CE2-CB 3.64Å; Y139-R222 HydrophobicContact CE2-CG 4.14Å; Y139-I223 HydrophobicContact CD2-CG1 4.38Å
140	C	91.6	Very high	91.1	Very high	42 Å²	42	48.5 Å²	48.5	28%	0.284	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-41.1	177.7	-64.8	0	0	0	0	111.9	I136 H144 Y148	I136-C140 PolarHBondContact O-N 3.35Å; I136-C140 PolarHBondContact O-SG 2.96Å; I136-C140 VanDerWaalsContact O-SG 3.33Å; C140-H144 CarbonylContact O-C 3.51Å; C140-H144 WeakPolarHBondContact O-CA 3.45Å; C140-H144 WeakPolarHBondContact O-CB 3.32Å; C140-H144 PolarHBondContact O-N 3.45Å; C140-H144 VanDerWaalsContact O-N 3.13Å; C140-Y148 HydrophobicContact CB-CD2 3.84Å; C140-Y148 HydrophobicContact CB-CE2 4.41Å
141	Y	88.4	Confident	90.5	Very high	53 Å²	53	53.6 Å²	53.6	21%	0.208	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-42.6	178.2	-178.6	-106.7	0	0	0	113.1	N137 R138 Y139 S145 Y148 H149 R243	N137-Y141 VanDerWaalsContact O-CB 3.26Å; N137-Y141 WeakPolarHBondContact O-CB 3.3Å; N137-Y141 PolarHBondContact O-N 2.98Å; R138-Y141 PolarHBondContact O-N 3.44Å; Y139-Y141 PolarHBondContact O-N 3.41Å; Y141-S145 WeakPolarHBondContact O-CA 3.41Å; Y141-S145 WeakPolarHBondContact O-CB 3.23Å; Y141-Y148 AromaticContact CD2-CD1 3.7Å; Y141-Y148 HydrophobicContact CD2-CD1 3.7Å; Y141-Y148 AromaticContact CD2-CE1 3.63Å; Y141-Y148 HydrophobicContact CD2-CE1 3.63Å; Y141-Y148 HydrophobicContact CD2-CG 4.35Å; Y141-Y148 HydrophobicContact CE2-CD1 4.47Å; Y141-Y148 HydrophobicContact CE2-CE1 4.39Å; Y141-H149 AromaticContact CE2-NE2 3.81Å; Y141-R243 PolarHBondContact OH-NH2 2.91Å
142	I	87.5	Confident	90	Very high	20 Å²	20	55.6 Å²	55.6	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-87.2	-50.1	-173.5	-65.9	170.1	0	0	0	111.7	R138 Y139 I223 L226 L242 F250	R138-I142 WeakPolarHBondContact O-CB 3.36Å; R138-I142 WeakPolarHBondContact O-CG1 3.44Å; R138-I142 PolarHBondContact O-N 3.12Å; Y139-I142 PolarHBondContact O-N 3.23Å; I142-I223 HydrophobicContact CD1-CD1 4.36Å; I142-I223 HydrophobicContact CD1-CG2 3.92Å; I142-I223 HydrophobicContact CG2-CG2 4.04Å; I142-L226 HydrophobicContact CG2-CD2 3.9Å; I142-L242 HydrophobicContact CG2-CD1 4.49Å; I142-L242 HydrophobicContact CG2-CD2 3.98Å; I142-F250 HydrophobicContact CD1-CB 4.35Å; I142-F250 HydrophobicContact CD1-CD2 4.38Å
143	C	87.8	Confident	89.5	Confident	34 Å²	34	63.4 Å²	63.4	23%	0.23	31%	0.309	C	S	.	.	H	α-helix	trans	-82.1	-23.6	-174.3	-61.9	0	0	0	0	113.1	Y139	Y139-C143 HydrophobicContact CD2-CB 4.04Å; Y139-C143 HydrophobicContact CE2-CB 3.81Å; Y139-C143 VanDerWaalsContact O-CB 3.29Å; Y139-C143 WeakPolarHBondContact O-CB 3.34Å; Y139-C143 PolarHBondContact O-N 2.92Å
144	H	87.5	Confident	88.8	Confident	89 Å²	89	73.6 Å²	73.6	41%	0.412	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	40.5	-174.8	-59.5	-70.7	0	0	0	111.9	Y139 C140 V146 A147 Y148	Y139-H144 AromaticContact CE1-CD2 3.74Å; Y139-H144 AromaticContact CE1-NE2 3.7Å; Y139-H144 AromaticContact CZ-CD2 3.84Å; Y139-H144 AromaticContact CZ-NE2 3.45Å; Y139-H144 PolarHBondContact OH-NE2 3.46Å; C140-H144 CarbonylContact O-C 3.51Å; C140-H144 WeakPolarHBondContact O-CA 3.45Å; C140-H144 WeakPolarHBondContact O-CB 3.32Å; C140-H144 PolarHBondContact O-N 3.45Å; C140-H144 VanDerWaalsContact O-N 3.13Å; H144-V146 VanDerWaalsContact C-N 3.35Å; H144-V146 PolarHBondContact O-N 2.9Å; H144-A147 HydrophobicContact CB-CB 4.49Å; H144-A147 PolarHBondContact O-N 3.07Å; H144-A147 VanDerWaalsContact O-N 3.11Å; H144-Y148 WeakPolarHBondContact O-CB 3.49Å; H144-Y148 PolarHBondContact O-N 3.3Å
145	S	86	Confident	88.4	Confident	56 Å²	56	83.7 Å²	83.7	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-52.2	-44	-170.2	62.7	0	0	0	0	114.5	Y141 Y148 H149	Y141-S145 WeakPolarHBondContact O-CA 3.41Å; Y141-S145 WeakPolarHBondContact O-CB 3.23Å; S145-Y148 PolarHBondContact O-N 3.35Å; S145-H149 PolarHBondContact O-CD2 3.12Å; S145-H149 PolarHBondContact O-N 3.46Å
146	V	86.8	Confident	88.3	Confident	122 Å²	122	86.8 Å²	86.8	74%	0.739	40%	0.395	S	S	*	.	H	α-helix	trans	-63.6	-47.2	179.4	-179.6	0	0	0	0	111.2	H144 H149 R150	H144-V146 VanDerWaalsContact C-N 3.35Å; H144-V146 PolarHBondContact O-N 2.9Å; V146-H149 PolarHBondContact O-N 3.29Å; V146-R150 PolarHBondContact O-N 2.63Å
147	A	89.3	Confident	88.2	Confident	39 Å²	39	83.4 Å²	83.4	32%	0.322	38%	0.378	S	S	.	.	H	α-helix	trans	-67	-39	177.7	0	0	0	0	0	111.4	H144 R150 I151	H144-A147 HydrophobicContact CB-CB 4.49Å; H144-A147 PolarHBondContact O-N 3.07Å; H144-A147 VanDerWaalsContact O-N 3.11Å; A147-R150 PolarHBondContact O-N 3.25Å; A147-I151 HydrophobicContact CB-CD1 4.49Å; A147-I151 WeakPolarHBondContact O-CB 3.4Å; A147-I151 WeakPolarHBondContact O-CG1 3.28Å; A147-I151 PolarHBondContact O-N 3.44Å
148	Y	88.4	Confident	88.2	Confident	29 Å²	29	85.8 Å²	85.8	11%	0.114	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-49.1	176.4	-174.8	-87.5	0	0	0	111.4	N137 C140 Y141 H144 S145 R150 I151 Y152	N137-Y148 PolarHBondContact OD1-OH 3.47Å; C140-Y148 HydrophobicContact CB-CD2 3.84Å; C140-Y148 HydrophobicContact CB-CE2 4.41Å; Y141-Y148 AromaticContact CD2-CD1 3.7Å; Y141-Y148 HydrophobicContact CD2-CD1 3.7Å; Y141-Y148 AromaticContact CD2-CE1 3.63Å; Y141-Y148 HydrophobicContact CD2-CE1 3.63Å; Y141-Y148 HydrophobicContact CD2-CG 4.35Å; Y141-Y148 HydrophobicContact CE2-CD1 4.47Å; Y141-Y148 HydrophobicContact CE2-CE1 4.39Å; H144-Y148 WeakPolarHBondContact O-CB 3.49Å; H144-Y148 PolarHBondContact O-N 3.3Å; S145-Y148 PolarHBondContact O-N 3.35Å; Y148-R150 VanDerWaalsContact C-N 3.25Å; Y148-R150 PolarHBondContact O-N 3.29Å; Y148-I151 PolarHBondContact O-N 2.94Å; Y148-Y152 HydrophobicContact CD1-CG 4.48Å; Y148-Y152 HydrophobicContact CD2-CD2 4.14Å; Y148-Y152 HydrophobicContact CD2-CG 4.23Å; Y148-Y152 HydrophobicContact CE1-CD1 4.03Å; Y148-Y152 AromaticContact CE1-CG 3.89Å; Y148-Y152 HydrophobicContact CE1-CG 3.89Å; Y148-Y152 HydrophobicContact CE2-CD1 4.29Å; Y148-Y152 AromaticContact CE2-CD2 3.45Å; Y148-Y152 HydrophobicContact CE2-CD2 3.45Å; Y148-Y152 VanDerWaalsContact CE2-CD2 3.45Å; Y148-Y152 AromaticContact CE2-CE2 3.95Å; Y148-Y152 HydrophobicContact CE2-CE2 3.95Å; Y148-Y152 AromaticContact CE2-CG 3.63Å; Y148-Y152 HydrophobicContact CE2-CG 3.63Å; Y148-Y152 AromaticContact CZ-CD1 3.66Å; Y148-Y152 AromaticContact CZ-CD2 3.71Å; Y148-Y152 AromaticContact CZ-CG 3.44Å; Y148-Y152 VanDerWaalsContact CZ-CG 3.44Å; Y148-Y152 WeakPolarHBondContact O-CA 3.49Å; Y148-Y152 WeakPolarHBondContact O-CB 3.48Å; Y148-Y152 PolarHBondContact O-N 3.35Å; Y148-Y152 WeakPolarHBondContact OH-CD1 3.41Å; Y148-Y152 WeakPolarHBondContact OH-CE1 3.49Å
149	H	86.4	Confident	88.4	Confident	130 Å²	130	89.1 Å²	89.1	60%	0.602	41%	0.413	S	S	*	.	H	α-helix	trans	-67.3	-24.9	179.1	-78.6	-65.3	0	0	0	113.7	Y141 S145 V146	Y141-H149 AromaticContact CE2-NE2 3.81Å; S145-H149 PolarHBondContact O-CD2 3.12Å; S145-H149 PolarHBondContact O-N 3.46Å; V146-H149 PolarHBondContact O-N 3.29Å
150	R	89.5	Confident	88.6	Confident	205 Å²	205	90.8 Å²	90.8	77%	0.774	42%	0.422	S	S	*	.	H	α-helix	trans	-78.3	-38	175.5	-170.1	174.7	70.4	-178.3	2.9	113	V146 A147 Y148	V146-R150 PolarHBondContact O-N 2.63Å; A147-R150 PolarHBondContact O-N 3.25Å; Y148-R150 VanDerWaalsContact C-N 3.25Å; Y148-R150 PolarHBondContact O-N 3.29Å
151	I	85.1	Confident	88.8	Confident	108 Å²	108	90 Å²	90	55%	0.554	42%	0.415	S	S	*	.	H	α-helix	trans	-99.8	-40.2	-170.2	-61.3	168.7	0	0	0	111.7	A147 Y148 R153	A147-I151 HydrophobicContact CB-CD1 4.49Å; A147-I151 WeakPolarHBondContact O-CB 3.4Å; A147-I151 WeakPolarHBondContact O-CG1 3.28Å; A147-I151 PolarHBondContact O-N 3.44Å; Y148-I151 PolarHBondContact O-N 2.94Å; I151-R153 PolarHBondContact O-N 2.91Å
152	Y	84.9	Confident	89.2	Confident	49 Å²	49	91.3 Å²	91.3	19%	0.192	43%	0.431	C	S	.	.			trans	-77.9	106.9	-169.1	-160.4	-84.6	0	0	0	111.8	A74 Y148 H156 T157	A74-Y152 HydrophobicContact CB-CE1 3.51Å; A74-Y152 WeakPolarHBondContact CB-OH 3.2Å; Y148-Y152 HydrophobicContact CD1-CG 4.48Å; Y148-Y152 HydrophobicContact CD2-CD2 4.14Å; Y148-Y152 HydrophobicContact CD2-CG 4.23Å; Y148-Y152 HydrophobicContact CE1-CD1 4.03Å; Y148-Y152 AromaticContact CE1-CG 3.89Å; Y148-Y152 HydrophobicContact CE1-CG 3.89Å; Y148-Y152 HydrophobicContact CE2-CD1 4.29Å; Y148-Y152 AromaticContact CE2-CD2 3.45Å; Y148-Y152 HydrophobicContact CE2-CD2 3.45Å; Y148-Y152 VanDerWaalsContact CE2-CD2 3.45Å; Y148-Y152 AromaticContact CE2-CE2 3.95Å; Y148-Y152 HydrophobicContact CE2-CE2 3.95Å; Y148-Y152 AromaticContact CE2-CG 3.63Å; Y148-Y152 HydrophobicContact CE2-CG 3.63Å; Y148-Y152 AromaticContact CZ-CD1 3.66Å; Y148-Y152 AromaticContact CZ-CD2 3.71Å; Y148-Y152 AromaticContact CZ-CG 3.44Å; Y148-Y152 VanDerWaalsContact CZ-CG 3.44Å; Y148-Y152 WeakPolarHBondContact O-CA 3.49Å; Y148-Y152 WeakPolarHBondContact O-CB 3.48Å; Y148-Y152 PolarHBondContact O-N 3.35Å; Y148-Y152 WeakPolarHBondContact OH-CD1 3.41Å; Y148-Y152 WeakPolarHBondContact OH-CE1 3.49Å; Y152-H156 HydrophobicContact CE2-CB 4.37Å; Y152-T157 WeakPolarHBondContact CE1-OG1 3.49Å; Y152-T157 WeakPolarHBondContact OH-CB 3.47Å; Y152-T157 PolarHBondContact OH-OG1 3.43Å
153	R	85.6	Confident	89.7	Confident	182 Å²	182	94.7 Å²	94.7	69%	0.687	45%	0.449	S	S	*	.			trans	-97.8	160.4	172.8	-54.3	175.9	174	-177	-2.5	111.9	I151 W155 H156	I151-R153 PolarHBondContact O-N 2.91Å; R153-W155 PolarHBondContact O-N 3.38Å; R153-W155 VanDerWaalsContact O-N 3.13Å; R153-H156 PolarHBondContact N-CD2 3.01Å; R153-H156 VanDerWaalsContact N-CD2 3.31Å; R153-H156 PolarHBondContact O-CD2 3.45Å; R153-H156 PolarHBondContact O-N 3.32Å; R153-H156 VanDerWaalsContact O-N 3.11Å
154	R	81.4	Confident	90.1	Very high	233 Å²	233	93.8 Å²	93.8	88%	0.879	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.6	-178.4	-64.5	-176.2	-178.4	169.8	2.2	114.3	P158	R154-P158 VanDerWaalsContact O-CD 3.26Å; R154-P158 WeakPolarHBondContact O-CD 3.3Å
155	W	87.4	Confident	90.6	Very high	219 Å²	219	92.9 Å²	92.9	83%	0.83	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-16.9	-179.8	-66.9	93.7	0	0	0	114.2	R153 P158 L159	R153-W155 PolarHBondContact O-N 3.38Å; R153-W155 VanDerWaalsContact O-N 3.13Å; W155-P158 VanDerWaalsContact O-CD 3.32Å; W155-P158 WeakPolarHBondContact O-CD 3.38Å; W155-P158 WeakPolarHBondContact O-CG 3.48Å; W155-L159 WeakPolarHBondContact O-CB 3.28Å; W155-L159 PolarHBondContact O-N 3.35Å
156	H	91.4	Very high	91.2	Very high	65 Å²	65	95.2 Å²	95.2	30%	0.301	44%	0.443	S	S	.	.	H	α-helix	trans	-70.4	-34.1	179.1	-68.5	-88	0	0	0	112.1	Y152 R153 L159 H160	Y152-H156 HydrophobicContact CE2-CB 4.37Å; R153-H156 PolarHBondContact N-CD2 3.01Å; R153-H156 VanDerWaalsContact N-CD2 3.31Å; R153-H156 PolarHBondContact O-CD2 3.45Å; R153-H156 PolarHBondContact O-N 3.32Å; R153-H156 VanDerWaalsContact O-N 3.11Å; H156-L159 PolarHBondContact O-N 3.02Å; H156-H160 WeakPolarHBondContact O-CB 3.26Å; H156-H160 PolarHBondContact O-N 2.98Å; H156-H160 PolarHBondContact O-ND1 2.98Å
157	T	91.7	Very high	91.7	Very high	4 Å²	4	93.7 Å²	93.7	3%	0.025	43%	0.43	C	S	.	.	H	α-helix	trans	-60	-55.4	178.7	-40.1	0	0	0	0	112.7	A74 L77 F78 Y152 L159 H160 I161	A74-T157 HydrophobicContact CB-CG2 4.1Å; A74-T157 WeakPolarHBondContact CB-OG1 3.32Å; A74-T157 VanDerWaalsContact O-CG2 3.3Å; A74-T157 WeakPolarHBondContact O-CG2 3.26Å; L77-T157 HydrophobicContact CB-CG2 4Å; L77-T157 HydrophobicContact CD2-CG2 3.91Å; L77-T157 HydrophobicContact CG-CG2 4.48Å; F78-T157 HydrophobicContact CD2-CG2 4.16Å; F78-T157 HydrophobicContact CE2-CG2 3.74Å; F78-T157 HydrophobicContact CZ-CG2 4.06Å; Y152-T157 WeakPolarHBondContact CE1-OG1 3.49Å; Y152-T157 WeakPolarHBondContact OH-CB 3.47Å; Y152-T157 PolarHBondContact OH-OG1 3.43Å; T157-L159 VanDerWaalsContact C-N 3.27Å; T157-L159 PolarHBondContact O-N 3.47Å; T157-H160 PolarHBondContact O-N 3.33Å; T157-I161 HydrophobicContact CG2-CD1 4.23Å; T157-I161 WeakPolarHBondContact O-CG1 3.45Å; T157-I161 PolarHBondContact O-N 3.06Å
158	P	93.3	Very high	92.1	Very high	59 Å²	59	91.9 Å²	91.9	38%	0.383	42%	0.415	S	S	.	.	H	α-helix	trans	-63.4	-33.2	177.9	24.7	-34	0	0	0	112.4	R154 W155 I161 C162	R154-P158 VanDerWaalsContact O-CD 3.26Å; R154-P158 WeakPolarHBondContact O-CD 3.3Å; W155-P158 VanDerWaalsContact O-CD 3.32Å; W155-P158 WeakPolarHBondContact O-CD 3.38Å; W155-P158 WeakPolarHBondContact O-CG 3.48Å; P158-I161 PolarHBondContact O-N 3.4Å; P158-C162 WeakPolarHBondContact O-CB 3.13Å; P158-C162 PolarHBondContact O-N 3.27Å
159	L	95.3	Very high	92.5	Very high	96 Å²	96	93.1 Å²	93.1	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-48.2	172.9	178.2	65.7	0	0	0	111.9	W155 H156 T157 I161 C162 L163	W155-L159 WeakPolarHBondContact O-CB 3.28Å; W155-L159 PolarHBondContact O-N 3.35Å; H156-L159 PolarHBondContact O-N 3.02Å; T157-L159 VanDerWaalsContact C-N 3.27Å; T157-L159 PolarHBondContact O-N 3.47Å; L159-I161 VanDerWaalsContact C-N 3.32Å; L159-I161 PolarHBondContact O-N 3.07Å; L159-C162 WeakPolarHBondContact O-CB 3.49Å; L159-C162 PolarHBondContact O-N 3.4Å; L159-L163 HydrophobicContact CG-CD1 4.28Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 2.95Å
160	H	94.9	Very high	93	Very high	73 Å²	73	90.6 Å²	90.6	34%	0.338	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-37.3	177.2	-64.8	150	0	0	0	112.2	F78 H156 T157 L163 V164	F78-H160 HydrophobicContact CE1-CB 4.14Å; F78-H160 HydrophobicContact CZ-CB 3.9Å; H156-H160 WeakPolarHBondContact O-CB 3.26Å; H156-H160 PolarHBondContact O-N 2.98Å; H156-H160 PolarHBondContact O-ND1 2.98Å; T157-H160 PolarHBondContact O-N 3.33Å; H160-L163 PolarHBondContact O-N 3.5Å; H160-V164 WeakPolarHBondContact O-CG2 3.41Å; H160-V164 PolarHBondContact O-N 3.25Å
161	I	96.8	Very high	93.2	Very high	26 Å²	26	81.4 Å²	81.4	13%	0.133	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-46.4	174.1	-69.2	168.7	0	0	0	110.1	L77 F78 T157 P158 L159 L163 V164 W165	L77-I161 HydrophobicContact CB-CD1 4.23Å; L77-I161 HydrophobicContact CD2-CD1 3.82Å; L77-I161 HydrophobicContact CG-CD1 3.67Å; F78-I161 HydrophobicContact CD1-CD1 4.26Å; F78-I161 HydrophobicContact CD1-CG1 3.62Å; F78-I161 HydrophobicContact CE1-CD1 4.46Å; F78-I161 HydrophobicContact CE1-CG1 3.57Å; F78-I161 HydrophobicContact CG-CG1 4.49Å; F78-I161 HydrophobicContact CZ-CG1 4.43Å; T157-I161 HydrophobicContact CG2-CD1 4.23Å; T157-I161 WeakPolarHBondContact O-CG1 3.45Å; T157-I161 PolarHBondContact O-N 3.06Å; P158-I161 PolarHBondContact O-N 3.4Å; L159-I161 VanDerWaalsContact C-N 3.32Å; L159-I161 PolarHBondContact O-N 3.07Å; I161-L163 VanDerWaalsContact C-N 3.32Å; I161-L163 PolarHBondContact O-N 3.34Å; I161-V164 WeakPolarHBondContact O-CB 3.28Å; I161-V164 PolarHBondContact O-N 2.75Å; I161-W165 PolarHBondContact O-N 3.09Å; I161-W165 VanDerWaalsContact O-N 3.11Å
162	C	97.4	Very high	93.7	Very high	80 Å²	80	76.5 Å²	76.5	54%	0.541	36%	0.362	S	S	.	.	H	α-helix	trans	-57.9	-45	175.4	-174.6	0	0	0	0	111.8	P158 L159 V164 W165 L166	P158-C162 WeakPolarHBondContact O-CB 3.13Å; P158-C162 PolarHBondContact O-N 3.27Å; L159-C162 WeakPolarHBondContact O-CB 3.49Å; L159-C162 PolarHBondContact O-N 3.4Å; C162-V164 PolarHBondContact O-N 2.94Å; C162-W165 PolarHBondContact O-N 3.45Å; C162-L166 WeakPolarHBondContact O-CB 3.5Å; C162-L166 PolarHBondContact O-N 3.02Å
163	L	96.8	Very high	94.2	Very high	91 Å²	91	77.9 Å²	77.9	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-40.1	176.5	-72.1	170.3	0	0	0	112.8	L159 H160 I161 L166 L167	L159-L163 HydrophobicContact CG-CD1 4.28Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 2.95Å; H160-L163 PolarHBondContact O-N 3.5Å; I161-L163 VanDerWaalsContact C-N 3.32Å; I161-L163 PolarHBondContact O-N 3.34Å; L163-L166 PolarHBondContact O-N 2.92Å; L163-L167 VanDerWaalsContact O-CB 3.28Å; L163-L167 WeakPolarHBondContact O-CB 3.22Å; L163-L167 PolarHBondContact O-N 2.88Å
164	V	96.9	Very high	94.6	Very high	15 Å²	15	71.4 Å²	71.4	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-47.8	175.4	161	0	0	0	0	110.6	F129 A133 H160 I161 C162 L167 T168	F129-V164 HydrophobicContact CB-CB 4.47Å; F129-V164 HydrophobicContact CB-CG1 3.67Å; F129-V164 HydrophobicContact CB-CG2 4.29Å; A133-V164 HydrophobicContact CB-CG2 4.27Å; H160-V164 WeakPolarHBondContact O-CG2 3.41Å; H160-V164 PolarHBondContact O-N 3.25Å; I161-V164 WeakPolarHBondContact O-CB 3.28Å; I161-V164 PolarHBondContact O-N 2.75Å; C162-V164 PolarHBondContact O-N 2.94Å; V164-L167 PolarHBondContact O-N 3.16Å; V164-T168 WeakPolarHBondContact O-CB 3.19Å; V164-T168 PolarHBondContact O-N 2.95Å; V164-T168 PolarHBondContact O-OG1 3.39Å
165	W	98.1	Very high	95.2	Very high	70 Å²	70	60.6 Å²	60.6	27%	0.265	31%	0.313	S	S	.	.	H	α-helix	trans	-68.3	-40.8	179.4	-73.7	109.2	0	0	0	112.6	S81 A85 I161 C162 L167 T168 V169	S81-W165 PolarHBondContact OG-NE1 2.83Å; A85-W165 HydrophobicContact CB-CH2 3.68Å; A85-W165 HydrophobicContact CB-CZ2 4.14Å; I161-W165 PolarHBondContact O-N 3.09Å; I161-W165 VanDerWaalsContact O-N 3.11Å; C162-W165 PolarHBondContact O-N 3.45Å; W165-L167 PolarHBondContact O-N 3.47Å; W165-T168 WeakPolarHBondContact O-CB 3.37Å; W165-T168 PolarHBondContact O-N 3.26Å; W165-V169 WeakPolarHBondContact O-CG2 3.31Å; W165-V169 PolarHBondContact O-N 2.92Å
166	L	97.8	Very high	95.5	Very high	105 Å²	105	55.3 Å²	55.3	55%	0.55	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-47.3	174.7	-178.8	63.3	0	0	0	111.2	C162 L163 T168 V169 V170	C162-L166 WeakPolarHBondContact O-CB 3.5Å; C162-L166 PolarHBondContact O-N 3.02Å; L163-L166 PolarHBondContact O-N 2.92Å; L166-T168 VanDerWaalsContact C-N 3.29Å; L166-T168 PolarHBondContact O-N 3.5Å; L166-V169 PolarHBondContact O-N 3.34Å; L166-V170 VanDerWaalsContact O-CG2 3.31Å; L166-V170 WeakPolarHBondContact O-CG2 3.39Å; L166-V170 PolarHBondContact O-N 3.38Å
167	L	96.7	Very high	95.5	Very high	90 Å²	90	60.9 Å²	60.9	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-38.2	177.4	-175.2	64.9	0	0	0	111.7	F129 L163 V164 W165 V170 A171	F129-L167 HydrophobicContact CD2-CB 4.38Å; F129-L167 HydrophobicContact CD2-CD2 3.97Å; F129-L167 HydrophobicContact CD2-CG 4.15Å; F129-L167 HydrophobicContact CE1-CD2 4.17Å; F129-L167 HydrophobicContact CE2-CB 4.12Å; F129-L167 HydrophobicContact CE2-CD2 3.57Å; F129-L167 HydrophobicContact CE2-CG 3.51Å; F129-L167 HydrophobicContact CG-CD2 4.45Å; F129-L167 HydrophobicContact CZ-CD2 3.65Å; F129-L167 HydrophobicContact CZ-CG 3.91Å; L163-L167 VanDerWaalsContact O-CB 3.28Å; L163-L167 WeakPolarHBondContact O-CB 3.22Å; L163-L167 PolarHBondContact O-N 2.88Å; V164-L167 PolarHBondContact O-N 3.16Å; W165-L167 PolarHBondContact O-N 3.47Å; L167-V170 PolarHBondContact O-N 3.49Å; L167-A171 WeakPolarHBondContact O-CB 3.35Å; L167-A171 PolarHBondContact O-N 3.49Å
168	T	97.7	Very high	95.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.3	-48.7	176	-55.6	0	0	0	0	111.1	L122 I125 G126 V164 W165 L166 V170 A171 L172	L122-T168 HydrophobicContact CD2-CG2 3.98Å; I125-T168 HydrophobicContact CB-CG2 3.94Å; I125-T168 HydrophobicContact CG2-CG2 3.95Å; G126-T168 WeakPolarHBondContact CA-OG1 3.35Å; V164-T168 WeakPolarHBondContact O-CB 3.19Å; V164-T168 PolarHBondContact O-N 2.95Å; V164-T168 PolarHBondContact O-OG1 3.39Å; W165-T168 WeakPolarHBondContact O-CB 3.37Å; W165-T168 PolarHBondContact O-N 3.26Å; L166-T168 VanDerWaalsContact C-N 3.29Å; L166-T168 PolarHBondContact O-N 3.5Å; T168-V170 PolarHBondContact O-N 3.23Å; T168-A171 WeakPolarHBondContact O-CB 3.35Å; T168-A171 PolarHBondContact O-N 3.47Å; T168-L172 HydrophobicContact CG2-CD1 4.04Å; T168-L172 WeakPolarHBondContact O-CD1 3.48Å; T168-L172 WeakPolarHBondContact O-CG 3.34Å; T168-L172 PolarHBondContact O-N 3.33Å
169	V	97.3	Very high	95.6	Very high	56 Å²	56	62.7 Å²	62.7	34%	0.339	34%	0.337	S	S	.	.	H	α-helix	trans	-60.4	-47.8	177.4	171.9	0	0	0	0	110.2	L122 W165 L166 A171 L172 L173	L122-V169 HydrophobicContact CD2-CG2 3.85Å; W165-V169 WeakPolarHBondContact O-CG2 3.31Å; W165-V169 PolarHBondContact O-N 2.92Å; L166-V169 PolarHBondContact O-N 3.34Å; V169-A171 VanDerWaalsContact C-N 3.3Å; V169-A171 PolarHBondContact O-N 2.93Å; V169-L172 PolarHBondContact O-N 2.93Å; V169-L173 WeakPolarHBondContact O-CG 3.41Å; V169-L173 PolarHBondContact O-N 2.94Å; V169-L173 VanDerWaalsContact O-N 3.13Å
170	V	96.6	Very high	95.5	Very high	76 Å²	76	58.1 Å²	58.1	46%	0.461	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-41.9	178.5	170.4	0	0	0	0	111.8	L166 L167 T168 L172 L173 P174	L166-V170 VanDerWaalsContact O-CG2 3.31Å; L166-V170 WeakPolarHBondContact O-CG2 3.39Å; L166-V170 PolarHBondContact O-N 3.38Å; L167-V170 PolarHBondContact O-N 3.49Å; T168-V170 PolarHBondContact O-N 3.23Å; V170-L172 PolarHBondContact O-N 2.67Å; V170-L173 PolarHBondContact O-N 2.92Å; V170-P174 WeakPolarHBondContact O-CD 3.45Å
171	A	94.9	Very high	95.6	Very high	12 Å²	12	55.1 Å²	55.1	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-27.7	177	0	0	0	0	0	113.7	I125 L167 T168 V169 P174 Y200 H208	I125-A171 HydrophobicContact CD1-CB 4.42Å; I125-A171 HydrophobicContact CG2-CB 4.26Å; L167-A171 WeakPolarHBondContact O-CB 3.35Å; L167-A171 PolarHBondContact O-N 3.49Å; T168-A171 WeakPolarHBondContact O-CB 3.35Å; T168-A171 PolarHBondContact O-N 3.47Å; V169-A171 VanDerWaalsContact C-N 3.3Å; V169-A171 PolarHBondContact O-N 2.93Å; A171-P174 WeakPolarHBondContact O-CD 3.4Å; A171-Y200 PolarHBondContact O-OH 2.88Å; A171-H208 WeakPolarHBondContact CB-NE2 3.5Å
172	L	95.7	Very high	95.6	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-89.4	-21.8	-178.8	-71.2	156.7	0	0	0	113.4	F118 L122 I125 T168 V169 V170 P174 N175	F118-L172 HydrophobicContact CD2-CB 4.09Å; F118-L172 HydrophobicContact CE2-CB 3.6Å; F118-L172 HydrophobicContact CE2-CD1 4.14Å; F118-L172 HydrophobicContact CE2-CG 4.42Å; L122-L172 HydrophobicContact CB-CD1 4.25Å; L122-L172 HydrophobicContact CD2-CD1 3.53Å; L122-L172 HydrophobicContact CG-CD1 3.73Å; I125-L172 HydrophobicContact CD1-CD2 3.78Å; I125-L172 HydrophobicContact CD1-CG 3.98Å; T168-L172 HydrophobicContact CG2-CD1 4.04Å; T168-L172 WeakPolarHBondContact O-CD1 3.48Å; T168-L172 WeakPolarHBondContact O-CG 3.34Å; T168-L172 PolarHBondContact O-N 3.33Å; V169-L172 PolarHBondContact O-N 2.93Å; V170-L172 PolarHBondContact O-N 2.67Å; L172-P174 VanDerWaalsContact C-CD 3.41Å; L172-N175 VanDerWaalsContact O-CB 3.27Å; L172-N175 WeakPolarHBondContact O-CB 3.29Å; L172-N175 PolarHBondContact O-N 2.94Å; L172-N175 VanDerWaalsContact O-N 3.11Å; L172-N175 PolarHBondContact O-ND2 3.36Å
173	L	94.3	Very high	95.6	Very high	78 Å²	78	57.5 Å²	57.5	41%	0.408	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-40.4	-178.7	-68.4	177.6	0	0	0	114.5	V169 V170 N175 F176 F177	V169-L173 WeakPolarHBondContact O-CG 3.41Å; V169-L173 PolarHBondContact O-N 2.94Å; V169-L173 VanDerWaalsContact O-N 3.13Å; V170-L173 PolarHBondContact O-N 2.92Å; L173-N175 PolarHBondContact O-N 2.87Å; L173-F176 PolarHBondContact O-N 2.9Å; L173-F176 VanDerWaalsContact O-N 3.13Å; L173-F177 WeakPolarHBondContact O-CD2 3.34Å
174	P	94.6	Very high	95.5	Very high	46 Å²	46	53.5 Å²	53.5	30%	0.299	28%	0.28	S	S	.	.	H	α-helix	trans	-55.6	-26.9	178.4	-28.1	36.9	0	0	0	114.5	V170 A171 L172 F176 F177 V178 Y200	V170-P174 WeakPolarHBondContact O-CD 3.45Å; A171-P174 WeakPolarHBondContact O-CD 3.4Å; L172-P174 VanDerWaalsContact C-CD 3.41Å; P174-F176 PolarHBondContact O-N 3.27Å; P174-F177 PolarHBondContact O-N 3.34Å; P174-F177 VanDerWaalsContact O-N 3.12Å; P174-V178 WeakPolarHBondContact O-CG2 3.49Å; P174-V178 PolarHBondContact O-N 2.79Å; P174-Y200 HydrophobicContact CB-CD2 4.05Å; P174-Y200 HydrophobicContact CB-CE2 3.57Å; P174-Y200 HydrophobicContact CG-CE2 3.99Å
175	N	93.7	Very high	95.3	Very high	5 Å²	5	55 Å²	55	3%	0.027	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-34.9	178.6	-74.2	-76.6	0	0	0	113.2	L172 L173 F177 G179 S180 L181 F192 Y200	L172-N175 VanDerWaalsContact O-CB 3.27Å; L172-N175 WeakPolarHBondContact O-CB 3.29Å; L172-N175 PolarHBondContact O-N 2.94Å; L172-N175 VanDerWaalsContact O-N 3.11Å; L172-N175 PolarHBondContact O-ND2 3.36Å; L173-N175 PolarHBondContact O-N 2.87Å; N175-F177 VanDerWaalsContact C-N 3.35Å; N175-G179 WeakPolarHBondContact O-CA 3.42Å; N175-G179 PolarHBondContact O-N 2.88Å; N175-S180 WeakPolarHBondContact CA-OG 3.38Å; N175-S180 PolarHBondContact O-N 3.4Å; N175-S180 PolarHBondContact OD1-OG 3.34Å; N175-L181 HydrophobicContact CB-CD1 3.93Å; N175-L181 HydrophobicContact CB-CD2 4Å; N175-L181 HydrophobicContact CB-CG 3.8Å; N175-F192 VanDerWaalsContact OD1-CD2 3.25Å; N175-F192 WeakPolarHBondContact OD1-CD2 3.48Å; N175-Y200 PolarHBondContact ND2-OH 3.4Å; N175-Y200 WeakPolarHBondContact OD1-CE1 3.26Å
176	F	92.8	Very high	95	Very high	108 Å²	108	56 Å²	56	47%	0.474	29%	0.293	S	S	.	.	H	α-helix	trans	-74.1	-26.9	-179.1	-65.1	-74	0	0	0	112.8	F118 L173 P174 L181	F118-F176 HydrophobicContact CB-CZ 4.46Å; F118-F176 AromaticContact CD2-CE2 3.66Å; F118-F176 HydrophobicContact CD2-CE2 3.66Å; F118-F176 AromaticContact CD2-CZ 3.62Å; F118-F176 HydrophobicContact CD2-CZ 3.62Å; F118-F176 AromaticContact CE2-CE2 3.68Å; F118-F176 HydrophobicContact CE2-CE2 3.68Å; F118-F176 HydrophobicContact CE2-CZ 4.03Å; F118-F176 HydrophobicContact CG-CZ 4.09Å; L173-F176 PolarHBondContact O-N 2.9Å; L173-F176 VanDerWaalsContact O-N 3.13Å; P174-F176 PolarHBondContact O-N 3.27Å; F176-L181 HydrophobicContact CE1-CD1 4.49Å
177	F	93.1	Very high	94.9	Very high	182 Å²	182	51 Å²	51	80%	0.798	27%	0.267	S	S	*	.	H	α-helix	trans	-86	-35.3	177.8	-58.3	-74.1	0	0	0	112.1	L173 P174 N175	L173-F177 WeakPolarHBondContact O-CD2 3.34Å; P174-F177 PolarHBondContact O-N 3.34Å; P174-F177 VanDerWaalsContact O-N 3.12Å; N175-F177 VanDerWaalsContact C-N 3.35Å
178	V	93.4	Very high	94.9	Very high	62 Å²	62	47.6 Å²	47.6	38%	0.376	25%	0.248	S	C	.	.	H	α-helix	trans	-78.3	-26.8	177.3	177.4	0	0	0	0	111.6	P174 A196	P174-V178 WeakPolarHBondContact O-CG2 3.49Å; P174-V178 PolarHBondContact O-N 2.79Å; V178-A196 HydrophobicContact CG1-CB 4.45Å
179	G	92.4	Very high	94.8	Very high	39 Å²	39	47.6 Å²	47.6	40%	0.402	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	34.3	-173.7	0	0	0	0	0	112.6	N175 L181	N175-G179 WeakPolarHBondContact O-CA 3.42Å; N175-G179 PolarHBondContact O-N 2.88Å; G179-L181 PolarHBondContact O-N 3.31Å
180	S	94.1	Very high	94.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.			trans	-88.9	5.9	-172.9	51	0	0	0	0	115.2	N175 F192 I193	N175-S180 WeakPolarHBondContact CA-OG 3.38Å; N175-S180 PolarHBondContact O-N 3.4Å; N175-S180 PolarHBondContact OD1-OG 3.34Å; S180-F192 CarbonylContact O-C 3.59Å; S180-F192 WeakPolarHBondContact O-CA 3.47Å; S180-I193 PolarHBondContact O-N 3.33Å
181	L	96.6	Very high	94.9	Very high	11 Å²	11	41.7 Å²	41.7	6%	0.058	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	100.6	179.8	-55.6	-179.4	0	0	0	109.8	K114 A117 F118 N175 F176 G179	K114-L181 HydrophobicContact CG-CB 4.49Å; A117-L181 HydrophobicContact CB-CB 3.96Å; A117-L181 HydrophobicContact CB-CD1 4.35Å; A117-L181 HydrophobicContact CB-CD2 3.97Å; A117-L181 HydrophobicContact CB-CG 4.28Å; F118-L181 HydrophobicContact CB-CD1 4.32Å; N175-L181 HydrophobicContact CB-CD1 3.93Å; N175-L181 HydrophobicContact CB-CD2 4Å; N175-L181 HydrophobicContact CB-CG 3.8Å; F176-L181 HydrophobicContact CE1-CD1 4.49Å; G179-L181 PolarHBondContact O-N 3.31Å
182	E	96.2	Very high	94.9	Very high	110 Å²	110	43 Å²	43	51%	0.514	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	168.5	-176.1	-55.1	-174.7	167.2	0	0	111.4	C190 T191 I193	E182-C190 CarbonylContact O-C 3.58Å; E182-C190 VanDerWaalsContact O-CA 3.3Å; E182-C190 WeakPolarHBondContact O-CA 3.38Å; E182-T191 PolarHBondContact N-O 3.42Å; E182-T191 VanDerWaalsContact N-O 3.16Å; E182-T191 PolarHBondContact O-N 3.47Å; E182-I193 HydrophobicContact CB-CD1 4.34Å; E182-I193 HydrophobicContact CB-CG1 3.8Å; E182-I193 HydrophobicContact CG-CG1 4.3Å
183	Y	96.8	Very high	94.9	Very high	46 Å²	46	43.8 Å²	43.8	18%	0.18	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.7	175	176.6	-112.5	0	0	0	111.3	G105 W106 P185 Y188	G105-Y183 WeakPolarHBondContact CA-OH 3.48Å; W106-Y183 HydrophobicContact CB-CD1 4.3Å; W106-Y183 HydrophobicContact CB-CD2 3.66Å; W106-Y183 HydrophobicContact CB-CE2 3.88Å; W106-Y183 HydrophobicContact CB-CG 3.87Å; W106-Y183 HydrophobicContact CD2-CD2 4.35Å; W106-Y183 HydrophobicContact CE3-CD2 4.03Å; W106-Y183 HydrophobicContact CE3-CE2 4.28Å; W106-Y183 HydrophobicContact CG-CD2 4.23Å; Y183-P185 HydrophobicContact CE1-CB 3.95Å; Y183-Y188 VanDerWaalsContact CE2-C 3.49Å
184	D	95.2	Very high	94.7	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.037	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.7	172	-168.3	-31	0	0	0	110.4	R186 I187 Y188 S189 T191 I193 F290	D184-R186 PolarHBondContact O-N 2.88Å; D184-R186 VanDerWaalsContact OD1-CB 3.24Å; D184-R186 WeakPolarHBondContact OD1-CB 3.38Å; D184-R186 WeakPolarHBondContact OD1-CG 3.29Å; D184-R186 IonicContact OD1-CZ 3.19Å; D184-R186 PolarHBondContact OD1-N 3.22Å; D184-R186 IonicContact OD1-NE 3.9Å; D184-R186 PolarHBondContact OD1-NE 2.85Å; D184-R186 IonicContact OD1-NH2 2.93Å; D184-R186 IonicContact OD2-CZ 3.84Å; D184-R186 IonicContact OD2-NE 3.75Å; D184-R186 PolarHBondContact OD2-NE 3.18Å; D184-R186 IonicContact OD2-NH2 2.63Å; D184-R186 PolarHBondContact OD2-NH2 2.9Å; D184-I187 HydrophobicContact CB-CD1 4.3Å; D184-I187 HydrophobicContact CB-CG1 3.88Å; D184-I187 PolarHBondContact O-N 3.44Å; D184-Y188 PolarHBondContact O-N 2.98Å; D184-Y188 VanDerWaalsContact O-N 3.13Å; D184-S189 PolarHBondContact N-O 3.3Å; D184-S189 PolarHBondContact O-N 2.84Å; D184-T191 HydrophobicContact CB-CG2 4.05Å; D184-I193 HydrophobicContact CB-CD1 4.15Å; D184-F290 WeakPolarHBondContact OD2-CE1 3.35Å; D184-F290 WeakPolarHBondContact OD2-CZ 3.15Å
185	P	93.3	Very high	94.6	Very high	45 Å²	45	42.8 Å²	42.8	29%	0.292	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.3	-176.8	27	-34.6	0	0	0	113	R35 Y183 I187	R35-P185 WeakPolarHBondContact CD-O 3.42Å; R35-P185 PolarHBondContact NE-O 3.33Å; R35-P185 VanDerWaalsContact NE-O 3.12Å; R35-P185 PolarHBondContact NH1-O 3.48Å; Y183-P185 HydrophobicContact CE1-CB 3.95Å; P185-I187 PolarHBondContact O-N 3.33Å
186	R	92.8	Very high	94.5	Very high	91 Å²	91	44.8 Å²	44.8	34%	0.343	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.7	-179.2	-59.9	173.4	-69.4	-175.2	-0.6	112	D184 E287 F290 V291	D184-R186 PolarHBondContact O-N 2.88Å; D184-R186 VanDerWaalsContact OD1-CB 3.24Å; D184-R186 WeakPolarHBondContact OD1-CB 3.38Å; D184-R186 WeakPolarHBondContact OD1-CG 3.29Å; D184-R186 IonicContact OD1-CZ 3.19Å; D184-R186 PolarHBondContact OD1-N 3.22Å; D184-R186 IonicContact OD1-NE 3.9Å; D184-R186 PolarHBondContact OD1-NE 2.85Å; D184-R186 IonicContact OD1-NH2 2.93Å; D184-R186 IonicContact OD2-CZ 3.84Å; D184-R186 IonicContact OD2-NE 3.75Å; D184-R186 PolarHBondContact OD2-NE 3.18Å; D184-R186 IonicContact OD2-NH2 2.63Å; D184-R186 PolarHBondContact OD2-NH2 2.9Å; R186-E287 HydrophobicContact CB-CG 4.41Å; R186-E287 HydrophobicContact CG-CG 4.36Å; R186-F290 HydrophobicContact CB-CD1 4.27Å; R186-F290 HydrophobicContact CB-CE1 4.31Å; R186-F290 VanDerWaalsContact NH2-CZ 3.26Å; R186-V291 WeakPolarHBondContact O-CG2 3.34Å
187	I	95.1	Very high	94.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	7	-175.4	58.7	165.1	0	0	0	113.4	D184 P185 S189 T191 F290 V291 Y294	D184-I187 HydrophobicContact CB-CD1 4.3Å; D184-I187 HydrophobicContact CB-CG1 3.88Å; D184-I187 PolarHBondContact O-N 3.44Å; P185-I187 PolarHBondContact O-N 3.33Å; I187-S189 PolarHBondContact O-N 3.36Å; I187-S189 VanDerWaalsContact O-N 3.11Å; I187-T191 HydrophobicContact CD1-CG2 3.83Å; I187-F290 HydrophobicContact CG2-CD1 3.98Å; I187-F290 HydrophobicContact CG2-CE1 3.84Å; I187-V291 HydrophobicContact CG2-CG2 4.13Å; I187-Y294 HydrophobicContact CD1-CD1 3.65Å; I187-Y294 HydrophobicContact CD1-CD2 4.08Å; I187-Y294 HydrophobicContact CD1-CE1 3.52Å; I187-Y294 HydrophobicContact CD1-CE2 3.97Å; I187-Y294 HydrophobicContact CD1-CG 3.92Å; I187-Y294 HydrophobicContact CG2-CD2 4.02Å; I187-Y294 HydrophobicContact CG2-CG 4.07Å
188	Y	96.1	Very high	94.6	Very high	19 Å²	19	34.8 Å²	34.8	8%	0.075	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	25.8	-179	-58.2	-100.6	0	0	0	114.2	R35 V39 A40 L43 A100 I101 D104 Y183 D184	R35-Y188 VanDerWaalsContact NH1-CD1 3.32Å; R35-Y188 PolarHBondContact NH1-OH 3.13Å; V39-Y188 HydrophobicContact CG1-CE2 4.13Å; A40-Y188 HydrophobicContact CB-CE2 4.35Å; L43-Y188 HydrophobicContact CD1-CD2 3.95Å; L43-Y188 HydrophobicContact CD1-CE2 4.49Å; A100-Y188 VanDerWaalsContact CB-O 3.31Å; A100-Y188 WeakPolarHBondContact CB-O 3.41Å; A100-Y188 WeakPolarHBondContact O-CD1 3.43Å; I101-Y188 HydrophobicContact CB-CD1 4.29Å; I101-Y188 HydrophobicContact CB-CG 4.33Å; I101-Y188 HydrophobicContact CG1-CD1 4.07Å; I101-Y188 HydrophobicContact CG1-CD2 3.93Å; I101-Y188 HydrophobicContact CG1-CG 3.61Å; D104-Y188 VanDerWaalsContact OD1-CE1 3.29Å; D104-Y188 WeakPolarHBondContact OD1-CE1 3.37Å; Y183-Y188 VanDerWaalsContact CE2-C 3.49Å; D184-Y188 PolarHBondContact O-N 2.98Å; D184-Y188 VanDerWaalsContact O-N 3.13Å
189	S	96.6	Very high	94.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.4	-172.3	-176.8	0	0	0	0	111.4	I97 M120 D184 I187 T191 Y298	I97-S189 VanDerWaalsContact CD1-OG 3.23Å; I97-S189 WeakPolarHBondContact CD1-OG 3.26Å; I97-S189 WeakPolarHBondContact CG1-OG 3.28Å; M120-S189 WeakPolarHBondContact CE-OG 3.34Å; D184-S189 PolarHBondContact N-O 3.3Å; D184-S189 PolarHBondContact O-N 2.84Å; I187-S189 PolarHBondContact O-N 3.36Å; I187-S189 VanDerWaalsContact O-N 3.11Å; S189-T191 PolarHBondContact O-N 3.11Å; S189-Y298 WeakPolarHBondContact CB-OH 3.25Å; S189-Y298 PolarHBondContact OG-OH 3.22Å
190	C	97.4	Very high	94.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123.2	160.8	-65.9	0	0	0	0	109.7	W106 C113 A117 M120 E182	W106-C190 VanDerWaalsContact CE3-SG 3.59Å; W106-C190 HydrophobicContact CH2-CB 4.4Å; W106-C190 HydrophobicContact CZ3-CB 4.38Å; C113-C190 WeakPolarHBondContact CA-SG 3.34Å; C113-C190 HydrophobicContact CB-CB 3.94Å; C113-C190 WeakPolarHBondContact CB-SG 3.31Å; C113-C190 WeakPolarHBondContact O-CB 3.44Å; C113-C190 WeakPolarHBondContact SG-CB 3.26Å; C113-C190 CovalentContact SG-SG 2.02Å; C113-C190 PolarHBondContact SG-SG 2.89Å; A117-C190 HydrophobicContact CB-CB 4.29Å; M120-C190 WeakPolarHBondContact CE-O 3.45Å; E182-C190 CarbonylContact O-C 3.58Å; E182-C190 VanDerWaalsContact O-CA 3.3Å; E182-C190 WeakPolarHBondContact O-CA 3.38Å
191	T	96.9	Very high	94.6	Very high	8 Å²	8	38.9 Å²	38.9	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	179	-172	-168.2	0	0	0	0	110.9	E182 D184 I187 S189 I193 Y294	E182-T191 PolarHBondContact N-O 3.42Å; E182-T191 VanDerWaalsContact N-O 3.16Å; E182-T191 PolarHBondContact O-N 3.47Å; D184-T191 HydrophobicContact CB-CG2 4.05Å; I187-T191 HydrophobicContact CD1-CG2 3.83Å; S189-T191 PolarHBondContact O-N 3.11Å; T191-I193 HydrophobicContact CG2-CD1 4.35Å; T191-I193 PolarHBondContact O-N 3.44Å; T191-Y294 PolarHBondContact OG1-OH 2.74Å
192	F	96.2	Very high	94.5	Very high	40 Å²	40	39.9 Å²	39.9	18%	0.175	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.2	169.7	174.7	-108.9	0	0	0	111.7	N175 S180 Q194 Y200 T201	N175-F192 VanDerWaalsContact OD1-CD2 3.25Å; N175-F192 WeakPolarHBondContact OD1-CD2 3.48Å; S180-F192 CarbonylContact O-C 3.59Å; S180-F192 WeakPolarHBondContact O-CA 3.47Å; F192-Q194 HydrophobicContact CD1-CG 4.17Å; F192-Q194 HydrophobicContact CE1-CG 4.09Å; F192-Q194 PolarHBondContact O-N 3.37Å; F192-Y200 HydrophobicContact CD2-CE1 4.2Å; F192-Y200 AromaticContact CE2-CD1 3.48Å; F192-Y200 HydrophobicContact CE2-CD1 3.48Å; F192-Y200 VanDerWaalsContact CE2-CD1 3.48Å; F192-Y200 AromaticContact CE2-CE1 3.42Å; F192-Y200 HydrophobicContact CE2-CE1 3.42Å; F192-Y200 VanDerWaalsContact CE2-CE1 3.42Å; F192-Y200 AromaticContact CZ-CD1 3.8Å; F192-Y200 HydrophobicContact CZ-CD1 3.8Å; F192-Y200 HydrophobicContact CZ-CE1 4.01Å; F192-T201 HydrophobicContact CE1-CG2 4.3Å; F192-T201 WeakPolarHBondContact CZ-OG1 3.26Å
193	I	94.6	Very high	94.5	Very high	23 Å²	23	36.3 Å²	36.3	12%	0.118	20%	0.199	C	C	.	.			trans	-86.2	108.9	177.3	-54.9	-55.2	0	0	0	110.3	S180 E182 D184 T191 T195 A196	S180-I193 PolarHBondContact O-N 3.33Å; E182-I193 HydrophobicContact CB-CD1 4.34Å; E182-I193 HydrophobicContact CB-CG1 3.8Å; E182-I193 HydrophobicContact CG-CG1 4.3Å; D184-I193 HydrophobicContact CB-CD1 4.15Å; T191-I193 HydrophobicContact CG2-CD1 4.35Å; T191-I193 PolarHBondContact O-N 3.44Å; I193-T195 WeakPolarHBondContact CG2-OG1 3.45Å; I193-T195 PolarHBondContact O-N 2.93Å; I193-A196 HydrophobicContact CB-CB 4.3Å; I193-A196 HydrophobicContact CG2-CB 4.41Å; I193-A196 WeakPolarHBondContact O-CB 3.3Å; I193-A196 PolarHBondContact O-N 3.03Å; I193-A196 VanDerWaalsContact O-N 3.14Å
194	Q	91.8	Very high	94.4	Very high	23 Å²	23	35.4 Å²	35.4	11%	0.107	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-24	-174.7	-64.5	177.1	-12.8	0	0	114.1	F192 T201 L267 G271 V274	F192-Q194 HydrophobicContact CD1-CG 4.17Å; F192-Q194 HydrophobicContact CE1-CG 4.09Å; F192-Q194 PolarHBondContact O-N 3.37Å; Q194-T201 WeakPolarHBondContact CA-OG1 3.43Å; Q194-T201 HydrophobicContact CB-CG2 4.08Å; Q194-T201 HydrophobicContact CG-CG2 4.32Å; Q194-T201 PolarHBondContact O-OG1 2.91Å; Q194-L267 PolarHBondContact NE2-O 3.33Å; Q194-G271 VanDerWaalsContact CD-CA 3.5Å; Q194-V274 HydrophobicContact CB-CG1 4.34Å
195	T	91.4	Very high	94.5	Very high	79 Å²	79	35.3 Å²	35.3	49%	0.485	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-9.7	179.4	49.6	0	0	0	0	113.7	I193 S197 V274 A282	I193-T195 WeakPolarHBondContact CG2-OG1 3.45Å; I193-T195 PolarHBondContact O-N 2.93Å; T195-S197 VanDerWaalsContact C-N 3.34Å; T195-S197 PolarHBondContact O-N 3.23Å; T195-V274 HydrophobicContact CG2-CG1 3.6Å; T195-A282 HydrophobicContact CG2-CB 4.25Å
196	A	92.1	Very high	94.6	Very high	48 Å²	48	36.6 Å²	36.6	40%	0.397	21%	0.205	S	C	.	.	S	Bend	trans	-65	-37.4	-177.5	0	0	0	0	0	112.3	V178 I193	V178-A196 HydrophobicContact CG1-CB 4.45Å; I193-A196 HydrophobicContact CB-CB 4.3Å; I193-A196 HydrophobicContact CG2-CB 4.41Å; I193-A196 WeakPolarHBondContact O-CB 3.3Å; I193-A196 PolarHBondContact O-N 3.03Å; I193-A196 VanDerWaalsContact O-N 3.14Å
197	S	93.6	Very high	94.8	Very high	31 Å²	31	36.3 Å²	36.3	22%	0.217	21%	0.209	C	C	.	.			trans	-153.9	112.8	171.2	171.8	0	0	0	0	110	T195 Q199 Y200 T201	T195-S197 VanDerWaalsContact C-N 3.34Å; T195-S197 PolarHBondContact O-N 3.23Å; S197-Q199 VanDerWaalsContact C-N 3.29Å; S197-Q199 PolarHBondContact O-N 3.48Å; S197-Y200 PolarHBondContact O-N 2.76Å; S197-Y200 PolarHBondContact OG-N 3.44Å; S197-T201 WeakPolarHBondContact O-CB 3.41Å; S197-T201 PolarHBondContact O-N 2.93Å; S197-T201 PolarHBondContact O-OG1 3.43Å; S197-T201 VanDerWaalsContact O-OG1 3.05Å
198	T	93.1	Very high	94.9	Very high	48 Å²	48	37.6 Å²	37.6	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-36.3	179.4	52.5	0	0	0	0	112.3	T201 A202 P278	T198-T201 PolarHBondContact O-N 3.3Å; T198-A202 VanDerWaalsContact O-CB 3.3Å; T198-A202 WeakPolarHBondContact O-CB 3.33Å; T198-A202 PolarHBondContact O-N 2.99Å; T198-P278 HydrophobicContact CG2-CB 4.07Å; T198-P278 HydrophobicContact CG2-CG 3.74Å
199	Q	92.9	Very high	94.9	Very high	160 Å²	160	37.5 Å²	37.5	75%	0.748	22%	0.215	S	C	*	.	H	α-helix	trans	-63.7	-44.7	176.7	-65.3	175.6	10.5	0	0	111.2	S197 A202 A203	S197-Q199 VanDerWaalsContact C-N 3.29Å; S197-Q199 PolarHBondContact O-N 3.48Å; Q199-A202 PolarHBondContact O-N 3.17Å; Q199-A203 PolarHBondContact O-N 3.31Å
200	Y	93.2	Very high	94.9	Very high	26 Å²	26	41.2 Å²	41.2	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-43.4	178.2	-176.6	-124	0	0	0	111.4	A171 P174 N175 F192 S197 A202 A203 V204	A171-Y200 PolarHBondContact O-OH 2.88Å; P174-Y200 HydrophobicContact CB-CD2 4.05Å; P174-Y200 HydrophobicContact CB-CE2 3.57Å; P174-Y200 HydrophobicContact CG-CE2 3.99Å; N175-Y200 PolarHBondContact ND2-OH 3.4Å; N175-Y200 WeakPolarHBondContact OD1-CE1 3.26Å; F192-Y200 HydrophobicContact CD2-CE1 4.2Å; F192-Y200 AromaticContact CE2-CD1 3.48Å; F192-Y200 HydrophobicContact CE2-CD1 3.48Å; F192-Y200 VanDerWaalsContact CE2-CD1 3.48Å; F192-Y200 AromaticContact CE2-CE1 3.42Å; F192-Y200 HydrophobicContact CE2-CE1 3.42Å; F192-Y200 VanDerWaalsContact CE2-CE1 3.42Å; F192-Y200 AromaticContact CZ-CD1 3.8Å; F192-Y200 HydrophobicContact CZ-CD1 3.8Å; F192-Y200 HydrophobicContact CZ-CE1 4.01Å; S197-Y200 PolarHBondContact O-N 2.76Å; S197-Y200 PolarHBondContact OG-N 3.44Å; Y200-A202 VanDerWaalsContact C-N 3.33Å; Y200-A202 PolarHBondContact O-N 3Å; Y200-A203 WeakPolarHBondContact O-CB 3.42Å; Y200-A203 PolarHBondContact O-N 3.47Å; Y200-A203 VanDerWaalsContact O-N 3.15Å; Y200-V204 HydrophobicContact CD1-CG2 4.47Å; Y200-V204 HydrophobicContact CD2-CG2 4.35Å; Y200-V204 HydrophobicContact CE1-CG2 4.06Å; Y200-V204 HydrophobicContact CE2-CG2 3.93Å; Y200-V204 WeakPolarHBondContact O-CG2 3.34Å; Y200-V204 PolarHBondContact O-N 2.98Å
201	T	94.9	Very high	94.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-44.3	173.5	-60.8	0	0	0	0	111.9	F192 Q194 S197 T198 A203 V204 V205 G271 A275	F192-T201 HydrophobicContact CE1-CG2 4.3Å; F192-T201 WeakPolarHBondContact CZ-OG1 3.26Å; Q194-T201 WeakPolarHBondContact CA-OG1 3.43Å; Q194-T201 HydrophobicContact CB-CG2 4.08Å; Q194-T201 HydrophobicContact CG-CG2 4.32Å; Q194-T201 PolarHBondContact O-OG1 2.91Å; S197-T201 WeakPolarHBondContact O-CB 3.41Å; S197-T201 PolarHBondContact O-N 2.93Å; S197-T201 PolarHBondContact O-OG1 3.43Å; S197-T201 VanDerWaalsContact O-OG1 3.05Å; T198-T201 PolarHBondContact O-N 3.3Å; T201-A203 PolarHBondContact O-N 3.08Å; T201-V204 PolarHBondContact O-N 3.33Å; T201-V205 WeakPolarHBondContact O-CG2 3.48Å; T201-V205 PolarHBondContact O-N 3.19Å; T201-G271 WeakPolarHBondContact CG2-O 3.44Å; T201-A275 HydrophobicContact CG2-CB 4.23Å
202	A	95.3	Very high	94.9	Very high	33 Å²	33	45.8 Å²	45.8	27%	0.273	26%	0.259	S	S	.	.	H	α-helix	trans	-60.1	-44.8	175.3	0	0	0	0	0	111.6	T198 Q199 Y200 V204 V205 V206 A275	T198-A202 VanDerWaalsContact O-CB 3.3Å; T198-A202 WeakPolarHBondContact O-CB 3.33Å; T198-A202 PolarHBondContact O-N 2.99Å; Q199-A202 PolarHBondContact O-N 3.17Å; Y200-A202 VanDerWaalsContact C-N 3.33Å; Y200-A202 PolarHBondContact O-N 3Å; A202-V204 PolarHBondContact O-N 3.03Å; A202-V205 PolarHBondContact O-N 3.09Å; A202-V206 WeakPolarHBondContact O-CB 3.48Å; A202-V206 VanDerWaalsContact O-CG2 3.3Å; A202-V206 WeakPolarHBondContact O-CG2 3.31Å; A202-V206 PolarHBondContact O-N 3.39Å; A202-A275 HydrophobicContact CB-CB 4.05Å
203	A	95.1	Very high	95	Very high	35 Å²	35	45.7 Å²	45.7	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176.3	0	0	0	0	0	112	Q199 Y200 T201 I207	Q199-A203 PolarHBondContact O-N 3.31Å; Y200-A203 WeakPolarHBondContact O-CB 3.42Å; Y200-A203 PolarHBondContact O-N 3.47Å; Y200-A203 VanDerWaalsContact O-N 3.15Å; T201-A203 PolarHBondContact O-N 3.08Å; A203-I207 HydrophobicContact CB-CD1 4.27Å; A203-I207 WeakPolarHBondContact O-CB 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.45Å; A203-I207 PolarHBondContact O-N 2.91Å
204	V	95.3	Very high	95.1	Very high	26 Å²	26	47.4 Å²	47.4	16%	0.158	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-52.6	174.7	171.4	0	0	0	0	110.5	Y200 T201 A202 V206 H208	Y200-V204 HydrophobicContact CD1-CG2 4.47Å; Y200-V204 HydrophobicContact CD2-CG2 4.35Å; Y200-V204 HydrophobicContact CE1-CG2 4.06Å; Y200-V204 HydrophobicContact CE2-CG2 3.93Å; Y200-V204 WeakPolarHBondContact O-CG2 3.34Å; Y200-V204 PolarHBondContact O-N 2.98Å; T201-V204 PolarHBondContact O-N 3.33Å; A202-V204 PolarHBondContact O-N 3.03Å; V204-V206 PolarHBondContact O-N 3.44Å; V204-H208 WeakPolarHBondContact O-CA 3.21Å; V204-H208 WeakPolarHBondContact O-CB 3.22Å; V204-H208 PolarHBondContact O-N 2.87Å
205	V	96.6	Very high	95.4	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-45.2	-178.9	175.3	0	0	0	0	111.9	T201 A202 F209 L210 N268 L272	T201-V205 WeakPolarHBondContact O-CG2 3.48Å; T201-V205 PolarHBondContact O-N 3.19Å; A202-V205 PolarHBondContact O-N 3.09Å; V205-F209 WeakPolarHBondContact O-CA 3.36Å; V205-F209 VanDerWaalsContact O-CB 3.3Å; V205-F209 WeakPolarHBondContact O-CB 3.27Å; V205-F209 PolarHBondContact O-N 3.47Å; V205-L210 HydrophobicContact CG1-CD1 4.23Å; V205-L210 HydrophobicContact CG1-CG 4.21Å; V205-L210 PolarHBondContact O-N 3.32Å; V205-N268 HydrophobicContact CG1-CB 4.31Å; V205-N268 HydrophobicContact CG2-CB 4.48Å; V205-L272 HydrophobicContact CG1-CB 4.23Å; V205-L272 HydrophobicContact CG1-CD1 4.41Å
206	V	96.4	Very high	95.7	Very high	72 Å²	72	44.9 Å²	44.9	44%	0.436	26%	0.263	S	S	.	.	I	π-helix	trans	-71.8	-51.3	-176	173.3	0	0	0	0	111.4	A202 V204 L210 L211	A202-V206 WeakPolarHBondContact O-CB 3.48Å; A202-V206 VanDerWaalsContact O-CG2 3.3Å; A202-V206 WeakPolarHBondContact O-CG2 3.31Å; A202-V206 PolarHBondContact O-N 3.39Å; V204-V206 PolarHBondContact O-N 3.44Å; V206-L210 HydrophobicContact CG2-CD1 4.37Å; V206-L211 WeakPolarHBondContact O-CB 3.45Å; V206-L211 PolarHBondContact O-N 3.48Å
207	I	96.4	Very high	95.9	Very high	85 Å²	85	45 Å²	45	44%	0.436	26%	0.261	S	S	.	.	I	π-helix	trans	-81.9	-36.8	-170.9	-58.8	173.8	0	0	0	111.4	A203 P212	A203-I207 HydrophobicContact CB-CD1 4.27Å; A203-I207 WeakPolarHBondContact O-CB 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.45Å; A203-I207 PolarHBondContact O-N 2.91Å; I207-P212 WeakPolarHBondContact O-CD 3.12Å
208	H	96	Very high	96	Very high	27 Å²	27	48.8 Å²	48.8	13%	0.125	27%	0.274	C	S	.	.	I	π-helix	trans	-103.8	-3.9	-172.4	-53	85.6	0	0	0	113.4	V128 F129 A171 V204	V128-H208 WeakPolarHBondContact CG1-O 3.42Å; F129-H208 AromaticContact CZ-CD2 3.51Å; A171-H208 WeakPolarHBondContact CB-NE2 3.5Å; V204-H208 WeakPolarHBondContact O-CA 3.21Å; V204-H208 WeakPolarHBondContact O-CB 3.22Å; V204-H208 PolarHBondContact O-N 2.87Å
209	F	96.5	Very high	96.2	Very high	18 Å²	18	46.7 Å²	46.7	8%	0.079	26%	0.261	C	S	.	.	I	π-helix	trans	-127.7	-66.5	172.8	-174.6	-106.9	0	0	0	112.2	V205 L211 P212 I213 F260 W264 A265 N268	V205-F209 WeakPolarHBondContact O-CA 3.36Å; V205-F209 VanDerWaalsContact O-CB 3.3Å; V205-F209 WeakPolarHBondContact O-CB 3.27Å; V205-F209 PolarHBondContact O-N 3.47Å; F209-L211 PolarHBondContact O-N 3.35Å; F209-P212 WeakPolarHBondContact O-CD 3.47Å; F209-I213 HydrophobicContact CD2-CG1 4.25Å; F209-I213 HydrophobicContact CE1-CG1 4.36Å; F209-I213 HydrophobicContact CE2-CD1 4.15Å; F209-I213 HydrophobicContact CE2-CG1 4.07Å; F209-I213 HydrophobicContact CG-CG1 4.47Å; F209-I213 HydrophobicContact CZ-CD1 4.4Å; F209-I213 HydrophobicContact CZ-CG1 4.12Å; F209-I213 WeakPolarHBondContact O-CB 3.47Å; F209-I213 VanDerWaalsContact O-CG1 3.23Å; F209-I213 WeakPolarHBondContact O-CG1 3.5Å; F209-I213 PolarHBondContact O-N 3.49Å; F209-F260 HydrophobicContact CE2-CE1 4.43Å; F209-W264 HydrophobicContact CD2-CB 4.35Å; F209-W264 HydrophobicContact CE2-CB 3.73Å; F209-W264 HydrophobicContact CZ-CB 4.48Å; F209-A265 HydrophobicContact CZ-CB 4.06Å; F209-N268 WeakPolarHBondContact CB-OD1 3.27Å; F209-N268 HydrophobicContact CD1-CB 3.55Å; F209-N268 HydrophobicContact CE1-CB 3.78Å; F209-N268 HydrophobicContact CG-CB 3.98Å; F209-N268 VanDerWaalsContact CG-CG 3.44Å; F209-N268 HydrophobicContact CZ-CB 4.39Å
210	L	97.3	Very high	96.2	Very high	78 Å²	78	39.4 Å²	39.4	41%	0.408	23%	0.227	S	C	.	.	I	π-helix	trans	-62	-44.7	-172.5	-63.3	178.8	0	0	0	113.4	V205 V206 I213 A214	V205-L210 HydrophobicContact CG1-CD1 4.23Å; V205-L210 HydrophobicContact CG1-CG 4.21Å; V205-L210 PolarHBondContact O-N 3.32Å; V206-L210 HydrophobicContact CG2-CD1 4.37Å; L210-I213 PolarHBondContact O-N 2.95Å; L210-A214 WeakPolarHBondContact O-CB 3.47Å; L210-A214 PolarHBondContact O-N 3.04Å
211	L	97.3	Very high	96.3	Very high	95 Å²	95	43.4 Å²	43.4	50%	0.497	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-51.9	177.3	170.7	69.4	0	0	0	111.7	V206 F209 I213 A214 V215	V206-L211 WeakPolarHBondContact O-CB 3.45Å; V206-L211 PolarHBondContact O-N 3.48Å; F209-L211 PolarHBondContact O-N 3.35Å; L211-I213 PolarHBondContact O-N 3.27Å; L211-A214 WeakPolarHBondContact O-CB 3.25Å; L211-A214 PolarHBondContact O-N 3.13Å; L211-A214 VanDerWaalsContact O-N 3.16Å; L211-V215 HydrophobicContact CD1-CG2 4.17Å; L211-V215 WeakPolarHBondContact O-CG2 3.12Å; L211-V215 PolarHBondContact O-N 3.12Å
212	P	97.2	Very high	96.2	Very high	8 Å²	8	49.7 Å²	49.7	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-54.9	-45.2	172.2	-31.8	35.9	0	0	0	113.9	V128 I207 F209 A214 V215 V216	V128-P212 HydrophobicContact CG1-CB 3.28Å; V128-P212 HydrophobicContact CG1-CG 3.53Å; I207-P212 WeakPolarHBondContact O-CD 3.12Å; F209-P212 WeakPolarHBondContact O-CD 3.47Å; P212-A214 VanDerWaalsContact C-N 3.3Å; P212-A214 PolarHBondContact O-N 2.9Å; P212-V215 PolarHBondContact O-N 2.92Å; P212-V216 VanDerWaalsContact O-CB 3.32Å; P212-V216 WeakPolarHBondContact O-CB 3.46Å; P212-V216 WeakPolarHBondContact O-CG2 3.18Å; P212-V216 PolarHBondContact O-N 3.41Å
213	I	97.1	Very high	96	Very high	38 Å²	38	48.2 Å²	48.2	20%	0.195	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-44.5	176.1	-68.6	-59.1	0	0	0	110.6	F209 L210 L211 S217 F257 A261	F209-I213 HydrophobicContact CD2-CG1 4.25Å; F209-I213 HydrophobicContact CE1-CG1 4.36Å; F209-I213 HydrophobicContact CE2-CD1 4.15Å; F209-I213 HydrophobicContact CE2-CG1 4.07Å; F209-I213 HydrophobicContact CG-CG1 4.47Å; F209-I213 HydrophobicContact CZ-CD1 4.4Å; F209-I213 HydrophobicContact CZ-CG1 4.12Å; F209-I213 WeakPolarHBondContact O-CB 3.47Å; F209-I213 VanDerWaalsContact O-CG1 3.23Å; F209-I213 WeakPolarHBondContact O-CG1 3.5Å; F209-I213 PolarHBondContact O-N 3.49Å; L210-I213 PolarHBondContact O-N 2.95Å; L211-I213 PolarHBondContact O-N 3.27Å; I213-S217 WeakPolarHBondContact O-CB 3.32Å; I213-S217 PolarHBondContact O-N 3.48Å; I213-S217 PolarHBondContact O-OG 3.36Å; I213-F257 HydrophobicContact CD1-CD2 4.39Å; I213-F257 HydrophobicContact CD1-CE2 3.47Å; I213-F257 VanDerWaalsContact CD1-CE2 3.47Å; I213-F257 HydrophobicContact CD1-CZ 4.05Å; I213-F257 HydrophobicContact CG2-CZ 4.36Å; I213-A261 HydrophobicContact CD1-CB 3.76Å
214	A	97.9	Very high	95.8	Very high	59 Å²	59	52.8 Å²	52.8	49%	0.488	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-46.9	178.9	0	0	0	0	0	112.2	L210 L211 P212 S217 F218	L210-A214 WeakPolarHBondContact O-CB 3.47Å; L210-A214 PolarHBondContact O-N 3.04Å; L211-A214 WeakPolarHBondContact O-CB 3.25Å; L211-A214 PolarHBondContact O-N 3.13Å; L211-A214 VanDerWaalsContact O-N 3.16Å; P212-A214 VanDerWaalsContact C-N 3.3Å; P212-A214 PolarHBondContact O-N 2.9Å; A214-S217 PolarHBondContact O-N 2.86Å; A214-F218 WeakPolarHBondContact O-CB 3.15Å; A214-F218 PolarHBondContact O-N 2.91Å
215	V	97.9	Very high	95.6	Very high	49 Å²	49	54 Å²	54	30%	0.297	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-47.8	178.4	172.3	0	0	0	0	110.9	T132 I136 L211 P212 F218 C219	T132-V215 HydrophobicContact CG2-CG1 4.06Å; I136-V215 HydrophobicContact CD1-CG1 4.27Å; I136-V215 HydrophobicContact CG1-CG1 4.34Å; L211-V215 HydrophobicContact CD1-CG2 4.17Å; L211-V215 WeakPolarHBondContact O-CG2 3.12Å; L211-V215 PolarHBondContact O-N 3.12Å; P212-V215 PolarHBondContact O-N 2.92Å; V215-F218 WeakPolarHBondContact O-CB 3.46Å; V215-F218 PolarHBondContact O-N 3.45Å; V215-C219 PolarHBondContact O-N 3.09Å; V215-C219 PolarHBondContact O-SG 2.89Å; V215-C219 VanDerWaalsContact O-SG 3.4Å
216	V	97	Very high	95.2	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-44.2	-179.9	176.2	0	0	0	0	110.7	T132 A135 P212 F218 C219 Y220 F257	T132-V216 HydrophobicContact CG2-CG2 4.21Å; A135-V216 HydrophobicContact CB-CB 4.24Å; A135-V216 HydrophobicContact CB-CG1 3.81Å; A135-V216 HydrophobicContact CB-CG2 3.91Å; P212-V216 VanDerWaalsContact O-CB 3.32Å; P212-V216 WeakPolarHBondContact O-CB 3.46Å; P212-V216 WeakPolarHBondContact O-CG2 3.18Å; P212-V216 PolarHBondContact O-N 3.41Å; V216-F218 VanDerWaalsContact C-N 3.33Å; V216-F218 PolarHBondContact O-N 3.04Å; V216-C219 WeakPolarHBondContact O-CB 3.18Å; V216-C219 PolarHBondContact O-N 3.28Å; V216-Y220 HydrophobicContact CG1-CD2 3.4Å; V216-Y220 VanDerWaalsContact CG1-CD2 3.4Å; V216-Y220 HydrophobicContact CG1-CE2 3.4Å; V216-Y220 VanDerWaalsContact O-CD2 3.22Å; V216-Y220 WeakPolarHBondContact O-CD2 3.3Å; V216-Y220 PolarHBondContact O-N 3.39Å; V216-F257 HydrophobicContact CB-CD2 3.97Å; V216-F257 HydrophobicContact CB-CE2 3.66Å; V216-F257 HydrophobicContact CB-CZ 4.11Å; V216-F257 HydrophobicContact CG1-CB 4.22Å; V216-F257 HydrophobicContact CG1-CD1 3.9Å; V216-F257 HydrophobicContact CG1-CD2 3.27Å; V216-F257 HydrophobicContact CG1-CE1 4.04Å; V216-F257 HydrophobicContact CG1-CE2 3.4Å; V216-F257 VanDerWaalsContact CG1-CE2 3.4Å; V216-F257 HydrophobicContact CG1-CG 3.51Å; V216-F257 HydrophobicContact CG1-CZ 3.81Å; V216-F257 HydrophobicContact CG2-CE2 4.44Å
217	S	96.8	Very high	94.7	Very high	50 Å²	50	54 Å²	54	35%	0.35	28%	0.276	S	S	.	.	H	α-helix	trans	-59.6	-43.7	176.1	-61.1	0	0	0	0	111.7	I213 A214 Y220 L221	I213-S217 WeakPolarHBondContact O-CB 3.32Å; I213-S217 PolarHBondContact O-N 3.48Å; I213-S217 PolarHBondContact O-OG 3.36Å; A214-S217 PolarHBondContact O-N 2.86Å; S217-Y220 PolarHBondContact O-N 3.21Å; S217-L221 WeakPolarHBondContact O-CB 3.27Å; S217-L221 PolarHBondContact O-N 3.24Å
218	F	96.9	Very high	94.2	Very high	110 Å²	110	53.2 Å²	53.2	48%	0.482	27%	0.272	S	S	.	.	H	α-helix	trans	-59.1	-48.2	174.3	168.5	-97.4	0	0	0	112	A214 V215 V216 Y220 L221 R222	A214-F218 WeakPolarHBondContact O-CB 3.15Å; A214-F218 PolarHBondContact O-N 2.91Å; V215-F218 WeakPolarHBondContact O-CB 3.46Å; V215-F218 PolarHBondContact O-N 3.45Å; V216-F218 VanDerWaalsContact C-N 3.33Å; V216-F218 PolarHBondContact O-N 3.04Å; F218-Y220 PolarHBondContact O-N 3.47Å; F218-L221 PolarHBondContact O-N 2.99Å; F218-R222 HydrophobicContact CD2-CG 4.2Å; F218-R222 HydrophobicContact CE1-CG 4.29Å; F218-R222 HydrophobicContact CE2-CG 3.8Å; F218-R222 HydrophobicContact CZ-CG 3.85Å; F218-R222 WeakPolarHBondContact O-CG 3.47Å; F218-R222 PolarHBondContact O-N 3.45Å
219	C	95.8	Very high	93.7	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.034	29%	0.288	C	S	.	.	H	α-helix	trans	-57.2	-50.4	177.9	-74.5	0	0	0	0	111.7	A135 Y139 V215 V216 R222 I223	A135-C219 HydrophobicContact CB-CB 4.21Å; Y139-C219 HydrophobicContact CG-CB 4.38Å; V215-C219 PolarHBondContact O-N 3.09Å; V215-C219 PolarHBondContact O-SG 2.89Å; V215-C219 VanDerWaalsContact O-SG 3.4Å; V216-C219 WeakPolarHBondContact O-CB 3.18Å; V216-C219 PolarHBondContact O-N 3.28Å; C219-R222 PolarHBondContact O-N 2.97Å; C219-I223 WeakPolarHBondContact O-CD1 3.4Å; C219-I223 VanDerWaalsContact O-CG1 3.28Å; C219-I223 WeakPolarHBondContact O-CG1 3.44Å; C219-I223 PolarHBondContact O-N 2.92Å; C219-I223 VanDerWaalsContact O-N 3.15Å
220	Y	93.7	Very high	92.9	Very high	7 Å²	7	57.8 Å²	57.8	3%	0.027	30%	0.3	C	S	.	.	H	α-helix	trans	-67.4	-38.3	-179.2	-79.3	-72.2	0	0	0	112.7	A135 V216 S217 F218 I223 W224 F250 M253 F254 F257	A135-Y220 HydrophobicContact CB-CD2 4.37Å; A135-Y220 HydrophobicContact CB-CE2 3.78Å; V216-Y220 HydrophobicContact CG1-CD2 3.4Å; V216-Y220 VanDerWaalsContact CG1-CD2 3.4Å; V216-Y220 HydrophobicContact CG1-CE2 3.4Å; V216-Y220 VanDerWaalsContact O-CD2 3.22Å; V216-Y220 WeakPolarHBondContact O-CD2 3.3Å; V216-Y220 PolarHBondContact O-N 3.39Å; S217-Y220 PolarHBondContact O-N 3.21Å; F218-Y220 PolarHBondContact O-N 3.47Å; Y220-I223 PolarHBondContact O-N 3.07Å; Y220-W224 WeakPolarHBondContact O-CB 3.36Å; Y220-W224 PolarHBondContact O-N 3.48Å; Y220-F250 AromaticContact CD1-CD2 3.79Å; Y220-F250 HydrophobicContact CD1-CD2 3.79Å; Y220-F250 AromaticContact CD1-CE2 3.12Å; Y220-F250 HydrophobicContact CD1-CE2 3.12Å; Y220-F250 AromaticContact CD1-CZ 3.69Å; Y220-F250 HydrophobicContact CD1-CZ 3.69Å; Y220-F250 AromaticContact CE1-CD2 3.65Å; Y220-F250 HydrophobicContact CE1-CD2 3.65Å; Y220-F250 AromaticContact CE1-CE2 3.51Å; Y220-F250 HydrophobicContact CE1-CE2 3.51Å; Y220-F250 HydrophobicContact CE1-CZ 4.32Å; Y220-F250 HydrophobicContact CG-CE2 4.26Å; Y220-M253 VanDerWaalsContact OH-C 3.27Å; Y220-M253 VanDerWaalsContact OH-CB 3.23Å; Y220-M253 WeakPolarHBondContact OH-CB 3.18Å; Y220-M253 PolarHBondContact OH-O 3.01Å; Y220-F254 HydrophobicContact CD1-CB 3.76Å; Y220-F254 AromaticContact CD1-CD2 3.69Å; Y220-F254 HydrophobicContact CD1-CD2 3.69Å; Y220-F254 HydrophobicContact CD1-CG 4.13Å; Y220-F254 HydrophobicContact CD2-CD2 4.03Å; Y220-F254 HydrophobicContact CE1-CB 3.65Å; Y220-F254 HydrophobicContact CE1-CD2 4.31Å; Y220-F254 HydrophobicContact CE1-CG 4.47Å; Y220-F254 AromaticContact CG-CD2 3.63Å; Y220-F254 HydrophobicContact CG-CD2 3.63Å; Y220-F254 HydrophobicContact CG-CE2 4.4Å; Y220-F254 PolarHBondContact OH-N 2.96Å; Y220-F257 HydrophobicContact CD2-CD1 4.33Å; Y220-F257 HydrophobicContact CE2-CB 4.26Å; Y220-F257 HydrophobicContact CE2-CG 4.44Å
221	L	94.6	Very high	92.1	Very high	109 Å²	109	61.2 Å²	61.2	57%	0.571	31%	0.308	S	S	*	.	H	α-helix	trans	-61.4	-45.8	175.8	-179.1	65	0	0	0	111.5	S217 F218 I223 W224 V225	S217-L221 WeakPolarHBondContact O-CB 3.27Å; S217-L221 PolarHBondContact O-N 3.24Å; F218-L221 PolarHBondContact O-N 2.99Å; L221-I223 VanDerWaalsContact C-N 3.35Å; L221-I223 PolarHBondContact O-N 3.4Å; L221-W224 WeakPolarHBondContact O-CB 3.4Å; L221-W224 PolarHBondContact O-N 3.39Å; L221-V225 WeakPolarHBondContact O-CG2 3.41Å; L221-V225 PolarHBondContact O-N 3.31Å
222	R	93.8	Very high	91.3	Very high	134 Å²	134	66.9 Å²	66.9	51%	0.506	32%	0.323	S	S	.	.	H	α-helix	trans	-63.9	-40	178.4	-69.4	-67.7	-67.4	-167.6	-5.2	112.2	Y139 F218 C219 W224 L226	Y139-R222 HydrophobicContact CD2-CB 4.03Å; Y139-R222 HydrophobicContact CE2-CB 3.64Å; Y139-R222 HydrophobicContact CE2-CG 4.14Å; F218-R222 HydrophobicContact CD2-CG 4.2Å; F218-R222 HydrophobicContact CE1-CG 4.29Å; F218-R222 HydrophobicContact CE2-CG 3.8Å; F218-R222 HydrophobicContact CZ-CG 3.85Å; F218-R222 WeakPolarHBondContact O-CG 3.47Å; F218-R222 PolarHBondContact O-N 3.45Å; C219-R222 PolarHBondContact O-N 2.97Å; R222-W224 VanDerWaalsContact C-N 3.35Å; R222-L226 PolarHBondContact O-N 3.14Å; R222-L226 VanDerWaalsContact O-N 3.09Å
223	I	90.6	Very high	90.1	Very high	1 Å²	1	74.7 Å²	74.7	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-62.5	-45.2	174.1	-64	161.6	0	0	0	110.1	R138 Y139 I142 C219 Y220 L221 V225 L226 V227 F250	R138-I223 HydrophobicContact CB-CD1 4.38Å; Y139-I223 HydrophobicContact CD2-CG1 4.38Å; I142-I223 HydrophobicContact CD1-CD1 4.36Å; I142-I223 HydrophobicContact CD1-CG2 3.92Å; I142-I223 HydrophobicContact CG2-CG2 4.04Å; C219-I223 WeakPolarHBondContact O-CD1 3.4Å; C219-I223 VanDerWaalsContact O-CG1 3.28Å; C219-I223 WeakPolarHBondContact O-CG1 3.44Å; C219-I223 PolarHBondContact O-N 2.92Å; C219-I223 VanDerWaalsContact O-N 3.15Å; Y220-I223 PolarHBondContact O-N 3.07Å; L221-I223 VanDerWaalsContact C-N 3.35Å; L221-I223 PolarHBondContact O-N 3.4Å; I223-V225 PolarHBondContact O-N 3.4Å; I223-L226 WeakPolarHBondContact O-CB 3.44Å; I223-L226 PolarHBondContact O-N 3.19Å; I223-V227 HydrophobicContact CG2-CG2 4.32Å; I223-V227 VanDerWaalsContact O-CG2 3.28Å; I223-V227 WeakPolarHBondContact O-CG2 3.44Å; I223-V227 PolarHBondContact O-N 3.29Å; I223-F250 HydrophobicContact CB-CD2 4.28Å; I223-F250 HydrophobicContact CB-CE2 3.56Å; I223-F250 HydrophobicContact CB-CZ 4.08Å; I223-F250 HydrophobicContact CD1-CD2 3.85Å; I223-F250 HydrophobicContact CD1-CE2 3.61Å; I223-F250 HydrophobicContact CG1-CE2 4.19Å; I223-F250 HydrophobicContact CG2-CD2 3.62Å; I223-F250 HydrophobicContact CG2-CE1 4.35Å; I223-F250 HydrophobicContact CG2-CE2 3.24Å; I223-F250 HydrophobicContact CG2-CG 4.26Å; I223-F250 HydrophobicContact CG2-CZ 3.7Å
224	W	90.6	Very high	88.4	Confident	131 Å²	131	75.5 Å²	75.5	50%	0.496	37%	0.369	S	S	.	.	H	α-helix	trans	-61.5	-44.3	179.9	-168.8	-100.9	0	0	0	112.6	Y220 L221 R222 L226 V227 L228 F250	Y220-W224 WeakPolarHBondContact O-CB 3.36Å; Y220-W224 PolarHBondContact O-N 3.48Å; L221-W224 WeakPolarHBondContact O-CB 3.4Å; L221-W224 PolarHBondContact O-N 3.39Å; R222-W224 VanDerWaalsContact C-N 3.35Å; W224-L226 VanDerWaalsContact C-N 3.34Å; W224-L226 PolarHBondContact O-N 2.8Å; W224-V227 PolarHBondContact O-N 3.43Å; W224-L228 VanDerWaalsContact CD1-CD1 3.49Å; W224-L228 HydrophobicContact CG-CD1 4.5Å; W224-L228 WeakPolarHBondContact O-CG 3.28Å; W224-L228 PolarHBondContact O-N 3.32Å; W224-F250 HydrophobicContact CE3-CE1 4.11Å; W224-F250 HydrophobicContact CE3-CZ 4.43Å; W224-F250 HydrophobicContact CZ3-CE1 4.46Å
225	V	91.3	Very high	86.4	Confident	53 Å²	53	80.9 Å²	80.9	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-43.7	175.4	171.1	0	0	0	0	111.1	L221 I223 V227 L228 Q229	L221-V225 WeakPolarHBondContact O-CG2 3.41Å; L221-V225 PolarHBondContact O-N 3.31Å; I223-V225 PolarHBondContact O-N 3.4Å; V225-V227 PolarHBondContact O-N 2.87Å; V225-L228 PolarHBondContact O-N 3.43Å; V225-Q229 HydrophobicContact CG1-CG 4.38Å; V225-Q229 WeakPolarHBondContact O-CB 3.31Å; V225-Q229 VanDerWaalsContact O-CG 3.27Å; V225-Q229 WeakPolarHBondContact O-CG 3.39Å; V225-Q229 PolarHBondContact O-N 3.44Å
226	L	87.9	Confident	84.3	Confident	61 Å²	61	85.2 Å²	85.2	32%	0.319	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-44.2	176.6	-173.4	74.9	0	0	0	111.7	I142 R222 I223 W224 L228 Q229 A230	I142-L226 HydrophobicContact CG2-CD2 3.9Å; R222-L226 PolarHBondContact O-N 3.14Å; R222-L226 VanDerWaalsContact O-N 3.09Å; I223-L226 WeakPolarHBondContact O-CB 3.44Å; I223-L226 PolarHBondContact O-N 3.19Å; W224-L226 VanDerWaalsContact C-N 3.34Å; W224-L226 PolarHBondContact O-N 2.8Å; L226-L228 PolarHBondContact O-N 2.96Å; L226-Q229 PolarHBondContact O-N 3.02Å; L226-A230 WeakPolarHBondContact O-CB 3.43Å; L226-A230 PolarHBondContact O-N 3.47Å
227	V	85.5	Confident	82	Confident	15 Å²	15	94 Å²	94	9%	0.091	45%	0.451	C	S	.	.	H	α-helix	trans	-59	-47	176.3	171.7	0	0	0	0	110.7	I223 W224 V225 A230 R231 L242 L247	I223-V227 HydrophobicContact CG2-CG2 4.32Å; I223-V227 VanDerWaalsContact O-CG2 3.28Å; I223-V227 WeakPolarHBondContact O-CG2 3.44Å; I223-V227 PolarHBondContact O-N 3.29Å; W224-V227 PolarHBondContact O-N 3.43Å; V225-V227 PolarHBondContact O-N 2.87Å; V227-A230 PolarHBondContact O-N 3.43Å; V227-R231 HydrophobicContact CG1-CG 4.49Å; V227-R231 VanDerWaalsContact O-CG 3.23Å; V227-R231 WeakPolarHBondContact O-CG 3.32Å; V227-R231 PolarHBondContact O-N 3.15Å; V227-L242 HydrophobicContact CG2-CD1 3.68Å; V227-L247 HydrophobicContact CG1-CD1 3.99Å; V227-L247 HydrophobicContact CG2-CD1 3.92Å
228	L	86.3	Confident	79.8	Confident	69 Å²	69	94.8 Å²	94.8	36%	0.361	46%	0.457	S	S	.	.	H	α-helix	trans	-63.4	-42.2	178.8	-74.4	172.5	0	0	0	112.2	W224 V225 L226 R231 R232	W224-L228 VanDerWaalsContact CD1-CD1 3.49Å; W224-L228 HydrophobicContact CG-CD1 4.5Å; W224-L228 WeakPolarHBondContact O-CG 3.28Å; W224-L228 PolarHBondContact O-N 3.32Å; V225-L228 PolarHBondContact O-N 3.43Å; L226-L228 PolarHBondContact O-N 2.96Å; L228-R231 PolarHBondContact O-N 2.98Å; L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.21Å
229	Q	86.4	Confident	77.6	Confident	99 Å²	99	96.5 Å²	96.5	46%	0.463	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-42.5	177.3	-72.8	175.9	3	0	0	111.8	V225 L226 R231 R232 K233	V225-Q229 HydrophobicContact CG1-CG 4.38Å; V225-Q229 WeakPolarHBondContact O-CB 3.31Å; V225-Q229 VanDerWaalsContact O-CG 3.27Å; V225-Q229 WeakPolarHBondContact O-CG 3.39Å; V225-Q229 PolarHBondContact O-N 3.44Å; L226-Q229 PolarHBondContact O-N 3.02Å; Q229-R231 VanDerWaalsContact C-N 3.35Å; Q229-R232 PolarHBondContact O-N 3.29Å; Q229-K233 WeakPolarHBondContact O-CB 3.26Å; Q229-K233 WeakPolarHBondContact O-CG 3.29Å; Q229-K233 PolarHBondContact O-N 3.24Å
230	A	80.3	Confident	75.6	Confident	41 Å²	41	103.7 Å²	103.7	34%	0.339	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-41.1	176.1	0	0	0	0	0	111.7	L226 V227 K233 A234	L226-A230 WeakPolarHBondContact O-CB 3.43Å; L226-A230 PolarHBondContact O-N 3.47Å; V227-A230 PolarHBondContact O-N 3.43Å; A230-K233 PolarHBondContact O-N 3.15Å; A230-A234 WeakPolarHBondContact O-CB 3.49Å; A230-A234 PolarHBondContact O-N 3.45Å; A230-A234 VanDerWaalsContact O-N 3.12Å
231	R	79.1	Confident	73.8	Confident	151 Å²	151	107.1 Å²	107.1	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-63	-41.8	174.9	-70.8	-76.8	-173.3	-163.9	-0.6	112.5	V227 L228 Q229	V227-R231 HydrophobicContact CG1-CG 4.49Å; V227-R231 VanDerWaalsContact O-CG 3.23Å; V227-R231 WeakPolarHBondContact O-CG 3.32Å; V227-R231 PolarHBondContact O-N 3.15Å; L228-R231 PolarHBondContact O-N 2.98Å; Q229-R231 VanDerWaalsContact C-N 3.35Å
232	R	80.2	Confident	72.4	Confident	213 Å²	213	104.2 Å²	104.2	80%	0.804	52%	0.522	S	S	*	.	H	α-helix	trans	-70.4	-32.7	179.4	-73.1	177.8	-177.3	-176.8	1.2	113.3	L228 Q229	L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.21Å; Q229-R232 PolarHBondContact O-N 3.29Å
233	K	73.3	Confident	71.3	Confident	172 Å²	172	104.3 Å²	104.3	75%	0.748	52%	0.523	S	S	*	.	H	α-helix	trans	-88.6	-8.9	-179.8	-71.4	-176.8	177.6	-176.9	0	114.1	Q229 A230 K235	Q229-K233 WeakPolarHBondContact O-CB 3.26Å; Q229-K233 WeakPolarHBondContact O-CG 3.29Å; Q229-K233 PolarHBondContact O-N 3.24Å; A230-K233 PolarHBondContact O-N 3.15Å; K233-K235 PolarHBondContact O-N 3.06Å
234	A	60	Low	70.3	Confident	56 Å²	56	108.5 Å²	108.5	46%	0.463	55%	0.55	S	S	.	.			trans	-70.8	99.3	179.6	0	0	0	0	0	110.7	A230	A230-A234 WeakPolarHBondContact O-CB 3.49Å; A230-A234 PolarHBondContact O-N 3.45Å; A230-A234 VanDerWaalsContact O-N 3.12Å
235	K	55.7	Low	69.4	Low	171 Å²	171	105.3 Å²	105.3	74%	0.743	55%	0.548	S	S	*	.			trans	-64.3	150.7	147.1	-79.6	-174.6	176	-175.6	0	107.9	K233 E237 S238	K233-K235 PolarHBondContact O-N 3.06Å; K235-E237 PolarHBondContact O-N 3.4Å; K235-S238 PolarHBondContact O-N 2.85Å
236	P	55.2	Low	68.5	Low	141 Å²	141	104.5 Å²	104.5	92%	0.916	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-11.8	-173.3	16.8	-28.9	0	0	0	116
237	E	48.1	Very low	67.9	Low	186 Å²	186	103.7 Å²	103.7	87%	0.869	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-2	-177.2	-79.4	-174.2	132.8	0	0	116.8	K235	K235-E237 PolarHBondContact O-N 3.4Å
238	S	50.2	Low	67.6	Low	66 Å²	66	109 Å²	109	46%	0.462	56%	0.556	S	S	.	*			trans	-90.4	116.8	-176	62.1	0	0	0	0	114.4	K235 L240	K235-S238 PolarHBondContact O-N 2.85Å; S238-L240 PolarHBondContact O-N 2.96Å
239	T	51.4	Low	67.1	Low	146 Å²	146	106.6 Å²	106.6	90%	0.896	55%	0.545	S	S	*	.	S	Bend	trans	-66.6	11	-171.8	43.9	0	0	0	0	117.2	C241	T239-C241 VanDerWaalsContact C-N 3.34Å
240	L	52.9	Low	66.9	Low	155 Å²	155	102.2 Å²	102.2	81%	0.812	52%	0.524	S	S	*	.			trans	-96.2	21.5	180	-109.5	154.5	0	0	0	113.2	S238 L242	S238-L240 PolarHBondContact O-N 2.96Å; L240-L242 PolarHBondContact O-N 3.44Å
241	C	57.4	Low	67.3	Low	80 Å²	80	104 Å²	104	54%	0.541	53%	0.528	S	S	.	.			trans	-70.3	112.8	174.6	-152.7	0	0	0	0	109	T239 R243	T239-C241 VanDerWaalsContact C-N 3.34Å; C241-R243 PolarHBondContact O-N 3.01Å
242	L	64.7	Low	67.8	Low	47 Å²	47	96.9 Å²	96.9	25%	0.246	50%	0.501	C	S	.	.			trans	-42.7	124.5	167.6	-88.8	150.3	0	0	0	109.7	I142 V227 L240	I142-L242 HydrophobicContact CG2-CD1 4.49Å; I142-L242 HydrophobicContact CG2-CD2 3.98Å; V227-L242 HydrophobicContact CG2-CD1 3.68Å; L240-L242 PolarHBondContact O-N 3.44Å
243	R	69.5	Low	68.2	Low	136 Å²	136	87.1 Å²	87.1	51%	0.513	47%	0.465	S	S	.	.			trans	-55.1	133.1	-177.1	-70.1	178.9	-65.3	-161	-3.8	108.9	Y141 C241 S245 D246 L247	Y141-R243 PolarHBondContact OH-NH2 2.91Å; C241-R243 PolarHBondContact O-N 3.01Å; R243-S245 PolarHBondContact O-N 3.48Å; R243-D246 HydrophobicContact CB-CB 4.43Å; R243-D246 IonicContact CZ-OD2 2.62Å; R243-D246 IonicContact NE-OD1 3.31Å; R243-D246 IonicContact NE-OD2 3.06Å; R243-D246 PolarHBondContact NE-OD2 3.43Å; R243-D246 IonicContact NH2-OD1 2.87Å; R243-D246 IonicContact NH2-OD2 2.84Å; R243-D246 PolarHBondContact NH2-OD2 3.08Å; R243-D246 WeakPolarHBondContact O-CB 3.26Å; R243-D246 PolarHBondContact O-N 3.45Å; R243-L247 PolarHBondContact O-N 3.31Å
244	P	70.9	Confident	69.1	Low	89 Å²	89	82.9 Å²	82.9	58%	0.578	45%	0.446	S	S	*	.	H	α-helix	trans	-53.9	-29.4	179.7	-28.6	34.7	0	0	0	113.8	R248	P244-R248 WeakPolarHBondContact O-CG 3.06Å; P244-R248 PolarHBondContact O-N 3.35Å; P244-R248 VanDerWaalsContact O-N 3.09Å
245	S	70.3	Confident	70.8	Confident	64 Å²	64	82.1 Å²	82.1	45%	0.448	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-40.9	172.9	55.2	0	0	0	0	113.2	R243 R248 S249	R243-S245 PolarHBondContact O-N 3.48Å; S245-R248 PolarHBondContact O-N 3.16Å; S245-S249 WeakPolarHBondContact O-CB 3.49Å; S245-S249 PolarHBondContact O-N 2.94Å
246	D	72.3	Confident	72.7	Confident	36 Å²	36	74.2 Å²	74.2	19%	0.193	40%	0.402	C	S	.	.	H	α-helix	trans	-72.6	-38.8	-176.7	-61.8	-14.4	0	0	0	109.6	R243 S249 F250	R243-D246 HydrophobicContact CB-CB 4.43Å; R243-D246 IonicContact CZ-OD2 2.62Å; R243-D246 IonicContact NE-OD1 3.31Å; R243-D246 IonicContact NE-OD2 3.06Å; R243-D246 PolarHBondContact NE-OD2 3.43Å; R243-D246 IonicContact NH2-OD1 2.87Å; R243-D246 IonicContact NH2-OD2 2.84Å; R243-D246 PolarHBondContact NH2-OD2 3.08Å; R243-D246 WeakPolarHBondContact O-CB 3.26Å; R243-D246 PolarHBondContact O-N 3.45Å; D246-S249 PolarHBondContact O-N 3.35Å; D246-F250 WeakPolarHBondContact O-CB 3.43Å; D246-F250 PolarHBondContact O-N 2.86Å
247	L	76	Confident	74.6	Confident	44 Å²	44	68.1 Å²	68.1	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-63	-43.8	173.2	-169.2	69.6	0	0	0	112.2	V227 R243 F250 L251	V227-L247 HydrophobicContact CG1-CD1 3.99Å; V227-L247 HydrophobicContact CG2-CD1 3.92Å; R243-L247 PolarHBondContact O-N 3.31Å; L247-F250 HydrophobicContact CD1-CD1 4.33Å; L247-F250 PolarHBondContact O-N 2.89Å; L247-L251 WeakPolarHBondContact O-CB 3.37Å; L247-L251 PolarHBondContact O-N 3.46Å
248	R	78.6	Confident	76.9	Confident	126 Å²	126	62 Å²	62	48%	0.475	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.2	-75.2	177.2	-174.4	166.3	3.1	112.1	P244 S245 L251 T252 Q313	P244-R248 WeakPolarHBondContact O-CG 3.06Å; P244-R248 PolarHBondContact O-N 3.35Å; P244-R248 VanDerWaalsContact O-N 3.09Å; S245-R248 PolarHBondContact O-N 3.16Å; R248-L251 PolarHBondContact O-N 2.93Å; R248-T252 PolarHBondContact O-N 3.4Å; R248-T252 PolarHBondContact O-OG1 2.79Å; R248-Q313 VanDerWaalsContact NH1-CD 3.26Å; R248-Q313 VanDerWaalsContact NH1-NE2 3.13Å
249	S	76.3	Confident	79.1	Confident	20 Å²	20	60.8 Å²	60.8	14%	0.14	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-42.5	176.7	-175	0	0	0	0	111.6	S245 D246 T252 M253	S245-S249 WeakPolarHBondContact O-CB 3.49Å; S245-S249 PolarHBondContact O-N 2.94Å; D246-S249 PolarHBondContact O-N 3.35Å; S249-T252 PolarHBondContact O-N 3.09Å; S249-M253 WeakPolarHBondContact O-CG 3.48Å; S249-M253 PolarHBondContact O-N 2.9Å
250	F	83.3	Confident	81.3	Confident	7 Å²	7	54 Å²	54	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-48.4	173.8	156.9	-95.2	0	0	0	111.5	I142 Y220 I223 W224 D246 L247 T252 M253 F254	I142-F250 HydrophobicContact CD1-CB 4.35Å; I142-F250 HydrophobicContact CD1-CD2 4.38Å; Y220-F250 AromaticContact CD1-CD2 3.79Å; Y220-F250 HydrophobicContact CD1-CD2 3.79Å; Y220-F250 AromaticContact CD1-CE2 3.12Å; Y220-F250 HydrophobicContact CD1-CE2 3.12Å; Y220-F250 AromaticContact CD1-CZ 3.69Å; Y220-F250 HydrophobicContact CD1-CZ 3.69Å; Y220-F250 AromaticContact CE1-CD2 3.65Å; Y220-F250 HydrophobicContact CE1-CD2 3.65Å; Y220-F250 AromaticContact CE1-CE2 3.51Å; Y220-F250 HydrophobicContact CE1-CE2 3.51Å; Y220-F250 HydrophobicContact CE1-CZ 4.32Å; Y220-F250 HydrophobicContact CG-CE2 4.26Å; I223-F250 HydrophobicContact CB-CD2 4.28Å; I223-F250 HydrophobicContact CB-CE2 3.56Å; I223-F250 HydrophobicContact CB-CZ 4.08Å; I223-F250 HydrophobicContact CD1-CD2 3.85Å; I223-F250 HydrophobicContact CD1-CE2 3.61Å; I223-F250 HydrophobicContact CG1-CE2 4.19Å; I223-F250 HydrophobicContact CG2-CD2 3.62Å; I223-F250 HydrophobicContact CG2-CE1 4.35Å; I223-F250 HydrophobicContact CG2-CE2 3.24Å; I223-F250 HydrophobicContact CG2-CG 4.26Å; I223-F250 HydrophobicContact CG2-CZ 3.7Å; W224-F250 HydrophobicContact CE3-CE1 4.11Å; W224-F250 HydrophobicContact CE3-CZ 4.43Å; W224-F250 HydrophobicContact CZ3-CE1 4.46Å; D246-F250 WeakPolarHBondContact O-CB 3.43Å; D246-F250 PolarHBondContact O-N 2.86Å; L247-F250 HydrophobicContact CD1-CD1 4.33Å; L247-F250 PolarHBondContact O-N 2.89Å; F250-T252 VanDerWaalsContact C-N 3.28Å; F250-T252 PolarHBondContact O-N 2.87Å; F250-M253 PolarHBondContact O-N 2.95Å; F250-M253 VanDerWaalsContact O-N 3.13Å; F250-F254 PolarHBondContact O-N 2.67Å
251	L	87.1	Confident	83.3	Confident	78 Å²	78	47.7 Å²	47.7	41%	0.408	25%	0.252	S	S	.	.	H	α-helix	trans	-61.5	-40.2	-179.8	-167.7	154.6	0	0	0	111	L247 R248 M253 F254 V255 L311	L247-L251 WeakPolarHBondContact O-CB 3.37Å; L247-L251 PolarHBondContact O-N 3.46Å; R248-L251 PolarHBondContact O-N 2.93Å; L251-M253 PolarHBondContact O-N 2.95Å; L251-F254 PolarHBondContact O-N 3.41Å; L251-V255 HydrophobicContact CD2-CG2 3.91Å; L251-V255 WeakPolarHBondContact O-CG2 3.34Å; L251-V255 PolarHBondContact O-N 2.94Å; L251-L311 HydrophobicContact CD2-CD1 4.27Å
252	T	89.6	Confident	85.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-47.2	174.7	-54.3	0	0	0	0	111.4	R248 S249 F250 V255 V256 V307 Y308 L311 N312	R248-T252 PolarHBondContact O-N 3.4Å; R248-T252 PolarHBondContact O-OG1 2.79Å; S249-T252 PolarHBondContact O-N 3.09Å; F250-T252 VanDerWaalsContact C-N 3.28Å; F250-T252 PolarHBondContact O-N 2.87Å; T252-V255 PolarHBondContact O-N 3.41Å; T252-V256 WeakPolarHBondContact O-CG2 3.23Å; T252-V256 PolarHBondContact O-N 3.38Å; T252-V256 VanDerWaalsContact O-N 3.07Å; T252-V307 HydrophobicContact CG2-CG1 4.05Å; T252-Y308 HydrophobicContact CG2-CD1 3.75Å; T252-Y308 HydrophobicContact CG2-CE1 4.28Å; T252-L311 HydrophobicContact CG2-CB 4Å; T252-L311 WeakPolarHBondContact OG1-CB 3.37Å; T252-N312 HydrophobicContact CG2-CB 4.35Å
253	M	89.8	Confident	86.8	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.039	24%	0.243	C	C	.	.	H	α-helix	trans	-70	-33.4	-179.7	-67.2	173.6	149.8	0	0	112.6	L79 I134 R138 Y220 S249 F250 L251 V256 F257	L79-M253 HydrophobicContact CD1-CE 4.15Å; L79-M253 HydrophobicContact CD2-CE 3.91Å; L79-M253 HydrophobicContact CG-CE 4.16Å; I134-M253 HydrophobicContact CG2-CB 4.21Å; I134-M253 HydrophobicContact CG2-CE 3.54Å; I134-M253 HydrophobicContact CG2-CG 4Å; I134-M253 HydrophobicContact CG2-SD 3.43Å; I134-M253 WeakPolarHBondContact CG2-SD 3.2Å; R138-M253 HydrophobicContact CG-SD 3.64Å; R138-M253 PolarHBondContact NE-SD 3.3Å; R138-M253 VanDerWaalsContact NH2-CE 3.31Å; Y220-M253 VanDerWaalsContact OH-C 3.27Å; Y220-M253 VanDerWaalsContact OH-CB 3.23Å; Y220-M253 WeakPolarHBondContact OH-CB 3.18Å; Y220-M253 PolarHBondContact OH-O 3.01Å; S249-M253 WeakPolarHBondContact O-CG 3.48Å; S249-M253 PolarHBondContact O-N 2.9Å; F250-M253 PolarHBondContact O-N 2.95Å; F250-M253 VanDerWaalsContact O-N 3.13Å; L251-M253 PolarHBondContact O-N 2.95Å; M253-V256 PolarHBondContact O-N 2.98Å; M253-F257 PolarHBondContact O-N 3.08Å; M253-F257 VanDerWaalsContact O-N 3.09Å
254	F	92.8	Very high	88.2	Confident	82 Å²	82	41.1 Å²	41.1	36%	0.36	22%	0.224	S	C	.	.	H	α-helix	trans	-63.6	-44.9	171.6	176.4	-109.5	0	0	0	111.6	Y220 F250 L251 V256 F257 V258	Y220-F254 HydrophobicContact CD1-CB 3.76Å; Y220-F254 AromaticContact CD1-CD2 3.69Å; Y220-F254 HydrophobicContact CD1-CD2 3.69Å; Y220-F254 HydrophobicContact CD1-CG 4.13Å; Y220-F254 HydrophobicContact CD2-CD2 4.03Å; Y220-F254 HydrophobicContact CE1-CB 3.65Å; Y220-F254 HydrophobicContact CE1-CD2 4.31Å; Y220-F254 HydrophobicContact CE1-CG 4.47Å; Y220-F254 AromaticContact CG-CD2 3.63Å; Y220-F254 HydrophobicContact CG-CD2 3.63Å; Y220-F254 HydrophobicContact CG-CE2 4.4Å; Y220-F254 PolarHBondContact OH-N 2.96Å; F250-F254 PolarHBondContact O-N 2.67Å; L251-F254 PolarHBondContact O-N 3.41Å; F254-V256 VanDerWaalsContact C-N 3.33Å; F254-V256 PolarHBondContact O-N 3.42Å; F254-F257 HydrophobicContact CD2-CD1 4.2Å; F254-F257 HydrophobicContact CE2-CD1 4.24Å; F254-F257 WeakPolarHBondContact O-CB 3.01Å; F254-F257 PolarHBondContact O-N 3.02Å; F254-F257 VanDerWaalsContact O-N 3.16Å; F254-V258 HydrophobicContact CD1-CG2 4.28Å; F254-V258 HydrophobicContact CD2-CG2 4.35Å; F254-V258 HydrophobicContact CE1-CG2 3.81Å; F254-V258 HydrophobicContact CE2-CG2 3.89Å; F254-V258 HydrophobicContact CZ-CG2 3.6Å; F254-V258 WeakPolarHBondContact O-CG2 3.3Å; F254-V258 PolarHBondContact O-N 3.24Å
255	V	95.2	Very high	89.4	Confident	41 Å²	41	38.4 Å²	38.4	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-41.8	177	170	0	0	0	0	111.2	L251 T252 F257 V258 I259 V307 L311	L251-V255 HydrophobicContact CD2-CG2 3.91Å; L251-V255 WeakPolarHBondContact O-CG2 3.34Å; L251-V255 PolarHBondContact O-N 2.94Å; T252-V255 PolarHBondContact O-N 3.41Å; V255-F257 VanDerWaalsContact C-N 3.32Å; V255-F257 PolarHBondContact O-N 3.49Å; V255-V258 PolarHBondContact O-N 3.45Å; V255-I259 HydrophobicContact CG1-CD1 3.76Å; V255-I259 HydrophobicContact CG1-CG1 4.42Å; V255-I259 WeakPolarHBondContact O-CG1 3.44Å; V255-I259 PolarHBondContact O-N 2.88Å; V255-V307 HydrophobicContact CB-CG1 4.32Å; V255-V307 HydrophobicContact CG1-CG1 3.92Å; V255-V307 HydrophobicContact CG1-CG2 4.35Å; V255-L311 HydrophobicContact CB-CD1 3.85Å; V255-L311 HydrophobicContact CG1-CD1 3.9Å; V255-L311 HydrophobicContact CG2-CD1 3.8Å
256	V	94.2	Very high	90.7	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-46.7	173.2	165.7	0	0	0	0	111.4	T252 M253 F254 I259 F260 N304 V307 Y308	T252-V256 WeakPolarHBondContact O-CG2 3.23Å; T252-V256 PolarHBondContact O-N 3.38Å; T252-V256 VanDerWaalsContact O-N 3.07Å; M253-V256 PolarHBondContact O-N 2.98Å; F254-V256 VanDerWaalsContact C-N 3.33Å; F254-V256 PolarHBondContact O-N 3.42Å; V256-I259 PolarHBondContact O-N 2.95Å; V256-F260 WeakPolarHBondContact O-CB 3Å; V256-F260 PolarHBondContact O-N 3.29Å; V256-N304 WeakPolarHBondContact CG1-OD1 3.4Å; V256-V307 HydrophobicContact CG2-CB 4.05Å; V256-V307 HydrophobicContact CG2-CG1 3.66Å; V256-Y308 HydrophobicContact CG2-CD1 4.4Å; V256-Y308 HydrophobicContact CG2-CE1 3.6Å
257	F	95.3	Very high	91.8	Very high	13 Å²	13	36.2 Å²	36.2	6%	0.057	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-45	176.1	159.6	-106.4	0	0	0	112.8	I131 I213 V216 Y220 M253 F254 V255 I259 F260 A261	I131-F257 HydrophobicContact CG2-CB 4.1Å; I131-F257 HydrophobicContact CG2-CD2 4.13Å; I213-F257 HydrophobicContact CD1-CD2 4.39Å; I213-F257 HydrophobicContact CD1-CE2 3.47Å; I213-F257 VanDerWaalsContact CD1-CE2 3.47Å; I213-F257 HydrophobicContact CD1-CZ 4.05Å; I213-F257 HydrophobicContact CG2-CZ 4.36Å; V216-F257 HydrophobicContact CB-CD2 3.97Å; V216-F257 HydrophobicContact CB-CE2 3.66Å; V216-F257 HydrophobicContact CB-CZ 4.11Å; V216-F257 HydrophobicContact CG1-CB 4.22Å; V216-F257 HydrophobicContact CG1-CD1 3.9Å; V216-F257 HydrophobicContact CG1-CD2 3.27Å; V216-F257 HydrophobicContact CG1-CE1 4.04Å; V216-F257 HydrophobicContact CG1-CE2 3.4Å; V216-F257 VanDerWaalsContact CG1-CE2 3.4Å; V216-F257 HydrophobicContact CG1-CG 3.51Å; V216-F257 HydrophobicContact CG1-CZ 3.81Å; V216-F257 HydrophobicContact CG2-CE2 4.44Å; Y220-F257 HydrophobicContact CD2-CD1 4.33Å; Y220-F257 HydrophobicContact CE2-CB 4.26Å; Y220-F257 HydrophobicContact CE2-CG 4.44Å; M253-F257 PolarHBondContact O-N 3.08Å; M253-F257 VanDerWaalsContact O-N 3.09Å; F254-F257 HydrophobicContact CD2-CD1 4.2Å; F254-F257 HydrophobicContact CE2-CD1 4.24Å; F254-F257 WeakPolarHBondContact O-CB 3.01Å; F254-F257 PolarHBondContact O-N 3.02Å; F254-F257 VanDerWaalsContact O-N 3.16Å; V255-F257 VanDerWaalsContact C-N 3.32Å; V255-F257 PolarHBondContact O-N 3.49Å; F257-I259 PolarHBondContact O-N 3.45Å; F257-F260 WeakPolarHBondContact O-CB 3.46Å; F257-F260 PolarHBondContact O-N 3.48Å; F257-A261 PolarHBondContact O-N 2.84Å
258	V	96.9	Very high	92.8	Very high	57 Å²	57	35.2 Å²	35.2	35%	0.345	19%	0.189	S	C	.	.	H	α-helix	trans	-62.6	-44.3	179.4	171.7	0	0	0	0	110.9	F254 V255 F260 A261 V262	F254-V258 HydrophobicContact CD1-CG2 4.28Å; F254-V258 HydrophobicContact CD2-CG2 4.35Å; F254-V258 HydrophobicContact CE1-CG2 3.81Å; F254-V258 HydrophobicContact CE2-CG2 3.89Å; F254-V258 HydrophobicContact CZ-CG2 3.6Å; F254-V258 WeakPolarHBondContact O-CG2 3.3Å; F254-V258 PolarHBondContact O-N 3.24Å; V255-V258 PolarHBondContact O-N 3.45Å; V258-F260 VanDerWaalsContact C-N 3.34Å; V258-F260 PolarHBondContact O-N 3.42Å; V258-A261 PolarHBondContact O-N 3.23Å; V258-V262 HydrophobicContact CG1-CG2 4.44Å; V258-V262 WeakPolarHBondContact O-CG2 3.19Å; V258-V262 PolarHBondContact O-N 3.19Å
259	I	97.1	Very high	93.7	Very high	41 Å²	41	33.1 Å²	33.1	21%	0.21	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-44.8	176.5	-73.7	168	0	0	0	110.6	V255 V256 F257 A261 V262 C263 L303 V307	V255-I259 HydrophobicContact CG1-CD1 3.76Å; V255-I259 HydrophobicContact CG1-CG1 4.42Å; V255-I259 WeakPolarHBondContact O-CG1 3.44Å; V255-I259 PolarHBondContact O-N 2.88Å; V256-I259 PolarHBondContact O-N 2.95Å; F257-I259 PolarHBondContact O-N 3.45Å; I259-A261 PolarHBondContact O-N 3.47Å; I259-V262 PolarHBondContact O-N 2.68Å; I259-C263 WeakPolarHBondContact O-CB 3.27Å; I259-C263 PolarHBondContact O-N 3.3Å; I259-C263 PolarHBondContact O-SG 2.89Å; I259-C263 VanDerWaalsContact O-SG 3.35Å; I259-L303 HydrophobicContact CG2-CB 4.01Å; I259-L303 HydrophobicContact CG2-CD1 3.43Å; I259-L303 VanDerWaalsContact CG2-CD1 3.43Å; I259-L303 HydrophobicContact CG2-CG 4.35Å; I259-V307 HydrophobicContact CD1-CG2 3.45Å; I259-V307 VanDerWaalsContact CD1-CG2 3.45Å
260	F	96.6	Very high	94.6	Very high	5 Å²	5	32.7 Å²	32.7	2%	0.022	19%	0.189	C	C	.	.	H	α-helix	trans	-56.6	-50.5	174.4	-176.7	-83.1	0	0	0	111.6	V128 I131 F209 V256 F257 V258 V262 C263 W264 N300	V128-F260 HydrophobicContact CB-CZ 4.36Å; V128-F260 HydrophobicContact CG2-CE1 3.52Å; V128-F260 HydrophobicContact CG2-CE2 4.17Å; V128-F260 HydrophobicContact CG2-CZ 3.19Å; I131-F260 HydrophobicContact CD1-CB 3.79Å; I131-F260 HydrophobicContact CD1-CD1 4.26Å; I131-F260 HydrophobicContact CD1-CD2 3.52Å; I131-F260 HydrophobicContact CD1-CE2 4.24Å; I131-F260 HydrophobicContact CD1-CG 3.56Å; F209-F260 HydrophobicContact CE2-CE1 4.43Å; V256-F260 WeakPolarHBondContact O-CB 3Å; V256-F260 PolarHBondContact O-N 3.29Å; F257-F260 WeakPolarHBondContact O-CB 3.46Å; F257-F260 PolarHBondContact O-N 3.48Å; V258-F260 VanDerWaalsContact C-N 3.34Å; V258-F260 PolarHBondContact O-N 3.42Å; F260-V262 VanDerWaalsContact C-N 3.32Å; F260-V262 PolarHBondContact O-N 3Å; F260-C263 PolarHBondContact O-N 3.11Å; F260-W264 AromaticContact CD2-CD1 3.59Å; F260-W264 AromaticContact CD2-NE1 3.78Å; F260-W264 HydrophobicContact CE1-CB 4.23Å; F260-W264 AromaticContact CE1-CD1 3.72Å; F260-W264 HydrophobicContact CE1-CG 4.05Å; F260-W264 AromaticContact CE2-CD1 3.3Å; F260-W264 HydrophobicContact CE2-CG 4.18Å; F260-W264 AromaticContact CE2-NE1 3.3Å; F260-W264 VanDerWaalsContact CE2-NE1 3.3Å; F260-W264 AromaticContact CG-CD1 3.92Å; F260-W264 HydrophobicContact CZ-CB 4.42Å; F260-W264 AromaticContact CZ-CD1 3.33Å; F260-W264 HydrophobicContact CZ-CD2 4.34Å; F260-W264 AromaticContact CZ-CG 3.78Å; F260-W264 HydrophobicContact CZ-CG 3.78Å; F260-W264 AromaticContact CZ-NE1 3.67Å; F260-W264 WeakPolarHBondContact O-CB 3.49Å; F260-W264 VanDerWaalsContact O-CD1 3.25Å; F260-W264 PolarHBondContact O-N 3.11Å; F260-N300 WeakPolarHBondContact CD2-OD1 3.48Å
261	A	96.6	Very high	95.1	Very high	21 Å²	21	32.4 Å²	32.4	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-43	179.5	0	0	0	0	0	112.1	I213 F257 V258 I259 A265	I213-A261 HydrophobicContact CD1-CB 3.76Å; F257-A261 PolarHBondContact O-N 2.84Å; V258-A261 PolarHBondContact O-N 3.23Å; I259-A261 PolarHBondContact O-N 3.47Å; A261-A265 WeakPolarHBondContact O-CA 3.41Å; A261-A265 WeakPolarHBondContact O-CB 3.35Å; A261-A265 PolarHBondContact O-N 3.06Å
262	V	97.7	Very high	95.5	Very high	89 Å²	89	31.6 Å²	31.6	54%	0.539	18%	0.184	S	C	.	.	H	α-helix	trans	-66.5	-43.2	178.7	170.7	0	0	0	0	111.9	V258 I259 F260 W264 P266	V258-V262 HydrophobicContact CG1-CG2 4.44Å; V258-V262 WeakPolarHBondContact O-CG2 3.19Å; V258-V262 PolarHBondContact O-N 3.19Å; I259-V262 PolarHBondContact O-N 2.68Å; F260-V262 VanDerWaalsContact C-N 3.32Å; F260-V262 PolarHBondContact O-N 3Å; V262-W264 VanDerWaalsContact C-N 3.34Å; V262-W264 PolarHBondContact O-N 3.13Å; V262-P266 VanDerWaalsContact O-CD 3.26Å; V262-P266 WeakPolarHBondContact O-CD 3.38Å
263	C	97.6	Very high	95.7	Very high	9 Å²	9	33 Å²	33	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-38.3	178.9	-75.5	0	0	0	0	112.6	I259 F260 L296 N300	I259-C263 WeakPolarHBondContact O-CB 3.27Å; I259-C263 PolarHBondContact O-N 3.3Å; I259-C263 PolarHBondContact O-SG 2.89Å; I259-C263 VanDerWaalsContact O-SG 3.35Å; F260-C263 PolarHBondContact O-N 3.11Å; C263-L296 WeakPolarHBondContact CB-O 3.38Å; C263-L296 PolarHBondContact SG-O 3.29Å; C263-L296 VanDerWaalsContact SG-O 3.39Å; C263-N300 HydrophobicContact CB-CB 3.76Å
264	W	97.3	Very high	95.8	Very high	27 Å²	27	32.9 Å²	32.9	10%	0.102	20%	0.195	C	C	.	.	H	α-helix	trans	-97.9	-18.4	-172.1	-72.8	97	0	0	0	114.5	V124 F209 F260 V262 L267 N268 A297 N300	V124-W264 HydrophobicContact CB-CH2 3.94Å; V124-W264 HydrophobicContact CB-CZ2 4.16Å; V124-W264 HydrophobicContact CB-CZ3 4.39Å; V124-W264 HydrophobicContact CG1-CD2 4.15Å; V124-W264 HydrophobicContact CG1-CE3 3.88Å; V124-W264 HydrophobicContact CG1-CH2 3.49Å; V124-W264 VanDerWaalsContact CG1-CH2 3.49Å; V124-W264 HydrophobicContact CG1-CZ2 3.73Å; V124-W264 HydrophobicContact CG1-CZ3 3.53Å; V124-W264 HydrophobicContact CG2-CH2 3.1Å; V124-W264 HydrophobicContact CG2-CZ2 3.43Å; V124-W264 VanDerWaalsContact CG2-CZ2 3.43Å; V124-W264 HydrophobicContact CG2-CZ3 3.92Å; F209-W264 HydrophobicContact CD2-CB 4.35Å; F209-W264 HydrophobicContact CE2-CB 3.73Å; F209-W264 HydrophobicContact CZ-CB 4.48Å; F260-W264 AromaticContact CD2-CD1 3.59Å; F260-W264 AromaticContact CD2-NE1 3.78Å; F260-W264 HydrophobicContact CE1-CB 4.23Å; F260-W264 AromaticContact CE1-CD1 3.72Å; F260-W264 HydrophobicContact CE1-CG 4.05Å; F260-W264 AromaticContact CE2-CD1 3.3Å; F260-W264 HydrophobicContact CE2-CG 4.18Å; F260-W264 AromaticContact CE2-NE1 3.3Å; F260-W264 VanDerWaalsContact CE2-NE1 3.3Å; F260-W264 AromaticContact CG-CD1 3.92Å; F260-W264 HydrophobicContact CZ-CB 4.42Å; F260-W264 AromaticContact CZ-CD1 3.33Å; F260-W264 HydrophobicContact CZ-CD2 4.34Å; F260-W264 AromaticContact CZ-CG 3.78Å; F260-W264 HydrophobicContact CZ-CG 3.78Å; F260-W264 AromaticContact CZ-NE1 3.67Å; F260-W264 WeakPolarHBondContact O-CB 3.49Å; F260-W264 VanDerWaalsContact O-CD1 3.25Å; F260-W264 PolarHBondContact O-N 3.11Å; V262-W264 VanDerWaalsContact C-N 3.34Å; V262-W264 PolarHBondContact O-N 3.13Å; W264-L267 HydrophobicContact CE3-CD2 4.25Å; W264-L267 HydrophobicContact CZ3-CD2 3.91Å; W264-L267 PolarHBondContact O-N 2.87Å; W264-N268 PolarHBondContact O-N 3.17Å; W264-N268 VanDerWaalsContact O-N 3.15Å; W264-N268 PolarHBondContact O-ND2 3.38Å; W264-A297 HydrophobicContact CD2-CB 4.3Å; W264-A297 HydrophobicContact CE3-CB 4.13Å; W264-A297 HydrophobicContact CH2-CB 3.74Å; W264-A297 HydrophobicContact CZ2-CB 3.96Å; W264-A297 HydrophobicContact CZ3-CB 3.87Å; W264-N300 PolarHBondContact NE1-OD1 3.22Å; W264-N300 VanDerWaalsContact NE1-OD1 3.12Å
265	A	97.2	Very high	95.8	Very high	32 Å²	32	29.7 Å²	29.7	26%	0.264	19%	0.185	S	C	.	.	H	α-helix	trans	-57.6	-47.9	-179.1	0	0	0	0	0	113.7	F209 A261 L267 N268 C269	F209-A265 HydrophobicContact CZ-CB 4.06Å; A261-A265 WeakPolarHBondContact O-CA 3.41Å; A261-A265 WeakPolarHBondContact O-CB 3.35Å; A261-A265 PolarHBondContact O-N 3.06Å; A265-L267 VanDerWaalsContact C-N 3.32Å; A265-L267 PolarHBondContact O-N 3.46Å; A265-N268 PolarHBondContact O-N 3.09Å; A265-C269 WeakPolarHBondContact O-CB 3.21Å; A265-C269 PolarHBondContact O-N 3.22Å; A265-C269 PolarHBondContact O-SG 3.3Å
266	P	97.6	Very high	95.7	Very high	42 Å²	42	34 Å²	34	27%	0.273	21%	0.205	S	C	.	.	H	α-helix	trans	-57.3	-45.2	-177.9	-25.5	35.3	0	0	0	112.4	V262 C269 I270 S293	V262-P266 VanDerWaalsContact O-CD 3.26Å; V262-P266 WeakPolarHBondContact O-CD 3.38Å; P266-C269 PolarHBondContact O-N 3.47Å; P266-I270 VanDerWaalsContact O-CG1 3.3Å; P266-I270 WeakPolarHBondContact O-CG1 3.08Å; P266-I270 PolarHBondContact O-N 3.36Å; P266-S293 VanDerWaalsContact CB-OG 3.29Å; P266-S293 WeakPolarHBondContact CB-OG 3.5Å
267	L	96.1	Very high	95.6	Very high	13 Å²	13	36.2 Å²	36.2	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-38.9	-178.9	-173.3	61.7	0	0	0	112.5	Q194 W264 A265 I270 G271 Y294 A297	Q194-L267 PolarHBondContact NE2-O 3.33Å; W264-L267 HydrophobicContact CE3-CD2 4.25Å; W264-L267 HydrophobicContact CZ3-CD2 3.91Å; W264-L267 PolarHBondContact O-N 2.87Å; A265-L267 VanDerWaalsContact C-N 3.32Å; A265-L267 PolarHBondContact O-N 3.46Å; L267-I270 PolarHBondContact O-N 2.93Å; L267-G271 PolarHBondContact O-N 3.5Å; L267-Y294 HydrophobicContact CD1-CD2 3.79Å; L267-Y294 HydrophobicContact CD1-CE2 3.32Å; L267-Y294 HydrophobicContact CD2-CE1 4.15Å; L267-Y294 HydrophobicContact CD2-CE2 4.24Å; L267-Y294 HydrophobicContact CG-CE2 4.44Å; L267-A297 HydrophobicContact CD2-CB 4.48Å
268	N	97.3	Very high	95.3	Very high	22 Å²	22	37.8 Å²	37.8	12%	0.118	23%	0.228	C	C	.	.	H	α-helix	trans	-71	-34.4	176.1	-78.9	-83.9	0	0	0	112.2	V205 F209 W264 A265 G271 L272	V205-N268 HydrophobicContact CG1-CB 4.31Å; V205-N268 HydrophobicContact CG2-CB 4.48Å; F209-N268 WeakPolarHBondContact CB-OD1 3.27Å; F209-N268 HydrophobicContact CD1-CB 3.55Å; F209-N268 HydrophobicContact CE1-CB 3.78Å; F209-N268 HydrophobicContact CG-CB 3.98Å; F209-N268 VanDerWaalsContact CG-CG 3.44Å; F209-N268 HydrophobicContact CZ-CB 4.39Å; W264-N268 PolarHBondContact O-N 3.17Å; W264-N268 VanDerWaalsContact O-N 3.15Å; W264-N268 PolarHBondContact O-ND2 3.38Å; A265-N268 PolarHBondContact O-N 3.09Å; N268-G271 PolarHBondContact O-N 3.31Å; N268-L272 WeakPolarHBondContact O-CB 3.19Å; N268-L272 PolarHBondContact O-N 2.02Å
269	C	96.7	Very high	94.8	Very high	82 Å²	82	43.3 Å²	43.3	55%	0.554	25%	0.25	S	C	*	.	H	α-helix	trans	-65	-42.5	172.7	-71.6	0	0	0	0	111.7	A265 P266 L272 A273	A265-C269 WeakPolarHBondContact O-CB 3.21Å; A265-C269 PolarHBondContact O-N 3.22Å; A265-C269 PolarHBondContact O-SG 3.3Å; P266-C269 PolarHBondContact O-N 3.47Å; C269-L272 PolarHBondContact O-N 2.93Å; C269-A273 PolarHBondContact O-N 3.45Å
270	I	95.3	Very high	94.4	Very high	12 Å²	12	46.7 Å²	46.7	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-59.8	-49	172.6	-68.1	168.7	0	0	0	110	P266 L267 L272 A273 V274 I285 L289 F290 S293	P266-I270 VanDerWaalsContact O-CG1 3.3Å; P266-I270 WeakPolarHBondContact O-CG1 3.08Å; P266-I270 PolarHBondContact O-N 3.36Å; L267-I270 PolarHBondContact O-N 2.93Å; I270-L272 VanDerWaalsContact C-N 3.3Å; I270-L272 PolarHBondContact O-N 2.85Å; I270-A273 PolarHBondContact O-N 3.15Å; I270-V274 HydrophobicContact CG2-CG2 4.49Å; I270-V274 WeakPolarHBondContact O-CG2 3.44Å; I270-V274 PolarHBondContact O-N 2.67Å; I270-I285 HydrophobicContact CD1-CG2 4.49Å; I270-I285 HydrophobicContact CG2-CD1 3.71Å; I270-I285 HydrophobicContact CG2-CG1 4.42Å; I270-I285 HydrophobicContact CG2-CG2 4.23Å; I270-L289 HydrophobicContact CD1-CG 4.36Å; I270-F290 HydrophobicContact CD1-CD2 4.48Å; I270-F290 HydrophobicContact CG2-CD2 4.3Å; I270-S293 WeakPolarHBondContact CD1-OG 3.25Å
271	G	94	Very high	94	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-39.4	178.2	0	0	0	0	0	113.1	Q194 T201 L267 N268 A275	Q194-G271 VanDerWaalsContact CD-CA 3.5Å; T201-G271 WeakPolarHBondContact CG2-O 3.44Å; L267-G271 PolarHBondContact O-N 3.5Å; N268-G271 PolarHBondContact O-N 3.31Å; G271-A275 VanDerWaalsContact O-CB 3.28Å; G271-A275 WeakPolarHBondContact O-CB 3.48Å; G271-A275 PolarHBondContact O-N 3.02Å
272	L	94.6	Very high	93.5	Very high	60 Å²	60	50.4 Å²	50.4	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-43.8	175.9	-171.8	60.4	0	0	0	112.1	V205 N268 C269 I270 V274 A275 I276	V205-L272 HydrophobicContact CG1-CB 4.23Å; V205-L272 HydrophobicContact CG1-CD1 4.41Å; N268-L272 WeakPolarHBondContact O-CB 3.19Å; N268-L272 PolarHBondContact O-N 2.02Å; C269-L272 PolarHBondContact O-N 2.93Å; I270-L272 VanDerWaalsContact C-N 3.3Å; I270-L272 PolarHBondContact O-N 2.85Å; L272-V274 VanDerWaalsContact C-N 3.35Å; L272-V274 PolarHBondContact O-N 3.42Å; L272-A275 PolarHBondContact O-N 3.38Å; L272-I276 HydrophobicContact CD1-CD1 4.39Å; L272-I276 HydrophobicContact CG-CD1 4.07Å; L272-I276 VanDerWaalsContact O-CG1 3.31Å; L272-I276 WeakPolarHBondContact O-CG1 3.35Å; L272-I276 PolarHBondContact O-N 2.92Å
273	A	94.5	Very high	93	Very high	33 Å²	33	51.2 Å²	51.2	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-44.9	177.1	0	0	0	0	0	111.4	C269 I270 A275 I276 N277 M281	C269-A273 PolarHBondContact O-N 3.45Å; I270-A273 PolarHBondContact O-N 3.15Å; A273-A275 VanDerWaalsContact C-N 3.32Å; A273-A275 PolarHBondContact O-N 3.16Å; A273-I276 PolarHBondContact O-N 2.88Å; A273-N277 PolarHBondContact O-N 3.4Å; A273-M281 HydrophobicContact CB-CB 4.49Å
274	V	92.4	Very high	92.7	Very high	4 Å²	4	57 Å²	57	2%	0.024	32%	0.319	C	S	.	.	H	α-helix	trans	-63.8	-36.9	175	173.3	0	0	0	0	111.6	Q194 T195 I270 L272 P278 I285	Q194-V274 HydrophobicContact CB-CG1 4.34Å; T195-V274 HydrophobicContact CG2-CG1 3.6Å; I270-V274 HydrophobicContact CG2-CG2 4.49Å; I270-V274 WeakPolarHBondContact O-CG2 3.44Å; I270-V274 PolarHBondContact O-N 2.67Å; L272-V274 VanDerWaalsContact C-N 3.35Å; L272-V274 PolarHBondContact O-N 3.42Å; V274-P278 HydrophobicContact CG1-CB 4.39Å; V274-P278 VanDerWaalsContact O-CA 3.32Å; V274-P278 WeakPolarHBondContact O-CA 3.45Å; V274-P278 WeakPolarHBondContact O-CB 3.33Å; V274-P278 WeakPolarHBondContact O-CD 3.37Å; V274-I285 HydrophobicContact CG2-CD1 3.46Å; V274-I285 VanDerWaalsContact CG2-CD1 3.46Å
275	A	92.6	Very high	92.4	Very high	16 Å²	16	57.5 Å²	57.5	13%	0.132	32%	0.323	C	S	.	.	H	α-helix	trans	-69.3	-31.7	178.8	0	0	0	0	0	113.3	T201 A202 G271 L272 A273	T201-A275 HydrophobicContact CG2-CB 4.23Å; A202-A275 HydrophobicContact CB-CB 4.05Å; G271-A275 VanDerWaalsContact O-CB 3.28Å; G271-A275 WeakPolarHBondContact O-CB 3.48Å; G271-A275 PolarHBondContact O-N 3.02Å; L272-A275 PolarHBondContact O-N 3.38Å; A273-A275 VanDerWaalsContact C-N 3.32Å; A273-A275 PolarHBondContact O-N 3.16Å
276	I	92.9	Very high	92.1	Very high	132 Å²	132	59.6 Å²	59.6	68%	0.677	33%	0.334	S	S	*	.	H	α-helix	trans	-75.7	-52.5	-179.7	-67.6	164.3	0	0	0	111.3	L272 A273	L272-I276 HydrophobicContact CD1-CD1 4.39Å; L272-I276 HydrophobicContact CG-CD1 4.07Å; L272-I276 VanDerWaalsContact O-CG1 3.31Å; L272-I276 WeakPolarHBondContact O-CG1 3.35Å; L272-I276 PolarHBondContact O-N 2.92Å; A273-I276 PolarHBondContact O-N 2.88Å
277	N	91	Very high	91.8	Very high	50 Å²	50	60 Å²	60	27%	0.267	33%	0.332	S	S	.	.			trans	-143.3	86	178.4	-168.5	-4.5	0	0	0	110.9	A273 Q279 E280 M281	A273-N277 PolarHBondContact O-N 3.4Å; N277-Q279 VanDerWaalsContact C-N 3.32Å; N277-Q279 PolarHBondContact O-N 2.91Å; N277-E280 WeakPolarHBondContact ND2-CG 3.46Å; N277-E280 PolarHBondContact ND2-OE2 3.32Å; N277-M281 HydrophobicContact CB-CG 4.35Å; N277-M281 WeakPolarHBondContact O-CB 3.4Å; N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.36Å; N277-M281 PolarHBondContact O-N 3.32Å
278	P	88.9	Confident	91.6	Very high	46 Å²	46	60.5 Å²	60.5	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-34.3	-173.9	26.5	-36.1	0	0	0	112.7	T198 V274 E280 A282	T198-P278 HydrophobicContact CG2-CB 4.07Å; T198-P278 HydrophobicContact CG2-CG 3.74Å; V274-P278 HydrophobicContact CG1-CB 4.39Å; V274-P278 VanDerWaalsContact O-CA 3.32Å; V274-P278 WeakPolarHBondContact O-CA 3.45Å; V274-P278 WeakPolarHBondContact O-CB 3.33Å; V274-P278 WeakPolarHBondContact O-CD 3.37Å; P278-E280 PolarHBondContact O-N 2.87Å; P278-A282 WeakPolarHBondContact O-CB 3.24Å; P278-A282 PolarHBondContact O-N 2.91Å; P278-A282 VanDerWaalsContact O-N 3.07Å
279	Q	86.7	Confident	91.5	Very high	172 Å²	172	63.7 Å²	63.7	80%	0.804	36%	0.357	S	S	*	.	H	α-helix	trans	-68.3	-37.8	-174.5	-65.8	-160.8	-2.7	0	0	112.3	N277 P283	N277-Q279 VanDerWaalsContact C-N 3.32Å; N277-Q279 PolarHBondContact O-N 2.91Å; Q279-P283 WeakPolarHBondContact O-CD 3.49Å
280	E	88.4	Confident	91.4	Very high	113 Å²	113	60 Å²	60	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-89.1	-39.1	178.8	-67.8	179.6	-171.6	0	0	112.5	N277 P278 Q284	N277-E280 WeakPolarHBondContact ND2-CG 3.46Å; N277-E280 PolarHBondContact ND2-OE2 3.32Å; P278-E280 PolarHBondContact O-N 2.87Å; E280-Q284 WeakPolarHBondContact O-CG 3.45Å; E280-Q284 PolarHBondContact O-NE2 3.4Å
281	M	88.9	Confident	91.4	Very high	70 Å²	70	59.5 Å²	59.5	35%	0.345	33%	0.329	S	S	.	.	H	α-helix	trans	-84.8	-38.1	-170.6	-63.7	-66.8	165.1	0	0	113.2	A273 N277 Q284 I285	A273-M281 HydrophobicContact CB-CB 4.49Å; N277-M281 HydrophobicContact CB-CG 4.35Å; N277-M281 WeakPolarHBondContact O-CB 3.4Å; N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.36Å; N277-M281 PolarHBondContact O-N 3.32Å; M281-Q284 PolarHBondContact O-N 3.41Å; M281-Q284 VanDerWaalsContact O-N 3.08Å; M281-I285 WeakPolarHBondContact O-CD1 3.43Å; M281-I285 WeakPolarHBondContact O-CG1 3.42Å; M281-I285 PolarHBondContact O-N 2.94Å
282	A	86.1	Confident	91.5	Very high	34 Å²	34	62.3 Å²	62.3	28%	0.281	35%	0.346	S	S	.	.	H	α-helix	trans	-58.9	-41.4	-176.9	0	0	0	0	0	113.3	T195 P278	T195-A282 HydrophobicContact CG2-CB 4.25Å; P278-A282 WeakPolarHBondContact O-CB 3.24Å; P278-A282 PolarHBondContact O-N 2.91Å; P278-A282 VanDerWaalsContact O-N 3.07Å
283	P	87.7	Confident	91.6	Very high	106 Å²	106	59.6 Å²	59.6	69%	0.688	33%	0.332	S	S	*	.	H	α-helix	trans	-72.9	-24.5	175.6	-17.9	32.9	0	0	0	114.1	Q279	Q279-P283 WeakPolarHBondContact O-CD 3.49Å
284	Q	90.3	Very high	91.8	Very high	130 Å²	130	58.5 Å²	58.5	61%	0.607	32%	0.321	S	S	*	.	H	α-helix	trans	-81.5	-18.9	-177.2	-72.9	-178.6	43.4	0	0	113.3	E280 M281 P286	E280-Q284 WeakPolarHBondContact O-CG 3.45Å; E280-Q284 PolarHBondContact O-NE2 3.4Å; M281-Q284 PolarHBondContact O-N 3.41Å; M281-Q284 VanDerWaalsContact O-N 3.08Å; Q284-P286 WeakPolarHBondContact O-CD 3.3Å
285	I	90.6	Very high	92	Very high	37 Å²	37	59.3 Å²	59.3	19%	0.19	33%	0.325	C	S	.	.	S	Bend	trans	-70.5	116.3	-179.8	-69	153.6	0	0	0	109.4	I270 V274 M281 E287 F290	I270-I285 HydrophobicContact CD1-CG2 4.49Å; I270-I285 HydrophobicContact CG2-CD1 3.71Å; I270-I285 HydrophobicContact CG2-CG1 4.42Å; I270-I285 HydrophobicContact CG2-CG2 4.23Å; V274-I285 HydrophobicContact CG2-CD1 3.46Å; V274-I285 VanDerWaalsContact CG2-CD1 3.46Å; M281-I285 WeakPolarHBondContact O-CD1 3.43Å; M281-I285 WeakPolarHBondContact O-CG1 3.42Å; M281-I285 PolarHBondContact O-N 2.94Å; I285-E287 PolarHBondContact O-N 2.99Å; I285-F290 HydrophobicContact CG2-CB 4.4Å
286	P	92.3	Very high	92.2	Very high	77 Å²	77	61.6 Å²	61.6	50%	0.5	34%	0.335	S	S	.	.			trans	-64.7	134.9	179.1	-20.8	34	0	0	0	111.1	Q284 G288 L289 F290	Q284-P286 WeakPolarHBondContact O-CD 3.3Å; P286-G288 PolarHBondContact O-N 3.11Å; P286-L289 HydrophobicContact CB-CB 4.27Å; P286-L289 WeakPolarHBondContact O-CB 3.29Å; P286-L289 PolarHBondContact O-N 3.13Å; P286-F290 PolarHBondContact O-N 3.29Å; P286-F290 VanDerWaalsContact O-N 3.13Å
287	E	90.4	Very high	92.4	Very high	49 Å²	49	55.4 Å²	55.4	23%	0.229	30%	0.303	C	S	.	.	H	α-helix	trans	-56.1	-39.7	179.3	-171.7	179.6	172.5	0	0	111.9	R186 I285 L289 F290 V291	R186-E287 HydrophobicContact CB-CG 4.41Å; R186-E287 HydrophobicContact CG-CG 4.36Å; I285-E287 PolarHBondContact O-N 2.99Å; E287-L289 VanDerWaalsContact C-N 3.33Å; E287-L289 PolarHBondContact O-N 3.34Å; E287-F290 WeakPolarHBondContact O-CB 3.43Å; E287-F290 PolarHBondContact O-N 3.35Å; E287-V291 HydrophobicContact CG-CG2 4.41Å; E287-V291 WeakPolarHBondContact O-CG2 3.3Å; E287-V291 PolarHBondContact O-N 2.89Å
288	G	92.2	Very high	92.7	Very high	24 Å²	24	53.2 Å²	53.2	25%	0.247	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-35.5	176.7	0	0	0	0	0	113.9	P286 T292	P286-G288 PolarHBondContact O-N 3.11Å; G288-T292 VanDerWaalsContact O-CB 3.26Å; G288-T292 WeakPolarHBondContact O-CB 3.49Å; G288-T292 PolarHBondContact O-N 3.41Å; G288-T292 PolarHBondContact O-OG1 3Å
289	L	94.4	Very high	93	Very high	89 Å²	89	54.9 Å²	54.9	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-41.4	175.5	-179.6	66.7	0	0	0	110.8	I270 P286 E287 T292 S293	I270-L289 HydrophobicContact CD1-CG 4.36Å; P286-L289 HydrophobicContact CB-CB 4.27Å; P286-L289 WeakPolarHBondContact O-CB 3.29Å; P286-L289 PolarHBondContact O-N 3.13Å; E287-L289 VanDerWaalsContact C-N 3.33Å; E287-L289 PolarHBondContact O-N 3.34Å; L289-T292 PolarHBondContact O-N 3.49Å; L289-S293 WeakPolarHBondContact O-CB 3.43Å; L289-S293 PolarHBondContact O-N 3.04Å; L289-S293 PolarHBondContact O-OG 3.23Å
290	F	95	Very high	93.5	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-51.2	176.4	-175.1	-100.4	0	0	0	111.4	D184 R186 I187 I270 I285 P286 E287 T292 S293 Y294	D184-F290 WeakPolarHBondContact OD2-CE1 3.35Å; D184-F290 WeakPolarHBondContact OD2-CZ 3.15Å; R186-F290 HydrophobicContact CB-CD1 4.27Å; R186-F290 HydrophobicContact CB-CE1 4.31Å; R186-F290 VanDerWaalsContact NH2-CZ 3.26Å; I187-F290 HydrophobicContact CG2-CD1 3.98Å; I187-F290 HydrophobicContact CG2-CE1 3.84Å; I270-F290 HydrophobicContact CD1-CD2 4.48Å; I270-F290 HydrophobicContact CG2-CD2 4.3Å; I285-F290 HydrophobicContact CG2-CB 4.4Å; P286-F290 PolarHBondContact O-N 3.29Å; P286-F290 VanDerWaalsContact O-N 3.13Å; E287-F290 WeakPolarHBondContact O-CB 3.43Å; E287-F290 PolarHBondContact O-N 3.35Å; F290-T292 PolarHBondContact O-N 3.29Å; F290-S293 WeakPolarHBondContact O-CB 3.41Å; F290-S293 PolarHBondContact O-N 3.22Å; F290-Y294 HydrophobicContact CD1-CD2 4.15Å; F290-Y294 HydrophobicContact CD1-CE2 4.29Å; F290-Y294 HydrophobicContact CD2-CE2 4.29Å; F290-Y294 AromaticContact CE1-CD2 3.88Å; F290-Y294 HydrophobicContact CE1-CD2 3.88Å; F290-Y294 AromaticContact CE1-CE2 3.63Å; F290-Y294 HydrophobicContact CE1-CE2 3.63Å; F290-Y294 HydrophobicContact CE2-CD2 4.3Å; F290-Y294 AromaticContact CE2-CE2 3.64Å; F290-Y294 HydrophobicContact CE2-CE2 3.64Å; F290-Y294 HydrophobicContact CG-CD2 4.49Å; F290-Y294 AromaticContact CZ-CD2 3.98Å; F290-Y294 HydrophobicContact CZ-CD2 3.98Å; F290-Y294 AromaticContact CZ-CE2 3.29Å; F290-Y294 HydrophobicContact CZ-CE2 3.29Å; F290-Y294 WeakPolarHBondContact O-CD2 3.41Å; F290-Y294 PolarHBondContact O-N 2.91Å; F290-Y294 VanDerWaalsContact O-N 3.09Å
291	V	95.5	Very high	93.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-44.7	177.1	173.9	0	0	0	0	111.3	W38 V39 L43 R186 I187 E287 S293 Y294 L295	W38-V291 HydrophobicContact CH2-CB 4.01Å; W38-V291 HydrophobicContact CH2-CG1 3.73Å; W38-V291 HydrophobicContact CZ3-CG1 3.84Å; V39-V291 HydrophobicContact CG1-CG1 3.91Å; V39-V291 HydrophobicContact CG1-CG2 4.08Å; V39-V291 HydrophobicContact CG2-CG1 4.2Å; V39-V291 HydrophobicContact CG2-CG2 4.18Å; L43-V291 HydrophobicContact CD1-CG1 4.48Å; L43-V291 HydrophobicContact CG-CG1 4.45Å; R186-V291 WeakPolarHBondContact O-CG2 3.34Å; I187-V291 HydrophobicContact CG2-CG2 4.13Å; E287-V291 HydrophobicContact CG-CG2 4.41Å; E287-V291 WeakPolarHBondContact O-CG2 3.3Å; E287-V291 PolarHBondContact O-N 2.89Å; V291-S293 VanDerWaalsContact C-N 3.29Å; V291-S293 PolarHBondContact O-N 3.49Å; V291-Y294 PolarHBondContact O-N 3.3Å; V291-Y294 VanDerWaalsContact O-N 3.17Å; V291-L295 HydrophobicContact CG1-CD1 4.19Å; V291-L295 HydrophobicContact CG1-CG 4.43Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 2.91Å
292	T	96.1	Very high	94	Very high	61 Å²	61	38.3 Å²	38.3	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-61.5	-39.2	178.3	-57.9	0	0	0	0	111.7	G288 L289 F290 Y294 L295 L296	G288-T292 VanDerWaalsContact O-CB 3.26Å; G288-T292 WeakPolarHBondContact O-CB 3.49Å; G288-T292 PolarHBondContact O-N 3.41Å; G288-T292 PolarHBondContact O-OG1 3Å; L289-T292 PolarHBondContact O-N 3.49Å; F290-T292 PolarHBondContact O-N 3.29Å; T292-Y294 VanDerWaalsContact C-N 3.34Å; T292-Y294 PolarHBondContact O-N 3.21Å; T292-L295 PolarHBondContact O-N 3.13Å; T292-L296 HydrophobicContact CG2-CD1 4.11Å; T292-L296 VanDerWaalsContact O-CD1 3.32Å; T292-L296 WeakPolarHBondContact O-CD1 3.36Å; T292-L296 PolarHBondContact O-N 3.37Å; T292-L296 VanDerWaalsContact O-N 3.11Å
293	S	97.5	Very high	94.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-41.7	175.9	-58.3	0	0	0	0	111.7	P266 I270 L289 F290 V291 L296 A297	P266-S293 VanDerWaalsContact CB-OG 3.29Å; P266-S293 WeakPolarHBondContact CB-OG 3.5Å; I270-S293 WeakPolarHBondContact CD1-OG 3.25Å; L289-S293 WeakPolarHBondContact O-CB 3.43Å; L289-S293 PolarHBondContact O-N 3.04Å; L289-S293 PolarHBondContact O-OG 3.23Å; F290-S293 WeakPolarHBondContact O-CB 3.41Å; F290-S293 PolarHBondContact O-N 3.22Å; V291-S293 VanDerWaalsContact C-N 3.29Å; V291-S293 PolarHBondContact O-N 3.49Å; S293-L296 PolarHBondContact O-N 2.94Å; S293-A297 WeakPolarHBondContact O-CB 3.42Å; S293-A297 PolarHBondContact O-N 3.29Å; S293-A297 VanDerWaalsContact O-N 3.09Å
294	Y	97.2	Very high	94.8	Very high	10 Å²	10	33.1 Å²	33.1	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-67.9	-37.6	174.7	-91.2	-85.2	0	0	0	113.1	I187 T191 L267 F290 V291 T292 L296 A297 Y298	I187-Y294 HydrophobicContact CD1-CD1 3.65Å; I187-Y294 HydrophobicContact CD1-CD2 4.08Å; I187-Y294 HydrophobicContact CD1-CE1 3.52Å; I187-Y294 HydrophobicContact CD1-CE2 3.97Å; I187-Y294 HydrophobicContact CD1-CG 3.92Å; I187-Y294 HydrophobicContact CG2-CD2 4.02Å; I187-Y294 HydrophobicContact CG2-CG 4.07Å; T191-Y294 PolarHBondContact OG1-OH 2.74Å; L267-Y294 HydrophobicContact CD1-CD2 3.79Å; L267-Y294 HydrophobicContact CD1-CE2 3.32Å; L267-Y294 HydrophobicContact CD2-CE1 4.15Å; L267-Y294 HydrophobicContact CD2-CE2 4.24Å; L267-Y294 HydrophobicContact CG-CE2 4.44Å; F290-Y294 HydrophobicContact CD1-CD2 4.15Å; F290-Y294 HydrophobicContact CD1-CE2 4.29Å; F290-Y294 HydrophobicContact CD2-CE2 4.29Å; F290-Y294 AromaticContact CE1-CD2 3.88Å; F290-Y294 HydrophobicContact CE1-CD2 3.88Å; F290-Y294 AromaticContact CE1-CE2 3.63Å; F290-Y294 HydrophobicContact CE1-CE2 3.63Å; F290-Y294 HydrophobicContact CE2-CD2 4.3Å; F290-Y294 AromaticContact CE2-CE2 3.64Å; F290-Y294 HydrophobicContact CE2-CE2 3.64Å; F290-Y294 HydrophobicContact CG-CD2 4.49Å; F290-Y294 AromaticContact CZ-CD2 3.98Å; F290-Y294 HydrophobicContact CZ-CD2 3.98Å; F290-Y294 AromaticContact CZ-CE2 3.29Å; F290-Y294 HydrophobicContact CZ-CE2 3.29Å; F290-Y294 WeakPolarHBondContact O-CD2 3.41Å; F290-Y294 PolarHBondContact O-N 2.91Å; F290-Y294 VanDerWaalsContact O-N 3.09Å; V291-Y294 PolarHBondContact O-N 3.3Å; V291-Y294 VanDerWaalsContact O-N 3.17Å; T292-Y294 VanDerWaalsContact C-N 3.34Å; T292-Y294 PolarHBondContact O-N 3.21Å; Y294-L296 VanDerWaalsContact C-N 3.33Å; Y294-L296 PolarHBondContact O-N 3.12Å; Y294-A297 PolarHBondContact O-N 2.98Å; Y294-Y298 HydrophobicContact CD1-CE1 4.2Å; Y294-Y298 HydrophobicContact CD1-CE2 4.17Å; Y294-Y298 AromaticContact CD1-CZ 3.73Å; Y294-Y298 VanDerWaalsContact O-CD2 3.3Å; Y294-Y298 WeakPolarHBondContact O-CD2 3.32Å; Y294-Y298 PolarHBondContact O-N 3.22Å
295	L	96.7	Very high	94.9	Very high	21 Å²	21	27.1 Å²	27.1	11%	0.11	15%	0.15	C	C	.	.	H	α-helix	trans	-58.1	-45.5	174.2	-74.6	169.3	0	0	0	111.5	W38 A42 L43 V46 V291 T292 A297 F299	W38-L295 HydrophobicContact CZ3-CD1 4.13Å; A42-L295 HydrophobicContact CB-CD1 4.41Å; L43-L295 HydrophobicContact CB-CD2 4.48Å; L43-L295 HydrophobicContact CD2-CD2 3.51Å; L43-L295 HydrophobicContact CD2-CG 4.03Å; L43-L295 HydrophobicContact CG-CD2 4.04Å; V46-L295 HydrophobicContact CB-CD2 3.77Å; V46-L295 HydrophobicContact CG1-CD2 4Å; V46-L295 HydrophobicContact CG2-CD2 3.85Å; V291-L295 HydrophobicContact CG1-CD1 4.19Å; V291-L295 HydrophobicContact CG1-CG 4.43Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 2.91Å; T292-L295 PolarHBondContact O-N 3.13Å; L295-A297 VanDerWaalsContact C-N 3.35Å; L295-F299 WeakPolarHBondContact O-CB 3.06Å; L295-F299 PolarHBondContact O-N 3.33Å
296	L	97.2	Very high	95.1	Very high	65 Å²	65	28.6 Å²	28.6	34%	0.34	16%	0.158	S	C	.	.	H	α-helix	trans	-63.4	-40.8	175.8	-94.8	72	0	0	0	112.1	C263 T292 S293 Y294 N300	C263-L296 WeakPolarHBondContact CB-O 3.38Å; C263-L296 PolarHBondContact SG-O 3.29Å; C263-L296 VanDerWaalsContact SG-O 3.39Å; T292-L296 HydrophobicContact CG2-CD1 4.11Å; T292-L296 VanDerWaalsContact O-CD1 3.32Å; T292-L296 WeakPolarHBondContact O-CD1 3.36Å; T292-L296 PolarHBondContact O-N 3.37Å; T292-L296 VanDerWaalsContact O-N 3.11Å; S293-L296 PolarHBondContact O-N 2.94Å; Y294-L296 VanDerWaalsContact C-N 3.33Å; Y294-L296 PolarHBondContact O-N 3.12Å; L296-N300 PolarHBondContact O-N 3.22Å
297	A	97	Very high	95.2	Very high	2 Å²	2	25.5 Å²	25.5	2%	0.017	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-44.4	178.9	0	0	0	0	0	112.1	W264 L267 S293 Y294 L295 N300	W264-A297 HydrophobicContact CD2-CB 4.3Å; W264-A297 HydrophobicContact CE3-CB 4.13Å; W264-A297 HydrophobicContact CH2-CB 3.74Å; W264-A297 HydrophobicContact CZ2-CB 3.96Å; W264-A297 HydrophobicContact CZ3-CB 3.87Å; L267-A297 HydrophobicContact CD2-CB 4.48Å; S293-A297 WeakPolarHBondContact O-CB 3.42Å; S293-A297 PolarHBondContact O-N 3.29Å; S293-A297 VanDerWaalsContact O-N 3.09Å; Y294-A297 PolarHBondContact O-N 2.98Å; L295-A297 VanDerWaalsContact C-N 3.35Å; A297-N300 WeakPolarHBondContact O-CB 3.42Å; A297-N300 PolarHBondContact O-N 3.26Å
298	Y	97	Very high	95.3	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-44	175.8	-64.5	-35.1	0	0	0	112	L43 L47 T50 Y94 M120 S189 Y294 N300 S301	L43-Y298 HydrophobicContact CD2-CD2 4.42Å; L43-Y298 HydrophobicContact CD2-CE2 4.3Å; L47-Y298 HydrophobicContact CD2-CD2 4.01Å; L47-Y298 HydrophobicContact CD2-CG 4.11Å; T50-Y298 VanDerWaalsContact CG2-O 3.29Å; T50-Y298 WeakPolarHBondContact CG2-O 3.19Å; Y94-Y298 AromaticContact CE1-CD1 3.81Å; Y94-Y298 HydrophobicContact CE1-CD1 3.81Å; Y94-Y298 HydrophobicContact CE1-CE1 4.35Å; Y94-Y298 HydrophobicContact CE1-CG 4.39Å; Y94-Y298 PolarHBondContact OH-O 3.31Å; M120-Y298 HydrophobicContact SD-CE1 3.8Å; S189-Y298 WeakPolarHBondContact CB-OH 3.25Å; S189-Y298 PolarHBondContact OG-OH 3.22Å; Y294-Y298 HydrophobicContact CD1-CE1 4.2Å; Y294-Y298 HydrophobicContact CD1-CE2 4.17Å; Y294-Y298 AromaticContact CD1-CZ 3.73Å; Y294-Y298 VanDerWaalsContact O-CD2 3.3Å; Y294-Y298 WeakPolarHBondContact O-CD2 3.32Å; Y294-Y298 PolarHBondContact O-N 3.22Å; Y298-N300 PolarHBondContact O-N 2.67Å; Y298-N300 VanDerWaalsContact O-N 3.07Å; Y298-S301 PolarHBondContact O-N 3.45Å; Y298-S301 PolarHBondContact O-OG 2.99Å
299	F	96.6	Very high	95.2	Very high	80 Å²	80	22.8 Å²	22.8	35%	0.351	12%	0.122	S	C	.	.	H	α-helix	trans	-61.9	-21.4	-179.9	-168.7	-122	0	0	0	113.4	V46 L295 S301 C302 L303	V46-F299 HydrophobicContact CG1-CB 4.36Å; L295-F299 WeakPolarHBondContact O-CB 3.06Å; L295-F299 PolarHBondContact O-N 3.33Å; F299-S301 VanDerWaalsContact C-N 3.31Å; F299-S301 PolarHBondContact O-N 2.85Å; F299-C302 PolarHBondContact O-SG 3.13Å; F299-L303 HydrophobicContact CD1-CD1 3.9Å; F299-L303 HydrophobicContact CD1-CD2 4.16Å; F299-L303 HydrophobicContact CD1-CG 4.12Å; F299-L303 HydrophobicContact CE1-CD1 4.12Å; F299-L303 HydrophobicContact CE1-CD2 3.6Å; F299-L303 HydrophobicContact CE1-CG 4.07Å; F299-L303 HydrophobicContact CZ-CD2 4.01Å
300	N	96.8	Very high	95	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-56.8	-39.5	-178	-176.6	-118.9	0	0	0	113.9	F260 C263 W264 L296 A297 Y298 C302 L303	F260-N300 WeakPolarHBondContact CD2-OD1 3.48Å; C263-N300 HydrophobicContact CB-CB 3.76Å; W264-N300 PolarHBondContact NE1-OD1 3.22Å; W264-N300 VanDerWaalsContact NE1-OD1 3.12Å; L296-N300 PolarHBondContact O-N 3.22Å; A297-N300 WeakPolarHBondContact O-CB 3.42Å; A297-N300 PolarHBondContact O-N 3.26Å; Y298-N300 PolarHBondContact O-N 2.67Å; Y298-N300 VanDerWaalsContact O-N 3.07Å; N300-C302 VanDerWaalsContact C-N 3.27Å; N300-C302 PolarHBondContact O-N 2.96Å; N300-L303 PolarHBondContact O-N 3.16Å; N300-L303 VanDerWaalsContact O-N 3.12Å
301	S	93.2	Very high	94.7	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.028	14%	0.142	C	C	.	.	H	α-helix	trans	-61.8	-34.8	-170.3	73	0	0	0	0	112.8	T50 D54 N58 Y298 F299	T50-S301 WeakPolarHBondContact CG2-OG 3.38Å; D54-S301 WeakPolarHBondContact OD2-CB 3.07Å; D54-S301 PolarHBondContact OD2-OG 3.44Å; N58-S301 PolarHBondContact ND2-O 3.31Å; Y298-S301 PolarHBondContact O-N 3.45Å; Y298-S301 PolarHBondContact O-OG 2.99Å; F299-S301 VanDerWaalsContact C-N 3.31Å; F299-S301 PolarHBondContact O-N 2.85Å
302	C	95.3	Very high	94.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-83	-18.5	180	79.2	0	0	0	0	114.1	T50 V53 D54 F299 N300 N304	T50-C302 HydrophobicContact CG2-CB 4.08Å; V53-C302 HydrophobicContact CB-CB 4.01Å; V53-C302 HydrophobicContact CG1-CB 3.96Å; D54-C302 HydrophobicContact CB-CB 3.98Å; F299-C302 PolarHBondContact O-SG 3.13Å; N300-C302 VanDerWaalsContact C-N 3.27Å; N300-C302 PolarHBondContact O-N 2.96Å; C302-N304 VanDerWaalsContact C-N 3.32Å; C302-N304 PolarHBondContact O-N 3.47Å
303	L	96.8	Very high	93.9	Very high	29 Å²	29	29.3 Å²	29.3	15%	0.152	15%	0.151	C	C	.	.	H	α-helix	trans	-70.4	-29	-173.2	-71.7	176.1	0	0	0	112.6	I259 F299 N300 A305 I306 V307	I259-L303 HydrophobicContact CG2-CB 4.01Å; I259-L303 HydrophobicContact CG2-CD1 3.43Å; I259-L303 VanDerWaalsContact CG2-CD1 3.43Å; I259-L303 HydrophobicContact CG2-CG 4.35Å; F299-L303 HydrophobicContact CD1-CD1 3.9Å; F299-L303 HydrophobicContact CD1-CD2 4.16Å; F299-L303 HydrophobicContact CD1-CG 4.12Å; F299-L303 HydrophobicContact CE1-CD1 4.12Å; F299-L303 HydrophobicContact CE1-CD2 3.6Å; F299-L303 HydrophobicContact CE1-CG 4.07Å; F299-L303 HydrophobicContact CZ-CD2 4.01Å; N300-L303 PolarHBondContact O-N 3.16Å; N300-L303 VanDerWaalsContact O-N 3.12Å; L303-A305 PolarHBondContact O-N 3.48Å; L303-I306 HydrophobicContact CD2-CD1 4.24Å; L303-I306 PolarHBondContact O-N 3.37Å; L303-V307 VanDerWaalsContact O-CG2 3.26Å; L303-V307 WeakPolarHBondContact O-CG2 3.49Å; L303-V307 PolarHBondContact O-N 3.23Å
304	N	92.8	Very high	93.4	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-57.2	-51	-178	-68.6	-30.4	0	0	0	111.7	D86 V256 C302 I306 V307 Y308	D86-N304 PolarHBondContact OD2-ND2 2.83Å; V256-N304 WeakPolarHBondContact CG1-OD1 3.4Å; C302-N304 VanDerWaalsContact C-N 3.32Å; C302-N304 PolarHBondContact O-N 3.47Å; N304-I306 VanDerWaalsContact C-N 3.35Å; N304-I306 PolarHBondContact O-N 2.89Å; N304-V307 PolarHBondContact O-N 2.9Å; N304-Y308 HydrophobicContact CB-CE2 4.01Å; N304-Y308 WeakPolarHBondContact O-CD2 3.43Å; N304-Y308 WeakPolarHBondContact O-CE2 3.43Å; N304-Y308 VanDerWaalsContact O-CG 3.24Å; N304-Y308 PolarHBondContact O-N 3.5Å
305	A	92	Very high	93.1	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-39.1	178.7	0	0	0	0	0	113.1	G57 V61 L303 Y308 G309 Y319	G57-A305 VanDerWaalsContact CA-CB 3.5Å; V61-A305 HydrophobicContact CG2-CB 4.02Å; L303-A305 PolarHBondContact O-N 3.48Å; A305-Y308 PolarHBondContact O-N 3.48Å; A305-G309 PolarHBondContact O-N 3.26Å; A305-Y319 PolarHBondContact O-OH 2.96Å
306	I	95.4	Very high	92.8	Very high	69 Å²	69	36.8 Å²	36.8	35%	0.354	18%	0.183	S	C	.	.	H	α-helix	trans	-61.1	-48.9	176.2	-60.8	175.9	0	0	0	109.9	V53 L303 N304 Y308 G309 L310	V53-I306 HydrophobicContact CG1-CD1 4.02Å; V53-I306 HydrophobicContact CG1-CG1 4.13Å; L303-I306 HydrophobicContact CD2-CD1 4.24Å; L303-I306 PolarHBondContact O-N 3.37Å; N304-I306 VanDerWaalsContact C-N 3.35Å; N304-I306 PolarHBondContact O-N 2.89Å; I306-Y308 VanDerWaalsContact C-N 3.3Å; I306-Y308 PolarHBondContact O-N 3.39Å; I306-G309 PolarHBondContact O-N 2.76Å; I306-L310 HydrophobicContact CG2-CD1 3.7Å; I306-L310 HydrophobicContact CG2-CG 4.18Å; I306-L310 WeakPolarHBondContact O-CB 3.39Å; I306-L310 WeakPolarHBondContact O-CG 3.4Å; I306-L310 PolarHBondContact O-N 2.91Å
307	V	94.8	Very high	92.6	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-41.5	179.8	174.4	0	0	0	0	111.1	T252 V255 V256 I259 L303 N304 L310 L311	T252-V307 HydrophobicContact CG2-CG1 4.05Å; V255-V307 HydrophobicContact CB-CG1 4.32Å; V255-V307 HydrophobicContact CG1-CG1 3.92Å; V255-V307 HydrophobicContact CG1-CG2 4.35Å; V256-V307 HydrophobicContact CG2-CB 4.05Å; V256-V307 HydrophobicContact CG2-CG1 3.66Å; I259-V307 HydrophobicContact CD1-CG2 3.45Å; I259-V307 VanDerWaalsContact CD1-CG2 3.45Å; L303-V307 VanDerWaalsContact O-CG2 3.26Å; L303-V307 WeakPolarHBondContact O-CG2 3.49Å; L303-V307 PolarHBondContact O-N 3.23Å; N304-V307 PolarHBondContact O-N 2.9Å; V307-L310 PolarHBondContact O-N 3.49Å; V307-L311 HydrophobicContact CG1-CD1 3.87Å; V307-L311 HydrophobicContact CG1-CG 4.39Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 PolarHBondContact O-N 2.88Å
308	Y	91.1	Very high	92.4	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-42.8	176.4	-57.2	-36.7	0	0	0	112.6	V61 L79 T252 V256 N304 A305 I306 L310 N312	V61-Y308 HydrophobicContact CG1-CD2 4.42Å; V61-Y308 HydrophobicContact CG2-CD2 3.68Å; V61-Y308 HydrophobicContact CG2-CE2 4.26Å; L79-Y308 HydrophobicContact CD2-CE1 4.06Å; L79-Y308 HydrophobicContact CD2-CE2 4.45Å; L79-Y308 WeakPolarHBondContact CD2-OH 3.19Å; T252-Y308 HydrophobicContact CG2-CD1 3.75Å; T252-Y308 HydrophobicContact CG2-CE1 4.28Å; V256-Y308 HydrophobicContact CG2-CD1 4.4Å; V256-Y308 HydrophobicContact CG2-CE1 3.6Å; N304-Y308 HydrophobicContact CB-CE2 4.01Å; N304-Y308 WeakPolarHBondContact O-CD2 3.43Å; N304-Y308 WeakPolarHBondContact O-CE2 3.43Å; N304-Y308 VanDerWaalsContact O-CG 3.24Å; N304-Y308 PolarHBondContact O-N 3.5Å; A305-Y308 PolarHBondContact O-N 3.48Å; I306-Y308 VanDerWaalsContact C-N 3.3Å; I306-Y308 PolarHBondContact O-N 3.39Å; Y308-L310 VanDerWaalsContact C-N 3.35Å; Y308-L310 PolarHBondContact O-N 2.86Å; Y308-N312 WeakPolarHBondContact O-CA 3.36Å; Y308-N312 WeakPolarHBondContact O-CB 3.45Å; Y308-N312 PolarHBondContact O-N 2.63Å
309	G	90	Very high	92.3	Very high	13 Å²	13	41.8 Å²	41.8	13%	0.134	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-35.1	176.4	0	0	0	0	0	113.6	A305 I306 R316	A305-G309 PolarHBondContact O-N 3.26Å; I306-G309 PolarHBondContact O-N 2.76Å; G309-R316 WeakPolarHBondContact O-CB 3.28Å; G309-R316 WeakPolarHBondContact O-CG 3.32Å; G309-R316 PolarHBondContact O-NE 2.99Å
310	L	91.9	Very high	92.1	Very high	108 Å²	108	44.3 Å²	44.3	57%	0.565	21%	0.209	S	C	*	.	H	α-helix	trans	-81.9	-42.8	-178.9	-68	-179.4	0	0	0	113	I306 V307 Y308 R316	I306-L310 HydrophobicContact CG2-CD1 3.7Å; I306-L310 HydrophobicContact CG2-CG 4.18Å; I306-L310 WeakPolarHBondContact O-CB 3.39Å; I306-L310 WeakPolarHBondContact O-CG 3.4Å; I306-L310 PolarHBondContact O-N 2.91Å; V307-L310 PolarHBondContact O-N 3.49Å; Y308-L310 VanDerWaalsContact C-N 3.35Å; Y308-L310 PolarHBondContact O-N 2.86Å; L310-R316 PolarHBondContact O-NH2 3.12Å
311	L	88.2	Confident	91.9	Very high	65 Å²	65	49.3 Å²	49.3	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-100.4	-26.3	-171.2	-59.6	-176.4	0	0	0	113.6	L251 T252 V255 V307	L251-L311 HydrophobicContact CD2-CD1 4.27Å; T252-L311 HydrophobicContact CG2-CB 4Å; T252-L311 WeakPolarHBondContact OG1-CB 3.37Å; V255-L311 HydrophobicContact CB-CD1 3.85Å; V255-L311 HydrophobicContact CG1-CD1 3.9Å; V255-L311 HydrophobicContact CG2-CD1 3.8Å; V307-L311 HydrophobicContact CG1-CD1 3.87Å; V307-L311 HydrophobicContact CG1-CG 4.39Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 PolarHBondContact O-N 2.88Å
312	N	86.6	Confident	91.9	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.08	23%	0.228	C	C	.	.			trans	-103	105.9	-176.6	-165.5	-40.9	0	0	0	112.1	T252 Y308 N314 F315 R316	T252-N312 HydrophobicContact CG2-CB 4.35Å; Y308-N312 WeakPolarHBondContact O-CA 3.36Å; Y308-N312 WeakPolarHBondContact O-CB 3.45Å; Y308-N312 PolarHBondContact O-N 2.63Å; N312-N314 PolarHBondContact O-N 3.23Å; N312-N314 VanDerWaalsContact O-N 3.15Å; N312-N314 WeakPolarHBondContact OD1-CB 3.38Å; N312-N314 PolarHBondContact OD1-N 2.85Å; N312-F315 HydrophobicContact CB-CB 4.19Å; N312-F315 HydrophobicContact CB-CD2 3.88Å; N312-F315 PolarHBondContact O-N 3.13Å; N312-F315 VanDerWaalsContact O-N 3.16Å; N312-F315 PolarHBondContact OD1-N 2.94Å; N312-R316 PolarHBondContact O-N 3.07Å
313	Q	86.9	Confident	91.8	Very high	104 Å²	104	53.9 Å²	53.9	49%	0.486	25%	0.25	S	S	.	.	H	α-helix	trans	-58.4	-30.2	-178.4	-67.1	-175.2	-15.8	0	0	113.8	R248 R317	R248-Q313 VanDerWaalsContact NH1-CD 3.26Å; R248-Q313 VanDerWaalsContact NH1-NE2 3.13Å; Q313-R317 WeakPolarHBondContact O-CB 3.49Å; Q313-R317 PolarHBondContact O-N 3.02Å; Q313-R317 VanDerWaalsContact O-N 3.12Å
314	N	87.9	Confident	91.6	Very high	78 Å²	78	57.6 Å²	57.6	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-73	-45.3	178.4	-60.1	-42.6	0	0	0	110.9	L71 N312 R317 E318	L71-N314 HydrophobicContact CD2-CB 3.77Å; N312-N314 PolarHBondContact O-N 3.23Å; N312-N314 VanDerWaalsContact O-N 3.15Å; N312-N314 WeakPolarHBondContact OD1-CB 3.38Å; N312-N314 PolarHBondContact OD1-N 2.85Å; N314-R317 PolarHBondContact O-N 3.1Å; N314-E318 PolarHBondContact O-N 3.23Å; N314-E318 VanDerWaalsContact O-N 3.08Å
315	F	89.9	Confident	91.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-46	174.1	-84.1	-77.6	0	0	0	111.3	V61 V65 L79 N312 R317 E318 Y319	V61-F315 HydrophobicContact CG1-CE1 4.2Å; V65-F315 HydrophobicContact CG2-CE1 3.78Å; V65-F315 HydrophobicContact CG2-CZ 3.78Å; L79-F315 HydrophobicContact CD1-CE2 3.8Å; L79-F315 HydrophobicContact CD1-CZ 3.75Å; N312-F315 HydrophobicContact CB-CB 4.19Å; N312-F315 HydrophobicContact CB-CD2 3.88Å; N312-F315 PolarHBondContact O-N 3.13Å; N312-F315 VanDerWaalsContact O-N 3.16Å; N312-F315 PolarHBondContact OD1-N 2.94Å; F315-R317 PolarHBondContact O-N 3.43Å; F315-E318 PolarHBondContact O-N 3.41Å; F315-E318 VanDerWaalsContact O-N 3.08Å; F315-Y319 HydrophobicContact CB-CE1 4.49Å; F315-Y319 HydrophobicContact CD1-CE1 4.07Å; F315-Y319 WeakPolarHBondContact O-CD1 3.38Å; F315-Y319 PolarHBondContact O-N 3.38Å
316	R	91.8	Very high	91.2	Very high	112 Å²	112	64.5 Å²	64.5	42%	0.423	31%	0.309	S	S	.	.	H	α-helix	trans	-54.4	-40.4	175.9	-167.3	-171.4	-67.6	-174.7	-4.6	112.5	G309 L310 N312 K320	G309-R316 WeakPolarHBondContact O-CB 3.28Å; G309-R316 WeakPolarHBondContact O-CG 3.32Å; G309-R316 PolarHBondContact O-NE 2.99Å; L310-R316 PolarHBondContact O-NH2 3.12Å; N312-R316 PolarHBondContact O-N 3.07Å; R316-K320 WeakPolarHBondContact O-CG 3.37Å; R316-K320 PolarHBondContact O-N 3.19Å
317	R	91.9	Very high	91	Very high	144 Å²	144	71.3 Å²	71.3	54%	0.543	33%	0.33	S	S	.	.	H	α-helix	trans	-67.6	-44	178.2	-168.3	-178.1	-59.8	-168.7	0	111.5	Q313 N314 F315 K320 R321	Q313-R317 WeakPolarHBondContact O-CB 3.49Å; Q313-R317 PolarHBondContact O-N 3.02Å; Q313-R317 VanDerWaalsContact O-N 3.12Å; N314-R317 PolarHBondContact O-N 3.1Å; F315-R317 PolarHBondContact O-N 3.43Å; R317-K320 PolarHBondContact O-N 3.34Å; R317-R321 VanDerWaalsContact CD-NH2 3.32Å; R317-R321 WeakPolarHBondContact O-CG 3.44Å; R317-R321 PolarHBondContact O-N 2.88Å; R317-R321 VanDerWaalsContact O-N 3.08Å
318	E	93.6	Very high	90.6	Very high	8 Å²	8	74.6 Å²	74.6	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-39.9	176.5	-63.5	-46	148.4	0	0	112.5	S64 N68 L71 N314 F315 K320 R321 I322	S64-E318 WeakPolarHBondContact OG-CB 3.47Å; N68-E318 HydrophobicContact CB-CG 4.26Å; N68-E318 PolarHBondContact ND2-OE1 3.19Å; L71-E318 HydrophobicContact CD1-CG 3.64Å; N314-E318 PolarHBondContact O-N 3.23Å; N314-E318 VanDerWaalsContact O-N 3.08Å; F315-E318 PolarHBondContact O-N 3.41Å; F315-E318 VanDerWaalsContact O-N 3.08Å; E318-K320 VanDerWaalsContact C-N 3.32Å; E318-K320 PolarHBondContact O-N 3.35Å; E318-R321 PolarHBondContact O-N 2.98Å; E318-R321 VanDerWaalsContact O-N 3.08Å; E318-R321 IonicContact OE1-CZ 3.84Å; E318-R321 IonicContact OE1-NH1 3Å; E318-R321 PolarHBondContact OE1-NH1 3.14Å; E318-R321 IonicContact OE2-NH1 2.9Å; E318-R321 PolarHBondContact OE2-NH1 2.93Å; E318-I322 VanDerWaalsContact O-CG1 3.31Å; E318-I322 WeakPolarHBondContact O-CG1 3.2Å; E318-I322 PolarHBondContact O-N 3.19Å
319	Y	93.9	Very high	89.6	Confident	25 Å²	25	78.6 Å²	78.6	10%	0.098	37%	0.373	C	S	.	.	H	α-helix	trans	-55.5	-49.2	175	-70.7	-1	0	0	0	110.9	L60 V61 S64 A305 F315 R321 I322 L323	L60-Y319 HydrophobicContact CB-CD1 3.84Å; L60-Y319 HydrophobicContact CB-CE1 3.69Å; V61-Y319 WeakPolarHBondContact CG2-OH 3.47Å; S64-Y319 WeakPolarHBondContact OG-CD1 3.3Å; S64-Y319 WeakPolarHBondContact OG-CE1 3.44Å; A305-Y319 PolarHBondContact O-OH 2.96Å; F315-Y319 HydrophobicContact CB-CE1 4.49Å; F315-Y319 HydrophobicContact CD1-CE1 4.07Å; F315-Y319 WeakPolarHBondContact O-CD1 3.38Å; F315-Y319 PolarHBondContact O-N 3.38Å; Y319-R321 VanDerWaalsContact C-N 3.34Å; Y319-R321 PolarHBondContact O-N 3.38Å; Y319-I322 PolarHBondContact O-N 2.96Å; Y319-L323 WeakPolarHBondContact O-CB 3.31Å; Y319-L323 VanDerWaalsContact O-CG 3.27Å; Y319-L323 WeakPolarHBondContact O-CG 3.35Å; Y319-L323 PolarHBondContact O-N 2.72Å
320	K	93.3	Very high	88.1	Confident	133 Å²	133	88.6 Å²	88.6	58%	0.578	41%	0.407	S	S	*	.	H	α-helix	trans	-59	-43.9	175.4	-72.3	-174.8	178.3	-166.6	0	112	R316 R317 E318 L324	R316-K320 WeakPolarHBondContact O-CG 3.37Å; R316-K320 PolarHBondContact O-N 3.19Å; R317-K320 PolarHBondContact O-N 3.34Å; E318-K320 VanDerWaalsContact C-N 3.32Å; E318-K320 PolarHBondContact O-N 3.35Å; K320-L324 VanDerWaalsContact O-CB 3.23Å; K320-L324 WeakPolarHBondContact O-CB 3.35Å; K320-L324 WeakPolarHBondContact O-CD1 3.22Å; K320-L324 WeakPolarHBondContact O-CG 3.3Å; K320-L324 PolarHBondContact O-N 3.47Å
321	R	93.2	Very high	86.4	Confident	109 Å²	109	89.1 Å²	89.1	41%	0.411	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-39.8	178.8	-73.8	-172	-165.3	134.8	-4.3	113.1	R317 E318 Y319 A325	R317-R321 VanDerWaalsContact CD-NH2 3.32Å; R317-R321 WeakPolarHBondContact O-CG 3.44Å; R317-R321 PolarHBondContact O-N 2.88Å; R317-R321 VanDerWaalsContact O-N 3.08Å; E318-R321 PolarHBondContact O-N 2.98Å; E318-R321 VanDerWaalsContact O-N 3.08Å; E318-R321 IonicContact OE1-CZ 3.84Å; E318-R321 IonicContact OE1-NH1 3Å; E318-R321 PolarHBondContact OE1-NH1 3.14Å; E318-R321 IonicContact OE2-NH1 2.9Å; E318-R321 PolarHBondContact OE2-NH1 2.93Å; Y319-R321 VanDerWaalsContact C-N 3.34Å; Y319-R321 PolarHBondContact O-N 3.38Å; R321-A325 WeakPolarHBondContact O-CB 3.4Å; R321-A325 PolarHBondContact O-N 2.88Å
322	I	93.3	Very high	84.6	Confident	9 Å²	9	88.5 Å²	88.5	5%	0.046	41%	0.407	C	S	.	.	H	α-helix	trans	-68.1	-47.9	179	-65.8	161.9	0	0	0	109.5	L60 L63 S64 E318 Y319 L324 A325 L326	L60-I322 HydrophobicContact CD2-CB 4.05Å; L60-I322 HydrophobicContact CD2-CD1 4.42Å; L60-I322 HydrophobicContact CD2-CG2 3.66Å; L63-I322 HydrophobicContact CB-CD1 3.84Å; L63-I322 HydrophobicContact CD1-CG2 4.31Å; S64-I322 WeakPolarHBondContact OG-CD1 3.1Å; E318-I322 VanDerWaalsContact O-CG1 3.31Å; E318-I322 WeakPolarHBondContact O-CG1 3.2Å; E318-I322 PolarHBondContact O-N 3.19Å; Y319-I322 PolarHBondContact O-N 2.96Å; I322-L324 PolarHBondContact O-N 3.26Å; I322-A325 PolarHBondContact O-N 3.49Å; I322-L326 HydrophobicContact CG2-CD1 3.87Å; I322-L326 WeakPolarHBondContact O-CG 3.31Å; I322-L326 PolarHBondContact O-N 2.91Å
323	L	92.4	Very high	83	Confident	90 Å²	90	94 Å²	94	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-44	178	-68.1	172.2	0	0	0	112.1	L60 Y319 A325 L326 W327	L60-L323 HydrophobicContact CD1-CD2 4.48Å; L60-L323 HydrophobicContact CD2-CD2 4.4Å; L60-L323 HydrophobicContact CD2-CG 4.46Å; Y319-L323 WeakPolarHBondContact O-CB 3.31Å; Y319-L323 VanDerWaalsContact O-CG 3.27Å; Y319-L323 WeakPolarHBondContact O-CG 3.35Å; Y319-L323 PolarHBondContact O-N 2.72Å; L323-A325 VanDerWaalsContact C-N 3.35Å; L323-A325 PolarHBondContact O-N 2.9Å; L323-L326 PolarHBondContact O-N 3.05Å; L323-W327 VanDerWaalsContact O-CB 3.3Å; L323-W327 WeakPolarHBondContact O-CB 3.32Å; L323-W327 PolarHBondContact O-N 3.48Å
324	L	92.3	Very high	81.2	Confident	107 Å²	107	94.6 Å²	94.6	56%	0.56	44%	0.438	S	S	*	.	H	α-helix	trans	-65.8	-36.4	176.2	-72.2	169.9	0	0	0	112.5	K320 I322 W327 N328	K320-L324 VanDerWaalsContact O-CB 3.23Å; K320-L324 WeakPolarHBondContact O-CB 3.35Å; K320-L324 WeakPolarHBondContact O-CD1 3.22Å; K320-L324 WeakPolarHBondContact O-CG 3.3Å; K320-L324 PolarHBondContact O-N 3.47Å; I322-L324 PolarHBondContact O-N 3.26Å; L324-W327 PolarHBondContact O-N 3.15Å; L324-N328 PolarHBondContact O-N 3.4Å
325	A	89.3	Confident	79.5	Confident	21 Å²	21	96.1 Å²	96.1	17%	0.174	45%	0.446	C	S	.	.	H	α-helix	trans	-67.4	-38.5	176	0	0	0	0	0	112.4	R321 I322 L323 N328 C332	R321-A325 WeakPolarHBondContact O-CB 3.4Å; R321-A325 PolarHBondContact O-N 2.88Å; I322-A325 PolarHBondContact O-N 3.49Å; L323-A325 VanDerWaalsContact C-N 3.35Å; L323-A325 PolarHBondContact O-N 2.9Å; A325-N328 CarbonylContact O-C 3.17Å; A325-C332 VanDerWaalsContact CB-SG 3.59Å
326	L	88.4	Confident	77.5	Confident	130 Å²	130	100.5 Å²	100.5	68%	0.681	48%	0.476	S	S	*	.	H	α-helix	trans	-69.8	-38.7	175.3	-71.9	165.6	0	0	0	111.7	I322 L323	I322-L326 HydrophobicContact CG2-CD1 3.87Å; I322-L326 WeakPolarHBondContact O-CG 3.31Å; I322-L326 PolarHBondContact O-N 2.91Å; L323-L326 PolarHBondContact O-N 3.05Å
327	W	89.9	Confident	75.2	Confident	212 Å²	212	98.2 Å²	98.2	80%	0.803	48%	0.478	S	S	*	.	H	α-helix	trans	-73.2	-38.8	179	-167.7	-88.1	0	0	0	112.6	L323 L324	L323-W327 VanDerWaalsContact O-CB 3.3Å; L323-W327 WeakPolarHBondContact O-CB 3.32Å; L323-W327 PolarHBondContact O-N 3.48Å; L324-W327 PolarHBondContact O-N 3.15Å
328	N	87	Confident	73	Confident	79 Å²	79	98.5 Å²	98.5	42%	0.422	48%	0.483	S	S	.	.			trans	-127.8	80.5	-177.2	-74.5	-23.3	0	0	0	111.7	L324 A325 R330 H331	L324-N328 PolarHBondContact O-N 3.4Å; A325-N328 CarbonylContact O-C 3.17Å; N328-R330 PolarHBondContact O-N 3.26Å; N328-H331 PolarHBondContact O-N 3.29Å; N328-H331 VanDerWaalsContact O-N 3.16Å
329	P	69.1	Low	70.5	Confident	88 Å²	88	100 Å²	100	57%	0.571	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.2	-177.1	21.1	-31.4	0	0	0	114	H331 C332	P329-H331 VanDerWaalsContact C-N 3.25Å; P329-H331 PolarHBondContact O-N 3.39Å; P329-C332 PolarHBondContact O-N 3.02Å
330	R	60.4	Low	68	Low	224 Å²	224	102.9 Å²	102.9	85%	0.845	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-23.4	177.4	-65	-173.2	-179.3	-169.2	0.5	113.8	N328	N328-R330 PolarHBondContact O-N 3.26Å
331	H	54.9	Low	65.5	Low	119 Å²	119	103.1 Å²	103.1	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-79.5	-26.4	179.9	-117.8	-67	0	0	0	113.5	N328 P329 I333 Q334	N328-H331 PolarHBondContact O-N 3.29Å; N328-H331 VanDerWaalsContact O-N 3.16Å; P329-H331 VanDerWaalsContact C-N 3.25Å; P329-H331 PolarHBondContact O-N 3.39Å; H331-I333 VanDerWaalsContact C-N 3.29Å; H331-I333 PolarHBondContact O-N 3.47Å; H331-Q334 PolarHBondContact O-N 3.22Å
332	C	51.6	Low	63.1	Low	51 Å²	51	100.8 Å²	100.8	35%	0.345	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-28.2	178.6	-90.4	0	0	0	0	113.2	A325 P329	A325-C332 VanDerWaalsContact CB-SG 3.59Å; P329-C332 PolarHBondContact O-N 3.02Å
333	I	52	Low	60.6	Low	132 Å²	132	108.1 Å²	108.1	68%	0.677	57%	0.566	S	S	*	*	H	α-helix	trans	-72	-32.8	-179.6	-59.6	176.5	0	0	0	110.9	H331 S337	H331-I333 VanDerWaalsContact C-N 3.29Å; H331-I333 PolarHBondContact O-N 3.47Å; I333-S337 PolarHBondContact O-N 2.85Å
334	Q	49.5	Very low	58.1	Low	115 Å²	115	107.6 Å²	107.6	54%	0.537	58%	0.575	S	S	.	*	H	α-helix	trans	-74.1	-33.4	-179.9	-96	175.1	-14.9	0	0	113.8	H331 S337 K338	H331-Q334 PolarHBondContact O-N 3.22Å; Q334-S337 PolarHBondContact O-N 3.49Å; Q334-K338 PolarHBondContact O-N 3.34Å
335	D	51	Low	55.9	Low	110 Å²	110	110 Å²	110	59%	0.588	59%	0.587	S	S	*	*	H	α-helix	trans	-72.8	-33.8	178.9	-82.4	-15	0	0	0	112.5	K338 G339	D335-K338 PolarHBondContact O-N 3.04Å; D335-G339 PolarHBondContact O-N 3.08Å
336	S	49.1	Very low	53.5	Low	92 Å²	92	116.9 Å²	116.9	64%	0.643	62%	0.616	S	S	*	*	H	α-helix	trans	-66.8	-36.3	171.9	-79	0	0	0	0	112.5	G339 S340	S336-G339 PolarHBondContact O-N 3.45Å; S336-S340 PolarHBondContact O-N 3.07Å
337	S	42.8	Very low	50.7	Low	65 Å²	65	116.1 Å²	116.1	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-67	-36.6	177.1	172.2	0	0	0	0	112.6	I333 Q334 H341	I333-S337 PolarHBondContact O-N 2.85Å; Q334-S337 PolarHBondContact O-N 3.49Å; S337-H341 PolarHBondContact O-CD2 3.47Å; S337-H341 PolarHBondContact O-N 3.25Å
338	K	45.5	Very low	48.2	Very low	149 Å²	149	111.7 Å²	111.7	65%	0.648	62%	0.62	S	S	*	*	H	α-helix	trans	-72	-28	176.6	-73.3	-179.3	178.8	178.1	0	113.6	Q334 D335 A342	Q334-K338 PolarHBondContact O-N 3.34Å; D335-K338 PolarHBondContact O-N 3.04Å; K338-A342 PolarHBondContact O-N 3.2Å
339	G	42.3	Very low	46	Very low	40 Å²	40	112.3 Å²	112.3	41%	0.412	64%	0.636	S	S	.	*	H	α-helix	trans	-66.4	-44.5	174.2	0	0	0	0	0	113.1	D335 S336 H341 A342 E343	D335-G339 PolarHBondContact O-N 3.08Å; S336-G339 PolarHBondContact O-N 3.45Å; G339-H341 PolarHBondContact O-N 2.97Å; G339-A342 PolarHBondContact O-N 3.49Å; G339-E343 PolarHBondContact O-N 2.97Å
340	S	41.5	Very low	44.5	Very low	85 Å²	85	113.6 Å²	113.6	59%	0.594	64%	0.644	S	S	*	*	H	α-helix	trans	-67.9	-31.5	178.7	-81.6	0	0	0	0	114.1	S336	S336-S340 PolarHBondContact O-N 3.07Å
341	H	40.4	Very low	43.4	Very low	138 Å²	138	108.5 Å²	108.5	64%	0.639	64%	0.64	S	S	*	*	H	α-helix	trans	-74.6	-24.6	177.1	-83.5	-65.3	0	0	0	113.6	S337 G339	S337-H341 PolarHBondContact O-CD2 3.47Å; S337-H341 PolarHBondContact O-N 3.25Å; G339-H341 PolarHBondContact O-N 2.97Å
342	A	42.2	Very low	42.7	Very low	61 Å²	61	110.9 Å²	110.9	50%	0.504	66%	0.655	S	S	.	*	H	α-helix	trans	-78.8	-32.8	178.5	0	0	0	0	0	113	K338 G339	K338-A342 PolarHBondContact O-N 3.2Å; G339-A342 PolarHBondContact O-N 3.49Å
343	E	40.7	Very low	41.9	Very low	162 Å²	162	115.6 Å²	115.6	76%	0.757	68%	0.675	S	S	*	*	H	α-helix	trans	-73.5	-25.6	175.3	-85.7	178.9	145	0	0	113.1	G339 L345	G339-E343 PolarHBondContact O-N 2.97Å; E343-L345 VanDerWaalsContact C-N 3.35Å; E343-L345 PolarHBondContact O-N 3.35Å
344	A	41	Very low	41.3	Very low	80 Å²	80	112.5 Å²	112.5	66%	0.661	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-17.8	179.1	0	0	0	0	0	114.2
345	L	44.4	Very low	40.6	Very low	156 Å²	156	113.2 Å²	113.2	82%	0.817	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	2.7	-174.9	-121	95.1	0	0	0	114.8	E343	E343-L345 VanDerWaalsContact C-N 3.35Å; E343-L345 PolarHBondContact O-N 3.35Å
346	Q	39.4	Very low	39.8	Very low	166 Å²	166	116.3 Å²	116.3	78%	0.776	70%	0.699	S	S	*	*	S	Bend	trans	-114.3	15.8	-172.7	-82.5	-173.5	-8.3	0	0	116	P348	Q346-P348 WeakPolarHBondContact O-CD 3.46Å
347	S	30.1	Very low	39.2	Very low	114 Å²	114	120.7 Å²	120.7	80%	0.797	71%	0.709	S	S	*	*			trans	-112.3	98.6	171.5	-72.9	0	0	0	0	112.2
348	P	38.2	Very low	38.8	Very low	119 Å²	119	127 Å²	127	77%	0.773	73%	0.731	S	S	*	*			trans	-86.6	113	153.6	25.7	-13.5	0	0	0	108.5	Q346	Q346-P348 WeakPolarHBondContact O-CD 3.46Å
349	A	39.3	Very low	38.4	Very low	93 Å²	93	124.2 Å²	124.2	77%	0.769	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-67.7	134.4	167.6	0	0	0	0	0	109.6
350	P	38.6	Very low	38.3	Very low	114 Å²	114	130.2 Å²	130.2	74%	0.74	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-76.6	148.8	173	29.5	-30.4	0	0	0	111
351	P	37.5	Very low	38.1	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-74.2	137.7	-179.7	29.3	-31.5	0	0	0	111.4	I353	P351-I353 PolarHBondContact O-N 3.03Å
352	I	38.6	Very low	37.9	Very low	168 Å²	168	136.1 Å²	136.1	86%	0.862	80%	0.8	S	S	*	*			trans	-76.2	114.6	173.6	-62	171.6	0	0	0	108
353	I	35	Very low	37.7	Very low	150 Å²	150	139.9 Å²	139.9	77%	0.769	82%	0.815	S	S	*	*			trans	-107.1	111.3	163.3	-63.5	177.1	0	0	0	106.7	P351 V355	P351-I353 PolarHBondContact O-N 3.03Å; I353-V355 HydrophobicContact CG2-CG2 4.32Å
354	G	39.1	Very low	37.5	Very low	67 Å²	67	138.7 Å²	138.7	69%	0.691	82%	0.818	S	S	*	*			trans	-83.1	134.9	168.8	0	0	0	0	0	110.5
355	V	34.8	Very low	37.3	Very low	130 Å²	130	142 Å²	142	79%	0.788	83%	0.827	S	S	*	*			trans	-141.2	123.8	159.3	-178.6	0	0	0	0	109.8	I353	I353-V355 HydrophobicContact CG2-CG2 4.32Å
356	Q	35.2	Very low	36.9	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	83%	0.827	S	S	*	*			trans	-10.9	140.7	164.2	-116.5	84.6	-15.1	0	0	120.9
357	H	37.4	Very low	36.8	Very low	183 Å²	183	139.6 Å²	139.6	85%	0.847	83%	0.83	S	S	*	*			trans	-43.1	141.5	154.1	-93.7	-76.4	0	0	0	114.6
358	Q	34	Very low	37.2	Very low	198 Å²	198	141.3 Å²	141.3	93%	0.925	83%	0.833	S	S	*	*			trans	-136.7	119.3	148.9	-144.1	166.9	-2.8	0	0	108.7
359	A	36.8	Very low	37.1	Very low	90 Å²	90	142.9 Å²	142.9	74%	0.744	84%	0.837	S	S	*	*			trans	-97.8	144.9	172.7	0	0	0	0	0	108.8
360	D	39.7	Very low	37	Very low	167 Å²	167	146.8 Å²	146.8	89%	0.893	84%	0.842	S	S	*	*			trans	-60.5	140.7	174.9	-64.1	-46.5	0	0	0	112.7
361	A	37.3	Very low	36.8	Very low	94 Å²	94	149.5 Å²	149.5	78%	0.777	85%	0.851	S	S	*	*			trans	-178.8	129.2	134.7	0	0	0	0	0	112.4
362	L	36.5	Very low	36.8	Very low	253 Å²	253	152.4 Å²	152.4	100%	1.325	86%	0.858	S	S	*	*			trans	81.9	0	162.9	-72.5	154.5	0	0	0	119.2

Retrieved 362 of 362 residues in 598.2 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).