G7PBL1_MACFA Loading...

Annexin

AlphaFold DB , UniProt , Accession G7PBL1, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene ANXA2, Length 357 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	T	40.2	Very low	34.2	Very low	202 Å²	202	137.9 Å²	137.9	100%	1.239	87%	0.871	S	S	*	*				0	91.5	0	36.6	0	0	0	0	107.4
2	G	36.6	Very low	33.8	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	86%	0.861	S	S	*	*			cis	106.7	90.1	44.9	0	0	0	0	0	108.6
3	R	36.6	Very low	33.8	Very low	252 Å²	252	138 Å²	138	95%	0.951	86%	0.863	S	S	*	*			trans	178.3	110.8	135.9	-99.7	175.2	-165.9	-164.1	4.5	111.4
4	Q	34.6	Very low	33.8	Very low	183 Å²	183	144.2 Å²	144.2	86%	0.855	87%	0.871	S	S	*	*			trans	-62	142.7	157.2	-72.3	153.3	-49.1	0	0	109.9
5	L	36.2	Very low	34.2	Very low	183 Å²	183	140.7 Å²	140.7	96%	0.958	86%	0.864	S	S	*	*			trans	-131	110.7	144.6	-82.6	174.1	0	0	0	108
6	A	35.1	Very low	34.5	Very low	92 Å²	92	139.1 Å²	139.1	76%	0.76	86%	0.86	S	S	*	*			trans	-74.5	152.8	179.6	0	0	0	0	0	111.1
7	G	31.5	Very low	34.4	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	86%	0.859	S	S	*	*			trans	-63	147.9	166.4	0	0	0	0	0	111.9
8	C	30.1	Very low	34.6	Very low	130 Å²	130	144.9 Å²	144.9	88%	0.878	86%	0.857	S	S	*	*			trans	-138.6	99.9	160.9	-143.7	0	0	0	0	106.5
9	G	28.7	Very low	34.5	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	86%	0.858	S	S	*	*			trans	-86.8	133	150.3	0	0	0	0	0	107
10	D	30	Very low	35.3	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	84%	0.842	S	S	*	*			trans	-164.7	146.3	136.1	-147.8	-2.9	0	0	0	112.4
11	A	36.5	Very low	36.3	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	82%	0.817	S	S	*	*			trans	23.3	112.6	150.2	0	0	0	0	0	120.1
12	G	29.4	Very low	36.4	Very low	73 Å²	73	133.3 Å²	133.3	75%	0.753	78%	0.783	S	S	*	*			trans	-162.2	82.9	163.8	0	0	0	0	0	113.8
13	K	33.9	Very low	36.8	Very low	204 Å²	204	134.7 Å²	134.7	89%	0.887	77%	0.77	S	S	*	*			trans	133.6	51.9	154.2	-70.6	171.3	-178.2	-179.5	0	114.7	A15	K13-A15 VanDerWaalsContact C-N 3.35Å
14	K	34.4	Very low	37.4	Very low	225 Å²	225	128 Å²	128	98%	0.978	75%	0.749	S	S	*	*			trans	-89.1	76.8	143.9	-91.2	-177.5	176.8	175.2	0	108.3
15	A	38.9	Very low	38.2	Very low	92 Å²	92	123.3 Å²	123.3	76%	0.76	73%	0.729	S	S	*	*			trans	-143.9	77.6	173	0	0	0	0	0	108.9	K13	K13-A15 VanDerWaalsContact C-N 3.35Å
16	S	38.6	Very low	38.4	Very low	114 Å²	114	119.4 Å²	119.4	80%	0.797	71%	0.709	S	S	*	*	S	Bend	trans	-151.4	-12.2	168.7	-171.7	0	0	0	0	114.5
17	F	34	Very low	38.7	Very low	192 Å²	192	116.9 Å²	116.9	84%	0.842	69%	0.685	S	S	*	*	S	Bend	trans	-106.3	5.4	-172.5	-117.8	-93.4	0	0	0	116.9
18	K	37.4	Very low	39.3	Very low	191 Å²	191	118.7 Å²	118.7	83%	0.83	67%	0.67	S	S	*	*	S	Bend	trans	-103.6	-9.2	-176	-87.7	-173.2	174.7	-177.3	0	116.2
19	M	33.2	Very low	39.7	Very low	176 Å²	176	118.6 Å²	118.6	87%	0.867	66%	0.66	S	S	*	*	H	α-helix	trans	-87.5	-10.9	-178.6	-80.6	-128	-83.7	0	0	114.8
20	S	49.8	Very low	40.1	Very low	79 Å²	79	120.2 Å²	120.2	55%	0.552	66%	0.66	S	S	*	*	H	α-helix	trans	-71.7	-39.2	178.4	-165.3	0	0	0	0	112.5	E24	S20-E24 PolarHBondContact O-N 2.96Å
21	T	55.6	Low	40.8	Very low	51 Å²	51	117.8 Å²	117.8	31%	0.313	65%	0.646	S	S	.	*	H	α-helix	trans	-81.6	-31.6	-166.7	-35.9	0	0	0	0	113.2	H23 E24 I25	T21-H23 VanDerWaalsContact C-N 3.31Å; T21-E24 PolarHBondContact O-N 3.49Å; T21-I25 HydrophobicContact CG2-CD1 4.39Å; T21-I25 WeakPolarHBondContact O-CD1 3.49Å; T21-I25 VanDerWaalsContact O-CG1 3.25Å; T21-I25 WeakPolarHBondContact O-CG1 3.41Å; T21-I25 PolarHBondContact O-N 3.37Å; T21-I25 VanDerWaalsContact O-N 3.13Å
22	V	43.8	Very low	40.7	Very low	87 Å²	87	122.7 Å²	122.7	53%	0.527	65%	0.654	S	S	.	*	H	α-helix	trans	-69.9	-33.1	176.4	-179.7	0	0	0	0	110.8	I25 L26	V22-I25 PolarHBondContact O-N 3.33Å; V22-L26 HydrophobicContact CG1-CD1 3.95Å; V22-L26 HydrophobicContact CG1-CG 4.44Å; V22-L26 WeakPolarHBondContact O-CB 3.49Å; V22-L26 WeakPolarHBondContact O-CG 3.35Å; V22-L26 PolarHBondContact O-N 2.86Å
23	H	44.3	Very low	40.9	Very low	103 Å²	103	121.2 Å²	121.2	48%	0.477	64%	0.639	S	S	.	*	H	α-helix	trans	-69.7	-38.5	176.7	-168.6	63.7	0	0	0	112.3	T21 L26 C27	T21-H23 VanDerWaalsContact C-N 3.31Å; H23-L26 PolarHBondContact O-N 3.08Å; H23-C27 PolarHBondContact O-N 2.7Å; H23-C27 PolarHBondContact O-SG 3.29Å
24	E	48.3	Very low	41	Very low	111 Å²	111	118.4 Å²	118.4	52%	0.519	63%	0.633	S	S	.	*	H	α-helix	trans	-64.7	-37.8	172.4	-75.9	173.6	162.5	0	0	112.3	S20 T21 K28	S20-E24 PolarHBondContact O-N 2.96Å; T21-E24 PolarHBondContact O-N 3.49Å; E24-K28 PolarHBondContact O-N 2.94Å
25	I	51.8	Low	41.1	Very low	86 Å²	86	115.8 Å²	115.8	44%	0.441	62%	0.624	S	S	.	*	H	α-helix	trans	-70.3	-40.7	176.9	-67	165.2	0	0	0	111.4	T21 V22 K28 L29	T21-I25 HydrophobicContact CG2-CD1 4.39Å; T21-I25 WeakPolarHBondContact O-CD1 3.49Å; T21-I25 VanDerWaalsContact O-CG1 3.25Å; T21-I25 WeakPolarHBondContact O-CG1 3.41Å; T21-I25 PolarHBondContact O-N 3.37Å; T21-I25 VanDerWaalsContact O-N 3.13Å; V22-I25 PolarHBondContact O-N 3.33Å; I25-K28 WeakPolarHBondContact O-CB 3.45Å; I25-K28 PolarHBondContact O-N 2.9Å; I25-L29 PolarHBondContact O-N 3.43Å
26	L	40.5	Very low	41.4	Very low	100 Å²	100	115.7 Å²	115.7	52%	0.524	62%	0.618	S	S	.	*	H	α-helix	trans	-68.1	-34.6	176.6	-77	166.8	0	0	0	112.2	V22 H23 K28 L29 S30	V22-L26 HydrophobicContact CG1-CD1 3.95Å; V22-L26 HydrophobicContact CG1-CG 4.44Å; V22-L26 WeakPolarHBondContact O-CB 3.49Å; V22-L26 WeakPolarHBondContact O-CG 3.35Å; V22-L26 PolarHBondContact O-N 2.86Å; H23-L26 PolarHBondContact O-N 3.08Å; L26-K28 VanDerWaalsContact C-N 3.28Å; L26-K28 PolarHBondContact O-N 3.19Å; L26-L29 PolarHBondContact O-N 3.27Å; L26-S30 PolarHBondContact O-N 3.46Å
27	C	41.7	Very low	42.1	Very low	39 Å²	39	114.4 Å²	114.4	26%	0.264	61%	0.605	S	S	.	*	H	α-helix	trans	-60.1	-40	170.4	-73.7	0	0	0	0	111.4	H23 L29 S30 L31	H23-C27 PolarHBondContact O-N 2.7Å; H23-C27 PolarHBondContact O-SG 3.29Å; C27-L29 VanDerWaalsContact C-N 3.34Å; C27-L29 PolarHBondContact O-N 2.96Å; C27-S30 PolarHBondContact O-N 3.33Å; C27-L31 WeakPolarHBondContact O-CD1 3.49Å; C27-L31 WeakPolarHBondContact O-CG 3.18Å; C27-L31 PolarHBondContact O-N 3.05Å
28	K	44.8	Very low	43.2	Very low	117 Å²	117	110.7 Å²	110.7	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-64.9	-33.9	177.5	-73	-174	177.9	-171.2	0	113.7	E24 I25 L26	E24-K28 PolarHBondContact O-N 2.94Å; I25-K28 WeakPolarHBondContact O-CB 3.45Å; I25-K28 PolarHBondContact O-N 2.9Å; L26-K28 VanDerWaalsContact C-N 3.28Å; L26-K28 PolarHBondContact O-N 3.19Å
29	L	38.2	Very low	45	Very low	128 Å²	128	107.6 Å²	107.6	67%	0.67	60%	0.6	S	S	*	*	H	α-helix	trans	-79.2	-20.1	178.8	-70.6	169.2	0	0	0	113.4	I25 L26 C27	I25-L29 PolarHBondContact O-N 3.43Å; L26-L29 PolarHBondContact O-N 3.27Å; C27-L29 VanDerWaalsContact C-N 3.34Å; C27-L29 PolarHBondContact O-N 2.96Å
30	S	36.7	Very low	47.6	Very low	110 Å²	110	101.5 Å²	101.5	77%	0.769	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-2.3	173.3	-75.8	0	0	0	0	114.2	L26 C27	L26-S30 PolarHBondContact O-N 3.46Å; C27-S30 PolarHBondContact O-N 3.33Å
31	L	44.1	Very low	49.7	Very low	106 Å²	106	101.1 Å²	101.1	56%	0.555	58%	0.577	S	S	*	*			trans	-96	18.7	-175.5	-75.7	168.6	0	0	0	114.5	C27 G33	C27-L31 WeakPolarHBondContact O-CD1 3.49Å; C27-L31 WeakPolarHBondContact O-CG 3.18Å; C27-L31 PolarHBondContact O-N 3.05Å; L31-G33 PolarHBondContact O-N 3.48Å
32	E	35.4	Very low	51.6	Low	193 Å²	193	104.2 Å²	104.2	90%	0.902	58%	0.583	S	S	*	*			trans	-73.5	43.2	162.4	-68.5	-173.8	174.7	0	0	111.7
33	G	32.5	Very low	54.2	Low	42 Å²	42	100.1 Å²	100.1	43%	0.433	56%	0.559	S	S	.	*	S	Bend	trans	-112.2	102.2	163	0	0	0	0	0	106.9	L31 H35	L31-G33 PolarHBondContact O-N 3.48Å; G33-H35 VanDerWaalsContact C-N 3.3Å; G33-H35 PolarHBondContact O-N 2.9Å
34	D	37.7	Very low	56.7	Low	144 Å²	144	96.4 Å²	96.4	77%	0.77	54%	0.544	S	S	*	.			trans	-63.2	85.3	-177.2	-151.1	-3.1	0	0	0	110.6	S36	D34-S36 PolarHBondContact OD1-OG 3.26Å
35	H	36.5	Very low	59.1	Low	171 Å²	171	91.7 Å²	91.7	79%	0.792	52%	0.523	S	S	*	.			trans	-106.5	35.6	168.1	-68.8	-48.8	0	0	0	110.2	G33 T37	G33-H35 VanDerWaalsContact C-N 3.3Å; G33-H35 PolarHBondContact O-N 2.9Å; H35-T37 PolarHBondContact O-N 2.98Å
36	S	44.4	Very low	61.2	Low	89 Å²	89	93.7 Å²	93.7	62%	0.622	53%	0.529	S	S	*	.			trans	-71.8	109.9	173.5	58.6	0	0	0	0	109	D34	D34-S36 PolarHBondContact OD1-OG 3.26Å
37	T	52.3	Low	63.8	Low	87 Å²	87	92.1 Å²	92.1	53%	0.534	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.3	164	29.9	0	0	0	0	108.3	H35 Q156	H35-T37 PolarHBondContact O-N 2.98Å; T37-Q156 VanDerWaalsContact CG2-NE2 3.3Å; T37-Q156 VanDerWaalsContact CG2-OE1 3.29Å
38	P	58.7	Low	66.5	Low	114 Å²	114	95.1 Å²	95.1	74%	0.74	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-55.7	138.8	178.1	19.8	-29.9	0	0	0	109.6	S40	P38-S40 PolarHBondContact O-N 3.02Å
39	P	75.1	Confident	68.9	Low	127 Å²	127	95.9 Å²	95.9	83%	0.825	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-52.6	128.8	-178.8	-26.4	33.2	0	0	0	111	A41	P39-A41 PolarHBondContact O-N 2.91Å
40	S	88.4	Confident	71.6	Confident	47 Å²	47	95.6 Å²	95.6	33%	0.329	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-64.9	124.8	179.4	-178.3	0	0	0	0	110.6	P38 Y42 G43 V316	P38-S40 PolarHBondContact O-N 3.02Å; S40-Y42 PolarHBondContact O-N 2.88Å; S40-Y42 VanDerWaalsContact O-N 3.16Å; S40-Y42 PolarHBondContact OG-N 2.99Å; S40-G43 PolarHBondContact O-N 2.94Å; S40-V316 VanDerWaalsContact CB-O 3.28Å; S40-V316 WeakPolarHBondContact CB-O 3.41Å; S40-V316 PolarHBondContact OG-O 3.47Å
41	A	91.9	Very high	74.5	Confident	72 Å²	72	93 Å²	93	60%	0.595	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.4	173.8	0	0	0	0	0	113.1	P39	P39-A41 PolarHBondContact O-N 2.91Å
42	Y	96.7	Very high	77.1	Confident	116 Å²	116	91.3 Å²	91.3	46%	0.455	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	5.8	-173.4	-56.5	-76.5	0	0	0	114.2	S40 V316 D317 M318 L319 K320	S40-Y42 PolarHBondContact O-N 2.88Å; S40-Y42 VanDerWaalsContact O-N 3.16Å; S40-Y42 PolarHBondContact OG-N 2.99Å; Y42-V316 CarbonylContact C-O 3.27Å; Y42-D317 CarbonylContact O-C 3.58Å; Y42-D317 WeakPolarHBondContact O-CA 3.45Å; Y42-M318 PolarHBondContact O-N 2.71Å; Y42-L319 WeakPolarHBondContact O-CB 3.48Å; Y42-L319 WeakPolarHBondContact O-CG 3.22Å; Y42-L319 PolarHBondContact O-N 3.35Å; Y42-K320 HydrophobicContact CD1-CD 4.18Å; Y42-K320 VanDerWaalsContact CD1-CE 3.42Å; Y42-K320 HydrophobicContact CD1-CG 3.87Å; Y42-K320 VanDerWaalsContact CE1-CE 3.42Å; Y42-K320 HydrophobicContact CE1-CG 4.47Å; Y42-K320 HydrophobicContact CG-CD 4.15Å; Y42-K320 VanDerWaalsContact CG-CE 3.49Å; Y42-K320 HydrophobicContact CG-CG 4.14Å
43	G	97.1	Very high	80.1	Confident	1 Å²	1	83 Å²	83	1%	0.01	48%	0.481	C	S	.	.			trans	-71.3	143.8	168.7	0	0	0	0	0	112	S40 S314	S40-G43 PolarHBondContact O-N 2.94Å; G43-S314 CarbonylContact C-O 3.53Å; G43-S314 WeakPolarHBondContact CA-O 3.18Å
44	S	98	Very high	83.2	Confident	25 Å²	25	86.1 Å²	86.1	18%	0.175	48%	0.484	C	S	.	.	S	Bend	trans	-78.8	-38	170.8	51.2	0	0	0	0	111.8	S314 M318 L352 C353	S44-S314 PolarHBondContact N-O 3.49Å; S44-S314 PolarHBondContact OG-O 3.36Å; S44-M318 WeakPolarHBondContact OG-CB 3.47Å; S44-M318 WeakPolarHBondContact OG-CG 3.16Å; S44-L352 WeakPolarHBondContact CB-O 3.16Å; S44-L352 PolarHBondContact OG-O 3.15Å; S44-C353 WeakPolarHBondContact CB-O 3.44Å
45	V	97.8	Very high	86.1	Confident	11 Å²	11	84.8 Å²	84.8	7%	0.067	47%	0.468	C	S	.	.	S	Bend	trans	-91.3	133.5	174.9	179.6	0	0	0	0	109.2	R81 S314 E315 L352	V45-R81 WeakPolarHBondContact CG1-O 3.14Å; V45-S314 PolarHBondContact N-O 3.43Å; V45-E315 HydrophobicContact CB-CG 3.84Å; V45-E315 HydrophobicContact CG1-CG 4.18Å; V45-L352 HydrophobicContact CG2-CD2 3.89Å
46	K	95.9	Very high	89.1	Confident	129 Å²	129	76.8 Å²	76.8	56%	0.561	43%	0.431	S	S	*	.			trans	-130.5	164.7	-178.7	-66.6	-178.9	178.8	170.8	0	110.6	Y48	K46-Y48 PolarHBondContact O-N 2.81Å
47	A	96.8	Very high	91.7	Very high	66 Å²	66	72.6 Å²	72.6	55%	0.545	40%	0.402	S	S	.	.			trans	-58.5	129.2	173.3	0	0	0	0	0	110.3
48	Y	97.3	Very high	93.9	Very high	103 Å²	103	71.7 Å²	71.7	40%	0.404	39%	0.393	S	S	.	.			trans	-73.8	126.1	176.2	-172.8	-108.1	0	0	0	110	K46 N50 F51 Q85	K46-Y48 PolarHBondContact O-N 2.81Å; Y48-N50 HydrophobicContact CE1-CB 4.34Å; Y48-N50 WeakPolarHBondContact CE1-O 3.48Å; Y48-N50 PolarHBondContact O-N 3.23Å; Y48-F51 HydrophobicContact CD1-CB 4.43Å; Y48-F51 WeakPolarHBondContact O-CB 3.49Å; Y48-Q85 PolarHBondContact O-NE2 2.76Å
49	T	94.8	Very high	95.8	Very high	133 Å²	133	69.3 Å²	69.3	82%	0.816	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-45.7	-168.4	-49.5	0	0	0	0	113.6	F51	T49-F51 PolarHBondContact O-N 3.47Å
50	N	95.2	Very high	96.9	Very high	121 Å²	121	63.3 Å²	63.3	65%	0.647	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	53.1	-177.7	-68.9	-44.9	0	0	0	111	Y48 R55	Y48-N50 HydrophobicContact CE1-CB 4.34Å; Y48-N50 WeakPolarHBondContact CE1-O 3.48Å; Y48-N50 PolarHBondContact O-N 3.23Å; N50-R55 PolarHBondContact O-NH2 3.43Å
51	F	98.1	Very high	97.4	Very high	55 Å²	55	62.5 Å²	62.5	24%	0.241	33%	0.326	C	S	.	.			trans	-75.6	136.1	-174.1	174.5	-116.2	0	0	0	113.1	Y48 T49 A53 D56 Q85 D88 I89	Y48-F51 HydrophobicContact CD1-CB 4.43Å; Y48-F51 WeakPolarHBondContact O-CB 3.49Å; T49-F51 PolarHBondContact O-N 3.47Å; F51-A53 HydrophobicContact CE1-CB 4.01Å; F51-A53 HydrophobicContact CE2-CB 4.34Å; F51-A53 HydrophobicContact CZ-CB 3.58Å; F51-D56 WeakPolarHBondContact CD2-OD2 3.36Å; F51-D56 WeakPolarHBondContact CE2-OD2 3.35Å; F51-Q85 HydrophobicContact CD1-CB 4.36Å; F51-Q85 HydrophobicContact CD1-CG 3.72Å; F51-Q85 HydrophobicContact CD2-CB 4.14Å; F51-Q85 HydrophobicContact CD2-CG 4.08Å; F51-Q85 HydrophobicContact CE1-CB 4Å; F51-Q85 HydrophobicContact CE1-CG 3.78Å; F51-Q85 HydrophobicContact CE2-CB 3.8Å; F51-Q85 HydrophobicContact CE2-CG 4.16Å; F51-Q85 HydrophobicContact CG-CB 4.41Å; F51-Q85 HydrophobicContact CG-CG 3.86Å; F51-Q85 HydrophobicContact CZ-CB 3.7Å; F51-Q85 HydrophobicContact CZ-CG 4Å; F51-Q85 WeakPolarHBondContact CZ-O 3.39Å; F51-D88 HydrophobicContact CE1-CB 4.01Å; F51-D88 HydrophobicContact CZ-CB 3.92Å; F51-I89 HydrophobicContact CE2-CD1 3.9Å; F51-I89 HydrophobicContact CE2-CG1 3.74Å; F51-I89 HydrophobicContact CZ-CD1 4.49Å; F51-I89 HydrophobicContact CZ-CG1 3.95Å
52	D	98.4	Very high	97.7	Very high	71 Å²	71	62.8 Å²	62.8	38%	0.38	32%	0.321	S	S	.	.			trans	-142.4	109.6	171.7	179.3	-35.9	0	0	0	107.8	E54 R55 D56	D52-E54 VanDerWaalsContact C-N 3.34Å; D52-E54 PolarHBondContact O-N 2.9Å; D52-E54 WeakPolarHBondContact OD1-CA 3.38Å; D52-E54 PolarHBondContact OD1-N 3.39Å; D52-R55 HydrophobicContact CB-CB 3.97Å; D52-R55 PolarHBondContact OD1-N 3.13Å; D52-D56 PolarHBondContact O-N 3.33Å
53	A	98.6	Very high	97.8	Very high	19 Å²	19	57.3 Å²	57.3	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-35.7	-177.4	0	0	0	0	0	112.9	F51 A57 D88 A92	F51-A53 HydrophobicContact CE1-CB 4.01Å; F51-A53 HydrophobicContact CE2-CB 4.34Å; F51-A53 HydrophobicContact CZ-CB 3.58Å; A53-A57 WeakPolarHBondContact O-CB 3.28Å; A53-A57 PolarHBondContact O-N 3.35Å; A53-D88 HydrophobicContact CB-CB 3.93Å; A53-A92 HydrophobicContact CB-CB 4.01Å
54	E	98.5	Very high	97.9	Very high	108 Å²	108	58.9 Å²	58.9	51%	0.505	31%	0.307	S	S	.	.	H	α-helix	trans	-73	-36.8	-177.4	-66.9	-160.5	171.7	0	0	112.1	D52 L58 A92 R96	D52-E54 VanDerWaalsContact C-N 3.34Å; D52-E54 PolarHBondContact O-N 2.9Å; D52-E54 WeakPolarHBondContact OD1-CA 3.38Å; D52-E54 PolarHBondContact OD1-N 3.39Å; E54-L58 WeakPolarHBondContact O-CB 3.43Å; E54-L58 PolarHBondContact O-N 2.97Å; E54-A92 HydrophobicContact CG-CB 4.38Å; E54-R96 PolarHBondContact O-NH2 2.96Å
55	R	98.6	Very high	97.9	Very high	116 Å²	116	64.7 Å²	64.7	44%	0.438	33%	0.33	S	S	.	.	H	α-helix	trans	-68.2	-46.8	173.9	-177.3	178.4	60.4	-178.4	-7.4	111.2	N50 D52 A57 L58 N59	N50-R55 PolarHBondContact O-NH2 3.43Å; D52-R55 HydrophobicContact CB-CB 3.97Å; D52-R55 PolarHBondContact OD1-N 3.13Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 3.29Å; R55-L58 PolarHBondContact O-N 3.07Å; R55-N59 VanDerWaalsContact O-CG 3.23Å; R55-N59 PolarHBondContact O-N 2.6Å; R55-N59 PolarHBondContact O-ND2 3.03Å
56	D	98.8	Very high	97.9	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-41.7	176.7	-77.7	-23.4	0	0	0	111.2	F51 D52 L58 N59 I60 I77 R81 I89	F51-D56 WeakPolarHBondContact CD2-OD2 3.36Å; F51-D56 WeakPolarHBondContact CE2-OD2 3.35Å; D52-D56 PolarHBondContact O-N 3.33Å; D56-L58 PolarHBondContact O-N 2.62Å; D56-N59 PolarHBondContact O-N 3.1Å; D56-I60 VanDerWaalsContact O-CG1 3.31Å; D56-I60 WeakPolarHBondContact O-CG1 3.46Å; D56-I60 PolarHBondContact O-N 2.94Å; D56-I77 HydrophobicContact CB-CG2 4.07Å; D56-R81 IonicContact OD1-CZ 3.82Å; D56-R81 IonicContact OD1-NE 3.95Å; D56-R81 IonicContact OD1-NH2 2.86Å; D56-R81 PolarHBondContact OD1-NH2 3.42Å; D56-R81 IonicContact OD2-CZ 3.32Å; D56-R81 VanDerWaalsContact OD2-CZ 3.32Å; D56-R81 IonicContact OD2-NE 2.7Å; D56-R81 PolarHBondContact OD2-NE 2.99Å; D56-R81 IonicContact OD2-NH2 3.08Å; D56-R81 PolarHBondContact OD2-NH2 3.24Å; D56-R81 VanDerWaalsContact OD2-NH2 3.08Å; D56-I89 HydrophobicContact CB-CD1 3.78Å; D56-I89 HydrophobicContact CB-CG1 3.79Å; D56-I89 HydrophobicContact CB-CG2 4.47Å
57	A	98.8	Very high	97.9	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.9	-41.2	174.7	0	0	0	0	0	112.8	A53 R55 E61 A92 Y93	A53-A57 WeakPolarHBondContact O-CB 3.28Å; A53-A57 PolarHBondContact O-N 3.35Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 3.29Å; A57-E61 WeakPolarHBondContact O-CB 3.34Å; A57-E61 PolarHBondContact O-N 3.49Å; A57-A92 HydrophobicContact CB-CB 3.95Å; A57-Y93 HydrophobicContact CB-CD2 4.44Å
58	L	98.7	Very high	97.7	Very high	68 Å²	68	71 Å²	71	36%	0.356	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-47.2	174.6	176.3	62.4	0	0	0	111.6	E54 R55 D56 I60 E61 T62	E54-L58 WeakPolarHBondContact O-CB 3.43Å; E54-L58 PolarHBondContact O-N 2.97Å; R55-L58 PolarHBondContact O-N 3.07Å; D56-L58 PolarHBondContact O-N 2.62Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 PolarHBondContact O-N 3.36Å; L58-E61 PolarHBondContact O-N 3.3Å; L58-T62 PolarHBondContact O-N 3.49Å; L58-T62 PolarHBondContact O-OG1 3.37Å
59	N	98.8	Very high	97.8	Very high	65 Å²	65	67.7 Å²	67.7	35%	0.348	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-40.4	-179.1	-69.1	-22	0	0	0	111.5	R55 D56 T62 A63 I77	R55-N59 VanDerWaalsContact O-CG 3.23Å; R55-N59 PolarHBondContact O-N 2.6Å; R55-N59 PolarHBondContact O-ND2 3.03Å; D56-N59 PolarHBondContact O-N 3.1Å; N59-T62 PolarHBondContact O-N 3.44Å; N59-A63 WeakPolarHBondContact O-CB 3.22Å; N59-A63 PolarHBondContact O-N 3.47Å; N59-I77 HydrophobicContact CB-CD1 3.68Å
60	I	98.8	Very high	97.9	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-42.6	174.5	-67.1	167.8	0	0	0	111.1	D56 L58 T62 A63 I64 I77 L78 I89 Y93 L101 L105	D56-I60 VanDerWaalsContact O-CG1 3.31Å; D56-I60 WeakPolarHBondContact O-CG1 3.46Å; D56-I60 PolarHBondContact O-N 2.94Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 PolarHBondContact O-N 3.36Å; I60-T62 VanDerWaalsContact C-N 3.35Å; I60-T62 PolarHBondContact O-N 2.94Å; I60-A63 PolarHBondContact O-N 3.44Å; I60-I64 HydrophobicContact CG2-CD1 3.84Å; I60-I64 HydrophobicContact CG2-CG1 4.39Å; I60-I64 VanDerWaalsContact O-CG1 3.31Å; I60-I64 WeakPolarHBondContact O-CG1 3.23Å; I60-I64 PolarHBondContact O-N 2.91Å; I60-I77 HydrophobicContact CD1-CG2 4Å; I60-I77 HydrophobicContact CG1-CD1 3.9Å; I60-I77 HydrophobicContact CG1-CG2 4.35Å; I60-L78 HydrophobicContact CD1-CD2 3.86Å; I60-L78 HydrophobicContact CD1-CG 4.2Å; I60-I89 HydrophobicContact CD1-CG2 3.62Å; I60-Y93 HydrophobicContact CG2-CE2 4.38Å; I60-L101 HydrophobicContact CG2-CD1 3.76Å; I60-L105 HydrophobicContact CG2-CD2 4.33Å
61	E	98.5	Very high	98.1	Very high	30 Å²	30	60.6 Å²	60.6	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-45.3	175.6	-175.2	-176.3	-173.6	0	0	111.8	A57 L58 I64 K65 Y93 R96 T97	A57-E61 WeakPolarHBondContact O-CB 3.34Å; A57-E61 PolarHBondContact O-N 3.49Å; L58-E61 PolarHBondContact O-N 3.3Å; E61-I64 PolarHBondContact O-N 3.23Å; E61-K65 HydrophobicContact CG-CD 4.36Å; E61-K65 WeakPolarHBondContact O-CG 3.31Å; E61-K65 PolarHBondContact O-N 3.48Å; E61-K65 VanDerWaalsContact O-N 3.11Å; E61-K65 VanDerWaalsContact OE1-CE 3.28Å; E61-K65 WeakPolarHBondContact OE1-CE 3.31Å; E61-K65 IonicContact OE1-NZ 3.82Å; E61-K65 PolarHBondContact OE1-NZ 2.94Å; E61-Y93 HydrophobicContact CB-CD2 4.41Å; E61-Y93 HydrophobicContact CB-CE2 3.74Å; E61-Y93 HydrophobicContact CG-CE2 4.35Å; E61-R96 WeakPolarHBondContact OE2-CD 3.43Å; E61-T97 VanDerWaalsContact CD-CG2 3.45Å; E61-T97 HydrophobicContact CG-CG2 4.07Å
62	T	98.6	Very high	98.1	Very high	79 Å²	79	60.5 Å²	60.5	49%	0.485	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-46.2	176	-65.7	0	0	0	0	110.5	L58 N59 I60 I64 K65 T66	L58-T62 PolarHBondContact O-N 3.49Å; L58-T62 PolarHBondContact O-OG1 3.37Å; N59-T62 PolarHBondContact O-N 3.44Å; I60-T62 VanDerWaalsContact C-N 3.35Å; I60-T62 PolarHBondContact O-N 2.94Å; T62-I64 VanDerWaalsContact C-N 3.32Å; T62-I64 PolarHBondContact O-N 3.28Å; T62-K65 PolarHBondContact O-N 2.91Å; T62-K65 VanDerWaalsContact O-N 3.08Å; T62-T66 PolarHBondContact O-N 3.08Å; T62-T66 PolarHBondContact O-OG1 3.37Å; T62-T66 VanDerWaalsContact O-OG1 3.1Å
63	A	98.6	Very high	98.1	Very high	1 Å²	1	59 Å²	59	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-39.2	178.3	0	0	0	0	0	113	N59 I60 K65 D70 T73 I74	N59-A63 WeakPolarHBondContact O-CB 3.22Å; N59-A63 PolarHBondContact O-N 3.47Å; I60-A63 PolarHBondContact O-N 3.44Å; A63-K65 VanDerWaalsContact C-N 3.34Å; A63-D70 HydrophobicContact CB-CB 3.91Å; A63-D70 PolarHBondContact O-N 2.99Å; A63-T73 HydrophobicContact CB-CG2 3.92Å; A63-I74 HydrophobicContact CB-CD1 4.28Å; A63-I74 HydrophobicContact CB-CG1 3.83Å
64	I	98.4	Very high	98.1	Very high	33 Å²	33	58.2 Å²	58.2	17%	0.169	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-35.8	175.1	-70.8	168	0	0	0	111.7	I60 E61 T62 I74 Y93 A104 L105 A108	I60-I64 HydrophobicContact CG2-CD1 3.84Å; I60-I64 HydrophobicContact CG2-CG1 4.39Å; I60-I64 VanDerWaalsContact O-CG1 3.31Å; I60-I64 WeakPolarHBondContact O-CG1 3.23Å; I60-I64 PolarHBondContact O-N 2.91Å; E61-I64 PolarHBondContact O-N 3.23Å; T62-I64 VanDerWaalsContact C-N 3.32Å; T62-I64 PolarHBondContact O-N 3.28Å; I64-I74 HydrophobicContact CG1-CD1 4.11Å; I64-Y93 HydrophobicContact CD1-CE2 4.34Å; I64-A104 HydrophobicContact CD1-CB 4.1Å; I64-L105 HydrophobicContact CD1-CD2 3.81Å; I64-L105 HydrophobicContact CD1-CG 4.08Å; I64-L105 HydrophobicContact CG1-CD2 4.05Å; I64-A108 HydrophobicContact CG1-CB 4.2Å; I64-A108 HydrophobicContact CG2-CB 4.04Å
65	K	97.5	Very high	98.1	Very high	147 Å²	147	53.1 Å²	53.1	64%	0.639	28%	0.28	S	S	*	.	H	α-helix	trans	-82	-18.3	-177.9	-71.7	178.9	-174.1	170.6	0	113.9	E61 T62 A63 K67	E61-K65 HydrophobicContact CG-CD 4.36Å; E61-K65 WeakPolarHBondContact O-CG 3.31Å; E61-K65 PolarHBondContact O-N 3.48Å; E61-K65 VanDerWaalsContact O-N 3.11Å; E61-K65 VanDerWaalsContact OE1-CE 3.28Å; E61-K65 WeakPolarHBondContact OE1-CE 3.31Å; E61-K65 IonicContact OE1-NZ 3.82Å; E61-K65 PolarHBondContact OE1-NZ 2.94Å; T62-K65 PolarHBondContact O-N 2.91Å; T62-K65 VanDerWaalsContact O-N 3.08Å; A63-K65 VanDerWaalsContact C-N 3.34Å; K65-K67 PolarHBondContact O-N 3.11Å
66	T	98	Very high	98.1	Very high	63 Å²	63	50.3 Å²	50.3	39%	0.387	27%	0.273	S	S	.	.	S	Bend	trans	-55.5	137.6	176.4	-62.6	0	0	0	0	110.2	T62 G68 V69 D70	T62-T66 PolarHBondContact O-N 3.08Å; T62-T66 PolarHBondContact O-OG1 3.37Å; T62-T66 VanDerWaalsContact O-OG1 3.1Å; T66-G68 PolarHBondContact O-N 3.35Å; T66-G68 VanDerWaalsContact O-N 3.13Å; T66-V69 WeakPolarHBondContact O-CA 3.43Å; T66-V69 PolarHBondContact O-N 3.38Å; T66-D70 HydrophobicContact CG2-CB 4.48Å
67	K	96	Very high	98.1	Very high	213 Å²	213	50.8 Å²	50.8	93%	0.926	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	118.1	176.9	-176.2	-178.6	179.4	-177.5	0	109.2	K65	K65-K67 PolarHBondContact O-N 3.11Å
68	G	93.7	Very high	98.1	Very high	64 Å²	64	50.8 Å²	50.8	66%	0.66	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-0.7	-174.4	0	0	0	0	0	114.4	T66	T66-G68 PolarHBondContact O-N 3.35Å; T66-G68 VanDerWaalsContact O-N 3.13Å
69	V	98	Very high	98.1	Very high	32 Å²	32	47.6 Å²	47.6	19%	0.194	26%	0.259	C	S	.	.			trans	63.2	146.4	-172.5	-174.1	0	0	0	0	111.5	T66 E71 I74 A108 L109	T66-V69 WeakPolarHBondContact O-CA 3.43Å; T66-V69 PolarHBondContact O-N 3.38Å; V69-E71 HydrophobicContact CG1-CG 4.3Å; V69-E71 VanDerWaalsContact O-OE2 3.13Å; V69-I74 HydrophobicContact CG1-CD1 3.85Å; V69-A108 HydrophobicContact CG1-CB 4.34Å; V69-A108 HydrophobicContact CG2-CB 4.21Å; V69-L109 HydrophobicContact CG1-CD2 4.38Å
70	D	98.3	Very high	98	Very high	51 Å²	51	47.7 Å²	47.7	27%	0.273	26%	0.26	S	S	.	.			trans	-106.4	80.2	171.5	178.9	1.6	0	0	0	109.4	A63 T66 V72 T73 I74	A63-D70 HydrophobicContact CB-CB 3.91Å; A63-D70 PolarHBondContact O-N 2.99Å; T66-D70 HydrophobicContact CG2-CB 4.48Å; D70-V72 PolarHBondContact O-N 2.93Å; D70-V72 PolarHBondContact OD1-N 2.63Å; D70-T73 VanDerWaalsContact CG-OG1 3.24Å; D70-T73 PolarHBondContact O-N 2.85Å; D70-T73 PolarHBondContact OD1-N 3.37Å; D70-T73 PolarHBondContact OD1-OG1 3.47Å; D70-T73 VanDerWaalsContact OD2-CB 3.23Å; D70-T73 WeakPolarHBondContact OD2-CB 3.24Å; D70-T73 PolarHBondContact OD2-OG1 2.85Å; D70-I74 WeakPolarHBondContact O-CG1 3.26Å; D70-I74 PolarHBondContact O-N 3.31Å
71	E	98.3	Very high	98	Very high	55 Å²	55	48.5 Å²	48.5	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-33	179.4	-64.7	89.7	162.7	0	0	111.7	V69 T73 I74 V75 L109 L113 D344	V69-E71 HydrophobicContact CG1-CG 4.3Å; V69-E71 VanDerWaalsContact O-OE2 3.13Å; E71-T73 PolarHBondContact O-N 3.11Å; E71-I74 PolarHBondContact O-N 3.45Å; E71-V75 WeakPolarHBondContact O-CB 3.06Å; E71-V75 VanDerWaalsContact O-CG2 3.26Å; E71-V75 WeakPolarHBondContact O-CG2 3.48Å; E71-V75 PolarHBondContact O-N 3.26Å; E71-L109 HydrophobicContact CG-CD2 3.83Å; E71-L113 HydrophobicContact CB-CD2 3.89Å; E71-L113 HydrophobicContact CG-CD2 3.74Å; E71-D344 HydrophobicContact CB-CB 4.2Å
72	V	98	Very high	98	Very high	53 Å²	53	47.7 Å²	47.7	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-47	-179.3	176.4	0	0	0	0	110.4	D70 V75 N76	D70-V72 PolarHBondContact O-N 2.93Å; D70-V72 PolarHBondContact OD1-N 2.63Å; V72-V75 PolarHBondContact O-N 3.5Å; V72-N76 WeakPolarHBondContact CG1-ND2 3.49Å; V72-N76 VanDerWaalsContact O-CB 3.28Å; V72-N76 WeakPolarHBondContact O-CB 3.45Å; V72-N76 PolarHBondContact O-N 3.3Å; V72-N76 PolarHBondContact O-ND2 2.87Å
73	T	98.5	Very high	98	Very high	40 Å²	40	45 Å²	45	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-43.7	176.2	-69.8	0	0	0	0	111.8	A63 D70 E71 V75 N76 I77	A63-T73 HydrophobicContact CB-CG2 3.92Å; D70-T73 VanDerWaalsContact CG-OG1 3.24Å; D70-T73 PolarHBondContact O-N 2.85Å; D70-T73 PolarHBondContact OD1-N 3.37Å; D70-T73 PolarHBondContact OD1-OG1 3.47Å; D70-T73 VanDerWaalsContact OD2-CB 3.23Å; D70-T73 WeakPolarHBondContact OD2-CB 3.24Å; D70-T73 PolarHBondContact OD2-OG1 2.85Å; E71-T73 PolarHBondContact O-N 3.11Å; T73-V75 PolarHBondContact O-N 3.44Å; T73-N76 PolarHBondContact O-N 3.4Å; T73-I77 HydrophobicContact CG2-CD1 3.83Å; T73-I77 WeakPolarHBondContact O-CG1 3.44Å; T73-I77 PolarHBondContact O-N 3.31Å
74	I	98.8	Very high	98	Very high	1 Å²	1	48 Å²	48	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-48.5	178.6	-65.3	165.1	0	0	0	110.7	A63 I64 V69 D70 E71 L78 L105 L109 I117	A63-I74 HydrophobicContact CB-CD1 4.28Å; A63-I74 HydrophobicContact CB-CG1 3.83Å; I64-I74 HydrophobicContact CG1-CD1 4.11Å; V69-I74 HydrophobicContact CG1-CD1 3.85Å; D70-I74 WeakPolarHBondContact O-CG1 3.26Å; D70-I74 PolarHBondContact O-N 3.31Å; E71-I74 PolarHBondContact O-N 3.45Å; I74-L78 HydrophobicContact CG2-CD1 3.91Å; I74-L78 WeakPolarHBondContact O-CB 3.47Å; I74-L78 WeakPolarHBondContact O-CG 3.28Å; I74-L78 PolarHBondContact O-N 3Å; I74-L105 HydrophobicContact CD1-CD2 3.8Å; I74-L105 HydrophobicContact CG1-CD2 4.21Å; I74-L105 HydrophobicContact CG2-CD2 3.69Å; I74-L109 HydrophobicContact CD1-CD2 4.22Å; I74-L109 HydrophobicContact CG2-CD1 4.46Å; I74-I117 HydrophobicContact CG2-CD1 4.44Å; I74-I117 HydrophobicContact CG2-CG2 4.41Å
75	V	98.8	Very high	98	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-51	178.7	168.6	0	0	0	0	110.6	E71 V72 T73 I77 L78 T79 L113 I117 K347 A348 Y351	E71-V75 WeakPolarHBondContact O-CB 3.06Å; E71-V75 VanDerWaalsContact O-CG2 3.26Å; E71-V75 WeakPolarHBondContact O-CG2 3.48Å; E71-V75 PolarHBondContact O-N 3.26Å; V72-V75 PolarHBondContact O-N 3.5Å; T73-V75 PolarHBondContact O-N 3.44Å; V75-I77 VanDerWaalsContact C-N 3.28Å; V75-I77 PolarHBondContact O-N 3.46Å; V75-L78 PolarHBondContact O-N 3.33Å; V75-T79 HydrophobicContact CG1-CG2 4.12Å; V75-T79 WeakPolarHBondContact O-CB 3.38Å; V75-T79 WeakPolarHBondContact O-CG2 3.45Å; V75-T79 PolarHBondContact O-N 3.27Å; V75-T79 PolarHBondContact O-OG1 2.97Å; V75-L113 HydrophobicContact CG2-CD1 3.59Å; V75-I117 HydrophobicContact CG2-CD1 4.33Å; V75-K347 HydrophobicContact CG1-CB 4.46Å; V75-A348 HydrophobicContact CG1-CB 3.92Å; V75-A348 HydrophobicContact CG2-CB 4.23Å; V75-Y351 HydrophobicContact CG1-CD2 3.86Å; V75-Y351 HydrophobicContact CG1-CE2 4.14Å
76	N	98.1	Very high	98.1	Very high	56 Å²	56	40.4 Å²	40.4	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-57.1	-41.9	-177.6	-75.3	-20.3	0	0	0	111.8	V72 T73 N80 Y351	V72-N76 WeakPolarHBondContact CG1-ND2 3.49Å; V72-N76 VanDerWaalsContact O-CB 3.28Å; V72-N76 WeakPolarHBondContact O-CB 3.45Å; V72-N76 PolarHBondContact O-N 3.3Å; V72-N76 PolarHBondContact O-ND2 2.87Å; T73-N76 PolarHBondContact O-N 3.4Å; N76-N80 WeakPolarHBondContact O-CB 3.49Å; N76-N80 PolarHBondContact O-ND2 2.61Å; N76-Y351 WeakPolarHBondContact OD1-CE2 3.45Å; N76-Y351 VanDerWaalsContact OD1-CZ 3.28Å; N76-Y351 PolarHBondContact OD1-OH 3.13Å
77	I	98.7	Very high	98.1	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.072	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-60.1	177	-64.4	169	0	0	0	109.8	D56 N59 I60 T73 V75 T79 N80 R81 I89	D56-I77 HydrophobicContact CB-CG2 4.07Å; N59-I77 HydrophobicContact CB-CD1 3.68Å; I60-I77 HydrophobicContact CD1-CG2 4Å; I60-I77 HydrophobicContact CG1-CD1 3.9Å; I60-I77 HydrophobicContact CG1-CG2 4.35Å; T73-I77 HydrophobicContact CG2-CD1 3.83Å; T73-I77 WeakPolarHBondContact O-CG1 3.44Å; T73-I77 PolarHBondContact O-N 3.31Å; V75-I77 VanDerWaalsContact C-N 3.28Å; V75-I77 PolarHBondContact O-N 3.46Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 2.78Å; I77-N80 CarbonylContact O-C 3.37Å; I77-N80 PolarHBondContact O-N 2.81Å; I77-N80 VanDerWaalsContact O-N 3.13Å; I77-R81 HydrophobicContact CG2-CG 4.39Å; I77-R81 VanDerWaalsContact O-CG 3.22Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.5Å; I77-I89 HydrophobicContact CG2-CD1 4.22Å
78	L	98.8	Very high	98.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.3	-25.7	-167.1	-66	178.5	0	0	0	113.7	I60 I74 V75 R86 L105 I117 L121	I60-L78 HydrophobicContact CD1-CD2 3.86Å; I60-L78 HydrophobicContact CD1-CG 4.2Å; I74-L78 HydrophobicContact CG2-CD1 3.91Å; I74-L78 WeakPolarHBondContact O-CB 3.47Å; I74-L78 WeakPolarHBondContact O-CG 3.28Å; I74-L78 PolarHBondContact O-N 3Å; V75-L78 PolarHBondContact O-N 3.33Å; L78-R86 HydrophobicContact CD2-CG 4.33Å; L78-R86 PolarHBondContact O-NE 3Å; L78-L105 HydrophobicContact CD1-CD1 3.85Å; L78-I117 HydrophobicContact CB-CD1 4.39Å; L78-I117 HydrophobicContact CD1-CD1 4.35Å; L78-I117 HydrophobicContact CD1-CG2 3.62Å; L78-L121 HydrophobicContact CD1-CD2 4.21Å; L78-L121 HydrophobicContact CD2-CD2 4.04Å
79	T	98.6	Very high	98.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-84.8	-11.5	176	61.1	0	0	0	0	113.9	V75 I77 L120 A348 Y351 L352	V75-T79 HydrophobicContact CG1-CG2 4.12Å; V75-T79 WeakPolarHBondContact O-CB 3.38Å; V75-T79 WeakPolarHBondContact O-CG2 3.45Å; V75-T79 PolarHBondContact O-N 3.27Å; V75-T79 PolarHBondContact O-OG1 2.97Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 2.78Å; T79-L120 HydrophobicContact CG2-CD1 3.93Å; T79-A348 HydrophobicContact CG2-CB 4.17Å; T79-Y351 VanDerWaalsContact OG1-CB 3.28Å; T79-Y351 WeakPolarHBondContact OG1-CB 3.5Å; T79-Y351 WeakPolarHBondContact OG1-CD2 3.37Å; T79-L352 HydrophobicContact CG2-CD2 4.19Å; T79-L352 HydrophobicContact CG2-CG 4.33Å
80	N	98.1	Very high	98.5	Very high	67 Å²	67	29.8 Å²	29.8	36%	0.358	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	30.5	177	-69.6	-84.6	0	0	0	112.4	N76 I77	N76-N80 WeakPolarHBondContact O-CB 3.49Å; N76-N80 PolarHBondContact O-ND2 2.61Å; I77-N80 CarbonylContact O-C 3.37Å; I77-N80 PolarHBondContact O-N 2.81Å; I77-N80 VanDerWaalsContact O-N 3.13Å
81	R	98.6	Very high	98.5	Very high	16 Å²	16	31.8 Å²	31.8	6%	0.06	18%	0.177	C	C	.	.	S	Bend	trans	-130.8	138.6	172.6	-63.8	-66.5	179.9	-76.1	-8.3	108.3	V45 D56 I77 Q85 R86 I89	V45-R81 WeakPolarHBondContact CG1-O 3.14Å; D56-R81 IonicContact OD1-CZ 3.82Å; D56-R81 IonicContact OD1-NE 3.95Å; D56-R81 IonicContact OD1-NH2 2.86Å; D56-R81 PolarHBondContact OD1-NH2 3.42Å; D56-R81 IonicContact OD2-CZ 3.32Å; D56-R81 VanDerWaalsContact OD2-CZ 3.32Å; D56-R81 IonicContact OD2-NE 2.7Å; D56-R81 PolarHBondContact OD2-NE 2.99Å; D56-R81 IonicContact OD2-NH2 3.08Å; D56-R81 PolarHBondContact OD2-NH2 3.24Å; D56-R81 VanDerWaalsContact OD2-NH2 3.08Å; I77-R81 HydrophobicContact CG2-CG 4.39Å; I77-R81 VanDerWaalsContact O-CG 3.22Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.5Å; R81-Q85 HydrophobicContact CB-CB 4.05Å; R81-R86 HydrophobicContact CB-CG 4.04Å; R81-R86 VanDerWaalsContact O-CZ 3.23Å; R81-R86 PolarHBondContact O-NE 3.11Å; R81-R86 VanDerWaalsContact O-NE 3.12Å; R81-R86 PolarHBondContact O-NH2 3.33Å; R81-I89 HydrophobicContact CB-CD1 4.45Å; R81-I89 HydrophobicContact CG-CD1 3.92Å
82	S	98.6	Very high	98.5	Very high	14 Å²	14	29.6 Å²	29.6	10%	0.098	17%	0.169	C	C	.	.			trans	-59.9	158.5	169.1	62.3	0	0	0	0	110.9	A84 Q85 R86 E315	S82-A84 VanDerWaalsContact C-N 3.26Å; S82-A84 PolarHBondContact O-N 2.7Å; S82-Q85 WeakPolarHBondContact O-CB 3.36Å; S82-Q85 PolarHBondContact O-N 3.37Å; S82-Q85 VanDerWaalsContact O-N 3.11Å; S82-Q85 VanDerWaalsContact OG-CG 3.26Å; S82-Q85 WeakPolarHBondContact OG-CG 3.1Å; S82-Q85 PolarHBondContact OG-N 3.43Å; S82-Q85 PolarHBondContact OG-OE1 3.18Å; S82-R86 WeakPolarHBondContact O-CG 3.43Å; S82-R86 PolarHBondContact O-N 3.37Å; S82-E315 WeakPolarHBondContact CA-OE2 3.33Å
83	N	98.5	Very high	98.6	Very high	21 Å²	21	27.6 Å²	27.6	11%	0.112	16%	0.155	C	C	.	.	H	α-helix	trans	-56	-41.5	178.5	-172	-92.7	0	0	0	112.5	Q85 R86 Q87 L120 K122 T123 E315	N83-Q85 PolarHBondContact O-N 3.17Å; N83-R86 WeakPolarHBondContact O-CA 3.45Å; N83-R86 WeakPolarHBondContact O-CB 3.44Å; N83-R86 PolarHBondContact O-N 3.15Å; N83-Q87 WeakPolarHBondContact O-CG 3.42Å; N83-Q87 PolarHBondContact O-N 3.19Å; N83-L120 PolarHBondContact ND2-O 3.46Å; N83-K122 PolarHBondContact ND2-O 2.96Å; N83-T123 WeakPolarHBondContact OD1-CA 3.4Å; N83-E315 VanDerWaalsContact N-CD 3.28Å; N83-E315 PolarHBondContact N-OE1 3.41Å; N83-E315 PolarHBondContact N-OE2 2.99Å
84	A	98.2	Very high	98.5	Very high	65 Å²	65	28 Å²	28	54%	0.537	16%	0.155	S	C	.	.	H	α-helix	trans	-57.9	-49.1	176.7	0	0	0	0	0	111.5	S82 R86 Q87 D88	S82-A84 VanDerWaalsContact C-N 3.26Å; S82-A84 PolarHBondContact O-N 2.7Å; A84-R86 VanDerWaalsContact C-N 3.28Å; A84-R86 PolarHBondContact O-N 2.9Å; A84-Q87 WeakPolarHBondContact O-CA 3.42Å; A84-Q87 VanDerWaalsContact O-CB 3.32Å; A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.12Å; A84-D88 PolarHBondContact O-N 3.47Å; A84-D88 VanDerWaalsContact O-N 3.14Å
85	Q	98.8	Very high	98.5	Very high	18 Å²	18	34.9 Å²	34.9	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-35.9	174.3	-70	175.2	-28.6	0	0	112.5	Y48 F51 R81 S82 N83 Q87 D88 I89	Y48-Q85 PolarHBondContact O-NE2 2.76Å; F51-Q85 HydrophobicContact CD1-CB 4.36Å; F51-Q85 HydrophobicContact CD1-CG 3.72Å; F51-Q85 HydrophobicContact CD2-CB 4.14Å; F51-Q85 HydrophobicContact CD2-CG 4.08Å; F51-Q85 HydrophobicContact CE1-CB 4Å; F51-Q85 HydrophobicContact CE1-CG 3.78Å; F51-Q85 HydrophobicContact CE2-CB 3.8Å; F51-Q85 HydrophobicContact CE2-CG 4.16Å; F51-Q85 HydrophobicContact CG-CB 4.41Å; F51-Q85 HydrophobicContact CG-CG 3.86Å; F51-Q85 HydrophobicContact CZ-CB 3.7Å; F51-Q85 HydrophobicContact CZ-CG 4Å; F51-Q85 WeakPolarHBondContact CZ-O 3.39Å; R81-Q85 HydrophobicContact CB-CB 4.05Å; S82-Q85 WeakPolarHBondContact O-CB 3.36Å; S82-Q85 PolarHBondContact O-N 3.37Å; S82-Q85 VanDerWaalsContact O-N 3.11Å; S82-Q85 VanDerWaalsContact OG-CG 3.26Å; S82-Q85 WeakPolarHBondContact OG-CG 3.1Å; S82-Q85 PolarHBondContact OG-N 3.43Å; S82-Q85 PolarHBondContact OG-OE1 3.18Å; N83-Q85 PolarHBondContact O-N 3.17Å; Q85-Q87 VanDerWaalsContact C-N 3.29Å; Q85-Q87 PolarHBondContact O-N 3.27Å; Q85-D88 PolarHBondContact O-N 3.12Å; Q85-I89 VanDerWaalsContact O-CG1 3.24Å; Q85-I89 WeakPolarHBondContact O-CG1 3.5Å; Q85-I89 PolarHBondContact O-N 2.9Å
86	R	98.9	Very high	98.4	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.011	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-33	174.1	-62.4	179.9	-154.4	125.9	17.3	112.1	L78 R81 S82 N83 A84 I89 A90 L120 E315	L78-R86 HydrophobicContact CD2-CG 4.33Å; L78-R86 PolarHBondContact O-NE 3Å; R81-R86 HydrophobicContact CB-CG 4.04Å; R81-R86 VanDerWaalsContact O-CZ 3.23Å; R81-R86 PolarHBondContact O-NE 3.11Å; R81-R86 VanDerWaalsContact O-NE 3.12Å; R81-R86 PolarHBondContact O-NH2 3.33Å; S82-R86 WeakPolarHBondContact O-CG 3.43Å; S82-R86 PolarHBondContact O-N 3.37Å; N83-R86 WeakPolarHBondContact O-CA 3.45Å; N83-R86 WeakPolarHBondContact O-CB 3.44Å; N83-R86 PolarHBondContact O-N 3.15Å; A84-R86 VanDerWaalsContact C-N 3.28Å; A84-R86 PolarHBondContact O-N 2.9Å; R86-I89 PolarHBondContact O-N 3.47Å; R86-A90 WeakPolarHBondContact O-CB 3.28Å; R86-A90 PolarHBondContact O-N 2.81Å; R86-L120 WeakPolarHBondContact CD-O 3.41Å; R86-L120 PolarHBondContact NH1-O 2.89Å; R86-E315 IonicContact CZ-OE1 3.58Å; R86-E315 IonicContact NH1-OE1 2.74Å; R86-E315 PolarHBondContact NH1-OE1 2.89Å; R86-E315 IonicContact NH2-OE1 3.64Å; R86-E315 PolarHBondContact NH2-OE1 2.93Å
87	Q	98.8	Very high	98.3	Very high	41 Å²	41	38.4 Å²	38.4	19%	0.192	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-41.9	173	-57.4	-47.5	-56.5	0	0	111.5	N83 A84 Q85 A90 F91 L121 T123	N83-Q87 WeakPolarHBondContact O-CG 3.42Å; N83-Q87 PolarHBondContact O-N 3.19Å; A84-Q87 WeakPolarHBondContact O-CA 3.42Å; A84-Q87 VanDerWaalsContact O-CB 3.32Å; A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.12Å; Q85-Q87 VanDerWaalsContact C-N 3.29Å; Q85-Q87 PolarHBondContact O-N 3.27Å; Q87-A90 PolarHBondContact O-N 3.04Å; Q87-F91 PolarHBondContact O-N 3.01Å; Q87-L121 PolarHBondContact NE2-O 3.36Å; Q87-T123 HydrophobicContact CG-CG2 4.25Å
88	D	98.8	Very high	98.3	Very high	83 Å²	83	45.8 Å²	45.8	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-41.6	176.6	-64.4	-28.7	0	0	0	111.7	F51 A53 A84 Q85 A90 F91 A92	F51-D88 HydrophobicContact CE1-CB 4.01Å; F51-D88 HydrophobicContact CZ-CB 3.92Å; A53-D88 HydrophobicContact CB-CB 3.93Å; A84-D88 PolarHBondContact O-N 3.47Å; A84-D88 VanDerWaalsContact O-N 3.14Å; Q85-D88 PolarHBondContact O-N 3.12Å; D88-A90 PolarHBondContact O-N 3.35Å; D88-F91 PolarHBondContact O-N 2.84Å; D88-A92 WeakPolarHBondContact O-CB 3.39Å; D88-A92 PolarHBondContact O-N 2.59Å
89	I	98.9	Very high	98.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-46.9	174	-67.5	166.7	0	0	0	110.4	F51 D56 I60 I77 R81 Q85 R86 F91 A92 Y93 L101	F51-I89 HydrophobicContact CE2-CD1 3.9Å; F51-I89 HydrophobicContact CE2-CG1 3.74Å; F51-I89 HydrophobicContact CZ-CD1 4.49Å; F51-I89 HydrophobicContact CZ-CG1 3.95Å; D56-I89 HydrophobicContact CB-CD1 3.78Å; D56-I89 HydrophobicContact CB-CG1 3.79Å; D56-I89 HydrophobicContact CB-CG2 4.47Å; I60-I89 HydrophobicContact CD1-CG2 3.62Å; I77-I89 HydrophobicContact CG2-CD1 4.22Å; R81-I89 HydrophobicContact CB-CD1 4.45Å; R81-I89 HydrophobicContact CG-CD1 3.92Å; Q85-I89 VanDerWaalsContact O-CG1 3.24Å; Q85-I89 WeakPolarHBondContact O-CG1 3.5Å; Q85-I89 PolarHBondContact O-N 2.9Å; R86-I89 PolarHBondContact O-N 3.47Å; I89-F91 VanDerWaalsContact C-N 3.3Å; I89-F91 PolarHBondContact O-N 3.27Å; I89-A92 PolarHBondContact O-N 3.33Å; I89-Y93 VanDerWaalsContact O-CB 3.26Å; I89-Y93 WeakPolarHBondContact O-CB 3.38Å; I89-Y93 PolarHBondContact O-N 2.84Å; I89-L101 HydrophobicContact CG2-CD2 3.91Å
90	A	98.6	Very high	98.1	Very high	24 Å²	24	56.6 Å²	56.6	20%	0.198	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-42.3	178.9	0	0	0	0	0	111.7	R86 Q87 D88 Q94 L101	R86-A90 WeakPolarHBondContact O-CB 3.28Å; R86-A90 PolarHBondContact O-N 2.81Å; Q87-A90 PolarHBondContact O-N 3.04Å; D88-A90 PolarHBondContact O-N 3.35Å; A90-Q94 PolarHBondContact O-N 3.32Å; A90-L101 HydrophobicContact CB-CB 4.18Å; A90-L101 HydrophobicContact CB-CD2 4.01Å
91	F	98.2	Very high	98.2	Very high	94 Å²	94	53.5 Å²	53.5	41%	0.412	26%	0.255	S	S	.	.	H	α-helix	trans	-65.9	-46.5	176.2	-179.4	-107.5	0	0	0	112.6	Q87 D88 I89 Y93 Q94 R95	Q87-F91 PolarHBondContact O-N 3.01Å; D88-F91 PolarHBondContact O-N 2.84Å; I89-F91 VanDerWaalsContact C-N 3.3Å; I89-F91 PolarHBondContact O-N 3.27Å; F91-Y93 VanDerWaalsContact C-N 3.32Å; F91-Y93 PolarHBondContact O-N 3.28Å; F91-Q94 PolarHBondContact O-N 3.02Å; F91-R95 VanDerWaalsContact CE1-CD 3.42Å; F91-R95 HydrophobicContact CE1-CG 4.25Å; F91-R95 HydrophobicContact CE2-CG 4.48Å; F91-R95 HydrophobicContact CZ-CG 4.2Å; F91-R95 WeakPolarHBondContact O-CG 3.2Å; F91-R95 PolarHBondContact O-N 3.44Å
92	A	98.6	Very high	98.1	Very high	9 Å²	9	55 Å²	55	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-41.4	176.9	0	0	0	0	0	111.7	A53 E54 A57 D88 I89 R95 R96	A53-A92 HydrophobicContact CB-CB 4.01Å; E54-A92 HydrophobicContact CG-CB 4.38Å; A57-A92 HydrophobicContact CB-CB 3.95Å; D88-A92 WeakPolarHBondContact O-CB 3.39Å; D88-A92 PolarHBondContact O-N 2.59Å; I89-A92 PolarHBondContact O-N 3.33Å; A92-R95 PolarHBondContact O-N 2.95Å; A92-R96 WeakPolarHBondContact O-CB 3.26Å; A92-R96 PolarHBondContact O-N 3.29Å
93	Y	98.7	Very high	98.1	Very high	10 Å²	10	57.2 Å²	57.2	4%	0.039	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-45.2	175.4	-173.1	-83.1	0	0	0	112	A57 I60 E61 I64 I89 F91 R95 R96 T97 K99 L101 A104	A57-Y93 HydrophobicContact CB-CD2 4.44Å; I60-Y93 HydrophobicContact CG2-CE2 4.38Å; E61-Y93 HydrophobicContact CB-CD2 4.41Å; E61-Y93 HydrophobicContact CB-CE2 3.74Å; E61-Y93 HydrophobicContact CG-CE2 4.35Å; I64-Y93 HydrophobicContact CD1-CE2 4.34Å; I89-Y93 VanDerWaalsContact O-CB 3.26Å; I89-Y93 WeakPolarHBondContact O-CB 3.38Å; I89-Y93 PolarHBondContact O-N 2.84Å; F91-Y93 VanDerWaalsContact C-N 3.32Å; F91-Y93 PolarHBondContact O-N 3.28Å; Y93-R95 PolarHBondContact O-N 3.5Å; Y93-R96 PolarHBondContact O-N 3.21Å; Y93-T97 HydrophobicContact CD1-CG2 4.2Å; Y93-T97 WeakPolarHBondContact CD1-OG1 3.33Å; Y93-T97 HydrophobicContact CD2-CG2 4.36Å; Y93-T97 HydrophobicContact CE1-CG2 3.9Å; Y93-T97 VanDerWaalsContact CE1-OG1 3.23Å; Y93-T97 WeakPolarHBondContact CE1-OG1 3.45Å; Y93-T97 HydrophobicContact CE2-CG2 4.09Å; Y93-T97 HydrophobicContact CG-CG2 4.41Å; Y93-T97 WeakPolarHBondContact O-CB 3.36Å; Y93-T97 WeakPolarHBondContact O-CG2 3.35Å; Y93-T97 PolarHBondContact O-N 2.79Å; Y93-T97 PolarHBondContact O-OG1 3.44Å; Y93-K99 WeakPolarHBondContact CD1-O 3.42Å; Y93-L101 HydrophobicContact CD1-CB 3.81Å; Y93-L101 HydrophobicContact CD1-CD1 4.09Å; Y93-L101 HydrophobicContact CD2-CD1 3.76Å; Y93-L101 HydrophobicContact CE1-CB 4.46Å; Y93-L101 HydrophobicContact CE1-CD1 4.29Å; Y93-L101 HydrophobicContact CE2-CD1 3.95Å; Y93-L101 HydrophobicContact CG-CB 3.99Å; Y93-L101 HydrophobicContact CG-CD1 3.83Å; Y93-L101 HydrophobicContact CG-CG 4.39Å; Y93-A104 HydrophobicContact CE1-CB 3.97Å; Y93-A104 WeakPolarHBondContact OH-CB 3.39Å
94	Q	97.6	Very high	98.1	Very high	49 Å²	49	56.9 Å²	56.9	23%	0.229	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-41.7	177	-167.3	-163.4	24.3	0	0	111.5	A90 F91 R96 K98 K99 E100	A90-Q94 PolarHBondContact O-N 3.32Å; F91-Q94 PolarHBondContact O-N 3.02Å; Q94-R96 VanDerWaalsContact C-N 3.35Å; Q94-R96 PolarHBondContact O-N 3.16Å; Q94-K98 WeakPolarHBondContact O-CA 3.28Å; Q94-K98 PolarHBondContact O-N 3.29Å; Q94-K99 WeakPolarHBondContact CA-O 3.47Å; Q94-E100 VanDerWaalsContact CD-OE1 3.3Å; Q94-E100 PolarHBondContact NE2-OE1 3.13Å
95	R	97.8	Very high	98.1	Very high	146 Å²	146	53.8 Å²	53.8	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-61.9	-41.7	176.2	-74.9	-174.6	67.1	-154.7	-0.1	112.3	F91 A92 Y93 K98	F91-R95 VanDerWaalsContact CE1-CD 3.42Å; F91-R95 HydrophobicContact CE1-CG 4.25Å; F91-R95 HydrophobicContact CE2-CG 4.48Å; F91-R95 HydrophobicContact CZ-CG 4.2Å; F91-R95 WeakPolarHBondContact O-CG 3.2Å; F91-R95 PolarHBondContact O-N 3.44Å; A92-R95 PolarHBondContact O-N 2.95Å; Y93-R95 PolarHBondContact O-N 3.5Å; R95-K98 WeakPolarHBondContact O-CE 3.41Å; R95-K98 PolarHBondContact O-NZ 3.04Å
96	R	96.9	Very high	98.1	Very high	105 Å²	105	58.9 Å²	58.9	40%	0.396	28%	0.284	S	S	.	.	H	α-helix	trans	-69.9	-52.8	179.7	-178.8	-176.1	-65.5	-78.5	1.1	112.3	E54 E61 A92 Y93 Q94	E54-R96 PolarHBondContact O-NH2 2.96Å; E61-R96 WeakPolarHBondContact OE2-CD 3.43Å; A92-R96 WeakPolarHBondContact O-CB 3.26Å; A92-R96 PolarHBondContact O-N 3.29Å; Y93-R96 PolarHBondContact O-N 3.21Å; Q94-R96 VanDerWaalsContact C-N 3.35Å; Q94-R96 PolarHBondContact O-N 3.16Å
97	T	96.4	Very high	98	Very high	26 Å²	26	64 Å²	64	16%	0.16	32%	0.32	C	S	.	.	H	α-helix	trans	-99.2	-13.3	-166.6	69.6	0	0	0	0	114.2	E61 Y93 K99	E61-T97 VanDerWaalsContact CD-CG2 3.45Å; E61-T97 HydrophobicContact CG-CG2 4.07Å; Y93-T97 HydrophobicContact CD1-CG2 4.2Å; Y93-T97 WeakPolarHBondContact CD1-OG1 3.33Å; Y93-T97 HydrophobicContact CD2-CG2 4.36Å; Y93-T97 HydrophobicContact CE1-CG2 3.9Å; Y93-T97 VanDerWaalsContact CE1-OG1 3.23Å; Y93-T97 WeakPolarHBondContact CE1-OG1 3.45Å; Y93-T97 HydrophobicContact CE2-CG2 4.09Å; Y93-T97 HydrophobicContact CG-CG2 4.41Å; Y93-T97 WeakPolarHBondContact O-CB 3.36Å; Y93-T97 WeakPolarHBondContact O-CG2 3.35Å; Y93-T97 PolarHBondContact O-N 2.79Å; Y93-T97 PolarHBondContact O-OG1 3.44Å; T97-K99 PolarHBondContact O-N 3.01Å; T97-K99 PolarHBondContact OG1-N 3.27Å; T97-K99 VanDerWaalsContact OG1-N 3.15Å; T97-K99 PolarHBondContact OG1-O 2.97Å
98	K	97.6	Very high	98	Very high	170 Å²	170	63.1 Å²	63.1	74%	0.739	32%	0.319	S	S	*	.	S	Bend	trans	58.6	20.5	-169	-48	-53.5	-176.8	-161.9	0	113.8	Q94 R95	Q94-K98 WeakPolarHBondContact O-CA 3.28Å; Q94-K98 PolarHBondContact O-N 3.29Å; R95-K98 WeakPolarHBondContact O-CE 3.41Å; R95-K98 PolarHBondContact O-NZ 3.04Å
99	K	97	Very high	98	Very high	139 Å²	139	59.7 Å²	59.7	60%	0.604	30%	0.301	S	S	*	.	S	Bend	trans	-123.8	147.8	175.3	-63.3	-178	-178.7	-179.1	0	110.2	Y93 Q94 T97	Y93-K99 WeakPolarHBondContact CD1-O 3.42Å; Q94-K99 WeakPolarHBondContact CA-O 3.47Å; T97-K99 PolarHBondContact O-N 3.01Å; T97-K99 PolarHBondContact OG1-N 3.27Å; T97-K99 VanDerWaalsContact OG1-N 3.15Å; T97-K99 PolarHBondContact OG1-O 2.97Å
100	E	97.8	Very high	97.9	Very high	88 Å²	88	64 Å²	64	41%	0.411	33%	0.331	S	S	.	.			trans	-65.8	134.1	172.4	-59.5	-48.2	127.7	0	0	111.3	Q94 A102 S103 A104	Q94-E100 VanDerWaalsContact CD-OE1 3.3Å; Q94-E100 PolarHBondContact NE2-OE1 3.13Å; E100-A102 VanDerWaalsContact C-N 3.33Å; E100-A102 PolarHBondContact O-N 3.24Å; E100-S103 PolarHBondContact O-N 2.87Å; E100-S103 PolarHBondContact O-OG 2.91Å; E100-A104 PolarHBondContact O-N 2.88Å
101	L	98.6	Very high	97.9	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-44.4	177.1	176.5	57.5	0	0	0	111.7	I60 I89 A90 Y93 S103 A104 L105 L121	I60-L101 HydrophobicContact CG2-CD1 3.76Å; I89-L101 HydrophobicContact CG2-CD2 3.91Å; A90-L101 HydrophobicContact CB-CB 4.18Å; A90-L101 HydrophobicContact CB-CD2 4.01Å; Y93-L101 HydrophobicContact CD1-CB 3.81Å; Y93-L101 HydrophobicContact CD1-CD1 4.09Å; Y93-L101 HydrophobicContact CD2-CD1 3.76Å; Y93-L101 HydrophobicContact CE1-CB 4.46Å; Y93-L101 HydrophobicContact CE1-CD1 4.29Å; Y93-L101 HydrophobicContact CE2-CD1 3.95Å; Y93-L101 HydrophobicContact CG-CB 3.99Å; Y93-L101 HydrophobicContact CG-CD1 3.83Å; Y93-L101 HydrophobicContact CG-CG 4.39Å; L101-S103 VanDerWaalsContact C-N 3.31Å; L101-S103 PolarHBondContact O-N 2.86Å; L101-A104 PolarHBondContact O-N 2.55Å; L101-L105 HydrophobicContact CD1-CD1 3.58Å; L101-L105 HydrophobicContact CD1-CG 3.95Å; L101-L105 HydrophobicContact CD2-CD1 4.49Å; L101-L105 HydrophobicContact CG-CD1 3.82Å; L101-L105 PolarHBondContact O-N 2.75Å; L101-L121 HydrophobicContact CD2-CD2 3.87Å; L101-L121 HydrophobicContact CG-CD1 4.3Å; L101-L121 HydrophobicContact CG-CD2 4.45Å
102	A	97.9	Very high	97.9	Very high	48 Å²	48	64.7 Å²	64.7	40%	0.397	34%	0.344	S	S	.	.	H	α-helix	trans	-61.4	-38.1	179.7	0	0	0	0	0	112.4	E100 K106 L118 L121	E100-A102 VanDerWaalsContact C-N 3.33Å; E100-A102 PolarHBondContact O-N 3.24Å; A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.12Å; A102-L118 HydrophobicContact CB-CD2 4.32Å; A102-L118 VanDerWaalsContact O-CD2 3.31Å; A102-L118 WeakPolarHBondContact O-CD2 3.44Å; A102-L121 HydrophobicContact CB-CD1 4.14Å
103	S	97.8	Very high	97.9	Very high	61 Å²	61	65.1 Å²	65.1	43%	0.427	35%	0.345	S	S	.	.	H	α-helix	trans	-73.1	-38.4	178.1	73.3	0	0	0	0	111.8	E100 L101 K106 S107	E100-S103 PolarHBondContact O-N 2.87Å; E100-S103 PolarHBondContact O-OG 2.91Å; L101-S103 VanDerWaalsContact C-N 3.31Å; L101-S103 PolarHBondContact O-N 2.86Å; S103-K106 PolarHBondContact O-N 2.77Å; S103-S107 PolarHBondContact O-N 3.07Å; S103-S107 VanDerWaalsContact O-N 3.1Å; S103-S107 PolarHBondContact O-OG 2.97Å
104	A	98.4	Very high	97.9	Very high	14 Å²	14	66.8 Å²	66.8	12%	0.116	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-47.3	175.9	0	0	0	0	0	111.6	I64 Y93 E100 L101 S107 A108	I64-A104 HydrophobicContact CD1-CB 4.1Å; Y93-A104 HydrophobicContact CE1-CB 3.97Å; Y93-A104 WeakPolarHBondContact OH-CB 3.39Å; E100-A104 PolarHBondContact O-N 2.88Å; L101-A104 PolarHBondContact O-N 2.55Å; A104-S107 PolarHBondContact O-N 3.45Å; A104-A108 WeakPolarHBondContact O-CB 3.26Å; A104-A108 PolarHBondContact O-N 3.31Å; A104-A108 VanDerWaalsContact O-N 3.1Å
105	L	98.4	Very high	97.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-67.4	-36.3	177.4	-75	168.1	0	0	0	112.4	I60 I64 I74 L78 L101 S107 A108 L109 I117 L118 L121	I60-L105 HydrophobicContact CG2-CD2 4.33Å; I64-L105 HydrophobicContact CD1-CD2 3.81Å; I64-L105 HydrophobicContact CD1-CG 4.08Å; I64-L105 HydrophobicContact CG1-CD2 4.05Å; I74-L105 HydrophobicContact CD1-CD2 3.8Å; I74-L105 HydrophobicContact CG1-CD2 4.21Å; I74-L105 HydrophobicContact CG2-CD2 3.69Å; L78-L105 HydrophobicContact CD1-CD1 3.85Å; L101-L105 HydrophobicContact CD1-CD1 3.58Å; L101-L105 HydrophobicContact CD1-CG 3.95Å; L101-L105 HydrophobicContact CD2-CD1 4.49Å; L101-L105 HydrophobicContact CG-CD1 3.82Å; L101-L105 PolarHBondContact O-N 2.75Å; L105-S107 PolarHBondContact O-N 2.97Å; L105-A108 PolarHBondContact O-N 3.26Å; L105-A108 VanDerWaalsContact O-N 3.15Å; L105-L109 HydrophobicContact CB-CD1 4.39Å; L105-L109 HydrophobicContact CD2-CD1 4.11Å; L105-L109 HydrophobicContact CD2-CG 4.46Å; L105-L109 WeakPolarHBondContact O-CB 3.37Å; L105-L109 WeakPolarHBondContact O-CG 3.33Å; L105-L109 PolarHBondContact O-N 3.02Å; L105-I117 HydrophobicContact CB-CG2 4.48Å; L105-I117 HydrophobicContact CD1-CG2 3.84Å; L105-L118 HydrophobicContact CB-CD2 4.44Å; L105-L121 HydrophobicContact CD1-CD1 3.73Å
106	K	98.2	Very high	98	Very high	125 Å²	125	60.6 Å²	60.6	54%	0.543	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-33.7	172.6	-176.4	172	-174.6	-173.2	0	112.9	A102 S103 E114 L118	A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.12Å; S103-K106 PolarHBondContact O-N 2.77Å; K106-E114 WeakPolarHBondContact CG-OE1 3.45Å; K106-L118 HydrophobicContact CB-CD1 3.98Å; K106-L118 HydrophobicContact CB-CD2 4.27Å; K106-L118 HydrophobicContact CD-CD1 4.27Å; K106-L118 HydrophobicContact CG-CD1 4.08Å
107	S	97.8	Very high	98.1	Very high	110 Å²	110	55.6 Å²	55.6	77%	0.769	32%	0.316	S	S	*	.	H	α-helix	trans	-80.8	-24	176	-62.6	0	0	0	0	113.6	S103 A104 L105	S103-S107 PolarHBondContact O-N 3.07Å; S103-S107 VanDerWaalsContact O-N 3.1Å; S103-S107 PolarHBondContact O-OG 2.97Å; A104-S107 PolarHBondContact O-N 3.45Å; L105-S107 PolarHBondContact O-N 2.97Å
108	A	97.8	Very high	98.2	Very high	22 Å²	22	55.7 Å²	55.7	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-91.3	-31	-176.7	0	0	0	0	0	113.2	I64 V69 A104 L105	I64-A108 HydrophobicContact CG1-CB 4.2Å; I64-A108 HydrophobicContact CG2-CB 4.04Å; V69-A108 HydrophobicContact CG1-CB 4.34Å; V69-A108 HydrophobicContact CG2-CB 4.21Å; A104-A108 WeakPolarHBondContact O-CB 3.26Å; A104-A108 PolarHBondContact O-N 3.31Å; A104-A108 VanDerWaalsContact O-N 3.1Å; L105-A108 PolarHBondContact O-N 3.26Å; L105-A108 VanDerWaalsContact O-N 3.15Å
109	L	98.1	Very high	98.2	Very high	11 Å²	11	47.7 Å²	47.7	6%	0.058	28%	0.281	C	S	.	.			trans	-104.6	165.5	-176.3	-56.1	178.8	0	0	0	110.9	V69 E71 I74 L105 L113 E114 I117	V69-L109 HydrophobicContact CG1-CD2 4.38Å; E71-L109 HydrophobicContact CG-CD2 3.83Å; I74-L109 HydrophobicContact CD1-CD2 4.22Å; I74-L109 HydrophobicContact CG2-CD1 4.46Å; L105-L109 HydrophobicContact CB-CD1 4.39Å; L105-L109 HydrophobicContact CD2-CD1 4.11Å; L105-L109 HydrophobicContact CD2-CG 4.46Å; L105-L109 WeakPolarHBondContact O-CB 3.37Å; L105-L109 WeakPolarHBondContact O-CG 3.33Å; L105-L109 PolarHBondContact O-N 3.02Å; L109-L113 HydrophobicContact CD2-CD2 4.04Å; L109-E114 HydrophobicContact CB-CB 3.9Å; L109-E114 HydrophobicContact CB-CG 4.27Å; L109-I117 HydrophobicContact CD1-CB 3.78Å; L109-I117 HydrophobicContact CD1-CG1 3.77Å; L109-I117 HydrophobicContact CD1-CG2 3.8Å
110	S	97.8	Very high	98.3	Very high	92 Å²	92	41.1 Å²	41.1	64%	0.643	25%	0.253	S	S	*	.			trans	-145	166.8	171.8	64.3	0	0	0	0	112.3	E114	S110-E114 WeakPolarHBondContact CA-OE2 3.28Å; S110-E114 PolarHBondContact O-N 3Å
111	G	98.1	Very high	98.4	Very high	47 Å²	47	37.5 Å²	37.5	49%	0.485	24%	0.236	S	C	.	.	H	α-helix	trans	65.1	-144.1	170.4	0	0	0	0	0	114.7	L113 E114 T115	G111-L113 VanDerWaalsContact C-N 3.33Å; G111-L113 PolarHBondContact O-N 3.2Å; G111-E114 PolarHBondContact O-N 3.01Å; G111-T115 PolarHBondContact O-N 3.29Å; G111-T115 PolarHBondContact O-OG1 3.24Å
112	H	98.4	Very high	98.4	Very high	85 Å²	85	40.5 Å²	40.5	39%	0.394	25%	0.249	S	C	.	.	H	α-helix	trans	-68.1	-32.5	-177.1	-61.3	-51.8	0	0	0	112.8	T115 V116 D303 I307 Y345	H112-T115 WeakPolarHBondContact O-CB 3.45Å; H112-T115 PolarHBondContact O-N 2.97Å; H112-V116 WeakPolarHBondContact O-CG2 3.26Å; H112-V116 PolarHBondContact O-N 3.48Å; H112-D303 IonicContact CE1-OD2 2.7Å; H112-D303 IonicContact NE2-OD2 3.03Å; H112-I307 HydrophobicContact CB-CD1 4.17Å; H112-Y345 HydrophobicContact CB-CD1 3.71Å; H112-Y345 HydrophobicContact CB-CD2 3.71Å; H112-Y345 HydrophobicContact CB-CE1 3.84Å; H112-Y345 HydrophobicContact CB-CE2 3.86Å; H112-Y345 HydrophobicContact CB-CG 3.63Å
113	L	98.6	Very high	98.4	Very high	18 Å²	18	40 Å²	40	9%	0.094	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-47.1	174.6	177.2	63.5	0	0	0	111.2	E71 V75 L109 G111 T115 V116 I117 D344 A348	E71-L113 HydrophobicContact CB-CD2 3.89Å; E71-L113 HydrophobicContact CG-CD2 3.74Å; V75-L113 HydrophobicContact CG2-CD1 3.59Å; L109-L113 HydrophobicContact CD2-CD2 4.04Å; G111-L113 VanDerWaalsContact C-N 3.33Å; G111-L113 PolarHBondContact O-N 3.2Å; L113-T115 VanDerWaalsContact C-N 3.26Å; L113-T115 PolarHBondContact O-N 3.14Å; L113-V116 PolarHBondContact O-N 3.32Å; L113-I117 HydrophobicContact CD1-CD1 4.38Å; L113-I117 HydrophobicContact CD1-CG1 3.89Å; L113-I117 HydrophobicContact CG-CG1 4.33Å; L113-I117 WeakPolarHBondContact O-CG1 3.48Å; L113-I117 PolarHBondContact O-N 2.87Å; L113-D344 HydrophobicContact CD1-CB 4.48Å; L113-D344 HydrophobicContact CD2-CB 3.89Å; L113-A348 HydrophobicContact CD1-CB 4.26Å
114	E	98.7	Very high	98.4	Very high	44 Å²	44	41.2 Å²	41.2	21%	0.206	25%	0.247	C	C	.	.	H	α-helix	trans	-54	-46.6	173.8	-175.4	-164.8	143.9	0	0	110.8	K106 L109 S110 G111 V116 I117 L118	K106-E114 WeakPolarHBondContact CG-OE1 3.45Å; L109-E114 HydrophobicContact CB-CB 3.9Å; L109-E114 HydrophobicContact CB-CG 4.27Å; S110-E114 WeakPolarHBondContact CA-OE2 3.28Å; S110-E114 PolarHBondContact O-N 3Å; G111-E114 PolarHBondContact O-N 3.01Å; E114-V116 PolarHBondContact O-N 2.87Å; E114-I117 PolarHBondContact O-N 3.43Å; E114-L118 HydrophobicContact CG-CD1 3.72Å; E114-L118 HydrophobicContact CG-CG 4.13Å; E114-L118 WeakPolarHBondContact O-CB 3.5Å; E114-L118 VanDerWaalsContact O-CG 3.27Å; E114-L118 WeakPolarHBondContact O-CG 3.46Å; E114-L118 PolarHBondContact O-N 3.03Å
115	T	98.7	Very high	98.5	Very high	66 Å²	66	40.9 Å²	40.9	41%	0.405	25%	0.245	S	C	.	.	H	α-helix	trans	-58.6	-47.8	179.9	-51.4	0	0	0	0	111.9	G111 H112 L113 G119 I307	G111-T115 PolarHBondContact O-N 3.29Å; G111-T115 PolarHBondContact O-OG1 3.24Å; H112-T115 WeakPolarHBondContact O-CB 3.45Å; H112-T115 PolarHBondContact O-N 2.97Å; L113-T115 VanDerWaalsContact C-N 3.26Å; L113-T115 PolarHBondContact O-N 3.14Å; T115-G119 PolarHBondContact O-N 3.15Å; T115-I307 HydrophobicContact CG2-CD1 3.94Å; T115-I307 HydrophobicContact CG2-CG2 4.11Å
116	V	98.8	Very high	98.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-52.2	177.4	173.1	0	0	0	0	110.7	H112 L113 E114 L118 G119 L120 I307 Y345 A348 L349 L352	H112-V116 WeakPolarHBondContact O-CG2 3.26Å; H112-V116 PolarHBondContact O-N 3.48Å; L113-V116 PolarHBondContact O-N 3.32Å; E114-V116 PolarHBondContact O-N 2.87Å; V116-L118 PolarHBondContact O-N 3.49Å; V116-G119 PolarHBondContact O-N 2.88Å; V116-G119 VanDerWaalsContact O-N 3.15Å; V116-L120 HydrophobicContact CG1-CD1 3.93Å; V116-L120 HydrophobicContact CG1-CG 4.38Å; V116-L120 WeakPolarHBondContact O-CG 3.43Å; V116-L120 PolarHBondContact O-N 2.8Å; V116-I307 HydrophobicContact CG2-CB 4.35Å; V116-I307 HydrophobicContact CG2-CD1 3.99Å; V116-I307 HydrophobicContact CG2-CG1 3.71Å; V116-I307 HydrophobicContact CG2-CG2 3.84Å; V116-Y345 HydrophobicContact CG2-CD2 3.85Å; V116-Y345 HydrophobicContact CG2-CE2 3.79Å; V116-A348 HydrophobicContact CG1-CB 4.03Å; V116-L349 HydrophobicContact CG2-CD2 3.96Å; V116-L352 HydrophobicContact CG1-CD1 4.12Å
117	I	98.8	Very high	98.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-44.3	-174.5	-65.2	-58.6	0	0	0	111.2	I74 V75 L78 L105 L109 L113 E114 G119 L120 L121	I74-I117 HydrophobicContact CG2-CD1 4.44Å; I74-I117 HydrophobicContact CG2-CG2 4.41Å; V75-I117 HydrophobicContact CG2-CD1 4.33Å; L78-I117 HydrophobicContact CB-CD1 4.39Å; L78-I117 HydrophobicContact CD1-CD1 4.35Å; L78-I117 HydrophobicContact CD1-CG2 3.62Å; L105-I117 HydrophobicContact CB-CG2 4.48Å; L105-I117 HydrophobicContact CD1-CG2 3.84Å; L109-I117 HydrophobicContact CD1-CB 3.78Å; L109-I117 HydrophobicContact CD1-CG1 3.77Å; L109-I117 HydrophobicContact CD1-CG2 3.8Å; L113-I117 HydrophobicContact CD1-CD1 4.38Å; L113-I117 HydrophobicContact CD1-CG1 3.89Å; L113-I117 HydrophobicContact CG-CG1 4.33Å; L113-I117 WeakPolarHBondContact O-CG1 3.48Å; L113-I117 PolarHBondContact O-N 2.87Å; E114-I117 PolarHBondContact O-N 3.43Å; I117-G119 VanDerWaalsContact C-N 3.27Å; I117-G119 PolarHBondContact O-N 3.28Å; I117-L120 HydrophobicContact CD1-CD1 4.37Å; I117-L120 PolarHBondContact O-N 3.02Å; I117-L121 WeakPolarHBondContact O-CG 3.1Å; I117-L121 PolarHBondContact O-N 3.24Å
118	L	98.8	Very high	98.5	Very high	27 Å²	27	33.5 Å²	33.5	14%	0.141	20%	0.2	C	C	.	.	H	α-helix	trans	-68.8	-25.3	176.8	-64.8	-175.7	0	0	0	113.1	A102 L105 K106 E114 V116 L121 K122	A102-L118 HydrophobicContact CB-CD2 4.32Å; A102-L118 VanDerWaalsContact O-CD2 3.31Å; A102-L118 WeakPolarHBondContact O-CD2 3.44Å; L105-L118 HydrophobicContact CB-CD2 4.44Å; K106-L118 HydrophobicContact CB-CD1 3.98Å; K106-L118 HydrophobicContact CB-CD2 4.27Å; K106-L118 HydrophobicContact CD-CD1 4.27Å; K106-L118 HydrophobicContact CG-CD1 4.08Å; E114-L118 HydrophobicContact CG-CD1 3.72Å; E114-L118 HydrophobicContact CG-CG 4.13Å; E114-L118 WeakPolarHBondContact O-CB 3.5Å; E114-L118 VanDerWaalsContact O-CG 3.27Å; E114-L118 WeakPolarHBondContact O-CG 3.46Å; E114-L118 PolarHBondContact O-N 3.03Å; V116-L118 PolarHBondContact O-N 3.49Å; L118-L121 HydrophobicContact CD2-CD1 4.36Å; L118-K122 PolarHBondContact O-NZ 3.24Å
119	G	98.7	Very high	98.6	Very high	2 Å²	2	32.4 Å²	32.4	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-49.8	169.2	0	0	0	0	0	111.4	T115 V116 I117 L121 K122	T115-G119 PolarHBondContact O-N 3.15Å; V116-G119 PolarHBondContact O-N 2.88Å; V116-G119 VanDerWaalsContact O-N 3.15Å; I117-G119 VanDerWaalsContact C-N 3.27Å; I117-G119 PolarHBondContact O-N 3.28Å; G119-L121 PolarHBondContact O-N 2.97Å; G119-K122 PolarHBondContact O-N 2.93Å; G119-K122 VanDerWaalsContact O-N 3.14Å
120	L	98.8	Very high	98.6	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-27.4	-178.3	-70.5	171.6	0	0	0	114	T79 N83 R86 V116 I117 V311 L352	T79-L120 HydrophobicContact CG2-CD1 3.93Å; N83-L120 PolarHBondContact ND2-O 3.46Å; R86-L120 WeakPolarHBondContact CD-O 3.41Å; R86-L120 PolarHBondContact NH1-O 2.89Å; V116-L120 HydrophobicContact CG1-CD1 3.93Å; V116-L120 HydrophobicContact CG1-CG 4.38Å; V116-L120 WeakPolarHBondContact O-CG 3.43Å; V116-L120 PolarHBondContact O-N 2.8Å; I117-L120 HydrophobicContact CD1-CD1 4.37Å; I117-L120 PolarHBondContact O-N 3.02Å; L120-V311 HydrophobicContact CD2-CB 4.47Å; L120-V311 HydrophobicContact CD2-CG1 4.12Å; L120-V311 HydrophobicContact CD2-CG2 4.11Å; L120-V311 HydrophobicContact CG-CG2 4.23Å; L120-L352 HydrophobicContact CD1-CD1 4.31Å; L120-L352 HydrophobicContact CD1-CD2 4.17Å; L120-L352 HydrophobicContact CD2-CD1 4.01Å; L120-L352 HydrophobicContact CD2-CD2 3.66Å; L120-L352 HydrophobicContact CD2-CG 4.49Å
121	L	98.6	Very high	98.7	Very high	13 Å²	13	29.6 Å²	29.6	7%	0.068	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-20.2	179.2	-67.6	175.4	0	0	0	114.3	L78 Q87 L101 A102 L105 I117 L118 G119	L78-L121 HydrophobicContact CD1-CD2 4.21Å; L78-L121 HydrophobicContact CD2-CD2 4.04Å; Q87-L121 PolarHBondContact NE2-O 3.36Å; L101-L121 HydrophobicContact CD2-CD2 3.87Å; L101-L121 HydrophobicContact CG-CD1 4.3Å; L101-L121 HydrophobicContact CG-CD2 4.45Å; A102-L121 HydrophobicContact CB-CD1 4.14Å; L105-L121 HydrophobicContact CD1-CD1 3.73Å; I117-L121 WeakPolarHBondContact O-CG 3.1Å; I117-L121 PolarHBondContact O-N 3.24Å; L118-L121 HydrophobicContact CD2-CD1 4.36Å; G119-L121 PolarHBondContact O-N 2.97Å
122	K	98.6	Very high	98.7	Very high	65 Å²	65	27.4 Å²	27.4	28%	0.283	15%	0.147	S	C	.	.	S	Bend	trans	-78.5	148.9	176.8	-68.2	-175.7	-170.5	70.1	0	109.6	N83 L118 G119 Q126 Y127	N83-K122 PolarHBondContact ND2-O 2.96Å; L118-K122 PolarHBondContact O-NZ 3.24Å; G119-K122 PolarHBondContact O-N 2.93Å; G119-K122 VanDerWaalsContact O-N 3.14Å; K122-Q126 HydrophobicContact CB-CB 3.89Å; K122-Q126 HydrophobicContact CD-CB 4.48Å; K122-Q126 HydrophobicContact CG-CB 4.39Å; K122-Y127 HydrophobicContact CD-CD2 4.32Å
123	T	98.7	Very high	98.7	Very high	37 Å²	37	26 Å²	26	23%	0.227	14%	0.14	C	C	.	.			trans	-61.2	158.4	164.8	69.5	0	0	0	0	109.9	N83 Q87 A125 Q126 Y127	N83-T123 WeakPolarHBondContact OD1-CA 3.4Å; Q87-T123 HydrophobicContact CG-CG2 4.25Å; T123-A125 VanDerWaalsContact C-N 3.26Å; T123-A125 PolarHBondContact O-N 3.35Å; T123-Q126 PolarHBondContact O-N 3.38Å; T123-Q126 VanDerWaalsContact O-N 3.09Å; T123-Q126 WeakPolarHBondContact OG1-CB 3.49Å; T123-Q126 WeakPolarHBondContact OG1-CG 3.46Å; T123-Q126 PolarHBondContact OG1-N 3.37Å; T123-Q126 PolarHBondContact OG1-OE1 3.01Å; T123-Y127 PolarHBondContact O-N 3.48Å
124	P	98.6	Very high	98.6	Very high	86 Å²	86	27.4 Å²	27.4	56%	0.558	15%	0.154	S	C	*	.	H	α-helix	trans	-51.9	-45.3	-179.8	-29.2	36.3	0	0	0	113	Y127 D128	P124-Y127 PolarHBondContact O-N 2.87Å; P124-D128 PolarHBondContact O-N 3.3Å
125	A	98.7	Very high	98.5	Very high	8 Å²	8	25.4 Å²	25.4	7%	0.066	15%	0.145	C	C	.	.	H	α-helix	trans	-70.1	-36	178.6	0	0	0	0	0	113.8	T123 Y127 A129 E160 I161 V164	T123-A125 VanDerWaalsContact C-N 3.26Å; T123-A125 PolarHBondContact O-N 3.35Å; A125-Y127 VanDerWaalsContact C-N 3.31Å; A125-A129 WeakPolarHBondContact O-CB 3.26Å; A125-A129 PolarHBondContact O-N 3.31Å; A125-E160 HydrophobicContact CB-CB 4.39Å; A125-E160 HydrophobicContact CB-CG 3.51Å; A125-I161 HydrophobicContact CB-CG1 4.36Å; A125-V164 HydrophobicContact CB-CB 4.21Å; A125-V164 HydrophobicContact CB-CG2 3.86Å
126	Q	98.8	Very high	98.3	Very high	62 Å²	62	22.8 Å²	22.8	29%	0.29	13%	0.128	S	C	.	.	H	α-helix	trans	-65	-37.7	172.2	-75.9	173.2	-22	0	0	111.6	K122 T123 S130 V164 M168	K122-Q126 HydrophobicContact CB-CB 3.89Å; K122-Q126 HydrophobicContact CD-CB 4.48Å; K122-Q126 HydrophobicContact CG-CB 4.39Å; T123-Q126 PolarHBondContact O-N 3.38Å; T123-Q126 VanDerWaalsContact O-N 3.09Å; T123-Q126 WeakPolarHBondContact OG1-CB 3.49Å; T123-Q126 WeakPolarHBondContact OG1-CG 3.46Å; T123-Q126 PolarHBondContact OG1-N 3.37Å; T123-Q126 PolarHBondContact OG1-OE1 3.01Å; Q126-S130 WeakPolarHBondContact O-CB 3.32Å; Q126-S130 PolarHBondContact O-N 3.04Å; Q126-S130 PolarHBondContact O-OG 2.98Å; Q126-V164 HydrophobicContact CB-CG1 4.28Å; Q126-V164 HydrophobicContact CG-CG1 3.68Å; Q126-M168 HydrophobicContact CB-SD 4.19Å; Q126-M168 HydrophobicContact CG-SD 4.04Å
127	Y	98.8	Very high	97.9	Very high	10 Å²	10	30.9 Å²	30.9	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-53.4	177.5	-172.5	-124.2	0	0	0	110.5	K122 T123 P124 A125 A129 S130 E131 R308 V311	K122-Y127 HydrophobicContact CD-CD2 4.32Å; T123-Y127 PolarHBondContact O-N 3.48Å; P124-Y127 PolarHBondContact O-N 2.87Å; A125-Y127 VanDerWaalsContact C-N 3.31Å; Y127-A129 PolarHBondContact O-N 3.18Å; Y127-S130 PolarHBondContact O-N 3.19Å; Y127-S130 VanDerWaalsContact O-N 3.08Å; Y127-S130 PolarHBondContact O-OG 3.47Å; Y127-E131 HydrophobicContact CD2-CG 4.49Å; Y127-E131 HydrophobicContact CE1-CG 4.34Å; Y127-E131 HydrophobicContact CE2-CG 4.12Å; Y127-E131 PolarHBondContact O-N 3.14Å; Y127-R308 HydrophobicContact CE1-CB 4.48Å; Y127-R308 HydrophobicContact CE1-CG 4.04Å; Y127-R308 VanDerWaalsContact OH-CA 3.26Å; Y127-R308 WeakPolarHBondContact OH-CA 3.47Å; Y127-V311 HydrophobicContact CD1-CG1 3.84Å; Y127-V311 HydrophobicContact CE1-CB 3.86Å; Y127-V311 HydrophobicContact CE1-CG1 3.63Å; Y127-V311 HydrophobicContact CG-CG1 4.39Å
128	D	98.8	Very high	97.1	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-42.5	178.5	-73.1	-20.5	0	0	0	112.7	P124 S130 E131 L132 I149 R153 I161	P124-D128 PolarHBondContact O-N 3.3Å; D128-S130 VanDerWaalsContact C-N 3.25Å; D128-S130 PolarHBondContact O-N 3.03Å; D128-E131 PolarHBondContact O-N 2.91Å; D128-L132 WeakPolarHBondContact O-CB 3.37Å; D128-L132 VanDerWaalsContact O-CG 3.32Å; D128-L132 WeakPolarHBondContact O-CG 3.23Å; D128-L132 PolarHBondContact O-N 3.43Å; D128-I149 HydrophobicContact CB-CG2 4.32Å; D128-R153 IonicContact OD1-CZ 3.45Å; D128-R153 IonicContact OD1-NE 3.33Å; D128-R153 IonicContact OD1-NH2 2.58Å; D128-R153 PolarHBondContact OD1-NH2 2.98Å; D128-R153 IonicContact OD2-CZ 2.88Å; D128-R153 IonicContact OD2-NE 3.43Å; D128-R153 PolarHBondContact OD2-NE 3.35Å; D128-R153 IonicContact OD2-NH2 3.18Å; D128-R153 PolarHBondContact OD2-NH2 3.15Å; D128-I161 HydrophobicContact CB-CD1 3.66Å; D128-I161 HydrophobicContact CB-CG1 3.82Å
129	A	98.8	Very high	96	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-38.7	174.8	0	0	0	0	0	111.6	A125 Y127 K133 V164 Y165 M168 Y169	A125-A129 WeakPolarHBondContact O-CB 3.26Å; A125-A129 PolarHBondContact O-N 3.31Å; Y127-A129 PolarHBondContact O-N 3.18Å; A129-K133 WeakPolarHBondContact O-CB 3.38Å; A129-K133 PolarHBondContact O-N 3.35Å; A129-V164 HydrophobicContact CB-CG1 4.21Å; A129-Y165 HydrophobicContact CB-CD2 3.9Å; A129-Y165 HydrophobicContact CB-CG 4.45Å; A129-Y165 WeakPolarHBondContact O-CE2 3.42Å; A129-M168 HydrophobicContact CB-SD 4.11Å; A129-Y169 HydrophobicContact CB-CE2 4.35Å
130	S	98.6	Very high	95.1	Very high	20 Å²	20	44.2 Å²	44.2	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-71	-36.2	176.8	74.2	0	0	0	0	113.9	Q126 Y127 D128 K133 A134 Y169	Q126-S130 WeakPolarHBondContact O-CB 3.32Å; Q126-S130 PolarHBondContact O-N 3.04Å; Q126-S130 PolarHBondContact O-OG 2.98Å; Y127-S130 PolarHBondContact O-N 3.19Å; Y127-S130 VanDerWaalsContact O-N 3.08Å; Y127-S130 PolarHBondContact O-OG 3.47Å; D128-S130 VanDerWaalsContact C-N 3.25Å; D128-S130 PolarHBondContact O-N 3.03Å; S130-K133 PolarHBondContact O-N 3.43Å; S130-A134 VanDerWaalsContact O-CB 3.28Å; S130-A134 WeakPolarHBondContact O-CB 3.49Å; S130-A134 PolarHBondContact O-N 2.99Å; S130-Y169 VanDerWaalsContact CA-OH 3.24Å; S130-Y169 WeakPolarHBondContact CA-OH 3.42Å
131	E	98.7	Very high	94.7	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.112	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-41.7	174.9	-71	-65.9	119.1	0	0	111.4	Y127 D128 A134 S135 I149 R308	Y127-E131 HydrophobicContact CD2-CG 4.49Å; Y127-E131 HydrophobicContact CE1-CG 4.34Å; Y127-E131 HydrophobicContact CE2-CG 4.12Å; Y127-E131 PolarHBondContact O-N 3.14Å; D128-E131 PolarHBondContact O-N 2.91Å; E131-A134 PolarHBondContact O-N 2.83Å; E131-S135 PolarHBondContact O-N 2.99Å; E131-I149 HydrophobicContact CB-CD1 3.52Å; E131-R308 HydrophobicContact CG-CG 4.21Å; E131-R308 WeakPolarHBondContact OE2-CD 3.38Å; E131-R308 IonicContact OE2-NH1 2.63Å; E131-R308 PolarHBondContact OE2-NH1 3.27Å
132	L	98.6	Very high	94.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-41.8	173.1	-72.6	169.4	0	0	0	111.6	D128 A134 S135 M136 L146 I149 I150 I161 Y165 L173	D128-L132 WeakPolarHBondContact O-CB 3.37Å; D128-L132 VanDerWaalsContact O-CG 3.32Å; D128-L132 WeakPolarHBondContact O-CG 3.23Å; D128-L132 PolarHBondContact O-N 3.43Å; L132-A134 VanDerWaalsContact C-N 3.29Å; L132-A134 PolarHBondContact O-N 2.71Å; L132-S135 PolarHBondContact O-N 2.72Å; L132-S135 PolarHBondContact O-OG 2.8Å; L132-M136 HydrophobicContact CB-CE 4.45Å; L132-M136 VanDerWaalsContact O-CE 3.26Å; L132-M136 WeakPolarHBondContact O-CE 3.48Å; L132-M136 PolarHBondContact O-N 2.58Å; L132-L146 HydrophobicContact CD2-CD1 3.61Å; L132-I149 HydrophobicContact CD1-CG2 4.02Å; L132-I149 HydrophobicContact CD2-CB 4.01Å; L132-I149 HydrophobicContact CD2-CD1 4.11Å; L132-I149 HydrophobicContact CD2-CG2 4.03Å; L132-I149 HydrophobicContact CG-CB 4.4Å; L132-I149 HydrophobicContact CG-CD1 3.99Å; L132-I149 HydrophobicContact CG-CG2 4.01Å; L132-I150 HydrophobicContact CD1-CD1 4.2Å; L132-I150 HydrophobicContact CD2-CD1 4.01Å; L132-I150 HydrophobicContact CD2-CG1 4.03Å; L132-I161 HydrophobicContact CD1-CG2 3.65Å; L132-Y165 HydrophobicContact CB-CE2 4.18Å; L132-L173 HydrophobicContact CB-CD1 4.24Å; L132-L173 HydrophobicContact CD1-CD1 4.06Å; L132-L173 HydrophobicContact CD1-CD2 3.83Å
133	K	98.1	Very high	94.4	Very high	56 Å²	56	46.6 Å²	46.6	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-40	175.3	-172.2	65.3	178.9	169	0	110.9	A129 S130 S135 M136 K137 Y165 Y169 D176	A129-K133 WeakPolarHBondContact O-CB 3.38Å; A129-K133 PolarHBondContact O-N 3.35Å; S130-K133 PolarHBondContact O-N 3.43Å; K133-S135 VanDerWaalsContact C-N 3.32Å; K133-M136 PolarHBondContact O-N 3.18Å; K133-K137 VanDerWaalsContact O-CB 3.3Å; K133-K137 WeakPolarHBondContact O-CB 3.5Å; K133-K137 PolarHBondContact O-N 2.66Å; K133-Y165 HydrophobicContact CB-CE2 3.93Å; K133-Y165 HydrophobicContact CD-CE2 4.29Å; K133-Y165 WeakPolarHBondContact CD-OH 3.18Å; K133-Y169 HydrophobicContact CB-CD2 4.2Å; K133-Y169 HydrophobicContact CB-CE1 4.15Å; K133-Y169 HydrophobicContact CB-CE2 3.61Å; K133-Y169 HydrophobicContact CD-CD1 4.2Å; K133-Y169 HydrophobicContact CD-CD2 4.17Å; K133-Y169 HydrophobicContact CD-CE1 4.44Å; K133-Y169 HydrophobicContact CD-CE2 4.41Å; K133-Y169 HydrophobicContact CD-CG 4.07Å; K133-Y169 HydrophobicContact CG-CD1 4Å; K133-Y169 HydrophobicContact CG-CD2 4.23Å; K133-Y169 HydrophobicContact CG-CE1 3.75Å; K133-Y169 HydrophobicContact CG-CE2 3.99Å; K133-Y169 HydrophobicContact CG-CG 4.24Å; K133-D176 IonicContact NZ-OD2 2.8Å; K133-D176 PolarHBondContact NZ-OD2 3.1Å
134	A	96.6	Very high	94.3	Very high	48 Å²	48	47 Å²	47	40%	0.397	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-32	177.9	0	0	0	0	0	112.4	S130 E131 L132 M136	S130-A134 VanDerWaalsContact O-CB 3.28Å; S130-A134 WeakPolarHBondContact O-CB 3.49Å; S130-A134 PolarHBondContact O-N 2.99Å; E131-A134 PolarHBondContact O-N 2.83Å; L132-A134 VanDerWaalsContact C-N 3.29Å; L132-A134 PolarHBondContact O-N 2.71Å; A134-M136 VanDerWaalsContact C-N 3.3Å
135	S	96.6	Very high	94.2	Very high	1 Å²	1	43 Å²	43	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-73.4	-22.1	178.1	70.3	0	0	0	0	113.5	E131 L132 K133 T141 D142	E131-S135 PolarHBondContact O-N 2.99Å; L132-S135 PolarHBondContact O-N 2.72Å; L132-S135 PolarHBondContact O-OG 2.8Å; K133-S135 VanDerWaalsContact C-N 3.32Å; S135-T141 CarbonylContact O-C 3.54Å; S135-T141 WeakPolarHBondContact O-CA 3.36Å; S135-T141 WeakPolarHBondContact O-CG2 3.42Å; S135-D142 PolarHBondContact O-N 3.35Å
136	M	96	Very high	94.2	Very high	12 Å²	12	42.6 Å²	42.6	6%	0.059	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	21.9	179.1	-58.9	179.3	-69.6	0	0	112.6	L132 K133 A134 T141 Y165 L173 D176 I177 D180	L132-M136 HydrophobicContact CB-CE 4.45Å; L132-M136 VanDerWaalsContact O-CE 3.26Å; L132-M136 WeakPolarHBondContact O-CE 3.48Å; L132-M136 PolarHBondContact O-N 2.58Å; K133-M136 PolarHBondContact O-N 3.18Å; A134-M136 VanDerWaalsContact C-N 3.3Å; M136-T141 HydrophobicContact CG-CG2 4.45Å; M136-Y165 HydrophobicContact CE-CE2 4.35Å; M136-Y165 WeakPolarHBondContact CE-OH 3.31Å; M136-L173 HydrophobicContact CE-CD1 3.7Å; M136-D176 HydrophobicContact CE-CB 3.86Å; M136-D176 HydrophobicContact SD-CB 4.15Å; M136-I177 HydrophobicContact CE-CG1 4.34Å; M136-I177 HydrophobicContact SD-CB 4.41Å; M136-I177 HydrophobicContact SD-CG1 3.78Å; M136-D180 WeakPolarHBondContact CA-OD2 3.34Å; M136-D180 HydrophobicContact CB-CB 4.23Å; M136-D180 WeakPolarHBondContact CB-OD2 3.39Å; M136-D180 HydrophobicContact CG-CB 4.21Å
137	K	88.8	Confident	94.2	Very high	170 Å²	170	39.6 Å²	39.6	74%	0.739	23%	0.234	S	C	*	.	S	Bend	trans	-109	119.7	-178.3	-176	-176.8	179.5	-173.5	0	110.6	K133	K133-K137 VanDerWaalsContact O-CB 3.3Å; K133-K137 WeakPolarHBondContact O-CB 3.5Å; K133-K137 PolarHBondContact O-N 2.66Å
138	G	83.2	Confident	94.2	Very high	62 Å²	62	39.1 Å²	39.1	64%	0.639	23%	0.232	S	C	*	.	S	Bend	trans	114.1	-156.2	170.9	0	0	0	0	0	111.7
139	L	75.1	Confident	94.2	Very high	189 Å²	189	38.8 Å²	38.8	99%	0.99	23%	0.231	S	C	*	.	S	Bend	trans	-87.6	119.6	172.4	-67.4	177.6	0	0	0	108.9
140	G	80.7	Confident	94.2	Very high	58 Å²	58	38.9 Å²	38.9	60%	0.598	23%	0.231	S	C	*	.	S	Bend	trans	89.6	168.2	-174.7	0	0	0	0	0	112.7
141	T	89	Confident	94.2	Very high	24 Å²	24	38.4 Å²	38.4	15%	0.147	23%	0.227	C	C	.	.			trans	-111.4	150.1	176.2	-51.9	0	0	0	0	108.5	S135 M136 E143 L146 D180	S135-T141 CarbonylContact O-C 3.54Å; S135-T141 WeakPolarHBondContact O-CA 3.36Å; S135-T141 WeakPolarHBondContact O-CG2 3.42Å; M136-T141 HydrophobicContact CG-CG2 4.45Å; T141-E143 WeakPolarHBondContact CB-OE1 3.48Å; T141-E143 HydrophobicContact CG2-CG 4.24Å; T141-E143 PolarHBondContact O-N 3.3Å; T141-L146 HydrophobicContact CG2-CD2 4.28Å; T141-D180 PolarHBondContact OG1-O 3.46Å; T141-D180 PolarHBondContact OG1-OD2 2.9Å
142	D	94.9	Very high	94.2	Very high	46 Å²	46	37.3 Å²	37.3	25%	0.246	22%	0.222	C	C	.	.			trans	-91.8	81.1	160.8	174.8	-5.6	0	0	0	107.2	S135 D144 S145 L146 K304	S135-D142 PolarHBondContact O-N 3.35Å; D142-D144 PolarHBondContact O-N 2.97Å; D142-S145 VanDerWaalsContact CG-OG 3.24Å; D142-S145 PolarHBondContact O-N 3.42Å; D142-S145 WeakPolarHBondContact OD1-CB 3.47Å; D142-S145 PolarHBondContact OD1-N 3.12Å; D142-S145 PolarHBondContact OD1-OG 2.76Å; D142-S145 WeakPolarHBondContact OD2-CB 3.48Å; D142-S145 PolarHBondContact OD2-OG 3.23Å; D142-L146 PolarHBondContact O-N 2.84Å; D142-L146 VanDerWaalsContact O-N 3.15Å; D142-K304 IonicContact OD2-NZ 3.42Å; D142-K304 PolarHBondContact OD2-NZ 3.4Å
143	E	96.1	Very high	94.2	Very high	58 Å²	58	38 Å²	38	27%	0.271	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-32.8	-175.6	-63.2	83	-176.7	0	0	111.2	T141 L146 I147 F185 D269	T141-E143 WeakPolarHBondContact CB-OE1 3.48Å; T141-E143 HydrophobicContact CG2-CG 4.24Å; T141-E143 PolarHBondContact O-N 3.3Å; E143-L146 PolarHBondContact O-N 2.93Å; E143-I147 HydrophobicContact CB-CD1 4.32Å; E143-I147 VanDerWaalsContact O-CB 3.24Å; E143-I147 WeakPolarHBondContact O-CB 3.46Å; E143-I147 WeakPolarHBondContact O-CD1 3.39Å; E143-I147 WeakPolarHBondContact O-CG1 3.26Å; E143-I147 PolarHBondContact O-N 3.21Å; E143-F185 HydrophobicContact CB-CE1 4.44Å; E143-F185 HydrophobicContact CB-CZ 4.19Å; E143-F185 HydrophobicContact CG-CE1 3.91Å; E143-F185 HydrophobicContact CG-CZ 4.17Å; E143-D269 HydrophobicContact CG-CB 4.39Å
144	D	96.1	Very high	94.2	Very high	46 Å²	46	38.1 Å²	38.1	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-46.4	-179.9	-170.1	64.5	0	0	0	112.2	D142 E148 R291	D142-D144 PolarHBondContact O-N 2.97Å; D144-E148 WeakPolarHBondContact O-CB 3.36Å; D144-E148 PolarHBondContact O-N 2.82Å; D144-R291 IonicContact OD1-CZ 3.57Å; D144-R291 IonicContact OD1-NH1 3.58Å; D144-R291 PolarHBondContact OD1-NH1 2.91Å; D144-R291 IonicContact OD1-NH2 2.88Å; D144-R291 IonicContact OD2-CZ 2.71Å; D144-R291 VanDerWaalsContact OD2-CZ 3.27Å; D144-R291 IonicContact OD2-NH1 3.55Å; D144-R291 PolarHBondContact OD2-NH1 3.47Å; D144-R291 IonicContact OD2-NH2 2.78Å; D144-R291 PolarHBondContact OD2-NH2 2.92Å
145	S	97.1	Very high	94.2	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-37.8	175.7	-62	0	0	0	0	112.5	D142 I149 R308	D142-S145 VanDerWaalsContact CG-OG 3.24Å; D142-S145 PolarHBondContact O-N 3.42Å; D142-S145 WeakPolarHBondContact OD1-CB 3.47Å; D142-S145 PolarHBondContact OD1-N 3.12Å; D142-S145 PolarHBondContact OD1-OG 2.76Å; D142-S145 WeakPolarHBondContact OD2-CB 3.48Å; D142-S145 PolarHBondContact OD2-OG 3.23Å; S145-I149 WeakPolarHBondContact O-CG1 3.39Å; S145-I149 PolarHBondContact O-N 3.06Å; S145-R308 PolarHBondContact OG-NH1 3.49Å; S145-R308 PolarHBondContact OG-NH2 3.38Å
146	L	98.5	Very high	94.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-48.9	175.7	176.5	61.4	0	0	0	111	L132 T141 D142 E143 I150 I177 T181 F185 M189	L132-L146 HydrophobicContact CD2-CD1 3.61Å; T141-L146 HydrophobicContact CG2-CD2 4.28Å; D142-L146 PolarHBondContact O-N 2.84Å; D142-L146 VanDerWaalsContact O-N 3.15Å; E143-L146 PolarHBondContact O-N 2.93Å; L146-I150 HydrophobicContact CD1-CG1 3.74Å; L146-I150 WeakPolarHBondContact O-CB 3.32Å; L146-I150 VanDerWaalsContact O-CG1 3.32Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.17Å; L146-I177 HydrophobicContact CD1-CD1 4.41Å; L146-I177 HydrophobicContact CD1-CG1 4.29Å; L146-T181 HydrophobicContact CD2-CG2 3.72Å; L146-F185 HydrophobicContact CD2-CE1 4.47Å; L146-F185 HydrophobicContact CD2-CZ 4.15Å; L146-M189 HydrophobicContact CD2-CG 4.3Å; L146-M189 HydrophobicContact CG-SD 4.23Å
147	I	98.8	Very high	94.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-47.8	179.1	-73	165.5	0	0	0	110.7	E143 I149 C151 F185 M189 N272 A273 N276	E143-I147 HydrophobicContact CB-CD1 4.32Å; E143-I147 VanDerWaalsContact O-CB 3.24Å; E143-I147 WeakPolarHBondContact O-CB 3.46Å; E143-I147 WeakPolarHBondContact O-CD1 3.39Å; E143-I147 WeakPolarHBondContact O-CG1 3.26Å; E143-I147 PolarHBondContact O-N 3.21Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 3.23Å; I147-C151 WeakPolarHBondContact O-CB 3.47Å; I147-C151 PolarHBondContact O-N 2.77Å; I147-C151 PolarHBondContact O-SG 3.5Å; I147-F185 HydrophobicContact CD1-CE2 3.78Å; I147-F185 HydrophobicContact CD1-CZ 4.11Å; I147-F185 HydrophobicContact CG1-CE2 3.67Å; I147-F185 HydrophobicContact CG1-CZ 3.99Å; I147-M189 HydrophobicContact CG1-CE 4.49Å; I147-M189 HydrophobicContact CG1-SD 4.21Å; I147-N272 HydrophobicContact CD1-CB 3.97Å; I147-A273 HydrophobicContact CD1-CB 4.09Å; I147-A273 HydrophobicContact CG1-CB 4.06Å; I147-N276 HydrophobicContact CG2-CB 3.37Å
148	E	98.7	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-47.5	-178.6	-178.6	-168.6	114.9	0	0	111.6	D144 S152 Y287 F288 R291 R308	D144-E148 WeakPolarHBondContact O-CB 3.36Å; D144-E148 PolarHBondContact O-N 2.82Å; E148-S152 VanDerWaalsContact O-CB 3.26Å; E148-S152 WeakPolarHBondContact O-CB 3.48Å; E148-S152 PolarHBondContact O-N 3.44Å; E148-S152 PolarHBondContact O-OG 3.29Å; E148-Y287 WeakPolarHBondContact CA-OH 3.22Å; E148-Y287 HydrophobicContact CG-CE1 4.3Å; E148-Y287 WeakPolarHBondContact CG-OH 3.45Å; E148-F288 HydrophobicContact CG-CE1 4.16Å; E148-R291 IonicContact OE2-CZ 2.68Å; E148-R291 IonicContact OE2-NE 3.37Å; E148-R291 PolarHBondContact OE2-NE 3.45Å; E148-R291 VanDerWaalsContact OE2-NE 3.16Å; E148-R291 IonicContact OE2-NH2 3.16Å; E148-R291 PolarHBondContact OE2-NH2 3.46Å; E148-R308 IonicContact OE1-CZ 3.51Å; E148-R308 IonicContact OE1-NE 2.66Å; E148-R308 PolarHBondContact OE1-NE 3.04Å; E148-R308 IonicContact OE1-NH2 3.8Å; E148-R308 PolarHBondContact OE1-NH2 3.05Å; E148-R308 IonicContact OE2-CZ 3.55Å; E148-R308 IonicContact OE2-NE 3.46Å; E148-R308 IonicContact OE2-NH2 3.75Å; E148-R308 PolarHBondContact OE2-NH2 3.45Å
149	I	98.8	Very high	95.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.9	-56.9	-178	-61.3	169.8	0	0	0	109.5	D128 E131 L132 S145 I147 C151 S152 R153	D128-I149 HydrophobicContact CB-CG2 4.32Å; E131-I149 HydrophobicContact CB-CD1 3.52Å; L132-I149 HydrophobicContact CD1-CG2 4.02Å; L132-I149 HydrophobicContact CD2-CB 4.01Å; L132-I149 HydrophobicContact CD2-CD1 4.11Å; L132-I149 HydrophobicContact CD2-CG2 4.03Å; L132-I149 HydrophobicContact CG-CB 4.4Å; L132-I149 HydrophobicContact CG-CD1 3.99Å; L132-I149 HydrophobicContact CG-CG2 4.01Å; S145-I149 WeakPolarHBondContact O-CG1 3.39Å; S145-I149 PolarHBondContact O-N 3.06Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 3.23Å; I149-C151 VanDerWaalsContact C-N 3.29Å; I149-C151 PolarHBondContact O-N 3.03Å; I149-S152 PolarHBondContact O-N 2.96Å; I149-S152 PolarHBondContact O-OG 3.33Å; I149-R153 HydrophobicContact CG2-CG 4.01Å; I149-R153 VanDerWaalsContact O-CG 3.26Å; I149-R153 WeakPolarHBondContact O-CG 3.25Å; I149-R153 PolarHBondContact O-N 2.88Å
150	I	98.8	Very high	96.7	Very high	2 Å²	2	32 Å²	32	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-34	-172.8	-63.6	-60	0	0	0	112.7	L132 L146 L158 L173 I177 M189 L192 A193	L132-I150 HydrophobicContact CD1-CD1 4.2Å; L132-I150 HydrophobicContact CD2-CD1 4.01Å; L132-I150 HydrophobicContact CD2-CG1 4.03Å; L146-I150 HydrophobicContact CD1-CG1 3.74Å; L146-I150 WeakPolarHBondContact O-CB 3.32Å; L146-I150 VanDerWaalsContact O-CG1 3.32Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.17Å; I150-L158 HydrophobicContact CD1-CD2 4.03Å; I150-L173 HydrophobicContact CD1-CD2 4.42Å; I150-I177 HydrophobicContact CD1-CD1 4.37Å; I150-M189 HydrophobicContact CB-SD 4.19Å; I150-M189 HydrophobicContact CG2-SD 4.11Å; I150-L192 HydrophobicContact CG2-CB 3.37Å; I150-L192 HydrophobicContact CG2-CD1 4.03Å; I150-L192 HydrophobicContact CG2-CG 4.36Å; I150-A193 HydrophobicContact CD1-CB 4.02Å
151	C	98.7	Very high	97.6	Very high	9 Å²	9	29.2 Å²	29.2	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-80	-21.9	-179.1	-63.7	0	0	0	0	114.2	I147 I149 N276 L277	I147-C151 WeakPolarHBondContact O-CB 3.47Å; I147-C151 PolarHBondContact O-N 2.77Å; I147-C151 PolarHBondContact O-SG 3.5Å; I149-C151 VanDerWaalsContact C-N 3.29Å; I149-C151 PolarHBondContact O-N 3.03Å; C151-N276 HydrophobicContact CB-CB 4.33Å; C151-L277 HydrophobicContact CB-CB 4.34Å
152	S	98.6	Very high	98	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-103.6	-21.2	-172.4	66.3	0	0	0	0	114.3	E148 I149 K284	E148-S152 VanDerWaalsContact O-CB 3.26Å; E148-S152 WeakPolarHBondContact O-CB 3.48Å; E148-S152 PolarHBondContact O-N 3.44Å; E148-S152 PolarHBondContact O-OG 3.29Å; I149-S152 PolarHBondContact O-N 2.96Å; I149-S152 PolarHBondContact O-OG 3.33Å; S152-K284 VanDerWaalsContact O-CE 3.25Å; S152-K284 WeakPolarHBondContact O-CE 3.26Å; S152-K284 PolarHBondContact O-NZ 2.9Å
153	R	98.6	Very high	98.2	Very high	14 Å²	14	31.8 Å²	31.8	5%	0.053	15%	0.153	C	C	.	.			trans	-76.1	144	178.5	-62.2	-54.3	178.8	-88.1	-0.4	111.9	D128 I149 E157 L158 I161	D128-R153 IonicContact OD1-CZ 3.45Å; D128-R153 IonicContact OD1-NE 3.33Å; D128-R153 IonicContact OD1-NH2 2.58Å; D128-R153 PolarHBondContact OD1-NH2 2.98Å; D128-R153 IonicContact OD2-CZ 2.88Å; D128-R153 IonicContact OD2-NE 3.43Å; D128-R153 PolarHBondContact OD2-NE 3.35Å; D128-R153 IonicContact OD2-NH2 3.18Å; D128-R153 PolarHBondContact OD2-NH2 3.15Å; I149-R153 HydrophobicContact CG2-CG 4.01Å; I149-R153 VanDerWaalsContact O-CG 3.26Å; I149-R153 WeakPolarHBondContact O-CG 3.25Å; I149-R153 PolarHBondContact O-N 2.88Å; R153-E157 WeakPolarHBondContact CA-OE2 3.38Å; R153-E157 HydrophobicContact CB-CB 3.98Å; R153-E157 HydrophobicContact CG-CB 4.44Å; R153-L158 HydrophobicContact CB-CD1 4.4Å; R153-L158 HydrophobicContact CB-CD2 3.93Å; R153-L158 HydrophobicContact CB-CG 3.74Å; R153-I161 HydrophobicContact CB-CD1 4.42Å; R153-I161 HydrophobicContact CG-CD1 3.88Å
154	T	98.1	Very high	98.3	Very high	60 Å²	60	29.2 Å²	29.2	37%	0.368	14%	0.142	S	C	.	.			trans	-77.6	169.9	176.5	59.1	0	0	0	0	111.4	Q156 E157 L158	T154-Q156 VanDerWaalsContact C-N 3.33Å; T154-Q156 PolarHBondContact O-N 2.94Å; T154-E157 WeakPolarHBondContact CB-OE2 3.35Å; T154-E157 WeakPolarHBondContact CG2-OE2 3.42Å; T154-E157 PolarHBondContact N-OE2 3.1Å; T154-E157 PolarHBondContact O-N 3.47Å; T154-E157 VanDerWaalsContact OG1-CG 3.31Å; T154-E157 WeakPolarHBondContact OG1-CG 3.38Å; T154-E157 PolarHBondContact OG1-N 3.26Å; T154-E157 PolarHBondContact OG1-OE2 3.39Å; T154-L158 WeakPolarHBondContact O-CB 3.5Å; T154-L158 WeakPolarHBondContact O-CG 3.17Å; T154-L158 PolarHBondContact O-N 3.35Å
155	N	97.8	Very high	98.5	Very high	27 Å²	27	27 Å²	27	14%	0.144	13%	0.13	C	C	.	.	H	α-helix	trans	-52.9	-51.1	173.5	-76	-14.9	0	0	0	111.6	E157 L158 Q159 G195 R196 R197 E199	N155-E157 PolarHBondContact O-N 3.39Å; N155-L158 PolarHBondContact O-N 2.86Å; N155-Q159 WeakPolarHBondContact O-CG 3.3Å; N155-Q159 PolarHBondContact O-N 3.38Å; N155-G195 WeakPolarHBondContact CB-O 3.33Å; N155-G195 VanDerWaalsContact CG-O 3.29Å; N155-G195 WeakPolarHBondContact OD1-CA 3.3Å; N155-G195 PolarHBondContact OD1-O 3.14Å; N155-R196 PolarHBondContact OD1-N 3.18Å; N155-R197 PolarHBondContact ND2-N 2.74Å; N155-R197 PolarHBondContact ND2-O 2.96Å; N155-R197 WeakPolarHBondContact OD1-CB 3.42Å; N155-R197 PolarHBondContact OD1-N 3.33Å; N155-E199 PolarHBondContact ND2-OE1 3.28Å
156	Q	97.6	Very high	98.5	Very high	108 Å²	108	32.2 Å²	32.2	51%	0.505	15%	0.152	S	C	.	.	H	α-helix	trans	-59.5	-47.5	-179.5	-176.3	-179.9	-8.8	0	0	112.1	T37 T154 L158 Q159 E160	T37-Q156 VanDerWaalsContact CG2-NE2 3.3Å; T37-Q156 VanDerWaalsContact CG2-OE1 3.29Å; T154-Q156 VanDerWaalsContact C-N 3.33Å; T154-Q156 PolarHBondContact O-N 2.94Å; Q156-L158 VanDerWaalsContact C-N 3.35Å; Q156-L158 PolarHBondContact O-N 3.25Å; Q156-Q159 PolarHBondContact O-N 3.25Å; Q156-E160 PolarHBondContact O-N 3.21Å; Q156-E160 VanDerWaalsContact O-N 3.14Å
157	E	98.5	Very high	98.5	Very high	52 Å²	52	35.7 Å²	35.7	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-43.9	177.2	-71	165.5	134.6	0	0	111.1	R153 T154 N155 E160 I161	R153-E157 WeakPolarHBondContact CA-OE2 3.38Å; R153-E157 HydrophobicContact CB-CB 3.98Å; R153-E157 HydrophobicContact CG-CB 4.44Å; T154-E157 WeakPolarHBondContact CB-OE2 3.35Å; T154-E157 WeakPolarHBondContact CG2-OE2 3.42Å; T154-E157 PolarHBondContact N-OE2 3.1Å; T154-E157 PolarHBondContact O-N 3.47Å; T154-E157 VanDerWaalsContact OG1-CG 3.31Å; T154-E157 WeakPolarHBondContact OG1-CG 3.38Å; T154-E157 PolarHBondContact OG1-N 3.26Å; T154-E157 PolarHBondContact OG1-OE2 3.39Å; N155-E157 PolarHBondContact O-N 3.39Å; E157-E160 PolarHBondContact O-N 2.76Å; E157-I161 WeakPolarHBondContact O-CB 3.4Å; E157-I161 WeakPolarHBondContact O-CD1 3.22Å; E157-I161 WeakPolarHBondContact O-CG1 3.48Å; E157-I161 PolarHBondContact O-N 3.15Å
158	L	98.7	Very high	98.5	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-39.4	179.6	-73.9	166.7	0	0	0	112.9	I150 R153 T154 N155 Q156 E160 I161 N162 L192	I150-L158 HydrophobicContact CD1-CD2 4.03Å; R153-L158 HydrophobicContact CB-CD1 4.4Å; R153-L158 HydrophobicContact CB-CD2 3.93Å; R153-L158 HydrophobicContact CB-CG 3.74Å; T154-L158 WeakPolarHBondContact O-CB 3.5Å; T154-L158 WeakPolarHBondContact O-CG 3.17Å; T154-L158 PolarHBondContact O-N 3.35Å; N155-L158 PolarHBondContact O-N 2.86Å; Q156-L158 VanDerWaalsContact C-N 3.35Å; Q156-L158 PolarHBondContact O-N 3.25Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 2.83Å; L158-I161 HydrophobicContact CD2-CD1 4.49Å; L158-I161 PolarHBondContact O-N 3.37Å; L158-N162 WeakPolarHBondContact O-CB 3.36Å; L158-N162 PolarHBondContact O-N 2.98Å; L158-N162 PolarHBondContact O-ND2 3.33Å; L158-L192 WeakPolarHBondContact CD1-O 3.4Å
159	Q	98.6	Very high	98.4	Very high	88 Å²	88	42.4 Å²	42.4	41%	0.411	20%	0.198	S	C	.	.	H	α-helix	trans	-60.7	-44.1	174.8	-67.9	-54	-24.9	0	0	110.9	N155 Q156 N162 R163 K194 G195	N155-Q159 WeakPolarHBondContact O-CG 3.3Å; N155-Q159 PolarHBondContact O-N 3.38Å; Q156-Q159 PolarHBondContact O-N 3.25Å; Q159-N162 PolarHBondContact O-N 3.27Å; Q159-R163 PolarHBondContact O-N 2.94Å; Q159-K194 PolarHBondContact NE2-O 3.29Å; Q159-G195 PolarHBondContact NE2-O 3.31Å
160	E	98.6	Very high	98.4	Very high	72 Å²	72	49.6 Å²	49.6	34%	0.336	23%	0.229	S	C	.	.	H	α-helix	trans	-68.7	-40	179.1	-180	60.8	-172.7	0	0	112	A125 Q156 E157 L158 N162 R163 V164	A125-E160 HydrophobicContact CB-CB 4.39Å; A125-E160 HydrophobicContact CB-CG 3.51Å; Q156-E160 PolarHBondContact O-N 3.21Å; Q156-E160 VanDerWaalsContact O-N 3.14Å; E157-E160 PolarHBondContact O-N 2.76Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 2.83Å; E160-N162 VanDerWaalsContact C-N 3.35Å; E160-N162 PolarHBondContact O-N 3.39Å; E160-R163 PolarHBondContact O-N 3.42Å; E160-R163 IonicContact OE1-CZ 2.66Å; E160-R163 IonicContact OE1-NE 3.56Å; E160-R163 IonicContact OE1-NH2 2.82Å; E160-R163 PolarHBondContact OE1-NH2 3.33Å; E160-R163 IonicContact OE2-CZ 3.58Å; E160-R163 IonicContact OE2-NE 3.45Å; E160-R163 PolarHBondContact OE2-NE 3.42Å; E160-R163 IonicContact OE2-NH2 3.7Å; E160-R163 PolarHBondContact OE2-NH2 2.98Å; E160-V164 HydrophobicContact CG-CG2 4.49Å; E160-V164 WeakPolarHBondContact O-CB 3.17Å; E160-V164 WeakPolarHBondContact O-CG2 3.43Å; E160-V164 PolarHBondContact O-N 3.28Å; E160-V164 WeakPolarHBondContact OE1-CG2 3.42Å
161	I	98.8	Very high	98.3	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-46.6	172.1	-71	163	0	0	0	110.5	A125 D128 L132 R153 E157 L158 R163 V164 Y165 L173	A125-I161 HydrophobicContact CB-CG1 4.36Å; D128-I161 HydrophobicContact CB-CD1 3.66Å; D128-I161 HydrophobicContact CB-CG1 3.82Å; L132-I161 HydrophobicContact CD1-CG2 3.65Å; R153-I161 HydrophobicContact CB-CD1 4.42Å; R153-I161 HydrophobicContact CG-CD1 3.88Å; E157-I161 WeakPolarHBondContact O-CB 3.4Å; E157-I161 WeakPolarHBondContact O-CD1 3.22Å; E157-I161 WeakPolarHBondContact O-CG1 3.48Å; E157-I161 PolarHBondContact O-N 3.15Å; L158-I161 HydrophobicContact CD2-CD1 4.49Å; L158-I161 PolarHBondContact O-N 3.37Å; I161-R163 VanDerWaalsContact C-N 3.34Å; I161-R163 PolarHBondContact O-N 3.06Å; I161-V164 PolarHBondContact O-N 3.01Å; I161-Y165 WeakPolarHBondContact O-CB 3.5Å; I161-Y165 PolarHBondContact O-N 3.45Å; I161-L173 HydrophobicContact CG2-CD2 3.98Å
162	N	98.7	Very high	98.3	Very high	35 Å²	35	52.8 Å²	52.8	19%	0.187	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-44.3	178.4	-82.5	-70.8	0	0	0	111.9	L158 Q159 E160 K166 A193	L158-N162 WeakPolarHBondContact O-CB 3.36Å; L158-N162 PolarHBondContact O-N 2.98Å; L158-N162 PolarHBondContact O-ND2 3.33Å; Q159-N162 PolarHBondContact O-N 3.27Å; E160-N162 VanDerWaalsContact C-N 3.35Å; E160-N162 PolarHBondContact O-N 3.39Å; N162-K166 WeakPolarHBondContact O-CB 3.41Å; N162-K166 PolarHBondContact O-N 3.27Å; N162-K166 VanDerWaalsContact O-N 3.16Å; N162-A193 PolarHBondContact ND2-O 2.87Å
163	R	98.8	Very high	98.3	Very high	88 Å²	88	52.8 Å²	52.8	33%	0.332	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-53.5	177.1	-172.1	-169.8	69.7	77.6	0.2	111	Q159 E160 I161 K166 E167	Q159-R163 PolarHBondContact O-N 2.94Å; E160-R163 PolarHBondContact O-N 3.42Å; E160-R163 IonicContact OE1-CZ 2.66Å; E160-R163 IonicContact OE1-NE 3.56Å; E160-R163 IonicContact OE1-NH2 2.82Å; E160-R163 PolarHBondContact OE1-NH2 3.33Å; E160-R163 IonicContact OE2-CZ 3.58Å; E160-R163 IonicContact OE2-NE 3.45Å; E160-R163 PolarHBondContact OE2-NE 3.42Å; E160-R163 IonicContact OE2-NH2 3.7Å; E160-R163 PolarHBondContact OE2-NH2 2.98Å; I161-R163 VanDerWaalsContact C-N 3.34Å; I161-R163 PolarHBondContact O-N 3.06Å; R163-K166 PolarHBondContact O-N 2.63Å; R163-E167 IonicContact CZ-OE1 2.76Å; R163-E167 IonicContact CZ-OE2 3.8Å; R163-E167 IonicContact NH1-OE1 3.3Å; R163-E167 PolarHBondContact NH1-OE1 3.19Å; R163-E167 IonicContact NH1-OE2 3.06Å; R163-E167 PolarHBondContact NH1-OE2 3.25Å; R163-E167 WeakPolarHBondContact O-CG 3.34Å; R163-E167 PolarHBondContact O-N 3.42Å; R163-E167 VanDerWaalsContact O-N 3.08Å
164	V	98.6	Very high	98.3	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.03	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-40	-177.8	170.6	0	0	0	0	111.9	A125 Q126 A129 E160 I161 K166 E167 M168	A125-V164 HydrophobicContact CB-CB 4.21Å; A125-V164 HydrophobicContact CB-CG2 3.86Å; Q126-V164 HydrophobicContact CB-CG1 4.28Å; Q126-V164 HydrophobicContact CG-CG1 3.68Å; A129-V164 HydrophobicContact CB-CG1 4.21Å; E160-V164 HydrophobicContact CG-CG2 4.49Å; E160-V164 WeakPolarHBondContact O-CB 3.17Å; E160-V164 WeakPolarHBondContact O-CG2 3.43Å; E160-V164 PolarHBondContact O-N 3.28Å; E160-V164 WeakPolarHBondContact OE1-CG2 3.42Å; I161-V164 PolarHBondContact O-N 3.01Å; V164-K166 VanDerWaalsContact C-N 3.31Å; V164-K166 PolarHBondContact O-N 2.92Å; V164-E167 PolarHBondContact O-N 3.47Å; V164-E167 VanDerWaalsContact O-N 3.17Å; V164-M168 HydrophobicContact CG1-CG 4.07Å; V164-M168 HydrophobicContact CG1-SD 3.49Å; V164-M168 WeakPolarHBondContact CG1-SD 3.38Å; V164-M168 WeakPolarHBondContact O-CB 3.43Å; V164-M168 VanDerWaalsContact O-CG 3.29Å; V164-M168 WeakPolarHBondContact O-CG 3.35Å; V164-M168 PolarHBondContact O-N 3.42Å
165	Y	98.7	Very high	98.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-44.5	176.8	-166.9	-80.7	0	0	0	111.2	A129 L132 K133 M136 I161 E167 M168 Y169 T171 L173 D176	A129-Y165 HydrophobicContact CB-CD2 3.9Å; A129-Y165 HydrophobicContact CB-CG 4.45Å; A129-Y165 WeakPolarHBondContact O-CE2 3.42Å; L132-Y165 HydrophobicContact CB-CE2 4.18Å; K133-Y165 HydrophobicContact CB-CE2 3.93Å; K133-Y165 HydrophobicContact CD-CE2 4.29Å; K133-Y165 WeakPolarHBondContact CD-OH 3.18Å; M136-Y165 HydrophobicContact CE-CE2 4.35Å; M136-Y165 WeakPolarHBondContact CE-OH 3.31Å; I161-Y165 WeakPolarHBondContact O-CB 3.5Å; I161-Y165 PolarHBondContact O-N 3.45Å; Y165-E167 VanDerWaalsContact C-N 3.34Å; Y165-E167 PolarHBondContact O-N 3.19Å; Y165-M168 PolarHBondContact O-N 2.92Å; Y165-Y169 AromaticContact CD1-CD2 3.84Å; Y165-Y169 HydrophobicContact CD1-CD2 3.84Å; Y165-Y169 AromaticContact CD2-CD2 3.73Å; Y165-Y169 HydrophobicContact CD2-CD2 3.73Å; Y165-Y169 AromaticContact CD2-CE2 3.85Å; Y165-Y169 HydrophobicContact CD2-CE2 3.85Å; Y165-Y169 AromaticContact CE1-CD2 3.89Å; Y165-Y169 HydrophobicContact CE1-CD2 3.89Å; Y165-Y169 HydrophobicContact CE1-CG 4.5Å; Y165-Y169 AromaticContact CE2-CD2 3.77Å; Y165-Y169 HydrophobicContact CE2-CD2 3.77Å; Y165-Y169 AromaticContact CE2-CE2 3.92Å; Y165-Y169 HydrophobicContact CE2-CE2 3.92Å; Y165-Y169 AromaticContact CG-CD2 3.76Å; Y165-Y169 HydrophobicContact CG-CD2 3.76Å; Y165-Y169 HydrophobicContact CG-CE2 4.28Å; Y165-Y169 AromaticContact CZ-CD2 3.86Å; Y165-Y169 WeakPolarHBondContact O-CB 3.26Å; Y165-Y169 WeakPolarHBondContact O-CD2 3.36Å; Y165-Y169 PolarHBondContact O-N 3.4Å; Y165-T171 HydrophobicContact CE1-CG2 3.97Å; Y165-L173 HydrophobicContact CD1-CB 3.86Å; Y165-L173 HydrophobicContact CD2-CB 4.36Å; Y165-L173 HydrophobicContact CD2-CD1 3.96Å; Y165-L173 HydrophobicContact CE1-CB 4.23Å; Y165-L173 HydrophobicContact CE1-CD1 4.38Å; Y165-L173 HydrophobicContact CE2-CD1 3.76Å; Y165-L173 HydrophobicContact CG-CB 3.92Å; Y165-L173 HydrophobicContact CG-CD1 4.37Å; Y165-D176 HydrophobicContact CE1-CB 4.48Å; Y165-D176 WeakPolarHBondContact CE1-OD2 3.25Å; Y165-D176 PolarHBondContact OH-OD2 3.13Å
166	K	98.4	Very high	98.3	Very high	110 Å²	110	58.2 Å²	58.2	48%	0.478	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-40.8	175.7	-173.1	172.3	-170.7	146	0	112.3	N162 R163 V164 K170 T171 D172	N162-K166 WeakPolarHBondContact O-CB 3.41Å; N162-K166 PolarHBondContact O-N 3.27Å; N162-K166 VanDerWaalsContact O-N 3.16Å; R163-K166 PolarHBondContact O-N 2.63Å; V164-K166 VanDerWaalsContact C-N 3.31Å; V164-K166 PolarHBondContact O-N 2.92Å; K166-K170 WeakPolarHBondContact O-CA 3.46Å; K166-K170 PolarHBondContact O-N 3.29Å; K166-T171 WeakPolarHBondContact CA-O 3.44Å; K166-D172 WeakPolarHBondContact CE-OD1 3.38Å; K166-D172 IonicContact NZ-OD1 2.74Å; K166-D172 PolarHBondContact NZ-OD1 2.93Å
167	E	98.3	Very high	98.3	Very high	73 Å²	73	53.1 Å²	53.1	34%	0.341	24%	0.243	S	C	.	.	H	α-helix	trans	-65.2	-43.3	176.3	-74.7	170.8	-169.8	0	0	112.3	R163 V164 Y165 K170	R163-E167 IonicContact CZ-OE1 2.76Å; R163-E167 IonicContact CZ-OE2 3.8Å; R163-E167 IonicContact NH1-OE1 3.3Å; R163-E167 PolarHBondContact NH1-OE1 3.19Å; R163-E167 IonicContact NH1-OE2 3.06Å; R163-E167 PolarHBondContact NH1-OE2 3.25Å; R163-E167 WeakPolarHBondContact O-CG 3.34Å; R163-E167 PolarHBondContact O-N 3.42Å; R163-E167 VanDerWaalsContact O-N 3.08Å; V164-E167 PolarHBondContact O-N 3.47Å; V164-E167 VanDerWaalsContact O-N 3.17Å; Y165-E167 VanDerWaalsContact C-N 3.34Å; Y165-E167 PolarHBondContact O-N 3.19Å; E167-K170 VanDerWaalsContact O-CE 3.23Å; E167-K170 WeakPolarHBondContact O-CE 3.31Å; E167-K170 PolarHBondContact O-NZ 2.55Å
168	M	97.8	Very high	98.3	Very high	72 Å²	72	53.6 Å²	53.6	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-74	-41	-177.1	-70.2	176	70.5	0	0	112.9	Q126 A129 V164 Y165	Q126-M168 HydrophobicContact CB-SD 4.19Å; Q126-M168 HydrophobicContact CG-SD 4.04Å; A129-M168 HydrophobicContact CB-SD 4.11Å; V164-M168 HydrophobicContact CG1-CG 4.07Å; V164-M168 HydrophobicContact CG1-SD 3.49Å; V164-M168 WeakPolarHBondContact CG1-SD 3.38Å; V164-M168 WeakPolarHBondContact O-CB 3.43Å; V164-M168 VanDerWaalsContact O-CG 3.29Å; V164-M168 WeakPolarHBondContact O-CG 3.35Å; V164-M168 PolarHBondContact O-N 3.42Å; Y165-M168 PolarHBondContact O-N 2.92Å
169	Y	97.7	Very high	98.2	Very high	69 Å²	69	57.9 Å²	57.9	27%	0.271	28%	0.277	S	S	.	.	H	α-helix	trans	-115.1	-3.3	-167.9	-54.4	-59.3	0	0	0	114.4	A129 S130 K133 Y165 T171	A129-Y169 HydrophobicContact CB-CE2 4.35Å; S130-Y169 VanDerWaalsContact CA-OH 3.24Å; S130-Y169 WeakPolarHBondContact CA-OH 3.42Å; K133-Y169 HydrophobicContact CB-CD2 4.2Å; K133-Y169 HydrophobicContact CB-CE1 4.15Å; K133-Y169 HydrophobicContact CB-CE2 3.61Å; K133-Y169 HydrophobicContact CD-CD1 4.2Å; K133-Y169 HydrophobicContact CD-CD2 4.17Å; K133-Y169 HydrophobicContact CD-CE1 4.44Å; K133-Y169 HydrophobicContact CD-CE2 4.41Å; K133-Y169 HydrophobicContact CD-CG 4.07Å; K133-Y169 HydrophobicContact CG-CD1 4Å; K133-Y169 HydrophobicContact CG-CD2 4.23Å; K133-Y169 HydrophobicContact CG-CE1 3.75Å; K133-Y169 HydrophobicContact CG-CE2 3.99Å; K133-Y169 HydrophobicContact CG-CG 4.24Å; Y165-Y169 AromaticContact CD1-CD2 3.84Å; Y165-Y169 HydrophobicContact CD1-CD2 3.84Å; Y165-Y169 AromaticContact CD2-CD2 3.73Å; Y165-Y169 HydrophobicContact CD2-CD2 3.73Å; Y165-Y169 AromaticContact CD2-CE2 3.85Å; Y165-Y169 HydrophobicContact CD2-CE2 3.85Å; Y165-Y169 AromaticContact CE1-CD2 3.89Å; Y165-Y169 HydrophobicContact CE1-CD2 3.89Å; Y165-Y169 HydrophobicContact CE1-CG 4.5Å; Y165-Y169 AromaticContact CE2-CD2 3.77Å; Y165-Y169 HydrophobicContact CE2-CD2 3.77Å; Y165-Y169 AromaticContact CE2-CE2 3.92Å; Y165-Y169 HydrophobicContact CE2-CE2 3.92Å; Y165-Y169 AromaticContact CG-CD2 3.76Å; Y165-Y169 HydrophobicContact CG-CD2 3.76Å; Y165-Y169 HydrophobicContact CG-CE2 4.28Å; Y165-Y169 AromaticContact CZ-CD2 3.86Å; Y165-Y169 WeakPolarHBondContact O-CB 3.26Å; Y165-Y169 WeakPolarHBondContact O-CD2 3.36Å; Y165-Y169 PolarHBondContact O-N 3.4Å; Y169-T171 PolarHBondContact O-N 2.9Å; Y169-T171 VanDerWaalsContact O-N 3.11Å
170	K	97.9	Very high	98	Very high	150 Å²	150	56.3 Å²	56.3	65%	0.652	27%	0.271	S	S	*	.	S	Bend	trans	56.1	26.6	178.4	-47.5	-53.3	-176.4	-166.5	0	113.4	K166 E167	K166-K170 WeakPolarHBondContact O-CA 3.46Å; K166-K170 PolarHBondContact O-N 3.29Å; E167-K170 VanDerWaalsContact O-CE 3.23Å; E167-K170 WeakPolarHBondContact O-CE 3.31Å; E167-K170 PolarHBondContact O-NZ 2.55Å
171	T	97.9	Very high	97.9	Very high	36 Å²	36	53.3 Å²	53.3	22%	0.221	26%	0.258	C	S	.	.	S	Bend	trans	-140.7	156.8	174	-174.1	0	0	0	0	109	Y165 K166 Y169 D176	Y165-T171 HydrophobicContact CE1-CG2 3.97Å; K166-T171 WeakPolarHBondContact CA-O 3.44Å; Y169-T171 PolarHBondContact O-N 2.9Å; Y169-T171 VanDerWaalsContact O-N 3.11Å; T171-D176 WeakPolarHBondContact CG2-OD1 3.26Å; T171-D176 WeakPolarHBondContact CG2-OD2 3.15Å; T171-D176 PolarHBondContact OG1-OD1 3.42Å
172	D	98.1	Very high	97.9	Very high	43 Å²	43	57.2 Å²	57.2	23%	0.23	29%	0.285	C	S	.	.			trans	-82.4	136.3	179.1	-53.7	-75.2	0	0	0	109.8	K166 E174 K175 D176	K166-D172 WeakPolarHBondContact CE-OD1 3.38Å; K166-D172 IonicContact NZ-OD1 2.74Å; K166-D172 PolarHBondContact NZ-OD1 2.93Å; D172-E174 PolarHBondContact O-N 3.4Å; D172-K175 HydrophobicContact CB-CB 4.45Å; D172-K175 HydrophobicContact CB-CD 4.12Å; D172-K175 HydrophobicContact CB-CG 4.15Å; D172-K175 WeakPolarHBondContact O-CB 3.34Å; D172-K175 PolarHBondContact O-N 3.37Å; D172-K175 WeakPolarHBondContact OD2-CD 3.49Å; D172-K175 VanDerWaalsContact OD2-CE 3.26Å; D172-K175 WeakPolarHBondContact OD2-CE 3.16Å; D172-K175 IonicContact OD2-NZ 3.89Å; D172-K175 PolarHBondContact OD2-NZ 3.26Å; D172-D176 PolarHBondContact O-N 3.02Å
173	L	98.4	Very high	97.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-54.7	-42.3	177.3	172	62.1	0	0	0	111.7	L132 M136 I150 I161 Y165 K175 D176 I177	L132-L173 HydrophobicContact CB-CD1 4.24Å; L132-L173 HydrophobicContact CD1-CD1 4.06Å; L132-L173 HydrophobicContact CD1-CD2 3.83Å; M136-L173 HydrophobicContact CE-CD1 3.7Å; I150-L173 HydrophobicContact CD1-CD2 4.42Å; I161-L173 HydrophobicContact CG2-CD2 3.98Å; Y165-L173 HydrophobicContact CD1-CB 3.86Å; Y165-L173 HydrophobicContact CD2-CB 4.36Å; Y165-L173 HydrophobicContact CD2-CD1 3.96Å; Y165-L173 HydrophobicContact CE1-CB 4.23Å; Y165-L173 HydrophobicContact CE1-CD1 4.38Å; Y165-L173 HydrophobicContact CE2-CD1 3.76Å; Y165-L173 HydrophobicContact CG-CB 3.92Å; Y165-L173 HydrophobicContact CG-CD1 4.37Å; L173-K175 VanDerWaalsContact C-N 3.28Å; L173-K175 PolarHBondContact O-N 2.62Å; L173-D176 PolarHBondContact O-N 2.95Å; L173-I177 HydrophobicContact CD1-CD1 3.99Å; L173-I177 HydrophobicContact CD1-CG1 4.09Å; L173-I177 HydrophobicContact CD2-CD1 4.48Å; L173-I177 HydrophobicContact CG-CD1 3.87Å; L173-I177 HydrophobicContact CG-CG1 4.39Å; L173-I177 WeakPolarHBondContact O-CG1 3.49Å; L173-I177 PolarHBondContact O-N 3.29Å
174	E	98.2	Very high	97.8	Very high	66 Å²	66	55.9 Å²	55.9	31%	0.308	30%	0.297	S	S	.	.	H	α-helix	trans	-56.5	-40.4	176.8	-177.4	173.6	145.3	0	0	112.3	D172 I177 I178 V190 K194	D172-E174 PolarHBondContact O-N 3.4Å; E174-I177 PolarHBondContact O-N 3.4Å; E174-I178 HydrophobicContact CG-CD1 3.88Å; E174-I178 WeakPolarHBondContact O-CB 3.18Å; E174-I178 WeakPolarHBondContact O-CD1 3.49Å; E174-I178 WeakPolarHBondContact O-CG1 3.49Å; E174-I178 PolarHBondContact O-N 2.89Å; E174-V190 HydrophobicContact CG-CG1 3.92Å; E174-V190 HydrophobicContact CG-CG2 4.32Å; E174-K194 WeakPolarHBondContact OE2-CE 3.4Å
175	K	98.1	Very high	97.8	Very high	125 Å²	125	56.5 Å²	56.5	54%	0.543	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-42.3	179.2	-72.3	175.5	179.5	157.4	0	111.6	D172 L173 I178 S179	D172-K175 HydrophobicContact CB-CB 4.45Å; D172-K175 HydrophobicContact CB-CD 4.12Å; D172-K175 HydrophobicContact CB-CG 4.15Å; D172-K175 WeakPolarHBondContact O-CB 3.34Å; D172-K175 PolarHBondContact O-N 3.37Å; D172-K175 WeakPolarHBondContact OD2-CD 3.49Å; D172-K175 VanDerWaalsContact OD2-CE 3.26Å; D172-K175 WeakPolarHBondContact OD2-CE 3.16Å; D172-K175 IonicContact OD2-NZ 3.89Å; D172-K175 PolarHBondContact OD2-NZ 3.26Å; L173-K175 VanDerWaalsContact C-N 3.28Å; L173-K175 PolarHBondContact O-N 2.62Å; K175-I178 PolarHBondContact O-N 3.44Å; K175-S179 WeakPolarHBondContact O-CB 3.42Å; K175-S179 PolarHBondContact O-N 3.4Å
176	D	97.9	Very high	97.8	Very high	25 Å²	25	60.7 Å²	60.7	13%	0.134	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-42.1	177.4	-77	13.4	0	0	0	110.5	K133 M136 Y165 T171 D172 L173 I178 S179 D180	K133-D176 IonicContact NZ-OD2 2.8Å; K133-D176 PolarHBondContact NZ-OD2 3.1Å; M136-D176 HydrophobicContact CE-CB 3.86Å; M136-D176 HydrophobicContact SD-CB 4.15Å; Y165-D176 HydrophobicContact CE1-CB 4.48Å; Y165-D176 WeakPolarHBondContact CE1-OD2 3.25Å; Y165-D176 PolarHBondContact OH-OD2 3.13Å; T171-D176 WeakPolarHBondContact CG2-OD1 3.26Å; T171-D176 WeakPolarHBondContact CG2-OD2 3.15Å; T171-D176 PolarHBondContact OG1-OD1 3.42Å; D172-D176 PolarHBondContact O-N 3.02Å; L173-D176 PolarHBondContact O-N 2.95Å; D176-I178 VanDerWaalsContact C-N 3.35Å; D176-I178 PolarHBondContact O-N 3.18Å; D176-S179 WeakPolarHBondContact O-CB 3.28Å; D176-S179 PolarHBondContact O-N 3.43Å; D176-S179 VanDerWaalsContact O-N 3.14Å; D176-D180 PolarHBondContact O-N 2.84Å
177	I	98.1	Very high	97.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.5	-45.1	173.7	-68	171.9	0	0	0	111	M136 L146 I150 L173 E174 S179 D180 T181 M189 V190 A193	M136-I177 HydrophobicContact CE-CG1 4.34Å; M136-I177 HydrophobicContact SD-CB 4.41Å; M136-I177 HydrophobicContact SD-CG1 3.78Å; L146-I177 HydrophobicContact CD1-CD1 4.41Å; L146-I177 HydrophobicContact CD1-CG1 4.29Å; I150-I177 HydrophobicContact CD1-CD1 4.37Å; L173-I177 HydrophobicContact CD1-CD1 3.99Å; L173-I177 HydrophobicContact CD1-CG1 4.09Å; L173-I177 HydrophobicContact CD2-CD1 4.48Å; L173-I177 HydrophobicContact CG-CD1 3.87Å; L173-I177 HydrophobicContact CG-CG1 4.39Å; L173-I177 WeakPolarHBondContact O-CG1 3.49Å; L173-I177 PolarHBondContact O-N 3.29Å; E174-I177 PolarHBondContact O-N 3.4Å; I177-S179 VanDerWaalsContact C-N 3.26Å; I177-S179 PolarHBondContact O-N 3.17Å; I177-D180 PolarHBondContact O-N 3.48Å; I177-T181 HydrophobicContact CG2-CG2 4.35Å; I177-T181 WeakPolarHBondContact O-CB 3.42Å; I177-T181 PolarHBondContact O-N 2.97Å; I177-T181 PolarHBondContact O-OG1 3.45Å; I177-M189 HydrophobicContact CG2-CB 3.76Å; I177-V190 HydrophobicContact CG2-CG2 3.9Å; I177-A193 HydrophobicContact CD1-CB 3.7Å
178	I	98.1	Very high	97.8	Very high	63 Å²	63	57.3 Å²	57.3	32%	0.323	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-36.4	178	-71.5	166.7	0	0	0	111.2	E174 K175 D176 R186 V190	E174-I178 HydrophobicContact CG-CD1 3.88Å; E174-I178 WeakPolarHBondContact O-CB 3.18Å; E174-I178 WeakPolarHBondContact O-CD1 3.49Å; E174-I178 WeakPolarHBondContact O-CG1 3.49Å; E174-I178 PolarHBondContact O-N 2.89Å; K175-I178 PolarHBondContact O-N 3.44Å; D176-I178 VanDerWaalsContact C-N 3.35Å; D176-I178 PolarHBondContact O-N 3.18Å; I178-R186 HydrophobicContact CG1-CG 4.39Å; I178-R186 PolarHBondContact O-NE 2.98Å; I178-R186 PolarHBondContact O-NH2 3.49Å; I178-V190 HydrophobicContact CD1-CG2 4.31Å; I178-V190 HydrophobicContact CG1-CG2 3.69Å
179	S	96.5	Very high	97.9	Very high	94 Å²	94	53.9 Å²	53.9	66%	0.657	28%	0.282	S	S	*	.	H	α-helix	trans	-69.2	-40.9	-180	-172.2	0	0	0	0	112.4	K175 D176 I177	K175-S179 WeakPolarHBondContact O-CB 3.42Å; K175-S179 PolarHBondContact O-N 3.4Å; D176-S179 WeakPolarHBondContact O-CB 3.28Å; D176-S179 PolarHBondContact O-N 3.43Å; D176-S179 VanDerWaalsContact O-N 3.14Å; I177-S179 VanDerWaalsContact C-N 3.26Å; I177-S179 PolarHBondContact O-N 3.17Å
180	D	95.1	Very high	97.9	Very high	55 Å²	55	51.4 Å²	51.4	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-92.9	-24.9	-170.9	-102.2	42.9	0	0	0	114.4	M136 T141 D176 I177	M136-D180 WeakPolarHBondContact CA-OD2 3.34Å; M136-D180 HydrophobicContact CB-CB 4.23Å; M136-D180 WeakPolarHBondContact CB-OD2 3.39Å; M136-D180 HydrophobicContact CG-CB 4.21Å; T141-D180 PolarHBondContact OG1-O 3.46Å; T141-D180 PolarHBondContact OG1-OD2 2.9Å; D176-D180 PolarHBondContact O-N 2.84Å; I177-D180 PolarHBondContact O-N 3.48Å
181	T	96.8	Very high	98	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	26%	0.255	C	S	.	.			trans	-106.5	168.1	-178.7	67.7	0	0	0	0	111.3	L146 I177 F185 R186	L146-T181 HydrophobicContact CD2-CG2 3.72Å; I177-T181 HydrophobicContact CG2-CG2 4.35Å; I177-T181 WeakPolarHBondContact O-CB 3.42Å; I177-T181 PolarHBondContact O-N 2.97Å; I177-T181 PolarHBondContact O-OG1 3.45Å; T181-F185 HydrophobicContact CG2-CD1 4.03Å; T181-F185 HydrophobicContact CG2-CE1 3.57Å; T181-F185 HydrophobicContact CG2-CZ 4.4Å; T181-R186 PolarHBondContact O-NE 2.7Å; T181-R186 PolarHBondContact O-NH2 3.44Å; T181-R186 VanDerWaalsContact OG1-CA 3.28Å; T181-R186 WeakPolarHBondContact OG1-CA 3.24Å; T181-R186 WeakPolarHBondContact OG1-CB 3.26Å; T181-R186 VanDerWaalsContact OG1-CG 3.32Å; T181-R186 WeakPolarHBondContact OG1-CG 3.48Å
182	S	97.1	Very high	98	Very high	83 Å²	83	44.6 Å²	44.6	58%	0.58	25%	0.247	S	C	*	.			trans	-144.9	174.7	175.1	71.6	0	0	0	0	113.1	R186	S182-R186 PolarHBondContact O-N 3.4Å
183	G	98	Very high	98	Very high	49 Å²	49	42.6 Å²	42.6	51%	0.505	24%	0.237	S	C	.	.	H	α-helix	trans	59.8	-148.3	174.7	0	0	0	0	0	114.4	F185 R186 K187	G183-F185 VanDerWaalsContact C-N 3.32Å; G183-R186 WeakPolarHBondContact O-CB 3.27Å; G183-R186 PolarHBondContact O-N 2.88Å; G183-K187 PolarHBondContact O-N 2.92Å
184	D	98.4	Very high	97.9	Very high	47 Å²	47	46.2 Å²	46.2	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-73.8	-24.1	179.6	-70.1	-27.8	0	0	0	113	K187 L188 V228 I232 L270	D184-K187 PolarHBondContact O-N 2.97Å; D184-K187 WeakPolarHBondContact OD1-CD 3.4Å; D184-K187 WeakPolarHBondContact OD1-CE 3.31Å; D184-K187 IonicContact OD1-NZ 2.78Å; D184-K187 PolarHBondContact OD1-NZ 3.31Å; D184-L188 PolarHBondContact O-N 3.24Å; D184-V228 HydrophobicContact CB-CB 4.49Å; D184-V228 HydrophobicContact CB-CG1 3.65Å; D184-I232 HydrophobicContact CB-CD1 4.49Å; D184-L270 HydrophobicContact CB-CD1 4.11Å; D184-L270 HydrophobicContact CB-CD2 3.97Å
185	F	98.5	Very high	97.8	Very high	18 Å²	18	43.2 Å²	43.2	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-46.9	170.9	174.1	-123	0	0	0	110.8	E143 L146 I147 T181 G183 K187 L188 M189 D269 A273	E143-F185 HydrophobicContact CB-CE1 4.44Å; E143-F185 HydrophobicContact CB-CZ 4.19Å; E143-F185 HydrophobicContact CG-CE1 3.91Å; E143-F185 HydrophobicContact CG-CZ 4.17Å; L146-F185 HydrophobicContact CD2-CE1 4.47Å; L146-F185 HydrophobicContact CD2-CZ 4.15Å; I147-F185 HydrophobicContact CD1-CE2 3.78Å; I147-F185 HydrophobicContact CD1-CZ 4.11Å; I147-F185 HydrophobicContact CG1-CE2 3.67Å; I147-F185 HydrophobicContact CG1-CZ 3.99Å; T181-F185 HydrophobicContact CG2-CD1 4.03Å; T181-F185 HydrophobicContact CG2-CE1 3.57Å; T181-F185 HydrophobicContact CG2-CZ 4.4Å; G183-F185 VanDerWaalsContact C-N 3.32Å; F185-K187 VanDerWaalsContact C-N 3.33Å; F185-K187 PolarHBondContact O-N 3.46Å; F185-L188 PolarHBondContact O-N 3.26Å; F185-M189 HydrophobicContact CD2-CE 4.45Å; F185-M189 HydrophobicContact CD2-CG 3.96Å; F185-M189 HydrophobicContact CE1-CG 4.39Å; F185-M189 HydrophobicContact CE2-CE 4Å; F185-M189 HydrophobicContact CE2-CG 3.48Å; F185-M189 VanDerWaalsContact CE2-CG 3.48Å; F185-M189 HydrophobicContact CE2-SD 3.76Å; F185-M189 HydrophobicContact CZ-CG 3.73Å; F185-M189 HydrophobicContact CZ-SD 4.17Å; F185-M189 WeakPolarHBondContact O-CG 3.49Å; F185-M189 PolarHBondContact O-N 2.83Å; F185-D269 HydrophobicContact CD1-CB 3.94Å; F185-D269 HydrophobicContact CD2-CB 3.95Å; F185-D269 HydrophobicContact CE1-CB 4.1Å; F185-D269 HydrophobicContact CE2-CB 4.14Å; F185-D269 HydrophobicContact CG-CB 3.87Å; F185-D269 HydrophobicContact CZ-CB 4.21Å; F185-A273 HydrophobicContact CD2-CB 3.99Å; F185-A273 HydrophobicContact CE2-CB 3.96Å
186	R	98.6	Very high	97.8	Very high	88 Å²	88	46.3 Å²	46.3	33%	0.332	25%	0.248	S	C	.	.	H	α-helix	trans	-54.5	-48.2	171.9	-179.8	-169.3	-67.1	-178.4	-0.7	111.6	I178 T181 S182 G183 L188 M189 V190	I178-R186 HydrophobicContact CG1-CG 4.39Å; I178-R186 PolarHBondContact O-NE 2.98Å; I178-R186 PolarHBondContact O-NH2 3.49Å; T181-R186 PolarHBondContact O-NE 2.7Å; T181-R186 PolarHBondContact O-NH2 3.44Å; T181-R186 VanDerWaalsContact OG1-CA 3.28Å; T181-R186 WeakPolarHBondContact OG1-CA 3.24Å; T181-R186 WeakPolarHBondContact OG1-CB 3.26Å; T181-R186 VanDerWaalsContact OG1-CG 3.32Å; T181-R186 WeakPolarHBondContact OG1-CG 3.48Å; S182-R186 PolarHBondContact O-N 3.4Å; G183-R186 WeakPolarHBondContact O-CB 3.27Å; G183-R186 PolarHBondContact O-N 2.88Å; R186-L188 VanDerWaalsContact C-N 3.32Å; R186-L188 PolarHBondContact O-N 3.39Å; R186-M189 PolarHBondContact O-N 3.14Å; R186-V190 HydrophobicContact CG-CG2 4.23Å; R186-V190 WeakPolarHBondContact O-CB 3.35Å; R186-V190 VanDerWaalsContact O-CG2 3.28Å; R186-V190 WeakPolarHBondContact O-CG2 3.41Å; R186-V190 PolarHBondContact O-N 3.45Å
187	K	98.8	Very high	97.7	Very high	112 Å²	112	46.8 Å²	46.8	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-43.3	-177.6	-65.4	177.8	-165.2	160.1	0	111.4	G183 D184 F185 A191 I232	G183-K187 PolarHBondContact O-N 2.92Å; D184-K187 PolarHBondContact O-N 2.97Å; D184-K187 WeakPolarHBondContact OD1-CD 3.4Å; D184-K187 WeakPolarHBondContact OD1-CE 3.31Å; D184-K187 IonicContact OD1-NZ 2.78Å; D184-K187 PolarHBondContact OD1-NZ 3.31Å; F185-K187 VanDerWaalsContact C-N 3.33Å; F185-K187 PolarHBondContact O-N 3.46Å; K187-A191 VanDerWaalsContact O-CB 3.28Å; K187-A191 WeakPolarHBondContact O-CB 3.25Å; K187-A191 PolarHBondContact O-N 3.02Å; K187-I232 HydrophobicContact CB-CD1 3.83Å
188	L	98.8	Very high	97.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-48.4	178	177.9	56.7	0	0	0	111.7	D184 F185 R186 V190 A191 L192 I232 T236 L270 A273 F274 L277	D184-L188 PolarHBondContact O-N 3.24Å; F185-L188 PolarHBondContact O-N 3.26Å; R186-L188 VanDerWaalsContact C-N 3.32Å; R186-L188 PolarHBondContact O-N 3.39Å; L188-V190 PolarHBondContact O-N 3.02Å; L188-A191 PolarHBondContact O-N 3.18Å; L188-L192 HydrophobicContact CD1-CD1 4.02Å; L188-L192 HydrophobicContact CD1-CG 4.21Å; L188-L192 HydrophobicContact CG-CD1 4.24Å; L188-L192 WeakPolarHBondContact O-CG 3.31Å; L188-L192 PolarHBondContact O-N 2.89Å; L188-I232 HydrophobicContact CB-CD1 4.02Å; L188-I232 HydrophobicContact CB-CG1 4.14Å; L188-I232 HydrophobicContact CD1-CG1 4.28Å; L188-I232 HydrophobicContact CD1-CG2 4.36Å; L188-T236 HydrophobicContact CD1-CG2 3.56Å; L188-L270 HydrophobicContact CD2-CD1 4.25Å; L188-A273 HydrophobicContact CD2-CB 3.6Å; L188-F274 HydrophobicContact CD1-CE1 4.22Å; L188-F274 HydrophobicContact CD2-CD1 3.95Å; L188-F274 HydrophobicContact CD2-CD2 4.2Å; L188-F274 HydrophobicContact CD2-CE1 3.97Å; L188-F274 HydrophobicContact CD2-CE2 4.23Å; L188-F274 HydrophobicContact CD2-CG 4.07Å; L188-F274 HydrophobicContact CD2-CZ 4.12Å; L188-L277 HydrophobicContact CD1-CD2 4.25Å
189	M	98.8	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-43.1	178.9	-67.4	-59	95.5	0	0	112	L146 I147 I150 I177 F185 R186 L192 A193 A273	L146-M189 HydrophobicContact CD2-CG 4.3Å; L146-M189 HydrophobicContact CG-SD 4.23Å; I147-M189 HydrophobicContact CG1-CE 4.49Å; I147-M189 HydrophobicContact CG1-SD 4.21Å; I150-M189 HydrophobicContact CB-SD 4.19Å; I150-M189 HydrophobicContact CG2-SD 4.11Å; I177-M189 HydrophobicContact CG2-CB 3.76Å; F185-M189 HydrophobicContact CD2-CE 4.45Å; F185-M189 HydrophobicContact CD2-CG 3.96Å; F185-M189 HydrophobicContact CE1-CG 4.39Å; F185-M189 HydrophobicContact CE2-CE 4Å; F185-M189 HydrophobicContact CE2-CG 3.48Å; F185-M189 VanDerWaalsContact CE2-CG 3.48Å; F185-M189 HydrophobicContact CE2-SD 3.76Å; F185-M189 HydrophobicContact CZ-CG 3.73Å; F185-M189 HydrophobicContact CZ-SD 4.17Å; F185-M189 WeakPolarHBondContact O-CG 3.49Å; F185-M189 PolarHBondContact O-N 2.83Å; R186-M189 PolarHBondContact O-N 3.14Å; M189-L192 HydrophobicContact CE-CD1 4.01Å; M189-L192 PolarHBondContact O-N 3.37Å; M189-A193 WeakPolarHBondContact O-CB 3.49Å; M189-A193 PolarHBondContact O-N 2.71Å; M189-A273 HydrophobicContact CE-CB 3.68Å
190	V	98.7	Very high	96.9	Very high	16 Å²	16	53.6 Å²	53.6	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-42.6	176.1	168.8	0	0	0	0	111.5	E174 I177 I178 R186 L188 L192 A193 K194	E174-V190 HydrophobicContact CG-CG1 3.92Å; E174-V190 HydrophobicContact CG-CG2 4.32Å; I177-V190 HydrophobicContact CG2-CG2 3.9Å; I178-V190 HydrophobicContact CD1-CG2 4.31Å; I178-V190 HydrophobicContact CG1-CG2 3.69Å; R186-V190 HydrophobicContact CG-CG2 4.23Å; R186-V190 WeakPolarHBondContact O-CB 3.35Å; R186-V190 VanDerWaalsContact O-CG2 3.28Å; R186-V190 WeakPolarHBondContact O-CG2 3.41Å; R186-V190 PolarHBondContact O-N 3.45Å; L188-V190 PolarHBondContact O-N 3.02Å; V190-L192 PolarHBondContact O-N 3Å; V190-A193 PolarHBondContact O-N 3.37Å; V190-K194 WeakPolarHBondContact O-CG 3.38Å; V190-K194 PolarHBondContact O-N 3.1Å
191	A	98.7	Very high	96.4	Very high	30 Å²	30	53.1 Å²	53.1	25%	0.248	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-44.2	178.7	0	0	0	0	0	111.8	K187 L188 I232 T236	K187-A191 VanDerWaalsContact O-CB 3.28Å; K187-A191 WeakPolarHBondContact O-CB 3.25Å; K187-A191 PolarHBondContact O-N 3.02Å; L188-A191 PolarHBondContact O-N 3.18Å; A191-I232 HydrophobicContact CB-CG2 4Å; A191-T236 HydrophobicContact CB-CG2 3.96Å
192	L	98.7	Very high	95.7	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-49.2	176.1	-71.1	171.9	0	0	0	111.9	I150 L158 L188 M189 V190 K194 G195 T236 L277	I150-L192 HydrophobicContact CG2-CB 3.37Å; I150-L192 HydrophobicContact CG2-CD1 4.03Å; I150-L192 HydrophobicContact CG2-CG 4.36Å; L158-L192 WeakPolarHBondContact CD1-O 3.4Å; L188-L192 HydrophobicContact CD1-CD1 4.02Å; L188-L192 HydrophobicContact CD1-CG 4.21Å; L188-L192 HydrophobicContact CG-CD1 4.24Å; L188-L192 WeakPolarHBondContact O-CG 3.31Å; L188-L192 PolarHBondContact O-N 2.89Å; M189-L192 HydrophobicContact CE-CD1 4.01Å; M189-L192 PolarHBondContact O-N 3.37Å; V190-L192 PolarHBondContact O-N 3Å; L192-K194 PolarHBondContact O-N 2.77Å; L192-G195 PolarHBondContact O-N 2.69Å; L192-T236 HydrophobicContact CD2-CG2 3.7Å; L192-T236 HydrophobicContact CG-CG2 3.81Å; L192-L277 HydrophobicContact CD1-CD1 4.29Å; L192-L277 HydrophobicContact CD1-CD2 4.27Å; L192-L277 HydrophobicContact CD2-CD1 3.88Å; L192-L277 HydrophobicContact CD2-CD2 4.2Å
193	A	98.4	Very high	95.4	Very high	2 Å²	2	60.5 Å²	60.5	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-58	-21.1	-175.7	0	0	0	0	0	113.8	I150 N162 I177 M189 V190 G195	I150-A193 HydrophobicContact CD1-CB 4.02Å; N162-A193 PolarHBondContact ND2-O 2.87Å; I177-A193 HydrophobicContact CD1-CB 3.7Å; M189-A193 WeakPolarHBondContact O-CB 3.49Å; M189-A193 PolarHBondContact O-N 2.71Å; V190-A193 PolarHBondContact O-N 3.37Å; A193-G195 PolarHBondContact O-N 3.39Å
194	K	95.9	Very high	95.1	Very high	75 Å²	75	61.7 Å²	61.7	33%	0.326	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25	173.7	-75.4	172.3	-175	-178.1	0	113.6	Q159 E174 V190 L192 R196	Q159-K194 PolarHBondContact NE2-O 3.29Å; E174-K194 WeakPolarHBondContact OE2-CE 3.4Å; V190-K194 WeakPolarHBondContact O-CG 3.38Å; V190-K194 PolarHBondContact O-N 3.1Å; L192-K194 PolarHBondContact O-N 2.77Å; K194-R196 HydrophobicContact CB-CG 4.22Å; K194-R196 WeakPolarHBondContact O-CG 3.22Å; K194-R196 PolarHBondContact O-N 2.78Å
195	G	96.9	Very high	95	Very high	4 Å²	4	63.1 Å²	63.1	4%	0.041	34%	0.336	C	S	.	.			trans	58.9	44.6	-179.8	0	0	0	0	0	113.3	N155 Q159 L192 A193	N155-G195 WeakPolarHBondContact CB-O 3.33Å; N155-G195 VanDerWaalsContact CG-O 3.29Å; N155-G195 WeakPolarHBondContact OD1-CA 3.3Å; N155-G195 PolarHBondContact OD1-O 3.14Å; Q159-G195 PolarHBondContact NE2-O 3.31Å; L192-G195 PolarHBondContact O-N 2.69Å; A193-G195 PolarHBondContact O-N 3.39Å
196	R	96.8	Very high	94.9	Very high	190 Å²	190	70.2 Å²	70.2	72%	0.717	36%	0.364	S	S	*	.			trans	-124.9	30.3	-177.9	-55.1	-176.5	-162.2	168.6	3.2	113	N155 K194	N155-R196 PolarHBondContact OD1-N 3.18Å; K194-R196 HydrophobicContact CB-CG 4.22Å; K194-R196 WeakPolarHBondContact O-CG 3.22Å; K194-R196 PolarHBondContact O-N 2.78Å
197	R	96.3	Very high	94.9	Very high	34 Å²	34	73.8 Å²	73.8	13%	0.128	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-58	145.8	171.5	-175.4	-179	-66.5	-75.9	-1.8	109.1	N155 E199 M235 R238	N155-R197 PolarHBondContact ND2-N 2.74Å; N155-R197 PolarHBondContact ND2-O 2.96Å; N155-R197 WeakPolarHBondContact OD1-CB 3.42Å; N155-R197 PolarHBondContact OD1-N 3.33Å; R197-E199 PolarHBondContact O-N 3.22Å; R197-M235 VanDerWaalsContact CZ-O 3.29Å; R197-M235 PolarHBondContact NH1-O 2.75Å; R197-M235 PolarHBondContact NH2-O 3.28Å; R197-R238 WeakPolarHBondContact CD-O 3.26Å; R197-R238 WeakPolarHBondContact CG-O 3.26Å; R197-R238 PolarHBondContact NH1-O 3.28Å
198	A	95.3	Very high	94.9	Very high	52 Å²	52	71.1 Å²	71.1	43%	0.43	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-56.6	132.7	171.4	0	0	0	0	0	110.3	E237 S239	A198-E237 WeakPolarHBondContact CB-O 3.31Å; A198-E237 PolarHBondContact N-O 2.87Å; A198-S239 VanDerWaalsContact O-CA 3.27Å; A198-S239 WeakPolarHBondContact O-CA 3.48Å; A198-S239 WeakPolarHBondContact O-CB 3.22Å
199	E	93	Very high	94.9	Very high	145 Å²	145	71.7 Å²	71.7	68%	0.678	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-66.3	156.5	171.7	-64.7	-56.6	145.9	0	0	110.3	N155 R197 G201	N155-E199 PolarHBondContact ND2-OE1 3.28Å; R197-E199 PolarHBondContact O-N 3.22Å; E199-G201 PolarHBondContact O-N 2.85Å
200	D	88.1	Confident	94.9	Very high	104 Å²	104	73 Å²	73	56%	0.556	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-68.1	128.5	179.1	-167.4	37.6	0	0	0	111.1	P241	D200-P241 HydrophobicContact CB-CG 4.15Å; D200-P241 WeakPolarHBondContact OD1-CB 3.27Å; D200-P241 WeakPolarHBondContact OD1-CG 3.17Å
201	G	83	Confident	94.9	Very high	44 Å²	44	76.7 Å²	76.7	45%	0.454	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-92	150.1	175.3	0	0	0	0	0	110.8	E199 V203	E199-G201 PolarHBondContact O-N 2.85Å; G201-V203 PolarHBondContact O-N 3.09Å
202	S	82.9	Confident	94.9	Very high	128 Å²	128	75.3 Å²	75.3	90%	0.895	39%	0.39	S	S	*	.	S	Bend	trans	-67.9	-18.8	172.5	54.7	0	0	0	0	113.3
203	V	90.1	Very high	94.9	Very high	119 Å²	119	74.7 Å²	74.7	72%	0.721	39%	0.387	S	S	*	.	S	Bend	trans	-97.7	127.7	-178.2	-178.8	0	0	0	0	109.9	G201	G201-V203 PolarHBondContact O-N 3.09Å
204	I	92.9	Very high	94.9	Very high	74 Å²	74	79.7 Å²	79.7	38%	0.379	41%	0.405	S	S	.	.			trans	-85.8	115.1	172.2	-58.6	170.8	0	0	0	108.5	Y206 I209 K245	I204-Y206 HydrophobicContact CB-CE2 4.15Å; I204-Y206 HydrophobicContact CG2-CD1 3.97Å; I204-Y206 HydrophobicContact CG2-CD2 4.26Å; I204-Y206 HydrophobicContact CG2-CE1 3.63Å; I204-Y206 HydrophobicContact CG2-CE2 3.94Å; I204-Y206 HydrophobicContact CG2-CG 4.27Å; I204-Y206 PolarHBondContact O-N 3.38Å; I204-I209 HydrophobicContact CG2-CD1 3.71Å; I204-K245 HydrophobicContact CG2-CD 3.93Å
205	D	95.3	Very high	95	Very high	77 Å²	77	77.7 Å²	77.7	41%	0.412	40%	0.398	S	S	.	.			trans	-90.6	90.1	176.4	-170.1	-21.2	0	0	0	110.9	E207 L208 I209	D205-E207 VanDerWaalsContact C-N 3.28Å; D205-E207 PolarHBondContact O-N 2.79Å; D205-E207 PolarHBondContact OD1-N 3.35Å; D205-L208 HydrophobicContact CB-CB 3.98Å; D205-L208 PolarHBondContact O-N 3.46Å; D205-L208 PolarHBondContact OD1-N 3.14Å; D205-L208 WeakPolarHBondContact OD2-CB 3.44Å; D205-I209 WeakPolarHBondContact O-CD1 3.49Å; D205-I209 WeakPolarHBondContact O-CG1 3.38Å; D205-I209 PolarHBondContact O-N 2.85Å
206	Y	97.3	Very high	95.1	Very high	168 Å²	168	77.5 Å²	77.5	66%	0.659	40%	0.396	S	S	*	.	H	α-helix	trans	-66.1	-29	-178.5	-64.9	-75.3	0	0	0	113.6	I204 D210	I204-Y206 HydrophobicContact CB-CE2 4.15Å; I204-Y206 HydrophobicContact CG2-CD1 3.97Å; I204-Y206 HydrophobicContact CG2-CD2 4.26Å; I204-Y206 HydrophobicContact CG2-CE1 3.63Å; I204-Y206 HydrophobicContact CG2-CE2 3.94Å; I204-Y206 HydrophobicContact CG2-CG 4.27Å; I204-Y206 PolarHBondContact O-N 3.38Å; Y206-D210 PolarHBondContact O-N 3.47Å; Y206-D210 VanDerWaalsContact O-N 3.08Å
207	E	98.1	Very high	95.2	Very high	163 Å²	163	71 Å²	71	76%	0.762	37%	0.372	S	S	*	.	H	α-helix	trans	-71.1	-46.4	178.3	-174.9	173.4	-174.6	0	0	110	D205 I209 D210 Q211	D205-E207 VanDerWaalsContact C-N 3.28Å; D205-E207 PolarHBondContact O-N 2.79Å; D205-E207 PolarHBondContact OD1-N 3.35Å; E207-I209 VanDerWaalsContact C-N 3.32Å; E207-I209 PolarHBondContact O-N 3.43Å; E207-D210 PolarHBondContact O-N 3.46Å; E207-Q211 WeakPolarHBondContact O-CB 3.12Å; E207-Q211 PolarHBondContact O-N 2.63Å
208	L	98.1	Very high	95.3	Very high	56 Å²	56	72.5 Å²	72.5	29%	0.293	38%	0.382	S	S	.	.	H	α-helix	trans	-64.1	-37	175	-174.8	62.5	0	0	0	112.1	D205 Q211 D212	D205-L208 HydrophobicContact CB-CB 3.98Å; D205-L208 PolarHBondContact O-N 3.46Å; D205-L208 PolarHBondContact OD1-N 3.14Å; D205-L208 WeakPolarHBondContact OD2-CB 3.44Å; L208-Q211 PolarHBondContact O-N 2.83Å; L208-D212 WeakPolarHBondContact O-CB 3.38Å; L208-D212 PolarHBondContact O-N 2.8Å
209	I	98.7	Very high	95.4	Very high	11 Å²	11	70.3 Å²	70.3	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-59.9	-47.4	174.7	-72.9	162.2	0	0	0	110.7	I204 D205 E207 A213 H242 K245 V246 R249	I204-I209 HydrophobicContact CG2-CD1 3.71Å; D205-I209 WeakPolarHBondContact O-CD1 3.49Å; D205-I209 WeakPolarHBondContact O-CG1 3.38Å; D205-I209 PolarHBondContact O-N 2.85Å; E207-I209 VanDerWaalsContact C-N 3.32Å; E207-I209 PolarHBondContact O-N 3.43Å; I209-A213 VanDerWaalsContact O-CB 3.27Å; I209-A213 WeakPolarHBondContact O-CB 3.31Å; I209-A213 PolarHBondContact O-N 3.47Å; I209-H242 VanDerWaalsContact CG1-CE1 3.49Å; I209-H242 WeakPolarHBondContact CG1-CE1 3.5Å; I209-K245 HydrophobicContact CD1-CB 3.72Å; I209-K245 HydrophobicContact CD1-CD 3.62Å; I209-K245 HydrophobicContact CD1-CG 4.32Å; I209-K245 HydrophobicContact CG1-CB 4.17Å; I209-K245 HydrophobicContact CG2-CB 4.18Å; I209-V246 HydrophobicContact CB-CG2 4.41Å; I209-V246 HydrophobicContact CG1-CG2 4.34Å; I209-V246 HydrophobicContact CG2-CG2 4.29Å; I209-R249 HydrophobicContact CG2-CB 3.92Å; I209-R249 HydrophobicContact CG2-CG 4.29Å
210	D	98.8	Very high	95.7	Very high	28 Å²	28	63.4 Å²	63.4	15%	0.15	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-42.4	179.3	-167.1	66	0	0	0	111.6	Y206 E207 A213 R214 R249 Y253	Y206-D210 PolarHBondContact O-N 3.47Å; Y206-D210 VanDerWaalsContact O-N 3.08Å; E207-D210 PolarHBondContact O-N 3.46Å; D210-A213 PolarHBondContact O-N 3.3Å; D210-R214 WeakPolarHBondContact O-CG 3.45Å; D210-R214 PolarHBondContact O-N 3.1Å; D210-R214 IonicContact OD2-CZ 3.27Å; D210-R214 IonicContact OD2-NE 2.95Å; D210-R214 PolarHBondContact OD2-NE 2.71Å; D210-R214 IonicContact OD2-NH2 2.73Å; D210-R214 PolarHBondContact OD2-NH2 2.86Å; D210-R249 IonicContact OD1-CZ 3.72Å; D210-R249 IonicContact OD1-NE 2.85Å; D210-R249 PolarHBondContact OD1-NE 3.04Å; D210-R249 IonicContact OD1-NH2 3.53Å; D210-R249 PolarHBondContact OD1-NH2 3.34Å; D210-Y253 PolarHBondContact OD1-OH 2.66Å; D210-Y253 PolarHBondContact OD2-OH 2.91Å
211	Q	98.8	Very high	96.1	Very high	93 Å²	93	60 Å²	60	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-64	-50.3	178.2	-173.4	61.4	55.2	0	0	111.8	E207 L208 A213 R214 D215	E207-Q211 WeakPolarHBondContact O-CB 3.12Å; E207-Q211 PolarHBondContact O-N 2.63Å; L208-Q211 PolarHBondContact O-N 2.83Å; Q211-A213 VanDerWaalsContact C-N 3.28Å; Q211-A213 PolarHBondContact O-N 3.38Å; Q211-R214 PolarHBondContact O-N 3.26Å; Q211-D215 PolarHBondContact NE2-OD1 2.91Å; Q211-D215 WeakPolarHBondContact O-CB 3.27Å; Q211-D215 PolarHBondContact O-N 3.43Å
212	D	98.8	Very high	96.8	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.011	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-36.3	178.8	-76.5	-23	0	0	0	111.1	L208 D215 L216 I234 R238 H242 V246	L208-D212 WeakPolarHBondContact O-CB 3.38Å; L208-D212 PolarHBondContact O-N 2.8Å; D212-D215 PolarHBondContact O-N 3.47Å; D212-L216 WeakPolarHBondContact O-CB 3.35Å; D212-L216 VanDerWaalsContact O-CG 3.29Å; D212-L216 WeakPolarHBondContact O-CG 3.35Å; D212-L216 PolarHBondContact O-N 2.79Å; D212-I234 HydrophobicContact CB-CD1 4.32Å; D212-I234 HydrophobicContact CB-CG2 4.13Å; D212-R238 IonicContact OD1-CZ 2.66Å; D212-R238 IonicContact OD1-NE 3.33Å; D212-R238 IonicContact OD1-NH2 3.71Å; D212-R238 PolarHBondContact OD1-NH2 3.33Å; D212-R238 WeakPolarHBondContact OD2-CD 3.31Å; D212-R238 IonicContact OD2-CZ 3Å; D212-R238 IonicContact OD2-NE 3.6Å; D212-R238 PolarHBondContact OD2-NE 3.3Å; D212-R238 IonicContact OD2-NH2 2.69Å; D212-H242 IonicContact OD2-CD2 3.28Å; D212-H242 IonicContact OD2-CE1 2.75Å; D212-H242 IonicContact OD2-NE2 3.71Å; D212-H242 PolarHBondContact OD2-NE2 3.36Å; D212-V246 HydrophobicContact CB-CG1 4.05Å; D212-V246 HydrophobicContact CB-CG2 3.89Å
213	A	98.8	Very high	97.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-42.5	175.7	0	0	0	0	0	112.2	I209 D210 Q211 Y217 V246 R249 Y253	I209-A213 VanDerWaalsContact O-CB 3.27Å; I209-A213 WeakPolarHBondContact O-CB 3.31Å; I209-A213 PolarHBondContact O-N 3.47Å; D210-A213 PolarHBondContact O-N 3.3Å; Q211-A213 VanDerWaalsContact C-N 3.28Å; Q211-A213 PolarHBondContact O-N 3.38Å; A213-Y217 PolarHBondContact O-N 2.78Å; A213-V246 HydrophobicContact CB-CG1 4.24Å; A213-R249 HydrophobicContact CB-CB 3.94Å; A213-R249 HydrophobicContact CB-CG 3.7Å; A213-Y253 HydrophobicContact CB-CD2 4.17Å; A213-Y253 HydrophobicContact CB-CE2 4.19Å
214	R	98.6	Very high	97.6	Very high	107 Å²	107	67.6 Å²	67.6	40%	0.404	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-46.4	172.7	-71.4	178.8	-168.8	-178.2	10.7	111.4	D210 Q211 L216 Y217 D218 Y253	D210-R214 WeakPolarHBondContact O-CG 3.45Å; D210-R214 PolarHBondContact O-N 3.1Å; D210-R214 IonicContact OD2-CZ 3.27Å; D210-R214 IonicContact OD2-NE 2.95Å; D210-R214 PolarHBondContact OD2-NE 2.71Å; D210-R214 IonicContact OD2-NH2 2.73Å; D210-R214 PolarHBondContact OD2-NH2 2.86Å; Q211-R214 PolarHBondContact O-N 3.26Å; R214-L216 VanDerWaalsContact C-N 3.32Å; R214-L216 PolarHBondContact O-N 2.89Å; R214-Y217 WeakPolarHBondContact O-CB 3.46Å; R214-Y217 PolarHBondContact O-N 2.68Å; R214-D218 WeakPolarHBondContact O-CB 3.47Å; R214-D218 PolarHBondContact O-N 2.99Å; R214-Y253 HydrophobicContact CG-CD1 4.06Å; R214-Y253 HydrophobicContact CG-CD2 4.11Å; R214-Y253 HydrophobicContact CG-CE1 3.6Å; R214-Y253 HydrophobicContact CG-CE2 3.63Å; R214-Y253 HydrophobicContact CG-CG 4.31Å; R214-Y253 PolarHBondContact NE-OH 2.79Å; R214-Y253 PolarHBondContact NH2-OH 3.46Å
215	D	98.8	Very high	97.5	Very high	33 Å²	33	66.3 Å²	66.3	18%	0.176	31%	0.311	C	S	.	.	H	α-helix	trans	-59.1	-42.2	-179.9	-87.7	26	0	0	0	111.4	Q211 D212 Y217 A219 K230 I234	Q211-D215 PolarHBondContact NE2-OD1 2.91Å; Q211-D215 WeakPolarHBondContact O-CB 3.27Å; Q211-D215 PolarHBondContact O-N 3.43Å; D212-D215 PolarHBondContact O-N 3.47Å; D215-Y217 VanDerWaalsContact C-N 3.32Å; D215-Y217 PolarHBondContact O-N 2.78Å; D215-A219 WeakPolarHBondContact O-CB 3.37Å; D215-A219 PolarHBondContact O-N 3.07Å; D215-K230 HydrophobicContact CB-CD 4.28Å; D215-K230 IonicContact OD2-NZ 2.72Å; D215-K230 PolarHBondContact OD2-NZ 2.99Å; D215-I234 HydrophobicContact CB-CD1 3.71Å
216	L	98.8	Very high	97.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63	-37.6	175.2	-73.6	175.4	0	0	0	112.2	D212 R214 G220 W231 I234 M235 V246 F247 Y250 M258	D212-L216 WeakPolarHBondContact O-CB 3.35Å; D212-L216 VanDerWaalsContact O-CG 3.29Å; D212-L216 WeakPolarHBondContact O-CG 3.35Å; D212-L216 PolarHBondContact O-N 2.79Å; R214-L216 VanDerWaalsContact C-N 3.32Å; R214-L216 PolarHBondContact O-N 2.89Å; L216-G220 PolarHBondContact O-N 3.13Å; L216-W231 HydrophobicContact CD2-CB 4.48Å; L216-W231 HydrophobicContact CD2-CG 3.99Å; L216-W231 PolarHBondContact O-NE1 3.15Å; L216-I234 HydrophobicContact CD1-CG2 4.24Å; L216-I234 HydrophobicContact CD2-CB 4.23Å; L216-I234 HydrophobicContact CD2-CD1 4.06Å; L216-I234 HydrophobicContact CD2-CG2 4.24Å; L216-I234 HydrophobicContact CG-CD1 4.03Å; L216-I234 HydrophobicContact CG-CG2 4.26Å; L216-M235 HydrophobicContact CD1-CE 4.4Å; L216-M235 HydrophobicContact CD2-CE 3.83Å; L216-V246 HydrophobicContact CD1-CG1 3.66Å; L216-F247 HydrophobicContact CD1-CD1 4.41Å; L216-F247 HydrophobicContact CD1-CE1 4.14Å; L216-Y250 HydrophobicContact CB-CD2 3.96Å; L216-Y250 HydrophobicContact CB-CE2 3.94Å; L216-M258 HydrophobicContact CD1-SD 4.09Å
217	Y	98.7	Very high	97.6	Very high	52 Å²	52	58.9 Å²	58.9	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-71.7	-47	178.2	174.6	-114.3	0	0	0	111.6	A213 R214 D215 A219 G220 V221 K222	A213-Y217 PolarHBondContact O-N 2.78Å; R214-Y217 WeakPolarHBondContact O-CB 3.46Å; R214-Y217 PolarHBondContact O-N 2.68Å; D215-Y217 VanDerWaalsContact C-N 3.32Å; D215-Y217 PolarHBondContact O-N 2.78Å; Y217-A219 VanDerWaalsContact C-N 3.27Å; Y217-A219 PolarHBondContact O-N 3.39Å; Y217-G220 CarbonylContact O-C 3.55Å; Y217-G220 PolarHBondContact O-N 3.4Å; Y217-G220 VanDerWaalsContact O-N 3.15Å; Y217-V221 HydrophobicContact CD2-CB 3.97Å; Y217-V221 HydrophobicContact CD2-CG1 4.45Å; Y217-V221 HydrophobicContact CE2-CB 3.85Å; Y217-V221 HydrophobicContact CE2-CG1 3.87Å; Y217-V221 PolarHBondContact O-N 2.99Å; Y217-K222 HydrophobicContact CD1-CB 4Å; Y217-K222 HydrophobicContact CD1-CD 3.98Å; Y217-K222 HydrophobicContact CD1-CG 4.39Å; Y217-K222 HydrophobicContact CE1-CB 3.7Å; Y217-K222 HydrophobicContact CE1-CD 3.74Å; Y217-K222 HydrophobicContact CE1-CG 3.83Å; Y217-K222 HydrophobicContact CE2-CB 4.24Å; Y217-K222 HydrophobicContact CG-CB 4.42Å; Y217-K222 WeakPolarHBondContact O-CB 3.41Å; Y217-K222 PolarHBondContact O-N 2.87Å; Y217-K222 VanDerWaalsContact O-N 3.13Å
218	D	98.6	Very high	97.6	Very high	66 Å²	66	51.6 Å²	51.6	35%	0.353	25%	0.25	S	S	.	.	H	α-helix	trans	-63.6	-33.1	178.1	-78	23.6	0	0	0	111.9	R214 K222 R223	R214-D218 WeakPolarHBondContact O-CB 3.47Å; R214-D218 PolarHBondContact O-N 2.99Å; D218-K222 HydrophobicContact CB-CD 4.25Å; D218-K222 WeakPolarHBondContact OD1-CD 3.07Å; D218-K222 WeakPolarHBondContact OD1-CE 3.27Å; D218-K222 IonicContact OD1-NZ 2.79Å; D218-K222 PolarHBondContact OD1-NZ 3.16Å; D218-K222 IonicContact OD2-NZ 3.17Å; D218-K222 PolarHBondContact OD2-NZ 3.13Å; D218-R223 WeakPolarHBondContact O-CD 3.17Å; D218-R223 VanDerWaalsContact O-CG 3.27Å; D218-R223 WeakPolarHBondContact O-CG 3.39Å
219	A	98.3	Very high	97.6	Very high	6 Å²	6	52.3 Å²	52.3	5%	0.05	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.4	176	0	0	0	0	0	114.4	D215 Y217 T226 D227 K230	D215-A219 WeakPolarHBondContact O-CB 3.37Å; D215-A219 PolarHBondContact O-N 3.07Å; Y217-A219 VanDerWaalsContact C-N 3.27Å; Y217-A219 PolarHBondContact O-N 3.39Å; A219-T226 CarbonylContact O-C 3.44Å; A219-T226 WeakPolarHBondContact O-CA 3.37Å; A219-T226 WeakPolarHBondContact O-CG2 3.27Å; A219-D227 HydrophobicContact CB-CB 3.9Å; A219-D227 PolarHBondContact O-N 3.38Å; A219-K230 HydrophobicContact CB-CB 4.04Å; A219-K230 HydrophobicContact CB-CG 3.87Å
220	G	97.8	Very high	97.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129	-105.8	-179.1	0	0	0	0	0	111.8	L216 Y217 K222 R223 E265	L216-G220 PolarHBondContact O-N 3.13Å; Y217-G220 CarbonylContact O-C 3.55Å; Y217-G220 PolarHBondContact O-N 3.4Å; Y217-G220 VanDerWaalsContact O-N 3.15Å; G220-K222 PolarHBondContact O-N 3.33Å; G220-R223 WeakPolarHBondContact O-CG 3.5Å; G220-R223 PolarHBondContact O-N 3.41Å; G220-E265 WeakPolarHBondContact CA-OE2 3.31Å
221	V	97.4	Very high	97.6	Very high	32 Å²	32	54 Å²	54	19%	0.194	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-32.1	-169.3	179.7	0	0	0	0	114.9	Y217 R223 P255 Y256 S261 E265	Y217-V221 HydrophobicContact CD2-CB 3.97Å; Y217-V221 HydrophobicContact CD2-CG1 4.45Å; Y217-V221 HydrophobicContact CE2-CB 3.85Å; Y217-V221 HydrophobicContact CE2-CG1 3.87Å; Y217-V221 PolarHBondContact O-N 2.99Å; V221-R223 VanDerWaalsContact C-N 3.3Å; V221-R223 PolarHBondContact O-N 3.09Å; V221-P255 HydrophobicContact CG1-CG 4.34Å; V221-Y256 HydrophobicContact CG1-CD2 4.14Å; V221-Y256 HydrophobicContact CG1-CE2 4.23Å; V221-Y256 HydrophobicContact CG2-CD2 4.29Å; V221-S261 VanDerWaalsContact CG2-OG 3.31Å; V221-S261 WeakPolarHBondContact CG2-OG 3.21Å; V221-E265 HydrophobicContact CG2-CG 4.4Å
222	K	97.3	Very high	97.6	Very high	119 Å²	119	50.2 Å²	50.2	52%	0.517	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.8	-179	-169.3	179.4	-179.9	-178.8	0	113.9	Y217 D218 G220	Y217-K222 HydrophobicContact CD1-CB 4Å; Y217-K222 HydrophobicContact CD1-CD 3.98Å; Y217-K222 HydrophobicContact CD1-CG 4.39Å; Y217-K222 HydrophobicContact CE1-CB 3.7Å; Y217-K222 HydrophobicContact CE1-CD 3.74Å; Y217-K222 HydrophobicContact CE1-CG 3.83Å; Y217-K222 HydrophobicContact CE2-CB 4.24Å; Y217-K222 HydrophobicContact CG-CB 4.42Å; Y217-K222 WeakPolarHBondContact O-CB 3.41Å; Y217-K222 PolarHBondContact O-N 2.87Å; Y217-K222 VanDerWaalsContact O-N 3.13Å; D218-K222 HydrophobicContact CB-CD 4.25Å; D218-K222 WeakPolarHBondContact OD1-CD 3.07Å; D218-K222 WeakPolarHBondContact OD1-CE 3.27Å; D218-K222 IonicContact OD1-NZ 2.79Å; D218-K222 PolarHBondContact OD1-NZ 3.16Å; D218-K222 IonicContact OD2-NZ 3.17Å; D218-K222 PolarHBondContact OD2-NZ 3.13Å; G220-K222 PolarHBondContact O-N 3.33Å
223	R	96	Very high	97.6	Very high	128 Å²	128	51.9 Å²	51.9	48%	0.483	26%	0.259	S	S	.	.	S	Bend	trans	-120.3	166.6	-171.8	56.2	171.5	-68.6	165.5	1.6	111.4	D218 G220 V221 G225	D218-R223 WeakPolarHBondContact O-CD 3.17Å; D218-R223 VanDerWaalsContact O-CG 3.27Å; D218-R223 WeakPolarHBondContact O-CG 3.39Å; G220-R223 WeakPolarHBondContact O-CG 3.5Å; G220-R223 PolarHBondContact O-N 3.41Å; V221-R223 VanDerWaalsContact C-N 3.3Å; V221-R223 PolarHBondContact O-N 3.09Å; R223-G225 WeakPolarHBondContact CD-O 3.36Å; R223-G225 VanDerWaalsContact CG-O 3.3Å; R223-G225 WeakPolarHBondContact CG-O 3.38Å; R223-G225 PolarHBondContact NE-O 3.29Å
224	K	93.1	Very high	97.6	Very high	204 Å²	204	51.9 Å²	51.9	89%	0.887	26%	0.259	S	S	*	.	S	Bend	trans	-80.4	120.4	168.6	-71.9	-173.8	178.4	-179.3	0	109.3
225	G	92.4	Very high	97.6	Very high	47 Å²	47	46.8 Å²	46.8	49%	0.485	24%	0.24	S	C	.	.	S	Bend	trans	70.6	163.8	-176.1	0	0	0	0	0	112.7	R223	R223-G225 WeakPolarHBondContact CD-O 3.36Å; R223-G225 VanDerWaalsContact CG-O 3.3Å; R223-G225 WeakPolarHBondContact CG-O 3.38Å; R223-G225 PolarHBondContact NE-O 3.29Å
226	T	96.1	Very high	97.6	Very high	32 Å²	32	45.8 Å²	45.8	20%	0.196	24%	0.235	C	C	.	.			trans	-107.8	135.7	-165.1	-39.7	0	0	0	0	112.4	A219 V228 W231 E265 V266	A219-T226 CarbonylContact O-C 3.44Å; A219-T226 WeakPolarHBondContact O-CA 3.37Å; A219-T226 WeakPolarHBondContact O-CG2 3.27Å; T226-V228 VanDerWaalsContact C-N 3.26Å; T226-V228 HydrophobicContact CG2-CG2 4.16Å; T226-V228 PolarHBondContact O-N 2.99Å; T226-V228 VanDerWaalsContact O-N 3.11Å; T226-W231 HydrophobicContact CG2-CD2 4.17Å; T226-W231 HydrophobicContact CG2-CE3 4.34Å; T226-W231 HydrophobicContact CG2-CH2 4.4Å; T226-W231 HydrophobicContact CG2-CZ2 4.23Å; T226-W231 HydrophobicContact CG2-CZ3 4.43Å; T226-E265 HydrophobicContact CG2-CB 4.15Å; T226-E265 WeakPolarHBondContact OG1-CB 3.37Å; T226-E265 PolarHBondContact OG1-O 3.46Å; T226-E265 PolarHBondContact OG1-OE2 3.07Å; T226-V266 HydrophobicContact CG2-CG1 4.45Å
227	D	98	Very high	97.6	Very high	57 Å²	57	50.2 Å²	50.2	31%	0.305	26%	0.255	S	S	.	.			trans	-80.9	77.7	164	-174	-14.2	0	0	0	109.2	A219 P229 K230 W231	A219-D227 HydrophobicContact CB-CB 3.9Å; A219-D227 PolarHBondContact O-N 3.38Å; D227-P229 VanDerWaalsContact OD1-CD 3.31Å; D227-P229 WeakPolarHBondContact OD1-CD 3.4Å; D227-K230 HydrophobicContact CB-CB 4.33Å; D227-K230 PolarHBondContact O-N 2.91Å; D227-K230 PolarHBondContact OD1-N 3.46Å; D227-W231 PolarHBondContact O-N 2.86Å
228	V	98.3	Very high	97.5	Very high	10 Å²	10	50.4 Å²	50.4	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-41.6	-179.7	178.6	0	0	0	0	112.6	D184 T226 K230 W231 I232 V266 L270 F274	D184-V228 HydrophobicContact CB-CB 4.49Å; D184-V228 HydrophobicContact CB-CG1 3.65Å; T226-V228 VanDerWaalsContact C-N 3.26Å; T226-V228 HydrophobicContact CG2-CG2 4.16Å; T226-V228 PolarHBondContact O-N 2.99Å; T226-V228 VanDerWaalsContact O-N 3.11Å; V228-K230 VanDerWaalsContact C-N 3.29Å; V228-K230 PolarHBondContact O-N 3.35Å; V228-W231 WeakPolarHBondContact O-CB 3.43Å; V228-W231 PolarHBondContact O-N 3.4Å; V228-W231 VanDerWaalsContact O-N 3.13Å; V228-I232 HydrophobicContact CG1-CD1 3.89Å; V228-I232 HydrophobicContact CG1-CG1 4.1Å; V228-I232 WeakPolarHBondContact O-CG1 3.41Å; V228-I232 PolarHBondContact O-N 2.89Å; V228-V266 HydrophobicContact CG2-CG1 4.08Å; V228-L270 HydrophobicContact CG1-CD1 4.26Å; V228-L270 HydrophobicContact CG1-CD2 3.87Å; V228-L270 HydrophobicContact CG2-CD2 4.05Å; V228-F274 HydrophobicContact CG1-CE2 4.13Å; V228-F274 HydrophobicContact CG1-CZ 4.36Å
229	P	98.6	Very high	97.5	Very high	72 Å²	72	47.9 Å²	47.9	47%	0.468	24%	0.243	S	C	.	.	H	α-helix	trans	-54.3	-41	175.2	-28.8	36	0	0	0	114.1	D227 I232 S233	D227-P229 VanDerWaalsContact OD1-CD 3.31Å; D227-P229 WeakPolarHBondContact OD1-CD 3.4Å; P229-I232 PolarHBondContact O-N 3.48Å; P229-S233 PolarHBondContact O-N 3.24Å
230	K	98.6	Very high	97.5	Very high	74 Å²	74	50.2 Å²	50.2	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-43.3	176.1	176.6	60.7	69.9	150.3	0	111.8	D215 A219 D227 V228 S233 I234	D215-K230 HydrophobicContact CB-CD 4.28Å; D215-K230 IonicContact OD2-NZ 2.72Å; D215-K230 PolarHBondContact OD2-NZ 2.99Å; A219-K230 HydrophobicContact CB-CB 4.04Å; A219-K230 HydrophobicContact CB-CG 3.87Å; D227-K230 HydrophobicContact CB-CB 4.33Å; D227-K230 PolarHBondContact O-N 2.91Å; D227-K230 PolarHBondContact OD1-N 3.46Å; V228-K230 VanDerWaalsContact C-N 3.29Å; V228-K230 PolarHBondContact O-N 3.35Å; K230-S233 PolarHBondContact O-N 2.91Å; K230-I234 HydrophobicContact CD-CD1 3.76Å; K230-I234 HydrophobicContact CD-CG1 4.17Å; K230-I234 HydrophobicContact CG-CD1 4.2Å; K230-I234 PolarHBondContact O-N 2.95Å; K230-I234 VanDerWaalsContact O-N 3.11Å
231	W	98.7	Very high	97.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-44.7	174.4	-81.1	22.2	0	0	0	112.3	L216 T226 D227 V228 M235 M258 I262 E265 F274	L216-W231 HydrophobicContact CD2-CB 4.48Å; L216-W231 HydrophobicContact CD2-CG 3.99Å; L216-W231 PolarHBondContact O-NE1 3.15Å; T226-W231 HydrophobicContact CG2-CD2 4.17Å; T226-W231 HydrophobicContact CG2-CE3 4.34Å; T226-W231 HydrophobicContact CG2-CH2 4.4Å; T226-W231 HydrophobicContact CG2-CZ2 4.23Å; T226-W231 HydrophobicContact CG2-CZ3 4.43Å; D227-W231 PolarHBondContact O-N 2.86Å; V228-W231 WeakPolarHBondContact O-CB 3.43Å; V228-W231 PolarHBondContact O-N 3.4Å; V228-W231 VanDerWaalsContact O-N 3.13Å; W231-M235 HydrophobicContact CD2-CE 4.33Å; W231-M235 HydrophobicContact CE3-CE 4.4Å; W231-M235 HydrophobicContact CG-CE 4.47Å; W231-M235 WeakPolarHBondContact O-CB 3.47Å; W231-M235 WeakPolarHBondContact O-CG 3.4Å; W231-M235 PolarHBondContact O-N 2.85Å; W231-M258 HydrophobicContact CD2-CE 4.49Å; W231-M258 HydrophobicContact CE3-CE 4.48Å; W231-M258 HydrophobicContact CH2-CE 3.6Å; W231-M258 HydrophobicContact CZ2-CE 3.57Å; W231-M258 HydrophobicContact CZ3-CE 4.08Å; W231-I262 HydrophobicContact CE3-CG1 4.28Å; W231-I262 HydrophobicContact CH2-CG1 3.99Å; W231-I262 HydrophobicContact CZ3-CB 4.22Å; W231-I262 HydrophobicContact CZ3-CG1 3.49Å; W231-I262 VanDerWaalsContact CZ3-CG1 3.49Å; W231-E265 HydrophobicContact CH2-CB 3.69Å; W231-E265 HydrophobicContact CH2-CG 3.88Å; W231-E265 HydrophobicContact CZ2-CB 4.4Å; W231-E265 HydrophobicContact CZ2-CG 4.22Å; W231-E265 HydrophobicContact CZ3-CB 4.23Å; W231-F274 HydrophobicContact CB-CE1 4.11Å; W231-F274 HydrophobicContact CB-CZ 3.79Å; W231-F274 HydrophobicContact CE3-CD2 4.38Å; W231-F274 HydrophobicContact CE3-CE2 4.2Å; W231-F274 HydrophobicContact CE3-CZ 4.32Å
232	I	98.8	Very high	97.5	Very high	13 Å²	13	51.1 Å²	51.1	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-49.5	176.7	-66.7	176.4	0	0	0	110.2	D184 K187 L188 A191 V228 P229 I234 M235 T236 F274	D184-I232 HydrophobicContact CB-CD1 4.49Å; K187-I232 HydrophobicContact CB-CD1 3.83Å; L188-I232 HydrophobicContact CB-CD1 4.02Å; L188-I232 HydrophobicContact CB-CG1 4.14Å; L188-I232 HydrophobicContact CD1-CG1 4.28Å; L188-I232 HydrophobicContact CD1-CG2 4.36Å; A191-I232 HydrophobicContact CB-CG2 4Å; V228-I232 HydrophobicContact CG1-CD1 3.89Å; V228-I232 HydrophobicContact CG1-CG1 4.1Å; V228-I232 WeakPolarHBondContact O-CG1 3.41Å; V228-I232 PolarHBondContact O-N 2.89Å; P229-I232 PolarHBondContact O-N 3.48Å; I232-I234 PolarHBondContact O-N 3.3Å; I232-M235 PolarHBondContact O-N 3.42Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 VanDerWaalsContact O-CB 3.31Å; I232-T236 WeakPolarHBondContact O-CB 3.21Å; I232-T236 VanDerWaalsContact O-CG2 3.24Å; I232-T236 WeakPolarHBondContact O-CG2 3.49Å; I232-T236 PolarHBondContact O-N 2.91Å; I232-T236 PolarHBondContact O-OG1 3Å; I232-F274 HydrophobicContact CG1-CE1 4.42Å; I232-F274 HydrophobicContact CG1-CZ 3.74Å
233	S	98.6	Very high	97.6	Very high	37 Å²	37	45.5 Å²	45.5	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-57.5	-53.8	-178.2	176.5	0	0	0	0	111.5	P229 K230 M235 T236 E237	P229-S233 PolarHBondContact O-N 3.24Å; K230-S233 PolarHBondContact O-N 2.91Å; S233-M235 PolarHBondContact O-N 3.33Å; S233-T236 PolarHBondContact O-N 3.28Å; S233-E237 WeakPolarHBondContact CA-OE1 3.46Å; S233-E237 WeakPolarHBondContact CB-OE1 3.37Å; S233-E237 WeakPolarHBondContact O-CB 3.45Å; S233-E237 WeakPolarHBondContact O-CG 3.31Å; S233-E237 PolarHBondContact O-N 2.98Å; S233-E237 VanDerWaalsContact OG-CD 3.24Å; S233-E237 PolarHBondContact OG-OE1 3.46Å; S233-E237 PolarHBondContact OG-OE2 3.23Å
234	I	98.7	Very high	97.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-51.1	-179.2	-66.2	173.6	0	0	0	111.1	D212 D215 L216 K230 I232 T236 R238 L243	D212-I234 HydrophobicContact CB-CD1 4.32Å; D212-I234 HydrophobicContact CB-CG2 4.13Å; D215-I234 HydrophobicContact CB-CD1 3.71Å; L216-I234 HydrophobicContact CD1-CG2 4.24Å; L216-I234 HydrophobicContact CD2-CB 4.23Å; L216-I234 HydrophobicContact CD2-CD1 4.06Å; L216-I234 HydrophobicContact CD2-CG2 4.24Å; L216-I234 HydrophobicContact CG-CD1 4.03Å; L216-I234 HydrophobicContact CG-CG2 4.26Å; K230-I234 HydrophobicContact CD-CD1 3.76Å; K230-I234 HydrophobicContact CD-CG1 4.17Å; K230-I234 HydrophobicContact CG-CD1 4.2Å; K230-I234 PolarHBondContact O-N 2.95Å; K230-I234 VanDerWaalsContact O-N 3.11Å; I232-I234 PolarHBondContact O-N 3.3Å; I234-T236 VanDerWaalsContact C-N 3.28Å; I234-T236 PolarHBondContact O-N 2.67Å; I234-R238 HydrophobicContact CG2-CG 4.27Å; I234-R238 WeakPolarHBondContact O-CB 3.48Å; I234-R238 WeakPolarHBondContact O-CG 3.42Å; I234-R238 PolarHBondContact O-N 3.19Å; I234-L243 HydrophobicContact CG2-CD2 3.91Å
235	M	98.6	Very high	97.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-74.6	-14.6	-171.8	-63.4	-170.8	-169.5	0	0	114.1	R197 L216 W231 I232 S233 F247 M258 F274 L277 V278	R197-M235 VanDerWaalsContact CZ-O 3.29Å; R197-M235 PolarHBondContact NH1-O 2.75Å; R197-M235 PolarHBondContact NH2-O 3.28Å; L216-M235 HydrophobicContact CD1-CE 4.4Å; L216-M235 HydrophobicContact CD2-CE 3.83Å; W231-M235 HydrophobicContact CD2-CE 4.33Å; W231-M235 HydrophobicContact CE3-CE 4.4Å; W231-M235 HydrophobicContact CG-CE 4.47Å; W231-M235 WeakPolarHBondContact O-CB 3.47Å; W231-M235 WeakPolarHBondContact O-CG 3.4Å; W231-M235 PolarHBondContact O-N 2.85Å; I232-M235 PolarHBondContact O-N 3.42Å; S233-M235 PolarHBondContact O-N 3.33Å; M235-F247 HydrophobicContact CE-CE1 4.24Å; M235-F247 HydrophobicContact CG-CZ 4.43Å; M235-F247 HydrophobicContact SD-CZ 4.45Å; M235-M258 HydrophobicContact CE-CE 3.73Å; M235-M258 HydrophobicContact CE-CG 4.02Å; M235-M258 HydrophobicContact CE-SD 3.64Å; M235-F274 HydrophobicContact SD-CD1 3.57Å; M235-F274 VanDerWaalsContact SD-CD1 3.57Å; M235-F274 HydrophobicContact SD-CE1 3.76Å; M235-L277 HydrophobicContact CB-CD2 3.89Å; M235-V278 HydrophobicContact CE-CG2 4.46Å; M235-V278 HydrophobicContact SD-CG2 4.06Å
236	T	98.4	Very high	98.2	Very high	12 Å²	12	34.4 Å²	34.4	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-104.1	-26.5	178	64.7	0	0	0	0	113.7	L188 A191 L192 I232 S233 I234	L188-T236 HydrophobicContact CD1-CG2 3.56Å; A191-T236 HydrophobicContact CB-CG2 3.96Å; L192-T236 HydrophobicContact CD2-CG2 3.7Å; L192-T236 HydrophobicContact CG-CG2 3.81Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 VanDerWaalsContact O-CB 3.31Å; I232-T236 WeakPolarHBondContact O-CB 3.21Å; I232-T236 VanDerWaalsContact O-CG2 3.24Å; I232-T236 WeakPolarHBondContact O-CG2 3.49Å; I232-T236 PolarHBondContact O-N 2.91Å; I232-T236 PolarHBondContact O-OG1 3Å; S233-T236 PolarHBondContact O-N 3.28Å; I234-T236 VanDerWaalsContact C-N 3.28Å; I234-T236 PolarHBondContact O-N 2.67Å
237	E	97.8	Very high	98.4	Very high	93 Å²	93	33 Å²	33	44%	0.435	17%	0.171	S	C	.	.	H	α-helix	trans	-95.1	-32.7	-175.3	-63.5	167.3	-150.6	0	0	113.6	A198 S233	A198-E237 WeakPolarHBondContact CB-O 3.31Å; A198-E237 PolarHBondContact N-O 2.87Å; S233-E237 WeakPolarHBondContact CA-OE1 3.46Å; S233-E237 WeakPolarHBondContact CB-OE1 3.37Å; S233-E237 WeakPolarHBondContact O-CB 3.45Å; S233-E237 WeakPolarHBondContact O-CG 3.31Å; S233-E237 PolarHBondContact O-N 2.98Å; S233-E237 VanDerWaalsContact OG-CD 3.24Å; S233-E237 PolarHBondContact OG-OE1 3.46Å; S233-E237 PolarHBondContact OG-OE2 3.23Å
238	R	98.1	Very high	98.4	Very high	55 Å²	55	34.9 Å²	34.9	21%	0.208	18%	0.181	C	C	.	.	S	Bend	trans	-77	149.9	-177.3	-62.2	-63.4	-177.2	-85.9	-10.9	112.7	R197 D212 I234 L243	R197-R238 WeakPolarHBondContact CD-O 3.26Å; R197-R238 WeakPolarHBondContact CG-O 3.26Å; R197-R238 PolarHBondContact NH1-O 3.28Å; D212-R238 IonicContact OD1-CZ 2.66Å; D212-R238 IonicContact OD1-NE 3.33Å; D212-R238 IonicContact OD1-NH2 3.71Å; D212-R238 PolarHBondContact OD1-NH2 3.33Å; D212-R238 WeakPolarHBondContact OD2-CD 3.31Å; D212-R238 IonicContact OD2-CZ 3Å; D212-R238 IonicContact OD2-NE 3.6Å; D212-R238 PolarHBondContact OD2-NE 3.3Å; D212-R238 IonicContact OD2-NH2 2.69Å; I234-R238 HydrophobicContact CG2-CG 4.27Å; I234-R238 WeakPolarHBondContact O-CB 3.48Å; I234-R238 WeakPolarHBondContact O-CG 3.42Å; I234-R238 PolarHBondContact O-N 3.19Å; R238-L243 HydrophobicContact CB-CD1 4.09Å; R238-L243 HydrophobicContact CB-CD2 3.75Å; R238-L243 HydrophobicContact CB-CG 3.66Å; R238-L243 HydrophobicContact CG-CD2 4.21Å
239	S	98.1	Very high	98.4	Very high	13 Å²	13	39.3 Å²	39.3	9%	0.091	20%	0.197	C	C	.	.			trans	-61.2	153.8	176.2	78.2	0	0	0	0	111.6	A198 H242 L243	A198-S239 VanDerWaalsContact O-CA 3.27Å; A198-S239 WeakPolarHBondContact O-CA 3.48Å; A198-S239 WeakPolarHBondContact O-CB 3.22Å; S239-H242 WeakPolarHBondContact O-CB 3.02Å; S239-H242 PolarHBondContact O-N 3.17Å; S239-H242 VanDerWaalsContact OG-CB 3.31Å; S239-H242 WeakPolarHBondContact OG-CB 3.38Å; S239-H242 PolarHBondContact OG-N 3.2Å; S239-L243 WeakPolarHBondContact O-CG 3.42Å; S239-L243 PolarHBondContact O-N 2.61Å
240	V	97.2	Very high	98.4	Very high	55 Å²	55	35.9 Å²	35.9	33%	0.333	18%	0.175	S	C	.	.	H	α-helix	trans	-59.2	-46.5	178.2	170.8	0	0	0	0	111.5	H242 L243 Q244 I281	V240-H242 VanDerWaalsContact C-N 3.28Å; V240-H242 PolarHBondContact O-N 3.43Å; V240-L243 PolarHBondContact O-N 3.23Å; V240-Q244 WeakPolarHBondContact O-CG 3.16Å; V240-Q244 PolarHBondContact O-N 3.25Å; V240-I281 HydrophobicContact CG1-CG2 4.25Å
241	P	97.6	Very high	98.4	Very high	33 Å²	33	37.2 Å²	37.2	21%	0.214	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-26.1	179.6	-26	40.3	0	0	0	114.3	D200 K245	D200-P241 HydrophobicContact CB-CG 4.15Å; D200-P241 WeakPolarHBondContact OD1-CB 3.27Å; D200-P241 WeakPolarHBondContact OD1-CG 3.17Å; P241-K245 PolarHBondContact O-NZ 2.89Å
242	H	98.4	Very high	98.4	Very high	19 Å²	19	40.4 Å²	40.4	9%	0.088	20%	0.203	C	C	.	.	H	α-helix	trans	-67.9	-52	169	178.2	87	0	0	0	110.9	I209 D212 S239 V240 Q244 K245 V246	I209-H242 VanDerWaalsContact CG1-CE1 3.49Å; I209-H242 WeakPolarHBondContact CG1-CE1 3.5Å; D212-H242 IonicContact OD2-CD2 3.28Å; D212-H242 IonicContact OD2-CE1 2.75Å; D212-H242 IonicContact OD2-NE2 3.71Å; D212-H242 PolarHBondContact OD2-NE2 3.36Å; S239-H242 WeakPolarHBondContact O-CB 3.02Å; S239-H242 PolarHBondContact O-N 3.17Å; S239-H242 VanDerWaalsContact OG-CB 3.31Å; S239-H242 WeakPolarHBondContact OG-CB 3.38Å; S239-H242 PolarHBondContact OG-N 3.2Å; V240-H242 VanDerWaalsContact C-N 3.28Å; V240-H242 PolarHBondContact O-N 3.43Å; H242-Q244 VanDerWaalsContact C-N 3.28Å; H242-Q244 PolarHBondContact O-N 2.94Å; H242-K245 WeakPolarHBondContact O-CA 3.32Å; H242-K245 WeakPolarHBondContact O-CB 3.42Å; H242-K245 PolarHBondContact O-N 3.41Å; H242-V246 VanDerWaalsContact CD2-CG2 3.5Å; H242-V246 WeakPolarHBondContact CD2-CG2 3.24Å; H242-V246 VanDerWaalsContact NE2-CG2 3.31Å; H242-V246 WeakPolarHBondContact NE2-CG2 3.2Å; H242-V246 WeakPolarHBondContact O-CG2 3.32Å; H242-V246 PolarHBondContact O-N 3.44Å
243	L	98.6	Very high	98.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-33.7	-177.6	-72.6	172.9	0	0	0	113.2	I234 R238 S239 V240 K245 V246 F247 I281	I234-L243 HydrophobicContact CG2-CD2 3.91Å; R238-L243 HydrophobicContact CB-CD1 4.09Å; R238-L243 HydrophobicContact CB-CD2 3.75Å; R238-L243 HydrophobicContact CB-CG 3.66Å; R238-L243 HydrophobicContact CG-CD2 4.21Å; S239-L243 WeakPolarHBondContact O-CG 3.42Å; S239-L243 PolarHBondContact O-N 2.61Å; V240-L243 PolarHBondContact O-N 3.23Å; L243-K245 VanDerWaalsContact C-N 3.33Å; L243-K245 PolarHBondContact O-N 2.75Å; L243-V246 PolarHBondContact O-N 2.87Å; L243-F247 HydrophobicContact CB-CE2 4.38Å; L243-F247 HydrophobicContact CB-CZ 4.33Å; L243-F247 WeakPolarHBondContact O-CD2 3.34Å; L243-F247 WeakPolarHBondContact O-CG 3.39Å; L243-F247 PolarHBondContact O-N 2.92Å; L243-I281 HydrophobicContact CB-CD1 4.46Å; L243-I281 HydrophobicContact CB-CG2 3.71Å; L243-I281 HydrophobicContact CD1-CD1 3.7Å; L243-I281 HydrophobicContact CD1-CG1 4.46Å
244	Q	98.4	Very high	98.3	Very high	71 Å²	71	41.3 Å²	41.3	33%	0.332	20%	0.202	S	C	.	.	H	α-helix	trans	-56.8	-47	171.4	-73.2	174.5	-22.8	0	0	111.5	V240 H242 F247 D248 I281	V240-Q244 WeakPolarHBondContact O-CG 3.16Å; V240-Q244 PolarHBondContact O-N 3.25Å; H242-Q244 VanDerWaalsContact C-N 3.28Å; H242-Q244 PolarHBondContact O-N 2.94Å; Q244-F247 PolarHBondContact O-N 3.22Å; Q244-D248 PolarHBondContact O-N 3.35Å; Q244-D248 VanDerWaalsContact O-N 3.13Å; Q244-I281 HydrophobicContact CG-CG2 4.04Å; Q244-I281 WeakPolarHBondContact CG-O 3.49Å; Q244-I281 PolarHBondContact NE2-O 3.46Å
245	K	98.6	Very high	98.3	Very high	76 Å²	76	45.8 Å²	45.8	33%	0.33	23%	0.231	S	C	.	.	H	α-helix	trans	-68.7	-37.2	177.5	-62.8	178.3	-173	74	0	112.1	I204 I209 P241 H242 L243 D248 R249	I204-K245 HydrophobicContact CG2-CD 3.93Å; I209-K245 HydrophobicContact CD1-CB 3.72Å; I209-K245 HydrophobicContact CD1-CD 3.62Å; I209-K245 HydrophobicContact CD1-CG 4.32Å; I209-K245 HydrophobicContact CG1-CB 4.17Å; I209-K245 HydrophobicContact CG2-CB 4.18Å; P241-K245 PolarHBondContact O-NZ 2.89Å; H242-K245 WeakPolarHBondContact O-CA 3.32Å; H242-K245 WeakPolarHBondContact O-CB 3.42Å; H242-K245 PolarHBondContact O-N 3.41Å; L243-K245 VanDerWaalsContact C-N 3.33Å; L243-K245 PolarHBondContact O-N 2.75Å; K245-D248 PolarHBondContact O-N 3.33Å; K245-R249 WeakPolarHBondContact O-CB 3.33Å; K245-R249 PolarHBondContact O-N 3.4Å
246	V	98.8	Very high	98.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-45.8	173.2	172	0	0	0	0	110.8	I209 D212 A213 L216 H242 L243 D248 R249 Y250	I209-V246 HydrophobicContact CB-CG2 4.41Å; I209-V246 HydrophobicContact CG1-CG2 4.34Å; I209-V246 HydrophobicContact CG2-CG2 4.29Å; D212-V246 HydrophobicContact CB-CG1 4.05Å; D212-V246 HydrophobicContact CB-CG2 3.89Å; A213-V246 HydrophobicContact CB-CG1 4.24Å; L216-V246 HydrophobicContact CD1-CG1 3.66Å; H242-V246 VanDerWaalsContact CD2-CG2 3.5Å; H242-V246 WeakPolarHBondContact CD2-CG2 3.24Å; H242-V246 VanDerWaalsContact NE2-CG2 3.31Å; H242-V246 WeakPolarHBondContact NE2-CG2 3.2Å; H242-V246 WeakPolarHBondContact O-CG2 3.32Å; H242-V246 PolarHBondContact O-N 3.44Å; L243-V246 PolarHBondContact O-N 2.87Å; V246-D248 VanDerWaalsContact C-N 3.31Å; V246-D248 PolarHBondContact O-N 2.73Å; V246-R249 CarbonylContact O-C 3.46Å; V246-R249 PolarHBondContact O-N 3.08Å; V246-Y250 VanDerWaalsContact O-CB 3.28Å; V246-Y250 WeakPolarHBondContact O-CB 3.49Å; V246-Y250 PolarHBondContact O-N 2.74Å
247	F	98.8	Very high	98.2	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-68.1	-29.6	179.8	-62.6	-21.7	0	0	0	113.2	L216 M235 L243 Q244 M258 V278 I281 Q282	L216-F247 HydrophobicContact CD1-CD1 4.41Å; L216-F247 HydrophobicContact CD1-CE1 4.14Å; M235-F247 HydrophobicContact CE-CE1 4.24Å; M235-F247 HydrophobicContact CG-CZ 4.43Å; M235-F247 HydrophobicContact SD-CZ 4.45Å; L243-F247 HydrophobicContact CB-CE2 4.38Å; L243-F247 HydrophobicContact CB-CZ 4.33Å; L243-F247 WeakPolarHBondContact O-CD2 3.34Å; L243-F247 WeakPolarHBondContact O-CG 3.39Å; L243-F247 PolarHBondContact O-N 2.92Å; Q244-F247 PolarHBondContact O-N 3.22Å; F247-M258 HydrophobicContact CD1-CB 4.15Å; F247-M258 HydrophobicContact CD1-CG 3.82Å; F247-M258 HydrophobicContact CD1-SD 4.26Å; F247-M258 HydrophobicContact CE1-CG 3.82Å; F247-M258 HydrophobicContact CE1-SD 4.22Å; F247-M258 HydrophobicContact CG-CB 4.36Å; F247-M258 HydrophobicContact CG-CG 4.43Å; F247-M258 HydrophobicContact CZ-CG 4.39Å; F247-V278 HydrophobicContact CD2-CG1 4.12Å; F247-V278 HydrophobicContact CE2-CB 4.25Å; F247-V278 HydrophobicContact CE2-CG1 3.85Å; F247-V278 HydrophobicContact CE2-CG2 3.98Å; F247-V278 HydrophobicContact CZ-CG1 4.42Å; F247-V278 HydrophobicContact CZ-CG2 3.81Å; F247-I281 HydrophobicContact CD2-CG2 4.1Å; F247-I281 HydrophobicContact CE2-CB 4.02Å; F247-I281 HydrophobicContact CE2-CD1 4.06Å; F247-I281 HydrophobicContact CE2-CG2 3.59Å; F247-I281 HydrophobicContact CZ-CD1 4.14Å; F247-Q282 HydrophobicContact CD2-CG 4.02Å
248	D	98.4	Very high	98.3	Very high	97 Å²	97	48.5 Å²	48.5	52%	0.519	24%	0.242	S	C	.	.	H	α-helix	trans	-72.8	-42.8	170.7	-75.9	-30	0	0	0	111.9	Q244 K245 V246 Y250 K251	Q244-D248 PolarHBondContact O-N 3.35Å; Q244-D248 VanDerWaalsContact O-N 3.13Å; K245-D248 PolarHBondContact O-N 3.33Å; V246-D248 VanDerWaalsContact C-N 3.31Å; V246-D248 PolarHBondContact O-N 2.73Å; D248-Y250 VanDerWaalsContact C-N 3.33Å; D248-Y250 PolarHBondContact O-N 3.25Å; D248-K251 WeakPolarHBondContact O-CB 3.35Å; D248-K251 PolarHBondContact O-N 2.98Å; D248-K251 IonicContact OD1-NZ 2.71Å; D248-K251 PolarHBondContact OD1-NZ 3.3Å
249	R	98.6	Very high	98.3	Very high	103 Å²	103	47.1 Å²	47.1	39%	0.389	24%	0.238	S	C	.	.	H	α-helix	trans	-66.1	-34.2	175.9	-177.5	54.6	176.5	167.2	-3.4	112.6	I209 D210 A213 K245 V246 K251 S252 Y253	I209-R249 HydrophobicContact CG2-CB 3.92Å; I209-R249 HydrophobicContact CG2-CG 4.29Å; D210-R249 IonicContact OD1-CZ 3.72Å; D210-R249 IonicContact OD1-NE 2.85Å; D210-R249 PolarHBondContact OD1-NE 3.04Å; D210-R249 IonicContact OD1-NH2 3.53Å; D210-R249 PolarHBondContact OD1-NH2 3.34Å; A213-R249 HydrophobicContact CB-CB 3.94Å; A213-R249 HydrophobicContact CB-CG 3.7Å; K245-R249 WeakPolarHBondContact O-CB 3.33Å; K245-R249 PolarHBondContact O-N 3.4Å; V246-R249 CarbonylContact O-C 3.46Å; V246-R249 PolarHBondContact O-N 3.08Å; R249-K251 PolarHBondContact O-N 3.44Å; R249-K251 VanDerWaalsContact O-N 3.12Å; R249-S252 WeakPolarHBondContact CD-OG 3.49Å; R249-S252 PolarHBondContact NE-OG 3.23Å; R249-S252 PolarHBondContact NH1-OG 3.4Å; R249-S252 PolarHBondContact O-N 3.23Å; R249-S252 PolarHBondContact O-OG 2.88Å; R249-Y253 HydrophobicContact CG-CE2 4.2Å; R249-Y253 PolarHBondContact NH2-OH 2.79Å; R249-Y253 VanDerWaalsContact NH2-OH 3.13Å
250	Y	98.8	Very high	98.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-52.7	-35.1	177.5	178.4	-100	0	0	0	112.7	L216 V246 D248 S252 Y253 S254 Y256 M258 S261	L216-Y250 HydrophobicContact CB-CD2 3.96Å; L216-Y250 HydrophobicContact CB-CE2 3.94Å; V246-Y250 VanDerWaalsContact O-CB 3.28Å; V246-Y250 WeakPolarHBondContact O-CB 3.49Å; V246-Y250 PolarHBondContact O-N 2.74Å; D248-Y250 VanDerWaalsContact C-N 3.33Å; D248-Y250 PolarHBondContact O-N 3.25Å; Y250-S252 PolarHBondContact O-N 2.89Å; Y250-S252 VanDerWaalsContact O-N 3.13Å; Y250-Y253 PolarHBondContact O-N 2.77Å; Y250-S254 WeakPolarHBondContact CE1-OG 3.44Å; Y250-S254 VanDerWaalsContact CZ-CB 3.44Å; Y250-S254 PolarHBondContact O-N 3.33Å; Y250-S254 PolarHBondContact OH-OG 3.43Å; Y250-Y256 VanDerWaalsContact CE1-O 3.27Å; Y250-Y256 WeakPolarHBondContact CE1-O 3.13Å; Y250-M258 HydrophobicContact CD1-CB 4.41Å; Y250-M258 HydrophobicContact CD1-SD 4.37Å; Y250-M258 HydrophobicContact CD2-SD 4.41Å; Y250-M258 HydrophobicContact CE1-SD 4.24Å; Y250-M258 HydrophobicContact CE2-SD 4.27Å; Y250-M258 HydrophobicContact CG-SD 4.45Å; Y250-S261 WeakPolarHBondContact CE1-OG 3.48Å; Y250-S261 VanDerWaalsContact OH-CB 3.24Å; Y250-S261 WeakPolarHBondContact OH-CB 3.4Å; Y250-S261 PolarHBondContact OH-OG 3Å
251	K	98.1	Very high	98.4	Very high	102 Å²	102	46.7 Å²	46.7	44%	0.443	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.7	178.9	-59.4	167.1	-174.1	162	0	113.7	D248 R249	D248-K251 WeakPolarHBondContact O-CB 3.35Å; D248-K251 PolarHBondContact O-N 2.98Å; D248-K251 IonicContact OD1-NZ 2.71Å; D248-K251 PolarHBondContact OD1-NZ 3.3Å; R249-K251 PolarHBondContact O-N 3.44Å; R249-K251 VanDerWaalsContact O-N 3.12Å
252	S	98.1	Very high	98.4	Very high	68 Å²	68	45.1 Å²	45.1	48%	0.476	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.3	173.4	67.4	0	0	0	0	114	R249 Y250	R249-S252 WeakPolarHBondContact CD-OG 3.49Å; R249-S252 PolarHBondContact NE-OG 3.23Å; R249-S252 PolarHBondContact NH1-OG 3.4Å; R249-S252 PolarHBondContact O-N 3.23Å; R249-S252 PolarHBondContact O-OG 2.88Å; Y250-S252 PolarHBondContact O-N 2.89Å; Y250-S252 VanDerWaalsContact O-N 3.13Å
253	Y	98.3	Very high	98.4	Very high	59 Å²	59	49 Å²	49	23%	0.231	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-40.4	178.5	-65.4	-70.7	0	0	0	112.2	D210 A213 R214 R249 Y250	D210-Y253 PolarHBondContact OD1-OH 2.66Å; D210-Y253 PolarHBondContact OD2-OH 2.91Å; A213-Y253 HydrophobicContact CB-CD2 4.17Å; A213-Y253 HydrophobicContact CB-CE2 4.19Å; R214-Y253 HydrophobicContact CG-CD1 4.06Å; R214-Y253 HydrophobicContact CG-CD2 4.11Å; R214-Y253 HydrophobicContact CG-CE1 3.6Å; R214-Y253 HydrophobicContact CG-CE2 3.63Å; R214-Y253 HydrophobicContact CG-CG 4.31Å; R214-Y253 PolarHBondContact NE-OH 2.79Å; R214-Y253 PolarHBondContact NH2-OH 3.46Å; R249-Y253 HydrophobicContact CG-CE2 4.2Å; R249-Y253 PolarHBondContact NH2-OH 2.79Å; R249-Y253 VanDerWaalsContact NH2-OH 3.13Å; Y250-Y253 PolarHBondContact O-N 2.77Å
254	S	98	Very high	98.4	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.063	26%	0.255	C	S	.	.			trans	-96.3	142.5	-176.3	177.5	0	0	0	0	112	Y250 Y256 S261	Y250-S254 WeakPolarHBondContact CE1-OG 3.44Å; Y250-S254 VanDerWaalsContact CZ-CB 3.44Å; Y250-S254 PolarHBondContact O-N 3.33Å; Y250-S254 PolarHBondContact OH-OG 3.43Å; S254-Y256 VanDerWaalsContact CB-O 3.25Å; S254-Y256 WeakPolarHBondContact CB-O 3.29Å; S254-Y256 PolarHBondContact O-N 3.39Å; S254-Y256 PolarHBondContact OG-N 2.92Å; S254-Y256 VanDerWaalsContact OG-N 3.09Å; S254-Y256 PolarHBondContact OG-O 3.29Å; S254-S261 PolarHBondContact OG-OG 2.66Å
255	P	97.8	Very high	98.4	Very high	96 Å²	96	52.4 Å²	52.4	62%	0.623	25%	0.249	S	C	*	.	S	Bend	trans	-71	-11.2	169.6	31	-35.4	0	0	0	113.4	V221	V221-P255 HydrophobicContact CG1-CG 4.34Å
256	Y	98.2	Very high	98.3	Very high	94 Å²	94	49.2 Å²	49.2	37%	0.369	24%	0.236	S	C	.	.	S	Bend	trans	-120.4	151.5	179.5	-48.7	-62.8	0	0	0	110.3	V221 Y250 S254 E260 K264	V221-Y256 HydrophobicContact CG1-CD2 4.14Å; V221-Y256 HydrophobicContact CG1-CE2 4.23Å; V221-Y256 HydrophobicContact CG2-CD2 4.29Å; Y250-Y256 VanDerWaalsContact CE1-O 3.27Å; Y250-Y256 WeakPolarHBondContact CE1-O 3.13Å; S254-Y256 VanDerWaalsContact CB-O 3.25Å; S254-Y256 WeakPolarHBondContact CB-O 3.29Å; S254-Y256 PolarHBondContact O-N 3.39Å; S254-Y256 PolarHBondContact OG-N 2.92Å; S254-Y256 VanDerWaalsContact OG-N 3.09Å; S254-Y256 PolarHBondContact OG-O 3.29Å; Y256-E260 HydrophobicContact CD1-CG 3.95Å; Y256-E260 HydrophobicContact CG-CG 4.11Å; Y256-K264 HydrophobicContact CD1-CD 4.46Å; Y256-K264 HydrophobicContact CD2-CD 3.77Å; Y256-K264 HydrophobicContact CE1-CD 4.29Å; Y256-K264 VanDerWaalsContact CE1-CE 3.44Å; Y256-K264 HydrophobicContact CE2-CD 3.55Å; Y256-K264 HydrophobicContact CG-CD 4.23Å; Y256-K264 VanDerWaalsContact CZ-CE 3.42Å
257	D	98.5	Very high	98.3	Very high	67 Å²	67	56 Å²	56	36%	0.358	27%	0.265	S	S	.	.			trans	-70	171.3	167.5	72.4	30.9	0	0	0	111.6	L259 E260 S261	D257-L259 VanDerWaalsContact C-N 3.29Å; D257-L259 PolarHBondContact O-N 3.08Å; D257-L259 WeakPolarHBondContact OD1-CB 3.44Å; D257-L259 PolarHBondContact OD1-N 3.05Å; D257-E260 PolarHBondContact O-N 2.85Å; D257-E260 PolarHBondContact OD1-N 3.32Å; D257-S261 WeakPolarHBondContact O-CB 3.23Å; D257-S261 PolarHBondContact O-N 3.4Å; D257-S261 PolarHBondContact O-OG 2.82Å; D257-S261 VanDerWaalsContact O-OG 3.11Å
258	M	98.6	Very high	98.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-37.1	-176.2	-165.8	68.1	-106.6	0	0	112.8	L216 W231 M235 F247 Y250 I262 V278	L216-M258 HydrophobicContact CD1-SD 4.09Å; W231-M258 HydrophobicContact CD2-CE 4.49Å; W231-M258 HydrophobicContact CE3-CE 4.48Å; W231-M258 HydrophobicContact CH2-CE 3.6Å; W231-M258 HydrophobicContact CZ2-CE 3.57Å; W231-M258 HydrophobicContact CZ3-CE 4.08Å; M235-M258 HydrophobicContact CE-CE 3.73Å; M235-M258 HydrophobicContact CE-CG 4.02Å; M235-M258 HydrophobicContact CE-SD 3.64Å; F247-M258 HydrophobicContact CD1-CB 4.15Å; F247-M258 HydrophobicContact CD1-CG 3.82Å; F247-M258 HydrophobicContact CD1-SD 4.26Å; F247-M258 HydrophobicContact CE1-CG 3.82Å; F247-M258 HydrophobicContact CE1-SD 4.22Å; F247-M258 HydrophobicContact CG-CB 4.36Å; F247-M258 HydrophobicContact CG-CG 4.43Å; F247-M258 HydrophobicContact CZ-CG 4.39Å; Y250-M258 HydrophobicContact CD1-CB 4.41Å; Y250-M258 HydrophobicContact CD1-SD 4.37Å; Y250-M258 HydrophobicContact CD2-SD 4.41Å; Y250-M258 HydrophobicContact CE1-SD 4.24Å; Y250-M258 HydrophobicContact CE2-SD 4.27Å; Y250-M258 HydrophobicContact CG-SD 4.45Å; M258-I262 HydrophobicContact CE-CD1 4.22Å; M258-I262 HydrophobicContact CE-CG1 3.85Å; M258-I262 HydrophobicContact CG-CD1 4.14Å; M258-I262 VanDerWaalsContact O-CD1 3.31Å; M258-I262 WeakPolarHBondContact O-CD1 3.48Å; M258-I262 VanDerWaalsContact O-CG1 3.22Å; M258-I262 WeakPolarHBondContact O-CG1 3.5Å; M258-I262 PolarHBondContact O-N 2.98Å; M258-V278 HydrophobicContact CB-CG1 4.38Å; M258-V278 HydrophobicContact CG-CG1 4.37Å; M258-V278 HydrophobicContact CG-CG2 4.04Å
259	L	98.5	Very high	98.2	Very high	25 Å²	25	56.8 Å²	56.8	13%	0.131	28%	0.282	C	S	.	.	H	α-helix	trans	-67.9	-45.5	-179.9	-68.4	172	0	0	0	110.8	D257 I262 R263 L275 V278 Q279	D257-L259 VanDerWaalsContact C-N 3.29Å; D257-L259 PolarHBondContact O-N 3.08Å; D257-L259 WeakPolarHBondContact OD1-CB 3.44Å; D257-L259 PolarHBondContact OD1-N 3.05Å; L259-I262 PolarHBondContact O-N 2.99Å; L259-R263 WeakPolarHBondContact O-CG 3.23Å; L259-R263 PolarHBondContact O-N 3.16Å; L259-R263 VanDerWaalsContact O-N 3.11Å; L259-L275 HydrophobicContact CB-CD2 4.19Å; L259-L275 HydrophobicContact CD2-CD2 3.71Å; L259-L275 WeakPolarHBondContact O-CD2 3.16Å; L259-V278 HydrophobicContact CD2-CB 3.8Å; L259-V278 HydrophobicContact CD2-CG1 3.56Å; L259-V278 HydrophobicContact CG-CG1 3.93Å; L259-Q279 HydrophobicContact CD1-CG 4.44Å; L259-Q279 HydrophobicContact CD2-CG 4.06Å
260	E	98.5	Very high	98.2	Very high	59 Å²	59	53 Å²	53	28%	0.276	27%	0.269	S	S	.	.	H	α-helix	trans	-69.2	-36.8	178.8	-177.2	59.2	-161.1	0	0	112	Y256 D257 R263 K264	Y256-E260 HydrophobicContact CD1-CG 3.95Å; Y256-E260 HydrophobicContact CG-CG 4.11Å; D257-E260 PolarHBondContact O-N 2.85Å; D257-E260 PolarHBondContact OD1-N 3.32Å; E260-R263 PolarHBondContact O-N 3.35Å; E260-R263 IonicContact OE2-CZ 3.24Å; E260-R263 IonicContact OE2-NH1 2.76Å; E260-R263 PolarHBondContact OE2-NH1 3.48Å; E260-K264 WeakPolarHBondContact O-CG 3.27Å; E260-K264 PolarHBondContact O-N 3.17Å; E260-K264 VanDerWaalsContact O-N 3.17Å; E260-K264 WeakPolarHBondContact OE1-CE 3.28Å; E260-K264 IonicContact OE1-NZ 2.7Å; E260-K264 PolarHBondContact OE1-NZ 2.97Å
261	S	98.6	Very high	98.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-45.7	170.2	-68.4	0	0	0	0	111.7	V221 Y250 S254 D257 R263 K264 E265	V221-S261 VanDerWaalsContact CG2-OG 3.31Å; V221-S261 WeakPolarHBondContact CG2-OG 3.21Å; Y250-S261 WeakPolarHBondContact CE1-OG 3.48Å; Y250-S261 VanDerWaalsContact OH-CB 3.24Å; Y250-S261 WeakPolarHBondContact OH-CB 3.4Å; Y250-S261 PolarHBondContact OH-OG 3Å; S254-S261 PolarHBondContact OG-OG 2.66Å; D257-S261 WeakPolarHBondContact O-CB 3.23Å; D257-S261 PolarHBondContact O-N 3.4Å; D257-S261 PolarHBondContact O-OG 2.82Å; D257-S261 VanDerWaalsContact O-OG 3.11Å; S261-R263 VanDerWaalsContact C-N 3.33Å; S261-R263 PolarHBondContact O-N 2.72Å; S261-K264 PolarHBondContact O-N 2.82Å; S261-K264 VanDerWaalsContact O-N 3.13Å; S261-E265 VanDerWaalsContact O-CB 3.29Å; S261-E265 WeakPolarHBondContact O-CB 3.49Å; S261-E265 VanDerWaalsContact O-CG 3.23Å; S261-E265 WeakPolarHBondContact O-CG 3.5Å; S261-E265 PolarHBondContact O-N 3.38Å
262	I	98.7	Very high	98.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57	-46.3	175.9	-72.6	157.7	0	0	0	111.1	W231 M258 L259 K264 E265 V266 E271 F274 L275 V278	W231-I262 HydrophobicContact CE3-CG1 4.28Å; W231-I262 HydrophobicContact CH2-CG1 3.99Å; W231-I262 HydrophobicContact CZ3-CB 4.22Å; W231-I262 HydrophobicContact CZ3-CG1 3.49Å; W231-I262 VanDerWaalsContact CZ3-CG1 3.49Å; M258-I262 HydrophobicContact CE-CD1 4.22Å; M258-I262 HydrophobicContact CE-CG1 3.85Å; M258-I262 HydrophobicContact CG-CD1 4.14Å; M258-I262 VanDerWaalsContact O-CD1 3.31Å; M258-I262 WeakPolarHBondContact O-CD1 3.48Å; M258-I262 VanDerWaalsContact O-CG1 3.22Å; M258-I262 WeakPolarHBondContact O-CG1 3.5Å; M258-I262 PolarHBondContact O-N 2.98Å; L259-I262 PolarHBondContact O-N 2.99Å; I262-K264 PolarHBondContact O-N 3.13Å; I262-E265 PolarHBondContact O-N 3.12Å; I262-V266 HydrophobicContact CG2-CG2 3.73Å; I262-V266 VanDerWaalsContact O-CG2 3.26Å; I262-V266 WeakPolarHBondContact O-CG2 3.49Å; I262-V266 PolarHBondContact O-N 2.88Å; I262-E271 HydrophobicContact CG2-CG 4.16Å; I262-F274 HydrophobicContact CD1-CB 3.81Å; I262-F274 HydrophobicContact CG1-CB 4.06Å; I262-F274 HydrophobicContact CG2-CB 3.73Å; I262-L275 HydrophobicContact CB-CD2 3.99Å; I262-L275 HydrophobicContact CG2-CD2 3.74Å; I262-L275 HydrophobicContact CG2-CG 3.78Å; I262-V278 HydrophobicContact CD1-CB 4.32Å; I262-V278 HydrophobicContact CD1-CG2 3.54Å
263	R	98.5	Very high	98.2	Very high	102 Å²	102	49.1 Å²	49.1	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-28.4	179	-67.3	-177.4	-161.5	111.8	6.1	113.5	L259 E260 S261 K267 E271 L275	L259-R263 WeakPolarHBondContact O-CG 3.23Å; L259-R263 PolarHBondContact O-N 3.16Å; L259-R263 VanDerWaalsContact O-N 3.11Å; E260-R263 PolarHBondContact O-N 3.35Å; E260-R263 IonicContact OE2-CZ 3.24Å; E260-R263 IonicContact OE2-NH1 2.76Å; E260-R263 PolarHBondContact OE2-NH1 3.48Å; S261-R263 VanDerWaalsContact C-N 3.33Å; S261-R263 PolarHBondContact O-N 2.72Å; R263-K267 PolarHBondContact O-NZ 3.48Å; R263-E271 WeakPolarHBondContact CA-OE1 3.46Å; R263-L275 HydrophobicContact CG-CD1 4.16Å; R263-L275 HydrophobicContact CG-CD2 4.12Å
264	K	97.9	Very high	98.2	Very high	96 Å²	96	46.3 Å²	46.3	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-84.7	-34.9	178.8	-71.1	178.4	-171.4	-62.4	0	112.6	Y256 E260 S261 I262	Y256-K264 HydrophobicContact CD1-CD 4.46Å; Y256-K264 HydrophobicContact CD2-CD 3.77Å; Y256-K264 HydrophobicContact CE1-CD 4.29Å; Y256-K264 VanDerWaalsContact CE1-CE 3.44Å; Y256-K264 HydrophobicContact CE2-CD 3.55Å; Y256-K264 HydrophobicContact CG-CD 4.23Å; Y256-K264 VanDerWaalsContact CZ-CE 3.42Å; E260-K264 WeakPolarHBondContact O-CG 3.27Å; E260-K264 PolarHBondContact O-N 3.17Å; E260-K264 VanDerWaalsContact O-N 3.17Å; E260-K264 WeakPolarHBondContact OE1-CE 3.28Å; E260-K264 IonicContact OE1-NZ 2.7Å; E260-K264 PolarHBondContact OE1-NZ 2.97Å; S261-K264 PolarHBondContact O-N 2.82Å; S261-K264 VanDerWaalsContact O-N 3.13Å; I262-K264 PolarHBondContact O-N 3.13Å
265	E	98	Very high	98.3	Very high	46 Å²	46	47 Å²	47	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-89.8	-38.1	-168.4	-73.2	-57.6	118.6	0	0	113.8	G220 V221 T226 W231 S261 I262	G220-E265 WeakPolarHBondContact CA-OE2 3.31Å; V221-E265 HydrophobicContact CG2-CG 4.4Å; T226-E265 HydrophobicContact CG2-CB 4.15Å; T226-E265 WeakPolarHBondContact OG1-CB 3.37Å; T226-E265 PolarHBondContact OG1-O 3.46Å; T226-E265 PolarHBondContact OG1-OE2 3.07Å; W231-E265 HydrophobicContact CH2-CB 3.69Å; W231-E265 HydrophobicContact CH2-CG 3.88Å; W231-E265 HydrophobicContact CZ2-CB 4.4Å; W231-E265 HydrophobicContact CZ2-CG 4.22Å; W231-E265 HydrophobicContact CZ3-CB 4.23Å; S261-E265 VanDerWaalsContact O-CB 3.29Å; S261-E265 WeakPolarHBondContact O-CB 3.49Å; S261-E265 VanDerWaalsContact O-CG 3.23Å; S261-E265 WeakPolarHBondContact O-CG 3.5Å; S261-E265 PolarHBondContact O-N 3.38Å; I262-E265 PolarHBondContact O-N 3.12Å
266	V	97.6	Very high	98.3	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.055	21%	0.21	C	C	.	.			trans	-125.8	164.9	-176	-66.2	0	0	0	0	111.6	T226 V228 I262 L270 E271 F274	T226-V266 HydrophobicContact CG2-CG1 4.45Å; V228-V266 HydrophobicContact CG2-CG1 4.08Å; I262-V266 HydrophobicContact CG2-CG2 3.73Å; I262-V266 VanDerWaalsContact O-CG2 3.26Å; I262-V266 WeakPolarHBondContact O-CG2 3.49Å; I262-V266 PolarHBondContact O-N 2.88Å; V266-L270 HydrophobicContact CB-CD2 4.1Å; V266-L270 HydrophobicContact CB-CG 4.33Å; V266-L270 HydrophobicContact CG1-CD2 3.8Å; V266-L270 HydrophobicContact CG1-CG 4.38Å; V266-E271 HydrophobicContact CG2-CB 3.94Å; V266-E271 HydrophobicContact CG2-CG 4.38Å; V266-F274 HydrophobicContact CG2-CD2 4.28Å
267	K	97.4	Very high	98.3	Very high	141 Å²	141	38.3 Å²	38.3	61%	0.613	19%	0.193	S	C	*	.			trans	-138.9	164.6	-177.9	-62.5	-64.2	168.2	-160.5	0	112.5	R263 E271	R263-K267 PolarHBondContact O-NZ 3.48Å; K267-E271 WeakPolarHBondContact CA-OE2 3.41Å; K267-E271 WeakPolarHBondContact CD-OE2 3.49Å; K267-E271 IonicContact NZ-OE2 2.68Å
268	G	97.8	Very high	98.4	Very high	50 Å²	50	35.1 Å²	35.1	52%	0.515	18%	0.176	S	C	.	.	H	α-helix	trans	66.8	-145.5	174.9	0	0	0	0	0	112.6	L270 E271 N272	G268-L270 PolarHBondContact O-N 2.75Å; G268-E271 WeakPolarHBondContact O-CB 3.49Å; G268-E271 PolarHBondContact O-N 2.87Å; G268-E271 VanDerWaalsContact O-N 3.1Å; G268-N272 PolarHBondContact O-N 2.68Å
269	D	97.6	Very high	98.4	Very high	65 Å²	65	37.6 Å²	37.6	35%	0.348	19%	0.187	S	C	.	.	H	α-helix	trans	-66.2	-26.3	-174.8	-52.6	-49.3	0	0	0	113.1	E143 F185 N272 A273	E143-D269 HydrophobicContact CG-CB 4.39Å; F185-D269 HydrophobicContact CD1-CB 3.94Å; F185-D269 HydrophobicContact CD2-CB 3.95Å; F185-D269 HydrophobicContact CE1-CB 4.1Å; F185-D269 HydrophobicContact CE2-CB 4.14Å; F185-D269 HydrophobicContact CG-CB 3.87Å; F185-D269 HydrophobicContact CZ-CB 4.21Å; D269-N272 PolarHBondContact O-N 2.78Å; D269-A273 WeakPolarHBondContact O-CB 3.41Å; D269-A273 PolarHBondContact O-N 3.13Å
270	L	98.4	Very high	98.4	Very high	23 Å²	23	36.8 Å²	36.8	12%	0.12	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-44.1	173.2	-176.7	65.7	0	0	0	111.5	D184 L188 V228 V266 G268 A273 F274	D184-L270 HydrophobicContact CB-CD1 4.11Å; D184-L270 HydrophobicContact CB-CD2 3.97Å; L188-L270 HydrophobicContact CD2-CD1 4.25Å; V228-L270 HydrophobicContact CG1-CD1 4.26Å; V228-L270 HydrophobicContact CG1-CD2 3.87Å; V228-L270 HydrophobicContact CG2-CD2 4.05Å; V266-L270 HydrophobicContact CB-CD2 4.1Å; V266-L270 HydrophobicContact CB-CG 4.33Å; V266-L270 HydrophobicContact CG1-CD2 3.8Å; V266-L270 HydrophobicContact CG1-CG 4.38Å; G268-L270 PolarHBondContact O-N 2.75Å; L270-A273 PolarHBondContact O-N 2.71Å; L270-F274 HydrophobicContact CD1-CD2 3.84Å; L270-F274 HydrophobicContact CD1-CE2 3.5Å; L270-F274 VanDerWaalsContact CD1-CE2 3.5Å; L270-F274 HydrophobicContact CD1-CZ 4.42Å; L270-F274 HydrophobicContact CD2-CE2 4.4Å; L270-F274 HydrophobicContact CG-CD2 3.92Å; L270-F274 HydrophobicContact CG-CE2 3.85Å; L270-F274 VanDerWaalsContact O-CD2 3.32Å; L270-F274 WeakPolarHBondContact O-CD2 3.5Å; L270-F274 PolarHBondContact O-N 2.56Å
271	E	98.6	Very high	98.4	Very high	37 Å²	37	34.2 Å²	34.2	17%	0.173	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-49.9	173.1	-177.6	-174.8	174.8	0	0	110.1	I262 R263 V266 K267 G268 A273 F274 L275	I262-E271 HydrophobicContact CG2-CG 4.16Å; R263-E271 WeakPolarHBondContact CA-OE1 3.46Å; V266-E271 HydrophobicContact CG2-CB 3.94Å; V266-E271 HydrophobicContact CG2-CG 4.38Å; K267-E271 WeakPolarHBondContact CA-OE2 3.41Å; K267-E271 WeakPolarHBondContact CD-OE2 3.49Å; K267-E271 IonicContact NZ-OE2 2.68Å; G268-E271 WeakPolarHBondContact O-CB 3.49Å; G268-E271 PolarHBondContact O-N 2.87Å; G268-E271 VanDerWaalsContact O-N 3.1Å; E271-A273 VanDerWaalsContact C-N 3.32Å; E271-A273 PolarHBondContact O-N 2.73Å; E271-F274 PolarHBondContact O-N 2.95Å; E271-L275 HydrophobicContact CG-CD1 3.92Å; E271-L275 HydrophobicContact CG-CG 4.35Å; E271-L275 WeakPolarHBondContact O-CB 3.36Å; E271-L275 VanDerWaalsContact O-CG 3.26Å; E271-L275 WeakPolarHBondContact O-CG 3.46Å; E271-L275 PolarHBondContact O-N 2.7Å
272	N	98.4	Very high	98.4	Very high	52 Å²	52	37.4 Å²	37.4	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-57.6	-46	179.6	-166.5	21.4	0	0	0	111.2	I147 G268 D269 L275 N276	I147-N272 HydrophobicContact CD1-CB 3.97Å; G268-N272 PolarHBondContact O-N 2.68Å; D269-N272 PolarHBondContact O-N 2.78Å; N272-L275 PolarHBondContact O-N 3.48Å; N272-N276 WeakPolarHBondContact O-CB 3.39Å; N272-N276 PolarHBondContact O-N 3.46Å; N272-N276 PolarHBondContact O-ND2 3.33Å; N272-N276 PolarHBondContact OD1-ND2 2.96Å
273	A	98.7	Very high	98.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-48.4	179.2	0	0	0	0	0	113	I147 F185 L188 M189 D269 L270 E271 L275 N276 L277	I147-A273 HydrophobicContact CD1-CB 4.09Å; I147-A273 HydrophobicContact CG1-CB 4.06Å; F185-A273 HydrophobicContact CD2-CB 3.99Å; F185-A273 HydrophobicContact CE2-CB 3.96Å; L188-A273 HydrophobicContact CD2-CB 3.6Å; M189-A273 HydrophobicContact CE-CB 3.68Å; D269-A273 WeakPolarHBondContact O-CB 3.41Å; D269-A273 PolarHBondContact O-N 3.13Å; L270-A273 PolarHBondContact O-N 2.71Å; E271-A273 VanDerWaalsContact C-N 3.32Å; E271-A273 PolarHBondContact O-N 2.73Å; A273-L275 PolarHBondContact O-N 3.47Å; A273-N276 PolarHBondContact O-N 2.93Å; A273-L277 WeakPolarHBondContact O-CB 3.31Å; A273-L277 PolarHBondContact O-N 3.03Å
274	F	98.8	Very high	98.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-41.2	177.7	-83.3	-59.4	0	0	0	112.2	L188 V228 W231 I232 M235 I262 V266 L270 E271 N276 L277 V278	L188-F274 HydrophobicContact CD1-CE1 4.22Å; L188-F274 HydrophobicContact CD2-CD1 3.95Å; L188-F274 HydrophobicContact CD2-CD2 4.2Å; L188-F274 HydrophobicContact CD2-CE1 3.97Å; L188-F274 HydrophobicContact CD2-CE2 4.23Å; L188-F274 HydrophobicContact CD2-CG 4.07Å; L188-F274 HydrophobicContact CD2-CZ 4.12Å; V228-F274 HydrophobicContact CG1-CE2 4.13Å; V228-F274 HydrophobicContact CG1-CZ 4.36Å; W231-F274 HydrophobicContact CB-CE1 4.11Å; W231-F274 HydrophobicContact CB-CZ 3.79Å; W231-F274 HydrophobicContact CE3-CD2 4.38Å; W231-F274 HydrophobicContact CE3-CE2 4.2Å; W231-F274 HydrophobicContact CE3-CZ 4.32Å; I232-F274 HydrophobicContact CG1-CE1 4.42Å; I232-F274 HydrophobicContact CG1-CZ 3.74Å; M235-F274 HydrophobicContact SD-CD1 3.57Å; M235-F274 VanDerWaalsContact SD-CD1 3.57Å; M235-F274 HydrophobicContact SD-CE1 3.76Å; I262-F274 HydrophobicContact CD1-CB 3.81Å; I262-F274 HydrophobicContact CG1-CB 4.06Å; I262-F274 HydrophobicContact CG2-CB 3.73Å; V266-F274 HydrophobicContact CG2-CD2 4.28Å; L270-F274 HydrophobicContact CD1-CD2 3.84Å; L270-F274 HydrophobicContact CD1-CE2 3.5Å; L270-F274 VanDerWaalsContact CD1-CE2 3.5Å; L270-F274 HydrophobicContact CD1-CZ 4.42Å; L270-F274 HydrophobicContact CD2-CE2 4.4Å; L270-F274 HydrophobicContact CG-CD2 3.92Å; L270-F274 HydrophobicContact CG-CE2 3.85Å; L270-F274 VanDerWaalsContact O-CD2 3.32Å; L270-F274 WeakPolarHBondContact O-CD2 3.5Å; L270-F274 PolarHBondContact O-N 2.56Å; E271-F274 PolarHBondContact O-N 2.95Å; F274-N276 VanDerWaalsContact C-N 3.35Å; F274-N276 PolarHBondContact O-N 2.76Å; F274-L277 PolarHBondContact O-N 3.24Å; F274-V278 WeakPolarHBondContact O-CB 3.42Å; F274-V278 WeakPolarHBondContact O-CG2 3.46Å; F274-V278 PolarHBondContact O-N 3.16Å
275	L	98.8	Very high	98.4	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.12	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-43.7	176.1	-69.9	176.9	0	0	0	111.5	L259 I262 R263 E271 N272 A273 Q279	L259-L275 HydrophobicContact CB-CD2 4.19Å; L259-L275 HydrophobicContact CD2-CD2 3.71Å; L259-L275 WeakPolarHBondContact O-CD2 3.16Å; I262-L275 HydrophobicContact CB-CD2 3.99Å; I262-L275 HydrophobicContact CG2-CD2 3.74Å; I262-L275 HydrophobicContact CG2-CG 3.78Å; R263-L275 HydrophobicContact CG-CD1 4.16Å; R263-L275 HydrophobicContact CG-CD2 4.12Å; E271-L275 HydrophobicContact CG-CD1 3.92Å; E271-L275 HydrophobicContact CG-CG 4.35Å; E271-L275 WeakPolarHBondContact O-CB 3.36Å; E271-L275 VanDerWaalsContact O-CG 3.26Å; E271-L275 WeakPolarHBondContact O-CG 3.46Å; E271-L275 PolarHBondContact O-N 2.7Å; N272-L275 PolarHBondContact O-N 3.48Å; A273-L275 PolarHBondContact O-N 3.47Å; L275-Q279 WeakPolarHBondContact O-CB 3.41Å; L275-Q279 VanDerWaalsContact O-CG 3.23Å; L275-Q279 WeakPolarHBondContact O-CG 3.35Å; L275-Q279 PolarHBondContact O-N 2.9Å; L275-Q279 PolarHBondContact O-NE2 3.34Å
276	N	98.8	Very high	98.4	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-42.7	178.1	-81.2	-106.6	0	0	0	111.3	I147 C151 N272 A273 F274 Q279 C280 Y287	I147-N276 HydrophobicContact CG2-CB 3.37Å; C151-N276 HydrophobicContact CB-CB 4.33Å; N272-N276 WeakPolarHBondContact O-CB 3.39Å; N272-N276 PolarHBondContact O-N 3.46Å; N272-N276 PolarHBondContact O-ND2 3.33Å; N272-N276 PolarHBondContact OD1-ND2 2.96Å; A273-N276 PolarHBondContact O-N 2.93Å; F274-N276 VanDerWaalsContact C-N 3.35Å; F274-N276 PolarHBondContact O-N 2.76Å; N276-Q279 PolarHBondContact O-N 2.76Å; N276-C280 WeakPolarHBondContact O-CB 3.47Å; N276-C280 PolarHBondContact O-N 3.32Å; N276-C280 PolarHBondContact O-SG 3.25Å; N276-Y287 HydrophobicContact CB-CE2 4.13Å; N276-Y287 WeakPolarHBondContact OD1-CE2 3.35Å; N276-Y287 VanDerWaalsContact OD1-CZ 3.27Å; N276-Y287 PolarHBondContact OD1-OH 3.27Å
277	L	98.8	Very high	98.5	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-48.7	177.5	179.3	61.2	0	0	0	112	C151 L188 L192 M235 A273 F274 Q279 C280 I281	C151-L277 HydrophobicContact CB-CB 4.34Å; L188-L277 HydrophobicContact CD1-CD2 4.25Å; L192-L277 HydrophobicContact CD1-CD1 4.29Å; L192-L277 HydrophobicContact CD1-CD2 4.27Å; L192-L277 HydrophobicContact CD2-CD1 3.88Å; L192-L277 HydrophobicContact CD2-CD2 4.2Å; M235-L277 HydrophobicContact CB-CD2 3.89Å; A273-L277 WeakPolarHBondContact O-CB 3.31Å; A273-L277 PolarHBondContact O-N 3.03Å; F274-L277 PolarHBondContact O-N 3.24Å; L277-Q279 PolarHBondContact O-N 2.99Å; L277-C280 PolarHBondContact O-N 2.67Å; L277-I281 HydrophobicContact CD1-CD1 3.94Å; L277-I281 HydrophobicContact CD1-CG1 4.33Å; L277-I281 HydrophobicContact CG-CD1 3.79Å; L277-I281 WeakPolarHBondContact O-CD1 3.28Å; L277-I281 VanDerWaalsContact O-CG1 3.31Å; L277-I281 WeakPolarHBondContact O-CG1 3.32Å; L277-I281 PolarHBondContact O-N 3.05Å
278	V	98.8	Very high	98.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.9	-42.8	179.1	171.5	0	0	0	0	111.1	M235 F247 M258 L259 I262 F274 C280 I281 Q282	M235-V278 HydrophobicContact CE-CG2 4.46Å; M235-V278 HydrophobicContact SD-CG2 4.06Å; F247-V278 HydrophobicContact CD2-CG1 4.12Å; F247-V278 HydrophobicContact CE2-CB 4.25Å; F247-V278 HydrophobicContact CE2-CG1 3.85Å; F247-V278 HydrophobicContact CE2-CG2 3.98Å; F247-V278 HydrophobicContact CZ-CG1 4.42Å; F247-V278 HydrophobicContact CZ-CG2 3.81Å; M258-V278 HydrophobicContact CB-CG1 4.38Å; M258-V278 HydrophobicContact CG-CG1 4.37Å; M258-V278 HydrophobicContact CG-CG2 4.04Å; L259-V278 HydrophobicContact CD2-CB 3.8Å; L259-V278 HydrophobicContact CD2-CG1 3.56Å; L259-V278 HydrophobicContact CG-CG1 3.93Å; I262-V278 HydrophobicContact CD1-CB 4.32Å; I262-V278 HydrophobicContact CD1-CG2 3.54Å; F274-V278 WeakPolarHBondContact O-CB 3.42Å; F274-V278 WeakPolarHBondContact O-CG2 3.46Å; F274-V278 PolarHBondContact O-N 3.16Å; V278-C280 VanDerWaalsContact C-N 3.35Å; V278-C280 PolarHBondContact O-N 3.08Å; V278-I281 PolarHBondContact O-N 3Å; V278-Q282 HydrophobicContact CG1-CG 4.25Å; V278-Q282 WeakPolarHBondContact O-CB 3.17Å; V278-Q282 WeakPolarHBondContact O-CG 3.08Å; V278-Q282 PolarHBondContact O-N 2.88Å
279	Q	98.8	Very high	98.6	Very high	52 Å²	52	24.3 Å²	24.3	24%	0.243	12%	0.123	C	C	.	.	H	α-helix	trans	-60.9	-42.8	174.9	-73.5	171.3	96.5	0	0	111.9	L259 L275 N276 L277 I281 Q282 N283 Y287	L259-Q279 HydrophobicContact CD1-CG 4.44Å; L259-Q279 HydrophobicContact CD2-CG 4.06Å; L275-Q279 WeakPolarHBondContact O-CB 3.41Å; L275-Q279 VanDerWaalsContact O-CG 3.23Å; L275-Q279 WeakPolarHBondContact O-CG 3.35Å; L275-Q279 PolarHBondContact O-N 2.9Å; L275-Q279 PolarHBondContact O-NE2 3.34Å; N276-Q279 PolarHBondContact O-N 2.76Å; L277-Q279 PolarHBondContact O-N 2.99Å; Q279-I281 PolarHBondContact O-N 3.43Å; Q279-Q282 PolarHBondContact O-N 2.76Å; Q279-N283 CarbonylContact O-C 3.6Å; Q279-N283 VanDerWaalsContact O-C 3.27Å; Q279-N283 PolarHBondContact O-N 3.23Å; Q279-Y287 HydrophobicContact CB-CD2 3.87Å; Q279-Y287 HydrophobicContact CB-CG 4.43Å
280	C	98.6	Very high	98.7	Very high	9 Å²	9	22.2 Å²	22.2	6%	0.061	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-38.6	175.5	-75.6	0	0	0	0	113	N276 L277 V278 K284 Y287	N276-C280 WeakPolarHBondContact O-CB 3.47Å; N276-C280 PolarHBondContact O-N 3.32Å; N276-C280 PolarHBondContact O-SG 3.25Å; L277-C280 PolarHBondContact O-N 2.67Å; V278-C280 VanDerWaalsContact C-N 3.35Å; V278-C280 PolarHBondContact O-N 3.08Å; C280-K284 PolarHBondContact O-N 3.23Å; C280-Y287 WeakPolarHBondContact SG-CD1 3.46Å
281	I	98.6	Very high	98.7	Very high	5 Å²	5	22.3 Å²	22.3	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-67.8	-45.4	176.7	-71.1	160.9	0	0	0	110.6	V240 L243 Q244 F247 L277 V278 Q279	V240-I281 HydrophobicContact CG1-CG2 4.25Å; L243-I281 HydrophobicContact CB-CD1 4.46Å; L243-I281 HydrophobicContact CB-CG2 3.71Å; L243-I281 HydrophobicContact CD1-CD1 3.7Å; L243-I281 HydrophobicContact CD1-CG1 4.46Å; Q244-I281 HydrophobicContact CG-CG2 4.04Å; Q244-I281 WeakPolarHBondContact CG-O 3.49Å; Q244-I281 PolarHBondContact NE2-O 3.46Å; F247-I281 HydrophobicContact CD2-CG2 4.1Å; F247-I281 HydrophobicContact CE2-CB 4.02Å; F247-I281 HydrophobicContact CE2-CD1 4.06Å; F247-I281 HydrophobicContact CE2-CG2 3.59Å; F247-I281 HydrophobicContact CZ-CD1 4.14Å; L277-I281 HydrophobicContact CD1-CD1 3.94Å; L277-I281 HydrophobicContact CD1-CG1 4.33Å; L277-I281 HydrophobicContact CG-CD1 3.79Å; L277-I281 WeakPolarHBondContact O-CD1 3.28Å; L277-I281 VanDerWaalsContact O-CG1 3.31Å; L277-I281 WeakPolarHBondContact O-CG1 3.32Å; L277-I281 PolarHBondContact O-N 3.05Å; V278-I281 PolarHBondContact O-N 3Å; Q279-I281 PolarHBondContact O-N 3.43Å
282	Q	98.3	Very high	98.7	Very high	67 Å²	67	20.6 Å²	20.6	31%	0.313	10%	0.103	S	C	.	.	H	α-helix	trans	-70.4	-51.2	-177.3	-72	179.8	-41	0	0	111.8	F247 V278 Q279	F247-Q282 HydrophobicContact CD2-CG 4.02Å; V278-Q282 HydrophobicContact CG1-CG 4.25Å; V278-Q282 WeakPolarHBondContact O-CB 3.17Å; V278-Q282 WeakPolarHBondContact O-CG 3.08Å; V278-Q282 PolarHBondContact O-N 2.88Å; Q279-Q282 PolarHBondContact O-N 2.76Å
283	N	98.3	Very high	98.7	Very high	49 Å²	49	21 Å²	21	26%	0.262	10%	0.101	S	C	.	.	H	α-helix	trans	-160.4	89.2	-178.1	-173.4	-17.8	0	0	0	110.8	Q279 P285 L286 Y287 E324	Q279-N283 CarbonylContact O-C 3.6Å; Q279-N283 VanDerWaalsContact O-C 3.27Å; Q279-N283 PolarHBondContact O-N 3.23Å; N283-P285 VanDerWaalsContact OD1-CD 3.28Å; N283-P285 WeakPolarHBondContact OD1-CD 3.3Å; N283-L286 HydrophobicContact CB-CB 3.86Å; N283-L286 HydrophobicContact CB-CD2 4.49Å; N283-L286 WeakPolarHBondContact ND2-CB 3.39Å; N283-L286 WeakPolarHBondContact O-CB 3.5Å; N283-L286 PolarHBondContact O-N 2.94Å; N283-L286 WeakPolarHBondContact OD1-CB 3.35Å; N283-L286 PolarHBondContact OD1-N 3.37Å; N283-Y287 PolarHBondContact O-N 3Å; N283-E324 PolarHBondContact ND2-OE2 2.94Å
284	K	98.6	Very high	98.6	Very high	50 Å²	50	23.6 Å²	23.6	22%	0.217	12%	0.115	C	C	.	.	H	α-helix	trans	-58.4	-42.1	178.9	-170.5	-174.2	-53.4	-173.9	0	114.1	S152 C280 L286 Y287 F288	S152-K284 VanDerWaalsContact O-CE 3.25Å; S152-K284 WeakPolarHBondContact O-CE 3.26Å; S152-K284 PolarHBondContact O-NZ 2.9Å; C280-K284 PolarHBondContact O-N 3.23Å; K284-L286 VanDerWaalsContact C-N 3.34Å; K284-L286 PolarHBondContact O-N 3.29Å; K284-Y287 WeakPolarHBondContact O-CB 3.48Å; K284-Y287 PolarHBondContact O-N 2.77Å; K284-F288 HydrophobicContact CD-CE2 4.09Å; K284-F288 HydrophobicContact CG-CD2 3.99Å; K284-F288 HydrophobicContact CG-CE2 3.71Å; K284-F288 WeakPolarHBondContact O-CD2 3.39Å; K284-F288 PolarHBondContact O-N 3.02Å; K284-F288 VanDerWaalsContact O-N 3.1Å
285	P	98.8	Very high	98.6	Very high	20 Å²	20	23.7 Å²	23.7	13%	0.13	12%	0.115	C	C	.	.	H	α-helix	trans	-58.6	-41.4	172.6	-29.9	37.8	0	0	0	113.9	N283 F288 A289 K320 I321 E324	N283-P285 VanDerWaalsContact OD1-CD 3.28Å; N283-P285 WeakPolarHBondContact OD1-CD 3.3Å; P285-F288 PolarHBondContact O-N 3.3Å; P285-A289 PolarHBondContact O-N 2.86Å; P285-K320 HydrophobicContact CB-CB 3.74Å; P285-K320 HydrophobicContact CG-CB 3.75Å; P285-K320 HydrophobicContact CG-CD 4.08Å; P285-I321 HydrophobicContact CB-CG1 4.24Å; P285-E324 HydrophobicContact CB-CG 3.81Å
286	L	98.8	Very high	98.6	Very high	45 Å²	45	22.9 Å²	22.9	24%	0.236	11%	0.111	C	C	.	.	H	α-helix	trans	-66.1	-40.8	175.8	-177.9	58.9	0	0	0	111.9	N283 K284 F288 A289 D290 E324 K328	N283-L286 HydrophobicContact CB-CB 3.86Å; N283-L286 HydrophobicContact CB-CD2 4.49Å; N283-L286 WeakPolarHBondContact ND2-CB 3.39Å; N283-L286 WeakPolarHBondContact O-CB 3.5Å; N283-L286 PolarHBondContact O-N 2.94Å; N283-L286 WeakPolarHBondContact OD1-CB 3.35Å; N283-L286 PolarHBondContact OD1-N 3.37Å; K284-L286 VanDerWaalsContact C-N 3.34Å; K284-L286 PolarHBondContact O-N 3.29Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.01Å; L286-A289 WeakPolarHBondContact O-CB 3.31Å; L286-A289 PolarHBondContact O-N 3.24Å; L286-D290 PolarHBondContact O-N 2.92Å; L286-E324 HydrophobicContact CB-CB 4.43Å; L286-E324 HydrophobicContact CB-CG 4.34Å; L286-E324 WeakPolarHBondContact CB-OE2 3.5Å; L286-E324 HydrophobicContact CD1-CB 4.22Å; L286-K328 HydrophobicContact CD1-CD 3.74Å
287	Y	98.8	Very high	98.3	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-53.8	-50.5	174	165.9	-102.1	0	0	0	111.7	E148 N276 Q279 C280 N283 K284 A289 D290 R291	E148-Y287 WeakPolarHBondContact CA-OH 3.22Å; E148-Y287 HydrophobicContact CG-CE1 4.3Å; E148-Y287 WeakPolarHBondContact CG-OH 3.45Å; N276-Y287 HydrophobicContact CB-CE2 4.13Å; N276-Y287 WeakPolarHBondContact OD1-CE2 3.35Å; N276-Y287 VanDerWaalsContact OD1-CZ 3.27Å; N276-Y287 PolarHBondContact OD1-OH 3.27Å; Q279-Y287 HydrophobicContact CB-CD2 3.87Å; Q279-Y287 HydrophobicContact CB-CG 4.43Å; C280-Y287 WeakPolarHBondContact SG-CD1 3.46Å; N283-Y287 PolarHBondContact O-N 3Å; K284-Y287 WeakPolarHBondContact O-CB 3.48Å; K284-Y287 PolarHBondContact O-N 2.77Å; Y287-A289 VanDerWaalsContact C-N 3.35Å; Y287-A289 PolarHBondContact O-N 2.86Å; Y287-D290 PolarHBondContact O-N 2.97Å; Y287-R291 HydrophobicContact CD1-CG 4.49Å; Y287-R291 HydrophobicContact CD2-CG 4.25Å; Y287-R291 HydrophobicContact CE1-CG 4.04Å; Y287-R291 HydrophobicContact CE2-CG 3.75Å; Y287-R291 VanDerWaalsContact O-CG 3.27Å; Y287-R291 WeakPolarHBondContact O-CG 3.48Å; Y287-R291 PolarHBondContact O-N 2.74Å
288	F	98.9	Very high	97.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-32.5	178.2	-75.8	-61.8	0	0	0	112.9	E148 K284 P285 L286 D290 R291 L292 I309 R313 I321	E148-F288 HydrophobicContact CG-CE1 4.16Å; K284-F288 HydrophobicContact CD-CE2 4.09Å; K284-F288 HydrophobicContact CG-CD2 3.99Å; K284-F288 HydrophobicContact CG-CE2 3.71Å; K284-F288 WeakPolarHBondContact O-CD2 3.39Å; K284-F288 PolarHBondContact O-N 3.02Å; K284-F288 VanDerWaalsContact O-N 3.1Å; P285-F288 PolarHBondContact O-N 3.3Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.01Å; F288-D290 VanDerWaalsContact C-N 3.33Å; F288-R291 PolarHBondContact O-N 3.47Å; F288-L292 WeakPolarHBondContact O-CB 3.25Å; F288-L292 VanDerWaalsContact O-CG 3.26Å; F288-L292 WeakPolarHBondContact O-CG 3.47Å; F288-L292 PolarHBondContact O-N 3.34Å; F288-I309 HydrophobicContact CB-CG2 4.24Å; F288-I309 HydrophobicContact CD1-CD1 4.07Å; F288-I309 HydrophobicContact CD1-CG1 3.96Å; F288-I309 HydrophobicContact CD1-CG2 3.86Å; F288-I309 HydrophobicContact CE1-CG1 4.28Å; F288-I309 HydrophobicContact CG-CG2 4.32Å; F288-R313 HydrophobicContact CD1-CG 4.36Å; F288-R313 HydrophobicContact CD2-CG 4.24Å; F288-R313 HydrophobicContact CE1-CG 4.41Å; F288-R313 HydrophobicContact CE2-CG 4.3Å; F288-R313 HydrophobicContact CG-CG 4.28Å; F288-R313 HydrophobicContact CZ-CG 4.38Å; F288-I321 HydrophobicContact CB-CD1 3.61Å; F288-I321 HydrophobicContact CB-CG1 3.93Å; F288-I321 HydrophobicContact CB-CG2 4.33Å; F288-I321 HydrophobicContact CD2-CD1 4.14Å; F288-I321 HydrophobicContact CG-CD1 4.12Å
289	A	98.8	Very high	97.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-43.4	172.5	0	0	0	0	0	111.6	P285 L286 Y287 L292 Y293 I321 E324 F325	P285-A289 PolarHBondContact O-N 2.86Å; L286-A289 WeakPolarHBondContact O-CB 3.31Å; L286-A289 PolarHBondContact O-N 3.24Å; Y287-A289 VanDerWaalsContact C-N 3.35Å; Y287-A289 PolarHBondContact O-N 2.86Å; A289-L292 PolarHBondContact O-N 3.47Å; A289-Y293 PolarHBondContact O-N 2.8Å; A289-I321 HydrophobicContact CB-CG2 4.26Å; A289-E324 HydrophobicContact CB-CB 4.1Å; A289-F325 HydrophobicContact CB-CB 3.84Å; A289-F325 HydrophobicContact CB-CD2 4.07Å; A289-F325 HydrophobicContact CB-CG 4.43Å; A289-F325 WeakPolarHBondContact O-CD2 3.45Å
290	D	98.7	Very high	96.8	Very high	22 Å²	22	40.6 Å²	40.6	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-42.8	177	-71.3	-5.6	0	0	0	111.8	L286 Y287 F288 L292 Y293 D294 K328 Y329	L286-D290 PolarHBondContact O-N 2.92Å; Y287-D290 PolarHBondContact O-N 2.97Å; F288-D290 VanDerWaalsContact C-N 3.33Å; D290-L292 VanDerWaalsContact C-N 3.35Å; D290-L292 PolarHBondContact O-N 2.74Å; D290-Y293 PolarHBondContact O-N 3.11Å; D290-D294 WeakPolarHBondContact O-CB 3.27Å; D290-D294 PolarHBondContact O-N 3.33Å; D290-K328 VanDerWaalsContact OD1-CD 3.31Å; D290-K328 WeakPolarHBondContact OD1-CD 3.26Å; D290-K328 VanDerWaalsContact OD1-CE 3.27Å; D290-K328 WeakPolarHBondContact OD1-CE 3.08Å; D290-K328 IonicContact OD1-NZ 3.6Å; D290-K328 PolarHBondContact OD1-NZ 3.13Å; D290-K328 IonicContact OD2-NZ 2.69Å; D290-K328 PolarHBondContact OD2-NZ 2.66Å; D290-Y329 WeakPolarHBondContact CA-OH 3.46Å; D290-Y329 PolarHBondContact OD1-OH 3.39Å
291	R	98.7	Very high	96.6	Very high	25 Å²	25	41.7 Å²	41.7	9%	0.094	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-40.3	175.3	-68.2	-77.4	-63.1	164.5	1.9	112.4	D144 E148 Y287 F288 D294 S295 I309	D144-R291 IonicContact OD1-CZ 3.57Å; D144-R291 IonicContact OD1-NH1 3.58Å; D144-R291 PolarHBondContact OD1-NH1 2.91Å; D144-R291 IonicContact OD1-NH2 2.88Å; D144-R291 IonicContact OD2-CZ 2.71Å; D144-R291 VanDerWaalsContact OD2-CZ 3.27Å; D144-R291 IonicContact OD2-NH1 3.55Å; D144-R291 PolarHBondContact OD2-NH1 3.47Å; D144-R291 IonicContact OD2-NH2 2.78Å; D144-R291 PolarHBondContact OD2-NH2 2.92Å; E148-R291 IonicContact OE2-CZ 2.68Å; E148-R291 IonicContact OE2-NE 3.37Å; E148-R291 PolarHBondContact OE2-NE 3.45Å; E148-R291 VanDerWaalsContact OE2-NE 3.16Å; E148-R291 IonicContact OE2-NH2 3.16Å; E148-R291 PolarHBondContact OE2-NH2 3.46Å; Y287-R291 HydrophobicContact CD1-CG 4.49Å; Y287-R291 HydrophobicContact CD2-CG 4.25Å; Y287-R291 HydrophobicContact CE1-CG 4.04Å; Y287-R291 HydrophobicContact CE2-CG 3.75Å; Y287-R291 VanDerWaalsContact O-CG 3.27Å; Y287-R291 WeakPolarHBondContact O-CG 3.48Å; Y287-R291 PolarHBondContact O-N 2.74Å; F288-R291 PolarHBondContact O-N 3.47Å; R291-D294 PolarHBondContact O-N 3.09Å; R291-S295 PolarHBondContact O-N 2.85Å; R291-I309 HydrophobicContact CB-CD1 3.52Å
292	L	98.8	Very high	96.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-39.6	175.1	-76	166.5	0	0	0	111.8	F288 A289 D290 D294 S295 M296 L306 I309 M310 I321 F325 L333	F288-L292 WeakPolarHBondContact O-CB 3.25Å; F288-L292 VanDerWaalsContact O-CG 3.26Å; F288-L292 WeakPolarHBondContact O-CG 3.47Å; F288-L292 PolarHBondContact O-N 3.34Å; A289-L292 PolarHBondContact O-N 3.47Å; D290-L292 VanDerWaalsContact C-N 3.35Å; D290-L292 PolarHBondContact O-N 2.74Å; L292-D294 VanDerWaalsContact C-N 3.34Å; L292-S295 PolarHBondContact O-N 3.33Å; L292-S295 PolarHBondContact O-OG 2.8Å; L292-M296 HydrophobicContact CB-CE 4.37Å; L292-M296 WeakPolarHBondContact O-CE 3.49Å; L292-M296 PolarHBondContact O-N 2.62Å; L292-L306 HydrophobicContact CD2-CD1 3.6Å; L292-I309 HydrophobicContact CD1-CG2 3.84Å; L292-I309 HydrophobicContact CD2-CB 3.89Å; L292-I309 HydrophobicContact CD2-CD1 4.29Å; L292-I309 HydrophobicContact CD2-CG2 3.8Å; L292-I309 HydrophobicContact CG-CB 4.29Å; L292-I309 HydrophobicContact CG-CD1 4.18Å; L292-I309 HydrophobicContact CG-CG2 3.75Å; L292-M310 HydrophobicContact CD1-SD 4.42Å; L292-M310 HydrophobicContact CD2-CG 4.25Å; L292-M310 HydrophobicContact CD2-SD 3.97Å; L292-I321 HydrophobicContact CD1-CG2 3.61Å; L292-F325 HydrophobicContact CB-CD2 4.33Å; L292-F325 HydrophobicContact CB-CE2 4.09Å; L292-L333 HydrophobicContact CB-CD1 4.07Å; L292-L333 HydrophobicContact CD1-CD1 3.91Å; L292-L333 HydrophobicContact CD1-CD2 3.76Å; L292-L333 HydrophobicContact CG-CD1 4.4Å
293	Y	98.6	Very high	96.6	Very high	62 Å²	62	46.6 Å²	46.6	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-45.5	174.6	-179.8	-97.7	0	0	0	110.3	A289 D290 S295 M296 K297 F325 Y329 Y336	A289-Y293 PolarHBondContact O-N 2.8Å; D290-Y293 PolarHBondContact O-N 3.11Å; Y293-S295 PolarHBondContact O-N 2.93Å; Y293-M296 CarbonylContact O-C 3.59Å; Y293-M296 PolarHBondContact O-N 2.9Å; Y293-M296 VanDerWaalsContact O-N 3.1Å; Y293-K297 HydrophobicContact CD1-CB 4.16Å; Y293-K297 HydrophobicContact CD1-CD 3.86Å; Y293-K297 HydrophobicContact CE1-CB 3.82Å; Y293-K297 HydrophobicContact CE1-CD 3.64Å; Y293-K297 HydrophobicContact CE1-CG 4.34Å; Y293-K297 VanDerWaalsContact O-CB 3.31Å; Y293-K297 WeakPolarHBondContact O-CB 3.24Å; Y293-K297 PolarHBondContact O-N 3.31Å; Y293-F325 HydrophobicContact CD2-CZ 4.09Å; Y293-Y329 VanDerWaalsContact CB-CE2 3.49Å; Y293-Y329 WeakPolarHBondContact CB-OH 3.23Å; Y293-Y329 HydrophobicContact CD1-CD1 4.19Å; Y293-Y329 AromaticContact CD1-CE1 3.46Å; Y293-Y329 HydrophobicContact CD1-CE1 3.46Å; Y293-Y329 VanDerWaalsContact CD1-CE1 3.46Å; Y293-Y329 AromaticContact CD1-CZ 3.67Å; Y293-Y329 AromaticContact CD2-CD1 3.43Å; Y293-Y329 HydrophobicContact CD2-CD1 3.43Å; Y293-Y329 VanDerWaalsContact CD2-CD1 3.43Å; Y293-Y329 AromaticContact CD2-CD2 3.99Å; Y293-Y329 HydrophobicContact CD2-CD2 3.99Å; Y293-Y329 AromaticContact CD2-CE1 3.54Å; Y293-Y329 HydrophobicContact CD2-CE1 3.54Å; Y293-Y329 HydrophobicContact CD2-CE2 4.1Å; Y293-Y329 AromaticContact CD2-CG 3.65Å; Y293-Y329 HydrophobicContact CD2-CG 3.65Å; Y293-Y329 AromaticContact CD2-CZ 3.86Å; Y293-Y329 HydrophobicContact CE1-CD1 4.25Å; Y293-Y329 AromaticContact CE1-CE1 3.74Å; Y293-Y329 HydrophobicContact CE1-CE1 3.74Å; Y293-Y329 AromaticContact CE2-CD1 3.5Å; Y293-Y329 HydrophobicContact CE2-CD1 3.5Å; Y293-Y329 AromaticContact CE2-CE1 3.81Å; Y293-Y329 HydrophobicContact CE2-CE1 3.81Å; Y293-Y329 HydrophobicContact CE2-CG 4.03Å; Y293-Y329 AromaticContact CG-CD1 3.79Å; Y293-Y329 HydrophobicContact CG-CD1 3.79Å; Y293-Y329 HydrophobicContact CG-CD2 4.2Å; Y293-Y329 AromaticContact CG-CE1 3.35Å; Y293-Y329 HydrophobicContact CG-CE1 3.35Å; Y293-Y329 AromaticContact CG-CE2 3.82Å; Y293-Y329 HydrophobicContact CG-CE2 3.82Å; Y293-Y329 HydrophobicContact CG-CG 4.18Å; Y293-Y329 AromaticContact CG-CZ 3.35Å; Y293-Y329 AromaticContact CZ-CD1 3.93Å; Y293-Y329 AromaticContact CZ-CE1 3.91Å; Y293-Y336 HydrophobicContact CD2-CE1 4.04Å; Y293-Y336 AromaticContact CE2-CE1 3.71Å; Y293-Y336 HydrophobicContact CE2-CE1 3.71Å; Y293-Y336 AromaticContact CE2-CZ 3.81Å
294	D	97.9	Very high	96.5	Very high	53 Å²	53	48.4 Å²	48.4	28%	0.283	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-24.4	179.3	-81	16.5	0	0	0	113.8	D290 R291 L292 K297	D290-D294 WeakPolarHBondContact O-CB 3.27Å; D290-D294 PolarHBondContact O-N 3.33Å; R291-D294 PolarHBondContact O-N 3.09Å; L292-D294 VanDerWaalsContact C-N 3.34Å; D294-K297 WeakPolarHBondContact OD1-CD 3.4Å; D294-K297 WeakPolarHBondContact OD1-CE 3.31Å; D294-K297 IonicContact OD1-NZ 2.8Å; D294-K297 PolarHBondContact OD1-NZ 3Å; D294-K297 IonicContact OD2-NZ 2.83Å; D294-K297 PolarHBondContact OD2-NZ 2.99Å
295	S	98	Very high	96.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-78.8	-20.7	175	74.8	0	0	0	0	113.6	R291 L292 Y293 R302	R291-S295 PolarHBondContact O-N 2.85Å; L292-S295 PolarHBondContact O-N 3.33Å; L292-S295 PolarHBondContact O-OG 2.8Å; Y293-S295 PolarHBondContact O-N 2.93Å; S295-R302 PolarHBondContact O-N 2.74Å
296	M	97.9	Very high	96.5	Very high	6 Å²	6	45.7 Å²	45.7	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-117.2	-4	-178.2	-61.5	179.9	-72.7	0	0	113.4	L292 Y293 T301 L306 F325 L333 I337 D340	L292-M296 HydrophobicContact CB-CE 4.37Å; L292-M296 WeakPolarHBondContact O-CE 3.49Å; L292-M296 PolarHBondContact O-N 2.62Å; Y293-M296 CarbonylContact O-C 3.59Å; Y293-M296 PolarHBondContact O-N 2.9Å; Y293-M296 VanDerWaalsContact O-N 3.1Å; M296-T301 HydrophobicContact CG-CG2 4.33Å; M296-L306 HydrophobicContact CE-CD1 4.28Å; M296-L306 HydrophobicContact CG-CD1 4.41Å; M296-L306 HydrophobicContact CG-CD2 4.09Å; M296-L306 HydrophobicContact SD-CD1 3.98Å; M296-L306 HydrophobicContact SD-CD2 4.06Å; M296-F325 HydrophobicContact CE-CE2 4.47Å; M296-F325 HydrophobicContact CE-CZ 4.45Å; M296-L333 HydrophobicContact CE-CD1 3.69Å; M296-I337 HydrophobicContact CE-CG1 4.28Å; M296-I337 HydrophobicContact SD-CG1 3.87Å; M296-D340 WeakPolarHBondContact CA-OD2 3.39Å; M296-D340 HydrophobicContact CB-CB 4.18Å; M296-D340 HydrophobicContact CG-CB 4.16Å; M296-D340 HydrophobicContact SD-CB 4.39Å
297	K	92.5	Very high	96.5	Very high	98 Å²	98	43.7 Å²	43.7	43%	0.426	23%	0.227	S	C	.	.	S	Bend	trans	-77.4	133.5	177.5	78.1	-175.8	178.4	-168.1	0	110.1	Y293 D294	Y293-K297 HydrophobicContact CD1-CB 4.16Å; Y293-K297 HydrophobicContact CD1-CD 3.86Å; Y293-K297 HydrophobicContact CE1-CB 3.82Å; Y293-K297 HydrophobicContact CE1-CD 3.64Å; Y293-K297 HydrophobicContact CE1-CG 4.34Å; Y293-K297 VanDerWaalsContact O-CB 3.31Å; Y293-K297 WeakPolarHBondContact O-CB 3.24Å; Y293-K297 PolarHBondContact O-N 3.31Å; D294-K297 WeakPolarHBondContact OD1-CD 3.4Å; D294-K297 WeakPolarHBondContact OD1-CE 3.31Å; D294-K297 IonicContact OD1-NZ 2.8Å; D294-K297 PolarHBondContact OD1-NZ 3Å; D294-K297 IonicContact OD2-NZ 2.83Å; D294-K297 PolarHBondContact OD2-NZ 2.99Å
298	G	88.7	Confident	96.5	Very high	70 Å²	70	43.5 Å²	43.5	72%	0.722	23%	0.226	S	C	*	.	S	Bend	trans	92.4	-146.7	171.6	0	0	0	0	0	113.2
299	K	86.4	Confident	96.5	Very high	217 Å²	217	43.5 Å²	43.5	94%	0.943	23%	0.226	S	C	*	.	S	Bend	trans	-91.4	114.2	-173.9	-174.8	-179.7	178.9	-179.4	0	110.4
300	G	90.8	Very high	96.5	Very high	48 Å²	48	43.5 Å²	43.5	50%	0.495	23%	0.226	S	C	.	.	S	Bend	trans	77.2	178.2	-179.7	0	0	0	0	0	112.5
301	T	94.9	Very high	96.5	Very high	33 Å²	33	43 Å²	43	20%	0.202	22%	0.224	C	C	.	.			trans	-115.1	140.3	-172.3	-44.9	0	0	0	0	110.5	M296 D303 L306 D340	M296-T301 HydrophobicContact CG-CG2 4.33Å; T301-D303 PolarHBondContact O-N 3.46Å; T301-D303 VanDerWaalsContact O-N 3.15Å; T301-L306 HydrophobicContact CG2-CB 4.5Å; T301-L306 HydrophobicContact CG2-CD2 3.68Å; T301-D340 VanDerWaalsContact CB-OD2 3.26Å; T301-D340 WeakPolarHBondContact CB-OD2 3.32Å; T301-D340 WeakPolarHBondContact CG2-OD2 3.44Å; T301-D340 VanDerWaalsContact OG1-CG 3.26Å; T301-D340 PolarHBondContact OG1-O 2.97Å; T301-D340 PolarHBondContact OG1-OD2 3.19Å
302	R	97.4	Very high	96.5	Very high	145 Å²	145	43 Å²	43	55%	0.547	23%	0.227	S	C	.	.			trans	-85.6	69.7	166.6	-58.8	179.4	-179.7	175.7	-2.2	108.9	S295 K304 V305 L306	S295-R302 PolarHBondContact O-N 2.74Å; R302-K304 PolarHBondContact O-N 2.79Å; R302-K304 VanDerWaalsContact O-N 3.09Å; R302-V305 HydrophobicContact CB-CB 4.48Å; R302-V305 HydrophobicContact CB-CG2 4.44Å; R302-V305 PolarHBondContact O-N 2.99Å; R302-L306 PolarHBondContact O-N 3.11Å; R302-L306 VanDerWaalsContact O-N 3.13Å
303	D	97.7	Very high	96.5	Very high	30 Å²	30	43.1 Å²	43.1	16%	0.16	23%	0.228	C	C	.	.	H	α-helix	trans	-54.1	-35	-169.8	-67.3	-75.7	0	0	0	113.8	H112 T301 V305 L306 I307 Y345	H112-D303 IonicContact CE1-OD2 2.7Å; H112-D303 IonicContact NE2-OD2 3.03Å; T301-D303 PolarHBondContact O-N 3.46Å; T301-D303 VanDerWaalsContact O-N 3.15Å; D303-V305 VanDerWaalsContact C-N 3.34Å; D303-V305 PolarHBondContact O-N 3.32Å; D303-L306 PolarHBondContact O-N 3.03Å; D303-I307 HydrophobicContact CB-CD1 4.32Å; D303-I307 VanDerWaalsContact O-CB 3.27Å; D303-I307 WeakPolarHBondContact O-CB 3.22Å; D303-I307 WeakPolarHBondContact O-CD1 3.45Å; D303-I307 WeakPolarHBondContact O-CG1 3.26Å; D303-I307 PolarHBondContact O-N 2.93Å; D303-Y345 WeakPolarHBondContact OD1-CE1 3.49Å; D303-Y345 VanDerWaalsContact OD1-CZ 3.26Å; D303-Y345 PolarHBondContact OD1-OH 3.11Å
304	K	97.1	Very high	96.5	Very high	86 Å²	86	40.3 Å²	40.3	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-57.8	-45.7	176.9	-171.2	-178.1	-179.2	-173	0	112.1	D142 R302 R308	D142-K304 IonicContact OD2-NZ 3.42Å; D142-K304 PolarHBondContact OD2-NZ 3.4Å; R302-K304 PolarHBondContact O-N 2.79Å; R302-K304 VanDerWaalsContact O-N 3.09Å; K304-R308 VanDerWaalsContact O-CB 3.31Å; K304-R308 WeakPolarHBondContact O-CB 3.38Å; K304-R308 PolarHBondContact O-N 2.81Å; K304-R308 VanDerWaalsContact O-N 3.14Å
305	V	98.1	Very high	96.5	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-46.4	179.4	178.8	0	0	0	0	110.3	R302 D303 I307 R308 I309	R302-V305 HydrophobicContact CB-CB 4.48Å; R302-V305 HydrophobicContact CB-CG2 4.44Å; R302-V305 PolarHBondContact O-N 2.99Å; D303-V305 VanDerWaalsContact C-N 3.34Å; D303-V305 PolarHBondContact O-N 3.32Å; V305-I307 PolarHBondContact O-N 3.23Å; V305-R308 PolarHBondContact O-N 2.88Å; V305-I309 HydrophobicContact CG1-CD1 3.71Å; V305-I309 HydrophobicContact CG1-CG1 4.47Å; V305-I309 WeakPolarHBondContact O-CG1 3.47Å; V305-I309 PolarHBondContact O-N 3.3Å
306	L	98.8	Very high	96.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-52.4	178.9	178.7	57.1	0	0	0	111.1	L292 M296 T301 R302 D303 R308 I309 M310 I337 T341 L349	L292-L306 HydrophobicContact CD2-CD1 3.6Å; M296-L306 HydrophobicContact CE-CD1 4.28Å; M296-L306 HydrophobicContact CG-CD1 4.41Å; M296-L306 HydrophobicContact CG-CD2 4.09Å; M296-L306 HydrophobicContact SD-CD1 3.98Å; M296-L306 HydrophobicContact SD-CD2 4.06Å; T301-L306 HydrophobicContact CG2-CB 4.5Å; T301-L306 HydrophobicContact CG2-CD2 3.68Å; R302-L306 PolarHBondContact O-N 3.11Å; R302-L306 VanDerWaalsContact O-N 3.13Å; D303-L306 PolarHBondContact O-N 3.03Å; L306-R308 PolarHBondContact O-N 3.46Å; L306-I309 PolarHBondContact O-N 3.33Å; L306-M310 HydrophobicContact CD1-CG 3.82Å; L306-M310 HydrophobicContact CG-CG 4.44Å; L306-M310 WeakPolarHBondContact O-CB 3.13Å; L306-M310 WeakPolarHBondContact O-CG 3.24Å; L306-M310 PolarHBondContact O-N 3.36Å; L306-I337 HydrophobicContact CD1-CG1 4.5Å; L306-T341 HydrophobicContact CD2-CG2 3.8Å; L306-L349 HydrophobicContact CD1-CD1 4.47Å; L306-L349 HydrophobicContact CD2-CD1 3.61Å; L306-L349 HydrophobicContact CG-CD1 3.84Å
307	I	98.9	Very high	96.5	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-48	-179.5	-67.8	169.7	0	0	0	110.8	H112 T115 V116 D303 V305 I309 M310 V311 Y345	H112-I307 HydrophobicContact CB-CD1 4.17Å; T115-I307 HydrophobicContact CG2-CD1 3.94Å; T115-I307 HydrophobicContact CG2-CG2 4.11Å; V116-I307 HydrophobicContact CG2-CB 4.35Å; V116-I307 HydrophobicContact CG2-CD1 3.99Å; V116-I307 HydrophobicContact CG2-CG1 3.71Å; V116-I307 HydrophobicContact CG2-CG2 3.84Å; D303-I307 HydrophobicContact CB-CD1 4.32Å; D303-I307 VanDerWaalsContact O-CB 3.27Å; D303-I307 WeakPolarHBondContact O-CB 3.22Å; D303-I307 WeakPolarHBondContact O-CD1 3.45Å; D303-I307 WeakPolarHBondContact O-CG1 3.26Å; D303-I307 PolarHBondContact O-N 2.93Å; V305-I307 PolarHBondContact O-N 3.23Å; I307-I309 PolarHBondContact O-N 2.84Å; I307-M310 PolarHBondContact O-N 3.27Å; I307-V311 HydrophobicContact CG2-CG2 4.16Å; I307-V311 WeakPolarHBondContact O-CB 3.39Å; I307-V311 VanDerWaalsContact O-CG2 3.3Å; I307-V311 WeakPolarHBondContact O-CG2 3.43Å; I307-V311 PolarHBondContact O-N 3.35Å; I307-Y345 HydrophobicContact CD1-CE2 3.9Å; I307-Y345 HydrophobicContact CG1-CE2 3.75Å
308	R	98.8	Very high	96.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-44	-177.3	-178.9	178.2	56.2	-117	2.7	112.7	Y127 E131 S145 E148 K304 V305 L306 S312	Y127-R308 HydrophobicContact CE1-CB 4.48Å; Y127-R308 HydrophobicContact CE1-CG 4.04Å; Y127-R308 VanDerWaalsContact OH-CA 3.26Å; Y127-R308 WeakPolarHBondContact OH-CA 3.47Å; E131-R308 HydrophobicContact CG-CG 4.21Å; E131-R308 WeakPolarHBondContact OE2-CD 3.38Å; E131-R308 IonicContact OE2-NH1 2.63Å; E131-R308 PolarHBondContact OE2-NH1 3.27Å; S145-R308 PolarHBondContact OG-NH1 3.49Å; S145-R308 PolarHBondContact OG-NH2 3.38Å; E148-R308 IonicContact OE1-CZ 3.51Å; E148-R308 IonicContact OE1-NE 2.66Å; E148-R308 PolarHBondContact OE1-NE 3.04Å; E148-R308 IonicContact OE1-NH2 3.8Å; E148-R308 PolarHBondContact OE1-NH2 3.05Å; E148-R308 IonicContact OE2-CZ 3.55Å; E148-R308 IonicContact OE2-NE 3.46Å; E148-R308 IonicContact OE2-NH2 3.75Å; E148-R308 PolarHBondContact OE2-NH2 3.45Å; K304-R308 VanDerWaalsContact O-CB 3.31Å; K304-R308 WeakPolarHBondContact O-CB 3.38Å; K304-R308 PolarHBondContact O-N 2.81Å; K304-R308 VanDerWaalsContact O-N 3.14Å; V305-R308 PolarHBondContact O-N 2.88Å; L306-R308 PolarHBondContact O-N 3.46Å; R308-S312 VanDerWaalsContact O-CB 3.24Å; R308-S312 WeakPolarHBondContact O-CB 3.21Å; R308-S312 PolarHBondContact O-N 3.48Å; R308-S312 PolarHBondContact O-OG 2.82Å
309	I	98.9	Very high	97.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-46.2	178.6	-62.3	170.4	0	0	0	110.2	F288 R291 L292 V305 L306 I307 V311 S312 R313	F288-I309 HydrophobicContact CB-CG2 4.24Å; F288-I309 HydrophobicContact CD1-CD1 4.07Å; F288-I309 HydrophobicContact CD1-CG1 3.96Å; F288-I309 HydrophobicContact CD1-CG2 3.86Å; F288-I309 HydrophobicContact CE1-CG1 4.28Å; F288-I309 HydrophobicContact CG-CG2 4.32Å; R291-I309 HydrophobicContact CB-CD1 3.52Å; L292-I309 HydrophobicContact CD1-CG2 3.84Å; L292-I309 HydrophobicContact CD2-CB 3.89Å; L292-I309 HydrophobicContact CD2-CD1 4.29Å; L292-I309 HydrophobicContact CD2-CG2 3.8Å; L292-I309 HydrophobicContact CG-CB 4.29Å; L292-I309 HydrophobicContact CG-CD1 4.18Å; L292-I309 HydrophobicContact CG-CG2 3.75Å; V305-I309 HydrophobicContact CG1-CD1 3.71Å; V305-I309 HydrophobicContact CG1-CG1 4.47Å; V305-I309 WeakPolarHBondContact O-CG1 3.47Å; V305-I309 PolarHBondContact O-N 3.3Å; L306-I309 PolarHBondContact O-N 3.33Å; I307-I309 PolarHBondContact O-N 2.84Å; I309-V311 VanDerWaalsContact C-N 3.3Å; I309-V311 PolarHBondContact O-N 2.83Å; I309-S312 PolarHBondContact O-N 3.15Å; I309-R313 HydrophobicContact CG2-CG 3.83Å; I309-R313 VanDerWaalsContact O-CB 3.3Å; I309-R313 WeakPolarHBondContact O-CB 3.29Å; I309-R313 VanDerWaalsContact O-CG 3.31Å; I309-R313 WeakPolarHBondContact O-CG 3.33Å; I309-R313 PolarHBondContact O-N 2.7Å
310	M	98.9	Very high	97.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-38	-179.3	-67.3	-55	-64	0	0	112.3	L292 L306 I307 S314 M318 L333 I337 L349 L352 C353	L292-M310 HydrophobicContact CD1-SD 4.42Å; L292-M310 HydrophobicContact CD2-CG 4.25Å; L292-M310 HydrophobicContact CD2-SD 3.97Å; L306-M310 HydrophobicContact CD1-CG 3.82Å; L306-M310 HydrophobicContact CG-CG 4.44Å; L306-M310 WeakPolarHBondContact O-CB 3.13Å; L306-M310 WeakPolarHBondContact O-CG 3.24Å; L306-M310 PolarHBondContact O-N 3.36Å; I307-M310 PolarHBondContact O-N 3.27Å; M310-S314 VanDerWaalsContact O-CB 3.26Å; M310-S314 WeakPolarHBondContact O-CB 3.33Å; M310-S314 PolarHBondContact O-N 3.21Å; M310-M318 HydrophobicContact CE-CE 3.89Å; M310-M318 HydrophobicContact CE-SD 4.22Å; M310-M318 HydrophobicContact SD-CE 3.72Å; M310-M318 HydrophobicContact SD-SD 4.21Å; M310-L333 HydrophobicContact SD-CD2 4.13Å; M310-I337 HydrophobicContact CE-CD1 3.73Å; M310-I337 HydrophobicContact SD-CD1 4.04Å; M310-L349 HydrophobicContact CB-CD2 3.88Å; M310-L349 WeakPolarHBondContact CE-O 3.44Å; M310-L349 HydrophobicContact CG-CD2 4.08Å; M310-L352 HydrophobicContact CB-CD1 4.34Å; M310-L352 HydrophobicContact CE-CB 4.18Å; M310-C353 HydrophobicContact CE-CB 3.72Å
311	V	98.8	Very high	98.2	Very high	13 Å²	13	29.1 Å²	29.1	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-71.1	-58.2	175	171.7	0	0	0	0	110.7	L120 Y127 I307 I309 R313 S314 L352	L120-V311 HydrophobicContact CD2-CB 4.47Å; L120-V311 HydrophobicContact CD2-CG1 4.12Å; L120-V311 HydrophobicContact CD2-CG2 4.11Å; L120-V311 HydrophobicContact CG-CG2 4.23Å; Y127-V311 HydrophobicContact CD1-CG1 3.84Å; Y127-V311 HydrophobicContact CE1-CB 3.86Å; Y127-V311 HydrophobicContact CE1-CG1 3.63Å; Y127-V311 HydrophobicContact CG-CG1 4.39Å; I307-V311 HydrophobicContact CG2-CG2 4.16Å; I307-V311 WeakPolarHBondContact O-CB 3.39Å; I307-V311 VanDerWaalsContact O-CG2 3.3Å; I307-V311 WeakPolarHBondContact O-CG2 3.43Å; I307-V311 PolarHBondContact O-N 3.35Å; I309-V311 VanDerWaalsContact C-N 3.3Å; I309-V311 PolarHBondContact O-N 2.83Å; V311-R313 VanDerWaalsContact C-N 3.31Å; V311-R313 PolarHBondContact O-N 3.03Å; V311-S314 PolarHBondContact O-N 3.02Å; V311-S314 PolarHBondContact O-OG 2.85Å; V311-L352 HydrophobicContact CG2-CD1 4.23Å
312	S	98.7	Very high	98.4	Very high	23 Å²	23	28.3 Å²	28.3	16%	0.161	13%	0.133	C	C	.	.	H	α-helix	trans	-68.6	-25.4	-169.9	63.6	0	0	0	0	114.3	R308 I309	R308-S312 VanDerWaalsContact O-CB 3.24Å; R308-S312 WeakPolarHBondContact O-CB 3.21Å; R308-S312 PolarHBondContact O-N 3.48Å; R308-S312 PolarHBondContact O-OG 2.82Å; I309-S312 PolarHBondContact O-N 3.15Å
313	R	98.7	Very high	98.5	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-100.6	-10.6	-177.2	-50	-46.9	-62.9	173.3	-8.6	114	F288 I309 V311 E315 V316 D317 M318 I321	F288-R313 HydrophobicContact CD1-CG 4.36Å; F288-R313 HydrophobicContact CD2-CG 4.24Å; F288-R313 HydrophobicContact CE1-CG 4.41Å; F288-R313 HydrophobicContact CE2-CG 4.3Å; F288-R313 HydrophobicContact CG-CG 4.28Å; F288-R313 HydrophobicContact CZ-CG 4.38Å; I309-R313 HydrophobicContact CG2-CG 3.83Å; I309-R313 VanDerWaalsContact O-CB 3.3Å; I309-R313 WeakPolarHBondContact O-CB 3.29Å; I309-R313 VanDerWaalsContact O-CG 3.31Å; I309-R313 WeakPolarHBondContact O-CG 3.33Å; I309-R313 PolarHBondContact O-N 2.7Å; V311-R313 VanDerWaalsContact C-N 3.31Å; V311-R313 PolarHBondContact O-N 3.03Å; R313-E315 PolarHBondContact O-N 2.83Å; R313-V316 VanDerWaalsContact NH2-CG1 3.34Å; R313-V316 PolarHBondContact O-N 3.41Å; R313-D317 IonicContact CZ-OD1 2.85Å; R313-D317 VanDerWaalsContact CZ-OD1 3.3Å; R313-D317 IonicContact CZ-OD2 2.8Å; R313-D317 IonicContact NE-OD1 3.91Å; R313-D317 PolarHBondContact NE-OD1 3.33Å; R313-D317 IonicContact NE-OD2 3.58Å; R313-D317 IonicContact NH2-OD1 3.07Å; R313-D317 PolarHBondContact NH2-OD1 3.42Å; R313-D317 IonicContact NH2-OD2 3.56Å; R313-D317 PolarHBondContact NH2-OD2 3.29Å; R313-D317 PolarHBondContact O-N 3.48Å; R313-M318 HydrophobicContact CB-CE 3.99Å; R313-M318 PolarHBondContact O-N 2.88Å; R313-I321 HydrophobicContact CB-CD1 3.66Å; R313-I321 HydrophobicContact CG-CD1 3.84Å
314	S	98.6	Very high	98.5	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.021	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-34.3	-176.8	56.6	0	0	0	0	114	G43 S44 V45 M310 V311	G43-S314 CarbonylContact C-O 3.53Å; G43-S314 WeakPolarHBondContact CA-O 3.18Å; S44-S314 PolarHBondContact N-O 3.49Å; S44-S314 PolarHBondContact OG-O 3.36Å; V45-S314 PolarHBondContact N-O 3.43Å; M310-S314 VanDerWaalsContact O-CB 3.26Å; M310-S314 WeakPolarHBondContact O-CB 3.33Å; M310-S314 PolarHBondContact O-N 3.21Å; V311-S314 PolarHBondContact O-N 3.02Å; V311-S314 PolarHBondContact O-OG 2.85Å
315	E	98.4	Very high	98.6	Very high	53 Å²	53	20.1 Å²	20.1	25%	0.248	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	11.9	-179.1	-64.7	179.2	-136.1	0	0	112.5	V45 S82 N83 R86 R313	V45-E315 HydrophobicContact CB-CG 3.84Å; V45-E315 HydrophobicContact CG1-CG 4.18Å; S82-E315 WeakPolarHBondContact CA-OE2 3.33Å; N83-E315 VanDerWaalsContact N-CD 3.28Å; N83-E315 PolarHBondContact N-OE1 3.41Å; N83-E315 PolarHBondContact N-OE2 2.99Å; R86-E315 IonicContact CZ-OE1 3.58Å; R86-E315 IonicContact NH1-OE1 2.74Å; R86-E315 PolarHBondContact NH1-OE1 2.89Å; R86-E315 IonicContact NH2-OE1 3.64Å; R86-E315 PolarHBondContact NH2-OE1 2.93Å; R313-E315 PolarHBondContact O-N 2.83Å
316	V	97.9	Very high	98.6	Very high	44 Å²	44	22.8 Å²	22.8	27%	0.267	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-69.7	-175.1	-172.9	0	0	0	0	112.1	S40 Y42 R313	S40-V316 VanDerWaalsContact CB-O 3.28Å; S40-V316 WeakPolarHBondContact CB-O 3.41Å; S40-V316 PolarHBondContact OG-O 3.47Å; Y42-V316 CarbonylContact C-O 3.27Å; R313-V316 VanDerWaalsContact NH2-CG1 3.34Å; R313-V316 PolarHBondContact O-N 3.41Å
317	D	98.1	Very high	98.6	Very high	15 Å²	15	30 Å²	30	8%	0.08	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-146.8	19.7	-170.5	58.4	-4.1	0	0	0	113.6	Y42 R313 L319 K320 I321	Y42-D317 CarbonylContact O-C 3.58Å; Y42-D317 WeakPolarHBondContact O-CA 3.45Å; R313-D317 IonicContact CZ-OD1 2.85Å; R313-D317 VanDerWaalsContact CZ-OD1 3.3Å; R313-D317 IonicContact CZ-OD2 2.8Å; R313-D317 IonicContact NE-OD1 3.91Å; R313-D317 PolarHBondContact NE-OD1 3.33Å; R313-D317 IonicContact NE-OD2 3.58Å; R313-D317 IonicContact NH2-OD1 3.07Å; R313-D317 PolarHBondContact NH2-OD1 3.42Å; R313-D317 IonicContact NH2-OD2 3.56Å; R313-D317 PolarHBondContact NH2-OD2 3.29Å; R313-D317 PolarHBondContact O-N 3.48Å; D317-L319 PolarHBondContact O-N 2.75Å; D317-L319 VanDerWaalsContact O-N 3.11Å; D317-K320 WeakPolarHBondContact O-CA 3.21Å; D317-K320 WeakPolarHBondContact O-CB 3.42Å; D317-K320 PolarHBondContact O-N 3.39Å; D317-I321 WeakPolarHBondContact O-CG1 3.24Å; D317-I321 PolarHBondContact O-N 3.48Å; D317-I321 WeakPolarHBondContact OD1-CD1 3.31Å
318	M	98.7	Very high	98.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-51.3	-36.9	179.7	-171.5	57	69.8	0	0	113.4	Y42 S44 M310 R313 K320 I321 R322 L333	Y42-M318 PolarHBondContact O-N 2.71Å; S44-M318 WeakPolarHBondContact OG-CB 3.47Å; S44-M318 WeakPolarHBondContact OG-CG 3.16Å; M310-M318 HydrophobicContact CE-CE 3.89Å; M310-M318 HydrophobicContact CE-SD 4.22Å; M310-M318 HydrophobicContact SD-CE 3.72Å; M310-M318 HydrophobicContact SD-SD 4.21Å; R313-M318 HydrophobicContact CB-CE 3.99Å; R313-M318 PolarHBondContact O-N 2.88Å; M318-K320 VanDerWaalsContact C-N 3.35Å; M318-K320 PolarHBondContact O-N 2.96Å; M318-I321 PolarHBondContact O-N 3.11Å; M318-R322 HydrophobicContact CG-CG 4.49Å; M318-R322 WeakPolarHBondContact O-CB 3.28Å; M318-R322 WeakPolarHBondContact O-CD 3.35Å; M318-R322 VanDerWaalsContact O-CG 3.26Å; M318-R322 WeakPolarHBondContact O-CG 3.4Å; M318-R322 PolarHBondContact O-N 3.49Å; M318-L333 HydrophobicContact SD-CD2 3.94Å
319	L	98.4	Very high	98.5	Very high	59 Å²	59	37 Å²	37	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-66.2	-36.3	177.5	-60.3	-176.5	0	0	0	112.4	Y42 D317 R322 S323	Y42-L319 WeakPolarHBondContact O-CB 3.48Å; Y42-L319 WeakPolarHBondContact O-CG 3.22Å; Y42-L319 PolarHBondContact O-N 3.35Å; D317-L319 PolarHBondContact O-N 2.75Å; D317-L319 VanDerWaalsContact O-N 3.11Å; L319-R322 VanDerWaalsContact CD2-NH1 3.26Å; L319-S323 PolarHBondContact O-N 3.26Å
320	K	98.5	Very high	98.4	Very high	87 Å²	87	39.6 Å²	39.6	38%	0.378	20%	0.203	S	C	.	.	H	α-helix	trans	-70.8	-42.9	173.9	-66.9	-177.9	175.9	176.2	0	110.7	Y42 P285 D317 M318 R322 S323 E324	Y42-K320 HydrophobicContact CD1-CD 4.18Å; Y42-K320 VanDerWaalsContact CD1-CE 3.42Å; Y42-K320 HydrophobicContact CD1-CG 3.87Å; Y42-K320 VanDerWaalsContact CE1-CE 3.42Å; Y42-K320 HydrophobicContact CE1-CG 4.47Å; Y42-K320 HydrophobicContact CG-CD 4.15Å; Y42-K320 VanDerWaalsContact CG-CE 3.49Å; Y42-K320 HydrophobicContact CG-CG 4.14Å; P285-K320 HydrophobicContact CB-CB 3.74Å; P285-K320 HydrophobicContact CG-CB 3.75Å; P285-K320 HydrophobicContact CG-CD 4.08Å; D317-K320 WeakPolarHBondContact O-CA 3.21Å; D317-K320 WeakPolarHBondContact O-CB 3.42Å; D317-K320 PolarHBondContact O-N 3.39Å; M318-K320 VanDerWaalsContact C-N 3.35Å; M318-K320 PolarHBondContact O-N 2.96Å; K320-R322 VanDerWaalsContact C-N 3.32Å; K320-R322 PolarHBondContact O-N 2.67Å; K320-S323 WeakPolarHBondContact O-CB 3.42Å; K320-S323 PolarHBondContact O-N 2.95Å; K320-E324 WeakPolarHBondContact O-CG 3.37Å; K320-E324 PolarHBondContact O-N 2.92Å
321	I	98.8	Very high	98.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-47.5	177	-66.4	169.3	0	0	0	110.3	P285 F288 A289 L292 R313 D317 M318 S323 E324 F325	P285-I321 HydrophobicContact CB-CG1 4.24Å; F288-I321 HydrophobicContact CB-CD1 3.61Å; F288-I321 HydrophobicContact CB-CG1 3.93Å; F288-I321 HydrophobicContact CB-CG2 4.33Å; F288-I321 HydrophobicContact CD2-CD1 4.14Å; F288-I321 HydrophobicContact CG-CD1 4.12Å; A289-I321 HydrophobicContact CB-CG2 4.26Å; L292-I321 HydrophobicContact CD1-CG2 3.61Å; R313-I321 HydrophobicContact CB-CD1 3.66Å; R313-I321 HydrophobicContact CG-CD1 3.84Å; D317-I321 WeakPolarHBondContact O-CG1 3.24Å; D317-I321 PolarHBondContact O-N 3.48Å; D317-I321 WeakPolarHBondContact OD1-CD1 3.31Å; M318-I321 PolarHBondContact O-N 3.11Å; I321-S323 PolarHBondContact O-N 3.45Å; I321-E324 PolarHBondContact O-N 3.36Å; I321-F325 VanDerWaalsContact O-CB 3.26Å; I321-F325 WeakPolarHBondContact O-CB 3.43Å; I321-F325 PolarHBondContact O-N 3.43Å
322	R	98.6	Very high	98.3	Very high	17 Å²	17	43.9 Å²	43.9	6%	0.064	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-46.9	175.5	-77.6	164.5	53.6	-177.3	-6.4	112.7	M318 L319 K320 F325 K326 L333 C353 G354 D357	M318-R322 HydrophobicContact CG-CG 4.49Å; M318-R322 WeakPolarHBondContact O-CB 3.28Å; M318-R322 WeakPolarHBondContact O-CD 3.35Å; M318-R322 VanDerWaalsContact O-CG 3.26Å; M318-R322 WeakPolarHBondContact O-CG 3.4Å; M318-R322 PolarHBondContact O-N 3.49Å; L319-R322 VanDerWaalsContact CD2-NH1 3.26Å; K320-R322 VanDerWaalsContact C-N 3.32Å; K320-R322 PolarHBondContact O-N 2.67Å; R322-F325 PolarHBondContact O-N 2.93Å; R322-K326 WeakPolarHBondContact O-CB 3.37Å; R322-K326 PolarHBondContact O-N 3.24Å; R322-L333 HydrophobicContact CG-CB 4.39Å; R322-L333 HydrophobicContact CG-CD2 4.09Å; R322-C353 WeakPolarHBondContact CD-O 3.38Å; R322-C353 PolarHBondContact NH1-O 3.01Å; R322-G354 VanDerWaalsContact NH1-C 3.33Å; R322-G354 PolarHBondContact NH1-O 3.18Å; R322-D357 WeakPolarHBondContact CB-OD2 3.38Å; R322-D357 IonicContact CZ-OD1 2.77Å; R322-D357 IonicContact CZ-OD2 3.7Å; R322-D357 IonicContact NE-OD1 2.67Å; R322-D357 IonicContact NE-OD2 3.72Å; R322-D357 PolarHBondContact NE-OD2 2.66Å; R322-D357 IonicContact NH2-OD1 2.71Å; R322-D357 PolarHBondContact NH2-OD1 2.72Å; R322-D357 IonicContact NH2-OD2 2.71Å; R322-D357 PolarHBondContact NH2-OD2 3.48Å
323	S	98.3	Very high	98.3	Very high	66 Å²	66	42.8 Å²	42.8	46%	0.462	21%	0.214	S	C	.	.	H	α-helix	trans	-60.1	-48.2	177.1	175.4	0	0	0	0	112.1	L319 K320 I321 R327	L319-S323 PolarHBondContact O-N 3.26Å; K320-S323 WeakPolarHBondContact O-CB 3.42Å; K320-S323 PolarHBondContact O-N 2.95Å; I321-S323 PolarHBondContact O-N 3.45Å; S323-R327 VanDerWaalsContact O-CB 3.31Å; S323-R327 WeakPolarHBondContact O-CB 3.32Å; S323-R327 PolarHBondContact O-N 3.02Å
324	E	98.6	Very high	98.3	Very high	23 Å²	23	45.2 Å²	45.2	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-42.8	177.2	-63.7	-68.6	123.9	0	0	111.8	N283 P285 L286 A289 K320 I321 R327 K328	N283-E324 PolarHBondContact ND2-OE2 2.94Å; P285-E324 HydrophobicContact CB-CG 3.81Å; L286-E324 HydrophobicContact CB-CB 4.43Å; L286-E324 HydrophobicContact CB-CG 4.34Å; L286-E324 WeakPolarHBondContact CB-OE2 3.5Å; L286-E324 HydrophobicContact CD1-CB 4.22Å; A289-E324 HydrophobicContact CB-CB 4.1Å; K320-E324 WeakPolarHBondContact O-CG 3.37Å; K320-E324 PolarHBondContact O-N 2.92Å; I321-E324 PolarHBondContact O-N 3.36Å; E324-R327 VanDerWaalsContact CD-NH1 3.31Å; E324-R327 PolarHBondContact O-N 3.28Å; E324-R327 IonicContact OE1-CZ 2.63Å; E324-R327 IonicContact OE1-NH1 3.46Å; E324-R327 PolarHBondContact OE1-NH1 3.27Å; E324-R327 IonicContact OE1-NH2 3.22Å; E324-R327 PolarHBondContact OE1-NH2 2.74Å; E324-R327 IonicContact OE2-CZ 2.94Å; E324-R327 IonicContact OE2-NH1 2.76Å; E324-R327 IonicContact OE2-NH2 2.7Å; E324-R327 PolarHBondContact OE2-NH2 3.24Å; E324-K328 WeakPolarHBondContact O-CB 3.47Å; E324-K328 PolarHBondContact O-N 3.29Å
325	F	98.7	Very high	98.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-53.2	178.8	-167.3	-73.3	0	0	0	111.2	A289 L292 Y293 M296 I321 R322 R327 K328 Y329 L333 Y336	A289-F325 HydrophobicContact CB-CB 3.84Å; A289-F325 HydrophobicContact CB-CD2 4.07Å; A289-F325 HydrophobicContact CB-CG 4.43Å; A289-F325 WeakPolarHBondContact O-CD2 3.45Å; L292-F325 HydrophobicContact CB-CD2 4.33Å; L292-F325 HydrophobicContact CB-CE2 4.09Å; Y293-F325 HydrophobicContact CD2-CZ 4.09Å; M296-F325 HydrophobicContact CE-CE2 4.47Å; M296-F325 HydrophobicContact CE-CZ 4.45Å; I321-F325 VanDerWaalsContact O-CB 3.26Å; I321-F325 WeakPolarHBondContact O-CB 3.43Å; I321-F325 PolarHBondContact O-N 3.43Å; R322-F325 PolarHBondContact O-N 2.93Å; F325-R327 VanDerWaalsContact C-N 3.3Å; F325-R327 PolarHBondContact O-N 2.69Å; F325-K328 PolarHBondContact O-N 3.17Å; F325-Y329 AromaticContact CD1-CD2 3.97Å; F325-Y329 HydrophobicContact CD1-CD2 3.97Å; F325-Y329 AromaticContact CD2-CD2 3.97Å; F325-Y329 HydrophobicContact CD2-CD2 3.97Å; F325-Y329 HydrophobicContact CD2-CE2 4.24Å; F325-Y329 HydrophobicContact CE1-CD2 4.03Å; F325-Y329 HydrophobicContact CE1-CG 4.4Å; F325-Y329 HydrophobicContact CE2-CD2 4.06Å; F325-Y329 HydrophobicContact CE2-CE2 4.33Å; F325-Y329 AromaticContact CG-CD2 3.93Å; F325-Y329 HydrophobicContact CG-CD2 3.93Å; F325-Y329 HydrophobicContact CZ-CD2 4.08Å; F325-Y329 WeakPolarHBondContact O-CB 3.21Å; F325-Y329 WeakPolarHBondContact O-CD2 3.47Å; F325-Y329 PolarHBondContact O-N 3.21Å; F325-L333 HydrophobicContact CB-CB 4.39Å; F325-L333 HydrophobicContact CD1-CB 4.05Å; F325-L333 HydrophobicContact CD2-CB 4.36Å; F325-L333 HydrophobicContact CD2-CD1 4Å; F325-L333 HydrophobicContact CE1-CB 4.45Å; F325-L333 HydrophobicContact CE2-CD1 3.85Å; F325-L333 HydrophobicContact CG-CB 4.01Å; F325-L333 HydrophobicContact CG-CD1 4.49Å; F325-L333 HydrophobicContact CZ-CD1 4.24Å; F325-Y336 AromaticContact CE1-CD2 3.51Å; F325-Y336 HydrophobicContact CE1-CD2 3.51Å; F325-Y336 AromaticContact CE1-CE2 3.88Å; F325-Y336 HydrophobicContact CE1-CE2 3.88Å; F325-Y336 HydrophobicContact CE1-CG 4.1Å; F325-Y336 HydrophobicContact CZ-CD1 4.5Å; F325-Y336 AromaticContact CZ-CD2 3.81Å; F325-Y336 HydrophobicContact CZ-CD2 3.81Å; F325-Y336 HydrophobicContact CZ-CE2 4.27Å; F325-Y336 AromaticContact CZ-CG 3.92Å; F325-Y336 HydrophobicContact CZ-CG 3.92Å
326	K	98.3	Very high	98.2	Very high	69 Å²	69	48.3 Å²	48.3	30%	0.3	23%	0.233	S	C	.	.	H	α-helix	trans	-58.5	-43.7	178	-178	73.5	-178.3	-76.9	0	110.7	R322 K328 G330 D357	R322-K326 WeakPolarHBondContact O-CB 3.37Å; R322-K326 PolarHBondContact O-N 3.24Å; K326-K328 PolarHBondContact O-N 3.22Å; K326-G330 WeakPolarHBondContact CE-O 3.36Å; K326-G330 WeakPolarHBondContact O-CA 3.29Å; K326-G330 PolarHBondContact O-N 2.97Å; K326-D357 PolarHBondContact NZ-O 3.31Å; K326-D357 PolarHBondContact NZ-OXT 2.75Å
327	R	98.3	Very high	98.3	Very high	151 Å²	151	46.2 Å²	46.2	57%	0.57	22%	0.22	S	C	*	.	H	α-helix	trans	-62.7	-40.5	179.6	-169.6	178.9	71.2	-124.2	0.4	112.5	S323 E324 F325	S323-R327 VanDerWaalsContact O-CB 3.31Å; S323-R327 WeakPolarHBondContact O-CB 3.32Å; S323-R327 PolarHBondContact O-N 3.02Å; E324-R327 VanDerWaalsContact CD-NH1 3.31Å; E324-R327 PolarHBondContact O-N 3.28Å; E324-R327 IonicContact OE1-CZ 2.63Å; E324-R327 IonicContact OE1-NH1 3.46Å; E324-R327 PolarHBondContact OE1-NH1 3.27Å; E324-R327 IonicContact OE1-NH2 3.22Å; E324-R327 PolarHBondContact OE1-NH2 2.74Å; E324-R327 IonicContact OE2-CZ 2.94Å; E324-R327 IonicContact OE2-NH1 2.76Å; E324-R327 IonicContact OE2-NH2 2.7Å; E324-R327 PolarHBondContact OE2-NH2 3.24Å; F325-R327 VanDerWaalsContact C-N 3.3Å; F325-R327 PolarHBondContact O-N 2.69Å
328	K	98.5	Very high	98.3	Very high	104 Å²	104	48.6 Å²	48.6	45%	0.452	23%	0.231	S	C	.	.	H	α-helix	trans	-84.5	-38.2	-176.1	-175.9	164.8	173.7	179	0	113.8	L286 D290 E324 F325 K326	L286-K328 HydrophobicContact CD1-CD 3.74Å; D290-K328 VanDerWaalsContact OD1-CD 3.31Å; D290-K328 WeakPolarHBondContact OD1-CD 3.26Å; D290-K328 VanDerWaalsContact OD1-CE 3.27Å; D290-K328 WeakPolarHBondContact OD1-CE 3.08Å; D290-K328 IonicContact OD1-NZ 3.6Å; D290-K328 PolarHBondContact OD1-NZ 3.13Å; D290-K328 IonicContact OD2-NZ 2.69Å; D290-K328 PolarHBondContact OD2-NZ 2.66Å; E324-K328 WeakPolarHBondContact O-CB 3.47Å; E324-K328 PolarHBondContact O-N 3.29Å; F325-K328 PolarHBondContact O-N 3.17Å; K326-K328 PolarHBondContact O-N 3.22Å
329	Y	97.8	Very high	98.2	Very high	45 Å²	45	53.8 Å²	53.8	18%	0.176	26%	0.255	C	S	.	.	H	α-helix	trans	-107.8	-2.2	-171.2	-59.2	-67.5	0	0	0	114.3	D290 Y293 F325 K331	D290-Y329 WeakPolarHBondContact CA-OH 3.46Å; D290-Y329 PolarHBondContact OD1-OH 3.39Å; Y293-Y329 VanDerWaalsContact CB-CE2 3.49Å; Y293-Y329 WeakPolarHBondContact CB-OH 3.23Å; Y293-Y329 HydrophobicContact CD1-CD1 4.19Å; Y293-Y329 AromaticContact CD1-CE1 3.46Å; Y293-Y329 HydrophobicContact CD1-CE1 3.46Å; Y293-Y329 VanDerWaalsContact CD1-CE1 3.46Å; Y293-Y329 AromaticContact CD1-CZ 3.67Å; Y293-Y329 AromaticContact CD2-CD1 3.43Å; Y293-Y329 HydrophobicContact CD2-CD1 3.43Å; Y293-Y329 VanDerWaalsContact CD2-CD1 3.43Å; Y293-Y329 AromaticContact CD2-CD2 3.99Å; Y293-Y329 HydrophobicContact CD2-CD2 3.99Å; Y293-Y329 AromaticContact CD2-CE1 3.54Å; Y293-Y329 HydrophobicContact CD2-CE1 3.54Å; Y293-Y329 HydrophobicContact CD2-CE2 4.1Å; Y293-Y329 AromaticContact CD2-CG 3.65Å; Y293-Y329 HydrophobicContact CD2-CG 3.65Å; Y293-Y329 AromaticContact CD2-CZ 3.86Å; Y293-Y329 HydrophobicContact CE1-CD1 4.25Å; Y293-Y329 AromaticContact CE1-CE1 3.74Å; Y293-Y329 HydrophobicContact CE1-CE1 3.74Å; Y293-Y329 AromaticContact CE2-CD1 3.5Å; Y293-Y329 HydrophobicContact CE2-CD1 3.5Å; Y293-Y329 AromaticContact CE2-CE1 3.81Å; Y293-Y329 HydrophobicContact CE2-CE1 3.81Å; Y293-Y329 HydrophobicContact CE2-CG 4.03Å; Y293-Y329 AromaticContact CG-CD1 3.79Å; Y293-Y329 HydrophobicContact CG-CD1 3.79Å; Y293-Y329 HydrophobicContact CG-CD2 4.2Å; Y293-Y329 AromaticContact CG-CE1 3.35Å; Y293-Y329 HydrophobicContact CG-CE1 3.35Å; Y293-Y329 AromaticContact CG-CE2 3.82Å; Y293-Y329 HydrophobicContact CG-CE2 3.82Å; Y293-Y329 HydrophobicContact CG-CG 4.18Å; Y293-Y329 AromaticContact CG-CZ 3.35Å; Y293-Y329 AromaticContact CZ-CD1 3.93Å; Y293-Y329 AromaticContact CZ-CE1 3.91Å; F325-Y329 AromaticContact CD1-CD2 3.97Å; F325-Y329 HydrophobicContact CD1-CD2 3.97Å; F325-Y329 AromaticContact CD2-CD2 3.97Å; F325-Y329 HydrophobicContact CD2-CD2 3.97Å; F325-Y329 HydrophobicContact CD2-CE2 4.24Å; F325-Y329 HydrophobicContact CE1-CD2 4.03Å; F325-Y329 HydrophobicContact CE1-CG 4.4Å; F325-Y329 HydrophobicContact CE2-CD2 4.06Å; F325-Y329 HydrophobicContact CE2-CE2 4.33Å; F325-Y329 AromaticContact CG-CD2 3.93Å; F325-Y329 HydrophobicContact CG-CD2 3.93Å; F325-Y329 HydrophobicContact CZ-CD2 4.08Å; F325-Y329 WeakPolarHBondContact O-CB 3.21Å; F325-Y329 WeakPolarHBondContact O-CD2 3.47Å; F325-Y329 PolarHBondContact O-N 3.21Å; Y329-K331 PolarHBondContact O-N 3.25Å
330	G	97.1	Very high	98.1	Very high	56 Å²	56	53 Å²	53	58%	0.577	25%	0.251	S	S	*	.	S	Bend	trans	76.8	-32.6	173.5	0	0	0	0	0	115.2	K326	K326-G330 WeakPolarHBondContact CE-O 3.36Å; K326-G330 WeakPolarHBondContact O-CA 3.29Å; K326-G330 PolarHBondContact O-N 2.97Å
331	K	97.3	Very high	98.1	Very high	97 Å²	97	49.1 Å²	49.1	42%	0.422	24%	0.235	S	C	.	.	S	Bend	trans	-104.3	155.8	170.5	-52.3	-177.4	179.3	172.2	0	110.8	Y329 Y335 Y336	Y329-K331 PolarHBondContact O-N 3.25Å; K331-Y335 HydrophobicContact CB-CD1 3.87Å; K331-Y335 HydrophobicContact CB-CG 4.16Å; K331-Y335 HydrophobicContact CD-CD1 3.46Å; K331-Y335 VanDerWaalsContact CD-CD1 3.46Å; K331-Y335 HydrophobicContact CD-CD2 4.39Å; K331-Y335 HydrophobicContact CD-CE1 3.26Å; K331-Y335 HydrophobicContact CD-CE2 4.18Å; K331-Y335 HydrophobicContact CD-CG 4.05Å; K331-Y335 HydrophobicContact CG-CD1 4.31Å; K331-Y335 PolarHBondContact NZ-OH 3.36Å; K331-Y336 HydrophobicContact CB-CD2 4.28Å; K331-Y336 HydrophobicContact CB-CE2 3.85Å
332	S	98.3	Very high	98	Very high	5 Å²	5	55.2 Å²	55.2	4%	0.035	26%	0.261	C	S	.	.			trans	-67.3	155.3	-178.5	64.5	0	0	0	0	111.9	Y334 Y335 Y336 D356	S332-Y334 PolarHBondContact O-N 3.39Å; S332-Y335 WeakPolarHBondContact O-CB 3.26Å; S332-Y335 PolarHBondContact O-N 2.8Å; S332-Y335 WeakPolarHBondContact OG-CB 3.44Å; S332-Y335 PolarHBondContact OG-N 3.1Å; S332-Y336 WeakPolarHBondContact O-CD2 3.49Å; S332-Y336 PolarHBondContact O-N 3.06Å; S332-D356 WeakPolarHBondContact CB-OD1 3.4Å; S332-D356 PolarHBondContact OG-OD1 3.25Å
333	L	98.6	Very high	98	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-40.5	169.3	173.3	60.4	0	0	0	110.8	L292 M296 M310 M318 R322 F325 Y335 Y336 I337	L292-L333 HydrophobicContact CB-CD1 4.07Å; L292-L333 HydrophobicContact CD1-CD1 3.91Å; L292-L333 HydrophobicContact CD1-CD2 3.76Å; L292-L333 HydrophobicContact CG-CD1 4.4Å; M296-L333 HydrophobicContact CE-CD1 3.69Å; M310-L333 HydrophobicContact SD-CD2 4.13Å; M318-L333 HydrophobicContact SD-CD2 3.94Å; R322-L333 HydrophobicContact CG-CB 4.39Å; R322-L333 HydrophobicContact CG-CD2 4.09Å; F325-L333 HydrophobicContact CB-CB 4.39Å; F325-L333 HydrophobicContact CD1-CB 4.05Å; F325-L333 HydrophobicContact CD2-CB 4.36Å; F325-L333 HydrophobicContact CD2-CD1 4Å; F325-L333 HydrophobicContact CE1-CB 4.45Å; F325-L333 HydrophobicContact CE2-CD1 3.85Å; F325-L333 HydrophobicContact CG-CB 4.01Å; F325-L333 HydrophobicContact CG-CD1 4.49Å; F325-L333 HydrophobicContact CZ-CD1 4.24Å; L333-Y335 VanDerWaalsContact C-N 3.35Å; L333-Y335 PolarHBondContact O-N 3.38Å; L333-Y336 PolarHBondContact O-N 3.4Å; L333-I337 HydrophobicContact CD1-CD1 4.08Å; L333-I337 HydrophobicContact CD1-CG1 4.26Å; L333-I337 HydrophobicContact CG-CD1 3.88Å; L333-I337 HydrophobicContact CG-CG1 4.49Å; L333-I337 WeakPolarHBondContact O-CG1 3.46Å; L333-I337 PolarHBondContact O-N 2.95Å
334	Y	98.5	Very high	98	Very high	54 Å²	54	55.4 Å²	55.4	21%	0.212	27%	0.269	C	S	.	.	H	α-helix	trans	-55.3	-47.7	177.1	-167.1	-85.9	0	0	0	112.2	S332 Y336 I337 Q338 L350 C353 G355 D356	S332-Y334 PolarHBondContact O-N 3.39Å; Y334-Y336 PolarHBondContact O-N 2.86Å; Y334-I337 PolarHBondContact O-N 2.76Å; Y334-Q338 HydrophobicContact CD1-CG 4.08Å; Y334-Q338 VanDerWaalsContact CE1-CD 3.4Å; Y334-Q338 HydrophobicContact CE1-CG 3.93Å; Y334-Q338 WeakPolarHBondContact O-CG 3.48Å; Y334-Q338 PolarHBondContact O-N 2.76Å; Y334-L350 HydrophobicContact CD1-CD2 3.96Å; Y334-L350 HydrophobicContact CD2-CB 4.27Å; Y334-L350 HydrophobicContact CD2-CD2 3.61Å; Y334-L350 HydrophobicContact CD2-CG 4.45Å; Y334-L350 HydrophobicContact CE1-CD1 4.21Å; Y334-L350 HydrophobicContact CE1-CD2 3.92Å; Y334-L350 HydrophobicContact CE2-CB 3.55Å; Y334-L350 HydrophobicContact CE2-CD1 4.29Å; Y334-L350 HydrophobicContact CE2-CD2 3.58Å; Y334-L350 HydrophobicContact CE2-CG 3.96Å; Y334-L350 HydrophobicContact CG-CD2 3.8Å; Y334-C353 HydrophobicContact CD2-CB 4.24Å; Y334-G355 WeakPolarHBondContact CB-O 3.31Å; Y334-G355 WeakPolarHBondContact CD2-O 3.38Å; Y334-D356 HydrophobicContact CD1-CB 3.82Å; Y334-D356 HydrophobicContact CE1-CB 4.38Å; Y334-D356 HydrophobicContact CG-CB 3.96Å
335	Y	97.9	Very high	98	Very high	75 Å²	75	55.2 Å²	55.2	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-57.5	-47.1	176.3	172	-84.9	0	0	0	111.7	K331 S332 L333 I337 Q338 Q339	K331-Y335 HydrophobicContact CB-CD1 3.87Å; K331-Y335 HydrophobicContact CB-CG 4.16Å; K331-Y335 HydrophobicContact CD-CD1 3.46Å; K331-Y335 VanDerWaalsContact CD-CD1 3.46Å; K331-Y335 HydrophobicContact CD-CD2 4.39Å; K331-Y335 HydrophobicContact CD-CE1 3.26Å; K331-Y335 HydrophobicContact CD-CE2 4.18Å; K331-Y335 HydrophobicContact CD-CG 4.05Å; K331-Y335 HydrophobicContact CG-CD1 4.31Å; K331-Y335 PolarHBondContact NZ-OH 3.36Å; S332-Y335 WeakPolarHBondContact O-CB 3.26Å; S332-Y335 PolarHBondContact O-N 2.8Å; S332-Y335 WeakPolarHBondContact OG-CB 3.44Å; S332-Y335 PolarHBondContact OG-N 3.1Å; L333-Y335 VanDerWaalsContact C-N 3.35Å; L333-Y335 PolarHBondContact O-N 3.38Å; Y335-I337 PolarHBondContact O-N 2.89Å; Y335-Q338 WeakPolarHBondContact O-CB 3.4Å; Y335-Q338 PolarHBondContact O-N 3.06Å; Y335-Q339 HydrophobicContact CD1-CG 4.08Å; Y335-Q339 HydrophobicContact CE1-CG 3.52Å; Y335-Q339 HydrophobicContact CE2-CG 4.23Å; Y335-Q339 WeakPolarHBondContact O-CG 3.35Å; Y335-Q339 PolarHBondContact O-N 3.15Å
336	Y	98.3	Very high	98	Very high	47 Å²	47	57 Å²	57	18%	0.184	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-43.1	-179.6	-85.9	-98.3	0	0	0	111.6	Y293 F325 K331 S332 L333 Y334 Q338 Q339 D340	Y293-Y336 HydrophobicContact CD2-CE1 4.04Å; Y293-Y336 AromaticContact CE2-CE1 3.71Å; Y293-Y336 HydrophobicContact CE2-CE1 3.71Å; Y293-Y336 AromaticContact CE2-CZ 3.81Å; F325-Y336 AromaticContact CE1-CD2 3.51Å; F325-Y336 HydrophobicContact CE1-CD2 3.51Å; F325-Y336 AromaticContact CE1-CE2 3.88Å; F325-Y336 HydrophobicContact CE1-CE2 3.88Å; F325-Y336 HydrophobicContact CE1-CG 4.1Å; F325-Y336 HydrophobicContact CZ-CD1 4.5Å; F325-Y336 AromaticContact CZ-CD2 3.81Å; F325-Y336 HydrophobicContact CZ-CD2 3.81Å; F325-Y336 HydrophobicContact CZ-CE2 4.27Å; F325-Y336 AromaticContact CZ-CG 3.92Å; F325-Y336 HydrophobicContact CZ-CG 3.92Å; K331-Y336 HydrophobicContact CB-CD2 4.28Å; K331-Y336 HydrophobicContact CB-CE2 3.85Å; S332-Y336 WeakPolarHBondContact O-CD2 3.49Å; S332-Y336 PolarHBondContact O-N 3.06Å; L333-Y336 PolarHBondContact O-N 3.4Å; Y334-Y336 PolarHBondContact O-N 2.86Å; Y336-Q338 VanDerWaalsContact C-N 3.28Å; Y336-Q338 PolarHBondContact O-N 3.3Å; Y336-Q339 PolarHBondContact O-N 3.39Å; Y336-Q339 VanDerWaalsContact O-N 3.14Å; Y336-D340 WeakPolarHBondContact O-CB 2.94Å; Y336-D340 PolarHBondContact O-N 3.45Å
337	I	98.4	Very high	98	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-41.7	174.9	-65.2	167.3	0	0	0	110.8	M296 L306 M310 L333 Y334 Y335 Q339 D340 T341 L349 L350 C353	M296-I337 HydrophobicContact CE-CG1 4.28Å; M296-I337 HydrophobicContact SD-CG1 3.87Å; L306-I337 HydrophobicContact CD1-CG1 4.5Å; M310-I337 HydrophobicContact CE-CD1 3.73Å; M310-I337 HydrophobicContact SD-CD1 4.04Å; L333-I337 HydrophobicContact CD1-CD1 4.08Å; L333-I337 HydrophobicContact CD1-CG1 4.26Å; L333-I337 HydrophobicContact CG-CD1 3.88Å; L333-I337 HydrophobicContact CG-CG1 4.49Å; L333-I337 WeakPolarHBondContact O-CG1 3.46Å; L333-I337 PolarHBondContact O-N 2.95Å; Y334-I337 PolarHBondContact O-N 2.76Å; Y335-I337 PolarHBondContact O-N 2.89Å; I337-Q339 VanDerWaalsContact C-N 3.35Å; I337-Q339 PolarHBondContact O-N 2.99Å; I337-D340 PolarHBondContact O-N 3.38Å; I337-T341 PolarHBondContact O-N 3.13Å; I337-T341 PolarHBondContact O-OG1 3.34Å; I337-L349 HydrophobicContact CG2-CB 3.66Å; I337-L349 HydrophobicContact CG2-CD1 4.07Å; I337-L350 HydrophobicContact CB-CD2 3.8Å; I337-L350 HydrophobicContact CG2-CD2 3.55Å; I337-L350 HydrophobicContact CG2-CG 4.08Å; I337-C353 HydrophobicContact CD1-CB 4.19Å
338	Q	97.7	Very high	98	Very high	65 Å²	65	50.6 Å²	50.6	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-62.8	-38.8	177.1	-76.1	-176.7	-46.4	0	0	113.1	Y334 Y335 Y336 K342 Q346 L350	Y334-Q338 HydrophobicContact CD1-CG 4.08Å; Y334-Q338 VanDerWaalsContact CE1-CD 3.4Å; Y334-Q338 HydrophobicContact CE1-CG 3.93Å; Y334-Q338 WeakPolarHBondContact O-CG 3.48Å; Y334-Q338 PolarHBondContact O-N 2.76Å; Y335-Q338 WeakPolarHBondContact O-CB 3.4Å; Y335-Q338 PolarHBondContact O-N 3.06Å; Y336-Q338 VanDerWaalsContact C-N 3.28Å; Y336-Q338 PolarHBondContact O-N 3.3Å; Q338-K342 PolarHBondContact O-NZ 3.24Å; Q338-Q346 PolarHBondContact O-NE2 3.28Å; Q338-L350 HydrophobicContact CG-CD1 3.73Å; Q338-L350 HydrophobicContact CG-CD2 3.79Å; Q338-L350 HydrophobicContact CG-CG 4.4Å
339	Q	96.9	Very high	98	Very high	108 Å²	108	45.7 Å²	45.7	51%	0.505	23%	0.231	S	C	.	.	H	α-helix	trans	-70.9	-41.4	179.2	-62.9	-46.5	-57.1	0	0	111.4	Y335 Y336 I337 K342	Y335-Q339 HydrophobicContact CD1-CG 4.08Å; Y335-Q339 HydrophobicContact CE1-CG 3.52Å; Y335-Q339 HydrophobicContact CE2-CG 4.23Å; Y335-Q339 WeakPolarHBondContact O-CG 3.35Å; Y335-Q339 PolarHBondContact O-N 3.15Å; Y336-Q339 PolarHBondContact O-N 3.39Å; Y336-Q339 VanDerWaalsContact O-N 3.14Å; I337-Q339 VanDerWaalsContact C-N 3.35Å; I337-Q339 PolarHBondContact O-N 2.99Å; Q339-K342 PolarHBondContact O-NZ 3.04Å
340	D	96.7	Very high	98	Very high	43 Å²	43	44.1 Å²	44.1	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-91.3	-28.5	-166.4	-136.5	49.2	0	0	0	114	M296 T301 Y336 I337	M296-D340 WeakPolarHBondContact CA-OD2 3.39Å; M296-D340 HydrophobicContact CB-CB 4.18Å; M296-D340 HydrophobicContact CG-CB 4.16Å; M296-D340 HydrophobicContact SD-CB 4.39Å; T301-D340 VanDerWaalsContact CB-OD2 3.26Å; T301-D340 WeakPolarHBondContact CB-OD2 3.32Å; T301-D340 WeakPolarHBondContact CG2-OD2 3.44Å; T301-D340 VanDerWaalsContact OG1-CG 3.26Å; T301-D340 PolarHBondContact OG1-O 2.97Å; T301-D340 PolarHBondContact OG1-OD2 3.19Å; Y336-D340 WeakPolarHBondContact O-CB 2.94Å; Y336-D340 PolarHBondContact O-N 3.45Å; I337-D340 PolarHBondContact O-N 3.38Å
341	T	97.9	Very high	98.1	Very high	5 Å²	5	46 Å²	46	3%	0.031	22%	0.216	C	C	.	.			trans	-111.6	166.8	-179.2	69.2	0	0	0	0	111.6	L306 I337 Y345 Q346 L349	L306-T341 HydrophobicContact CD2-CG2 3.8Å; I337-T341 PolarHBondContact O-N 3.13Å; I337-T341 PolarHBondContact O-OG1 3.34Å; T341-Y345 HydrophobicContact CG2-CD1 4.18Å; T341-Y345 HydrophobicContact CG2-CE1 3.48Å; T341-Y345 VanDerWaalsContact CG2-CE1 3.48Å; T341-Q346 PolarHBondContact O-NE2 2.64Å; T341-Q346 WeakPolarHBondContact OG1-CA 3.42Å; T341-Q346 VanDerWaalsContact OG1-CB 3.25Å; T341-Q346 WeakPolarHBondContact OG1-CB 3.39Å; T341-Q346 WeakPolarHBondContact OG1-CG 3.28Å; T341-L349 HydrophobicContact CG2-CD1 3.96Å
342	K	97.7	Very high	98.2	Very high	128 Å²	128	41.4 Å²	41.4	56%	0.557	20%	0.196	S	C	*	.			trans	-145.3	170	177.4	-61.7	-67.7	168.4	-83.9	0	111.9	Q338 Q339 Q346	Q338-K342 PolarHBondContact O-NZ 3.24Å; Q339-K342 PolarHBondContact O-NZ 3.04Å; K342-Q346 PolarHBondContact O-N 3.41Å
343	G	97.8	Very high	98.2	Very high	47 Å²	47	41.2 Å²	41.2	49%	0.485	20%	0.195	S	C	.	.	H	α-helix	trans	66.7	-156.3	173.9	0	0	0	0	0	113.9	Y345 Q346 K347	G343-Y345 PolarHBondContact O-N 3.43Å; G343-Q346 WeakPolarHBondContact O-CB 3.03Å; G343-Q346 PolarHBondContact O-N 3.3Å; G343-Q346 VanDerWaalsContact O-N 3.15Å; G343-K347 PolarHBondContact O-N 3.01Å; G343-K347 VanDerWaalsContact O-N 3.17Å
344	D	97.9	Very high	97.9	Very high	40 Å²	40	43.2 Å²	43.2	21%	0.214	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-22	-178.6	-61.7	-48.6	0	0	0	113	E71 L113 K347 A348	E71-D344 HydrophobicContact CB-CB 4.2Å; L113-D344 HydrophobicContact CD1-CB 4.48Å; L113-D344 HydrophobicContact CD2-CB 3.89Å; D344-K347 PolarHBondContact O-N 3.41Å; D344-K347 WeakPolarHBondContact OD1-CD 3.32Å; D344-K347 WeakPolarHBondContact OD1-CE 3.18Å; D344-K347 IonicContact OD1-NZ 3.63Å; D344-K347 PolarHBondContact OD1-NZ 2.92Å; D344-A348 WeakPolarHBondContact O-CB 3.46Å; D344-A348 PolarHBondContact O-N 3.05Å
345	Y	98.6	Very high	97.4	Very high	19 Å²	19	41.7 Å²	41.7	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-50	166.3	167.8	-135.1	0	0	0	111.5	H112 V116 D303 I307 T341 G343 K347 A348 L349	H112-Y345 HydrophobicContact CB-CD1 3.71Å; H112-Y345 HydrophobicContact CB-CD2 3.71Å; H112-Y345 HydrophobicContact CB-CE1 3.84Å; H112-Y345 HydrophobicContact CB-CE2 3.86Å; H112-Y345 HydrophobicContact CB-CG 3.63Å; V116-Y345 HydrophobicContact CG2-CD2 3.85Å; V116-Y345 HydrophobicContact CG2-CE2 3.79Å; D303-Y345 WeakPolarHBondContact OD1-CE1 3.49Å; D303-Y345 VanDerWaalsContact OD1-CZ 3.26Å; D303-Y345 PolarHBondContact OD1-OH 3.11Å; I307-Y345 HydrophobicContact CD1-CE2 3.9Å; I307-Y345 HydrophobicContact CG1-CE2 3.75Å; T341-Y345 HydrophobicContact CG2-CD1 4.18Å; T341-Y345 HydrophobicContact CG2-CE1 3.48Å; T341-Y345 VanDerWaalsContact CG2-CE1 3.48Å; G343-Y345 PolarHBondContact O-N 3.43Å; Y345-K347 PolarHBondContact O-N 3.06Å; Y345-A348 PolarHBondContact O-N 3.39Å; Y345-L349 HydrophobicContact CD2-CD1 4.19Å; Y345-L349 HydrophobicContact CD2-CG 4.05Å; Y345-L349 HydrophobicContact CE1-CD1 4.4Å; Y345-L349 HydrophobicContact CE2-CD1 3.42Å; Y345-L349 VanDerWaalsContact CE2-CD1 3.42Å; Y345-L349 HydrophobicContact CE2-CD2 3.96Å; Y345-L349 HydrophobicContact CE2-CG 3.63Å; Y345-L349 PolarHBondContact O-N 3.14Å; Y345-L349 VanDerWaalsContact O-N 3.12Å
346	Q	98.6	Very high	96.7	Very high	37 Å²	37	43 Å²	43	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-57.6	-49.5	174.4	178.3	-171	88.6	0	0	110.9	Q338 T341 K342 G343 A348 L349 L350	Q338-Q346 PolarHBondContact O-NE2 3.28Å; T341-Q346 PolarHBondContact O-NE2 2.64Å; T341-Q346 WeakPolarHBondContact OG1-CA 3.42Å; T341-Q346 VanDerWaalsContact OG1-CB 3.25Å; T341-Q346 WeakPolarHBondContact OG1-CB 3.39Å; T341-Q346 WeakPolarHBondContact OG1-CG 3.28Å; K342-Q346 PolarHBondContact O-N 3.41Å; G343-Q346 WeakPolarHBondContact O-CB 3.03Å; G343-Q346 PolarHBondContact O-N 3.3Å; G343-Q346 VanDerWaalsContact O-N 3.15Å; Q346-A348 VanDerWaalsContact C-N 3.26Å; Q346-A348 PolarHBondContact O-N 2.8Å; Q346-L349 PolarHBondContact O-N 3.41Å; Q346-L349 VanDerWaalsContact O-N 3.12Å; Q346-L350 HydrophobicContact CG-CD1 3.67Å; Q346-L350 HydrophobicContact CG-CG 4.02Å; Q346-L350 VanDerWaalsContact O-CG 3.28Å; Q346-L350 WeakPolarHBondContact O-CG 3.46Å; Q346-L350 PolarHBondContact O-N 3.38Å
347	K	98.3	Very high	95.2	Very high	87 Å²	87	45.7 Å²	45.7	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-55.4	-44.1	-179.7	-65.8	-178.1	-167.1	155.3	0	111.5	V75 G343 D344 Y345 L350 Y351	V75-K347 HydrophobicContact CG1-CB 4.46Å; G343-K347 PolarHBondContact O-N 3.01Å; G343-K347 VanDerWaalsContact O-N 3.17Å; D344-K347 PolarHBondContact O-N 3.41Å; D344-K347 WeakPolarHBondContact OD1-CD 3.32Å; D344-K347 WeakPolarHBondContact OD1-CE 3.18Å; D344-K347 IonicContact OD1-NZ 3.63Å; D344-K347 PolarHBondContact OD1-NZ 2.92Å; Y345-K347 PolarHBondContact O-N 3.06Å; K347-L350 PolarHBondContact O-N 3.42Å; K347-Y351 WeakPolarHBondContact O-CD2 3.16Å; K347-Y351 PolarHBondContact O-N 3.33Å
348	A	98.8	Very high	95	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-48.5	177.7	0	0	0	0	0	111.8	V75 T79 L113 V116 D344 Y345 Q346 L350 Y351 L352	V75-A348 HydrophobicContact CG1-CB 3.92Å; V75-A348 HydrophobicContact CG2-CB 4.23Å; T79-A348 HydrophobicContact CG2-CB 4.17Å; L113-A348 HydrophobicContact CD1-CB 4.26Å; V116-A348 HydrophobicContact CG1-CB 4.03Å; D344-A348 WeakPolarHBondContact O-CB 3.46Å; D344-A348 PolarHBondContact O-N 3.05Å; Y345-A348 PolarHBondContact O-N 3.39Å; Q346-A348 VanDerWaalsContact C-N 3.26Å; Q346-A348 PolarHBondContact O-N 2.8Å; A348-L350 VanDerWaalsContact C-N 3.35Å; A348-L350 PolarHBondContact O-N 2.96Å; A348-Y351 PolarHBondContact O-N 2.94Å; A348-L352 WeakPolarHBondContact O-CG 3.28Å; A348-L352 PolarHBondContact O-N 3.41Å
349	L	98.8	Very high	94.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.2	-37.6	178.4	-64.3	-171.8	0	0	0	113.1	V116 L306 M310 I337 T341 Y345 Q346 L352 C353	V116-L349 HydrophobicContact CG2-CD2 3.96Å; L306-L349 HydrophobicContact CD1-CD1 4.47Å; L306-L349 HydrophobicContact CD2-CD1 3.61Å; L306-L349 HydrophobicContact CG-CD1 3.84Å; M310-L349 HydrophobicContact CB-CD2 3.88Å; M310-L349 WeakPolarHBondContact CE-O 3.44Å; M310-L349 HydrophobicContact CG-CD2 4.08Å; I337-L349 HydrophobicContact CG2-CB 3.66Å; I337-L349 HydrophobicContact CG2-CD1 4.07Å; T341-L349 HydrophobicContact CG2-CD1 3.96Å; Y345-L349 HydrophobicContact CD2-CD1 4.19Å; Y345-L349 HydrophobicContact CD2-CG 4.05Å; Y345-L349 HydrophobicContact CE1-CD1 4.4Å; Y345-L349 HydrophobicContact CE2-CD1 3.42Å; Y345-L349 VanDerWaalsContact CE2-CD1 3.42Å; Y345-L349 HydrophobicContact CE2-CD2 3.96Å; Y345-L349 HydrophobicContact CE2-CG 3.63Å; Y345-L349 PolarHBondContact O-N 3.14Å; Y345-L349 VanDerWaalsContact O-N 3.12Å; Q346-L349 PolarHBondContact O-N 3.41Å; Q346-L349 VanDerWaalsContact O-N 3.12Å; L349-L352 PolarHBondContact O-N 2.74Å; L349-C353 WeakPolarHBondContact O-CB 3.27Å; L349-C353 PolarHBondContact O-N 2.79Å
350	L	98.6	Very high	94.8	Very high	13 Å²	13	43.7 Å²	43.7	7%	0.068	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-37.1	177.9	-67.1	179.7	0	0	0	112	Y334 I337 Q338 Q346 K347 A348 C353 G354	Y334-L350 HydrophobicContact CD1-CD2 3.96Å; Y334-L350 HydrophobicContact CD2-CB 4.27Å; Y334-L350 HydrophobicContact CD2-CD2 3.61Å; Y334-L350 HydrophobicContact CD2-CG 4.45Å; Y334-L350 HydrophobicContact CE1-CD1 4.21Å; Y334-L350 HydrophobicContact CE1-CD2 3.92Å; Y334-L350 HydrophobicContact CE2-CB 3.55Å; Y334-L350 HydrophobicContact CE2-CD1 4.29Å; Y334-L350 HydrophobicContact CE2-CD2 3.58Å; Y334-L350 HydrophobicContact CE2-CG 3.96Å; Y334-L350 HydrophobicContact CG-CD2 3.8Å; I337-L350 HydrophobicContact CB-CD2 3.8Å; I337-L350 HydrophobicContact CG2-CD2 3.55Å; I337-L350 HydrophobicContact CG2-CG 4.08Å; Q338-L350 HydrophobicContact CG-CD1 3.73Å; Q338-L350 HydrophobicContact CG-CD2 3.79Å; Q338-L350 HydrophobicContact CG-CG 4.4Å; Q346-L350 HydrophobicContact CG-CD1 3.67Å; Q346-L350 HydrophobicContact CG-CG 4.02Å; Q346-L350 VanDerWaalsContact O-CG 3.28Å; Q346-L350 WeakPolarHBondContact O-CG 3.46Å; Q346-L350 PolarHBondContact O-N 3.38Å; K347-L350 PolarHBondContact O-N 3.42Å; A348-L350 VanDerWaalsContact C-N 3.35Å; A348-L350 PolarHBondContact O-N 2.96Å; L350-C353 WeakPolarHBondContact O-CB 3.3Å; L350-C353 PolarHBondContact O-N 2.94Å; L350-G354 PolarHBondContact O-N 3.05Å
351	Y	98.4	Very high	94.7	Very high	96 Å²	96	43.7 Å²	43.7	38%	0.376	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-43.4	170.6	-78.3	-60.3	0	0	0	112.2	V75 N76 T79 K347 A348 C353 G354	V75-Y351 HydrophobicContact CG1-CD2 3.86Å; V75-Y351 HydrophobicContact CG1-CE2 4.14Å; N76-Y351 WeakPolarHBondContact OD1-CE2 3.45Å; N76-Y351 VanDerWaalsContact OD1-CZ 3.28Å; N76-Y351 PolarHBondContact OD1-OH 3.13Å; T79-Y351 VanDerWaalsContact OG1-CB 3.28Å; T79-Y351 WeakPolarHBondContact OG1-CB 3.5Å; T79-Y351 WeakPolarHBondContact OG1-CD2 3.37Å; K347-Y351 WeakPolarHBondContact O-CD2 3.16Å; K347-Y351 PolarHBondContact O-N 3.33Å; A348-Y351 PolarHBondContact O-N 2.94Å; Y351-C353 PolarHBondContact O-N 2.77Å; Y351-G354 WeakPolarHBondContact O-CA 3.38Å; Y351-G354 PolarHBondContact O-N 3.11Å; Y351-G354 VanDerWaalsContact O-N 3.12Å
352	L	98.7	Very high	94.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-29.7	175.4	-63	179.5	0	0	0	112.4	S44 V45 T79 V116 L120 M310 V311 A348 L349	S44-L352 WeakPolarHBondContact CB-O 3.16Å; S44-L352 PolarHBondContact OG-O 3.15Å; V45-L352 HydrophobicContact CG2-CD2 3.89Å; T79-L352 HydrophobicContact CG2-CD2 4.19Å; T79-L352 HydrophobicContact CG2-CG 4.33Å; V116-L352 HydrophobicContact CG1-CD1 4.12Å; L120-L352 HydrophobicContact CD1-CD1 4.31Å; L120-L352 HydrophobicContact CD1-CD2 4.17Å; L120-L352 HydrophobicContact CD2-CD1 4.01Å; L120-L352 HydrophobicContact CD2-CD2 3.66Å; L120-L352 HydrophobicContact CD2-CG 4.49Å; M310-L352 HydrophobicContact CB-CD1 4.34Å; M310-L352 HydrophobicContact CE-CB 4.18Å; V311-L352 HydrophobicContact CG2-CD1 4.23Å; A348-L352 WeakPolarHBondContact O-CG 3.28Å; A348-L352 PolarHBondContact O-N 3.41Å; L349-L352 PolarHBondContact O-N 2.74Å
353	C	98.4	Very high	94.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.1	-44.3	171.3	-170.4	0	0	0	0	110.7	S44 M310 R322 Y334 I337 L349 L350 Y351	S44-C353 WeakPolarHBondContact CB-O 3.44Å; M310-C353 HydrophobicContact CE-CB 3.72Å; R322-C353 WeakPolarHBondContact CD-O 3.38Å; R322-C353 PolarHBondContact NH1-O 3.01Å; Y334-C353 HydrophobicContact CD2-CB 4.24Å; I337-C353 HydrophobicContact CD1-CB 4.19Å; L349-C353 WeakPolarHBondContact O-CB 3.27Å; L349-C353 PolarHBondContact O-N 2.79Å; L350-C353 WeakPolarHBondContact O-CB 3.3Å; L350-C353 PolarHBondContact O-N 2.94Å; Y351-C353 PolarHBondContact O-N 2.77Å
354	G	93.6	Very high	94	Very high	44 Å²	44	40.2 Å²	40.2	45%	0.454	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	6.8	172.5	0	0	0	0	0	115.5	R322 L350 Y351	R322-G354 VanDerWaalsContact NH1-C 3.33Å; R322-G354 PolarHBondContact NH1-O 3.18Å; L350-G354 PolarHBondContact O-N 3.05Å; Y351-G354 WeakPolarHBondContact O-CA 3.38Å; Y351-G354 PolarHBondContact O-N 3.11Å; Y351-G354 VanDerWaalsContact O-N 3.12Å
355	G	87.9	Confident	93.7	Very high	22 Å²	22	40.2 Å²	40.2	23%	0.227	22%	0.219	C	C	.	.			trans	156.2	166.2	173.5	0	0	0	0	0	114.4	Y334	Y334-G355 WeakPolarHBondContact CB-O 3.31Å; Y334-G355 WeakPolarHBondContact CD2-O 3.38Å
356	D	81.9	Confident	93.3	Very high	101 Å²	101	42 Å²	42	54%	0.54	23%	0.231	S	C	.	.			trans	-102.7	103.9	173.2	-163.5	5.6	0	0	0	107.9	S332 Y334	S332-D356 WeakPolarHBondContact CB-OD1 3.4Å; S332-D356 PolarHBondContact OG-OD1 3.25Å; Y334-D356 HydrophobicContact CD1-CB 3.82Å; Y334-D356 HydrophobicContact CE1-CB 4.38Å; Y334-D356 HydrophobicContact CG-CB 3.96Å
357	D	67.4	Low	92.8	Very high	104 Å²	104	42.5 Å²	42.5	56%	0.556	24%	0.236	S	C	*	.			trans	-79.8	0	176.3	-53.4	-77.3	0	0	0	112.3	R322 K326	R322-D357 WeakPolarHBondContact CB-OD2 3.38Å; R322-D357 IonicContact CZ-OD1 2.77Å; R322-D357 IonicContact CZ-OD2 3.7Å; R322-D357 IonicContact NE-OD1 2.67Å; R322-D357 IonicContact NE-OD2 3.72Å; R322-D357 PolarHBondContact NE-OD2 2.66Å; R322-D357 IonicContact NH2-OD1 2.71Å; R322-D357 PolarHBondContact NH2-OD1 2.72Å; R322-D357 IonicContact NH2-OD2 2.71Å; R322-D357 PolarHBondContact NH2-OD2 3.48Å; K326-D357 PolarHBondContact NZ-O 3.31Å; K326-D357 PolarHBondContact NZ-OXT 2.75Å

Retrieved 357 of 357 residues in 809 ms (Link to these results)

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