A0A096LWU6_POEFO Loading...

RasGEF domain family member 1C

AlphaFold DB , UniProt , Accession A0A096LWU6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 490 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	20	Very low	24.2	Very low	239 Å²	239	134.9 Å²	134.9	100%	1.177	79%	0.787	S	S	*	*				0	121.5	0	-74.5	-171.3	171.8	0	0	107.5
2	P	24	Very low	24.2	Very low	129 Å²	129	131.8 Å²	131.8	84%	0.838	77%	0.771	S	S	*	*			trans	-87.6	124.8	-170.5	32.6	-27.9	0	0	0	110.3
3	Q	20.4	Very low	24.6	Very low	182 Å²	182	130 Å²	130	85%	0.85	76%	0.763	S	S	*	*			trans	-97.7	111.6	161.5	-77.5	-169.1	-16.1	0	0	108.2	V5	Q3-V5 PolarHBondContact O-N 3.4Å
4	T	22.1	Very low	24.5	Very low	140 Å²	140	129.6 Å²	129.6	86%	0.859	77%	0.771	S	S	*	*			trans	-70.2	112.7	169.5	-6.6	0	0	0	0	108.5
5	V	22.2	Very low	24.9	Very low	122 Å²	122	125.1 Å²	125.1	74%	0.739	75%	0.748	S	S	*	*			trans	-117.6	94.4	170	-173.4	0	0	0	0	107.7	Q3	Q3-V5 PolarHBondContact O-N 3.4Å
6	C	24.1	Very low	25.1	Very low	112 Å²	112	122.6 Å²	122.6	76%	0.757	76%	0.757	S	S	*	*			trans	-127.5	89.1	164.6	-89.1	0	0	0	0	108.1
7	S	22.8	Very low	25.2	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	76%	0.755	S	S	*	*	S	Bend	trans	-161.2	112.3	160.2	-80.6	0	0	0	0	106.9
8	G	22.3	Very low	25.1	Very low	73 Å²	73	124.8 Å²	124.8	75%	0.753	76%	0.76	S	S	*	*	S	Bend	trans	148.3	-13.1	170.8	0	0	0	0	0	118
9	T	26.2	Very low	25.1	Very low	110 Å²	110	124.4 Å²	124.4	68%	0.675	76%	0.76	S	S	*	*			trans	-119.5	56.5	-164.9	41.7	0	0	0	0	114.5	T12	T9-T12 VanDerWaalsContact CG2-OG1 3.26Å; T9-T12 WeakPolarHBondContact CG2-OG1 3.36Å
10	M	29.1	Very low	25	Very low	130 Å²	130	127.3 Å²	127.3	64%	0.64	76%	0.764	S	S	*	*	S	Bend	trans	-83.3	-14.3	161.5	-86.1	-168.7	-163.7	0	0	113.2	E273	M10-E273 HydrophobicContact CE-CG 4.44Å; M10-E273 WeakPolarHBondContact CE-OE1 3.21Å
11	F	32.8	Very low	25	Very low	137 Å²	137	129.8 Å²	129.8	60%	0.601	77%	0.772	S	S	*	*	S	Bend	trans	-136.8	21.2	-171	-65.6	-70.4	0	0	0	115.9	I395	F11-I395 HydrophobicContact CE1-CG2 3.78Å; F11-I395 HydrophobicContact CZ-CG2 3.95Å
12	T	24.2	Very low	25.2	Very low	97 Å²	97	123 Å²	123	60%	0.595	75%	0.754	S	S	*	*			trans	-108.5	87.1	165.8	55.6	0	0	0	0	109.3	T9 S14	T9-T12 VanDerWaalsContact CG2-OG1 3.26Å; T9-T12 WeakPolarHBondContact CG2-OG1 3.36Å; T12-S14 PolarHBondContact O-N 3.33Å
13	T	29.4	Very low	25.1	Very low	109 Å²	109	123.2 Å²	123.2	67%	0.669	76%	0.757	S	S	*	*			trans	-60.4	106.5	157.3	47.9	0	0	0	0	107.2	S15	T13-S15 PolarHBondContact O-N 3.16Å
14	S	23.4	Very low	25.2	Very low	125 Å²	125	119.3 Å²	119.3	87%	0.874	76%	0.756	S	S	*	*			trans	-71.7	60.9	167.6	60.3	0	0	0	0	110	T12	T12-S14 PolarHBondContact O-N 3.33Å
15	S	30.4	Very low	25.2	Very low	61 Å²	61	121.1 Å²	121.1	43%	0.427	76%	0.755	S	S	.	*			trans	-101.2	114.9	159.2	53.5	0	0	0	0	105.9	T13 F17	T13-S15 PolarHBondContact O-N 3.16Å; S15-F17 PolarHBondContact O-N 3.15Å
16	G	27.5	Very low	25.5	Very low	86 Å²	86	121.7 Å²	121.7	89%	0.887	76%	0.761	S	S	*	*			trans	-56.7	99	-178.1	0	0	0	0	0	112.1
17	F	27.6	Very low	25.5	Very low	164 Å²	164	120 Å²	120	72%	0.719	76%	0.762	S	S	*	*			trans	-117.6	117.5	160.8	-72.8	-78.3	0	0	0	106.6	S15	S15-F17 PolarHBondContact O-N 3.15Å
18	S	23.7	Very low	25.6	Very low	121 Å²	121	124.2 Å²	124.2	85%	0.846	77%	0.769	S	S	*	*			trans	-60.7	137.6	-179.6	-66.9	0	0	0	0	111.4
19	P	24.5	Very low	25.9	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	78%	0.776	S	S	*	*			trans	-90.7	107.3	176.6	33.2	-27.1	0	0	0	109.9
20	H	22.7	Very low	25.8	Very low	181 Å²	181	134.2 Å²	134.2	84%	0.838	79%	0.789	S	S	*	*			trans	-151.5	92.7	155.9	-95.9	-59.7	0	0	0	109.4
21	L	24.9	Very low	25.8	Very low	181 Å²	181	137.3 Å²	137.3	95%	0.948	80%	0.802	S	S	*	*			trans	-139.1	111.9	150.5	-97.3	111.1	0	0	0	107.7
22	A	24.3	Very low	25.5	Very low	96 Å²	96	139.1 Å²	139.1	79%	0.793	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.4	143.5	172.1	0	0	0	0	0	109.7
23	C	21.7	Very low	25.5	Very low	133 Å²	133	137.5 Å²	137.5	90%	0.899	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-56.2	133.9	170.8	-59.8	0	0	0	0	110.8
24	A	22.8	Very low	25.3	Very low	100 Å²	100	137.1 Å²	137.1	83%	0.826	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-103.9	127.9	158.9	0	0	0	0	0	107.8
25	E	23.1	Very low	25.7	Very low	179 Å²	179	137.1 Å²	137.1	84%	0.836	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70	157.8	174.3	-71.2	-167.1	159.6	0	0	111.7	G27	E25-G27 PolarHBondContact O-N 2.96Å
26	P	26.8	Very low	25.7	Very low	134 Å²	134	146.1 Å²	146.1	87%	0.87	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-76.8	124.4	-173.4	29.8	-31.4	0	0	0	111.8
27	G	24.8	Very low	25.7	Very low	75 Å²	75	151.4 Å²	151.4	77%	0.773	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-93.2	152.9	166	0	0	0	0	0	111.4	E25	E25-G27 PolarHBondContact O-N 2.96Å
28	E	24.8	Very low	25.7	Very low	199 Å²	199	147.1 Å²	147.1	93%	0.93	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-66.7	165	-162.4	-65.1	165.3	159.2	0	0	116.3
29	E	28.3	Very low	26.1	Very low	191 Å²	191	147.7 Å²	147.7	89%	0.893	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-52.3	146.2	-177.7	-58.9	170.9	162.3	0	0	115.3
30	E	25.4	Very low	26.2	Very low	202 Å²	202	145.5 Å²	145.5	94%	0.944	85%	0.853	S	S	*	*			trans	-147.7	119.7	146.4	-109.5	178.2	-175.8	0	0	109.8
31	E	28.6	Very low	26.7	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	86%	0.855	S	S	*	*			trans	-70.9	135.9	169.1	-76.6	-175.5	136	0	0	110.2
32	D	26.2	Very low	26.9	Very low	175 Å²	175	139.9 Å²	139.9	94%	0.936	85%	0.853	S	S	*	*			trans	-148.1	143.9	149.8	-147.6	-3.1	0	0	0	112.1
33	G	24.6	Very low	27.1	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	85%	0.85	S	S	*	*			trans	-103.8	161.4	-155.8	0	0	0	0	0	118
34	A	26.2	Very low	27.4	Very low	100 Å²	100	139.5 Å²	139.5	83%	0.826	85%	0.849	S	S	*	*			trans	80.2	157.2	153.3	0	0	0	0	0	120.3
35	P	30.3	Very low	28	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	85%	0.846	S	S	*	*			cis	-124.1	160.7	-25.5	27.9	-8.1	0	0	0	113.8
36	R	30	Very low	28.3	Very low	251 Å²	251	137.4 Å²	137.4	95%	0.947	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-82.6	127.2	175.1	-72.4	175.3	167.6	169.7	-4.1	111.3
37	E	28.7	Very low	28.9	Very low	197 Å²	197	137.4 Å²	137.4	92%	0.921	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92.6	136.4	161.7	-73.1	-171.5	157.5	0	0	110.4
38	G	26.9	Very low	30	Very low	74 Å²	74	136.3 Å²	136.3	76%	0.763	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-82.9	171.8	-162	0	0	0	0	0	116.8
39	P	31.7	Very low	31.6	Very low	133 Å²	133	132.6 Å²	132.6	86%	0.864	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89.3	138.1	-177.2	33.9	-30	0	0	0	112.6
40	G	26.9	Very low	33.9	Very low	70 Å²	70	128.8 Å²	128.8	72%	0.722	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-80.7	161.2	162.9	0	0	0	0	0	112
41	P	34.6	Very low	36.7	Very low	136 Å²	136	122.1 Å²	122.1	88%	0.883	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-94.3	130.5	-143.1	34.4	-32.2	0	0	0	113.4
42	A	29.1	Very low	39.6	Very low	109 Å²	109	116.3 Å²	116.3	90%	0.901	76%	0.757	S	S	*	*			trans	-138.3	91.8	154.3	0	0	0	0	0	107.2
43	A	28.5	Very low	42.8	Very low	89 Å²	89	109.6 Å²	109.6	74%	0.736	72%	0.723	S	S	*	*			trans	-104.3	124.4	170.2	0	0	0	0	0	108
44	C	27.3	Very low	46.2	Very low	131 Å²	131	107 Å²	107	89%	0.885	70%	0.696	S	S	*	*			trans	-171	79.8	137.3	-88.6	0	0	0	0	109.5
45	L	34.5	Very low	49.6	Very low	144 Å²	144	103.8 Å²	103.8	75%	0.754	67%	0.667	S	S	*	*	S	Bend	trans	30.2	91.3	149.1	-74.9	155.5	0	0	0	118.9	D47	L45-D47 HydrophobicContact CD2-CB 3.7Å; L45-D47 WeakPolarHBondContact CD2-OD2 3.45Å; L45-D47 WeakPolarHBondContact CG-OD2 3.44Å
46	A	31.4	Very low	52.7	Low	91 Å²	91	98.3 Å²	98.3	75%	0.752	63%	0.631	S	S	*	*				-121.9	56.9	120.6	0	0	0	0	0	107.8	G48	A46-G48 PolarHBondContact O-N 3.38Å
47	D	39	Very low	55.8	Low	135 Å²	135	90.9 Å²	90.9	72%	0.722	61%	0.607	S	S	*	*			trans	-75.2	79.2	-172.7	-70	-47.5	0	0	0	112.4	L45	L45-D47 HydrophobicContact CD2-CB 3.7Å; L45-D47 WeakPolarHBondContact CD2-OD2 3.45Å; L45-D47 WeakPolarHBondContact CG-OD2 3.44Å
48	G	47.2	Very low	59	Low	52 Å²	52	84.2 Å²	84.2	54%	0.536	58%	0.58	S	S	.	*	S	Bend	trans	-106.8	153.9	148.6	0	0	0	0	0	109.2	A46	A46-G48 PolarHBondContact O-N 3.38Å
49	P	58.9	Low	62.4	Low	121 Å²	121	80.7 Å²	80.7	79%	0.786	54%	0.543	S	S	*	.			trans	-54.4	143.1	165.9	23.9	-31.1	0	0	0	109.1	I51	P49-I51 PolarHBondContact O-N 3.44Å
50	P	76.1	Confident	65.5	Low	111 Å²	111	74.5 Å²	74.5	72%	0.721	50%	0.503	S	S	*	.			trans	-52.8	138.6	178.7	19.2	-29.7	0	0	0	110	T52	P50-T52 WeakPolarHBondContact O-CG2 3.2Å; P50-T52 PolarHBondContact O-N 3.2Å
51	I	83.8	Confident	68.8	Low	61 Å²	61	75.8 Å²	75.8	31%	0.313	49%	0.49	S	S	.	.			trans	-60.9	107.3	-178.3	-60.6	169.4	0	0	0	108.1	P49 A54 L59 N62 Y75 F416	P49-I51 PolarHBondContact O-N 3.44Å; I51-A54 HydrophobicContact CG2-CB 4.28Å; I51-L59 HydrophobicContact CG2-CD2 4.06Å; I51-N62 WeakPolarHBondContact CD1-ND2 3.18Å; I51-Y75 HydrophobicContact CD1-CD2 4.37Å; I51-Y75 HydrophobicContact CD1-CE2 3.89Å; I51-F416 HydrophobicContact CB-CD1 4.33Å; I51-F416 HydrophobicContact CG2-CB 4.31Å; I51-F416 HydrophobicContact CG2-CD1 4.32Å; I51-F416 HydrophobicContact CG2-CG 4.39Å; I51-F416 VanDerWaalsContact O-CD1 3.31Å; I51-F416 WeakPolarHBondContact O-CD1 3.38Å
52	T	89.4	Confident	71.7	Confident	74 Å²	74	71.6 Å²	71.6	45%	0.454	46%	0.46	S	S	.	.			trans	-87.8	-33.9	177	58.6	0	0	0	0	111.5	P50 F416 E417	P50-T52 WeakPolarHBondContact O-CG2 3.2Å; P50-T52 PolarHBondContact O-N 3.2Å; T52-F416 WeakPolarHBondContact O-CA 3.45Å; T52-F416 PolarHBondContact O-N 3.17Å; T52-E417 PolarHBondContact O-N 2.93Å
53	S	94.6	Very high	74.9	Confident	33 Å²	33	66.4 Å²	66.4	23%	0.231	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	151.8	172.6	69.6	0	0	0	0	112.2	L409 V414	S53-L409 VanDerWaalsContact CB-CD1 3.41Å; S53-L409 WeakPolarHBondContact OG-CD1 3.32Å; S53-V414 WeakPolarHBondContact CA-O 3.16Å; S53-V414 VanDerWaalsContact CB-O 3.26Å; S53-V414 WeakPolarHBondContact CB-O 3.46Å
54	A	95.9	Very high	78.1	Confident	10 Å²	10	62.2 Å²	62.2	8%	0.083	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	165.6	172.6	0	0	0	0	0	110.9	I51 T58 L59 H413 V414	I51-A54 HydrophobicContact CG2-CB 4.28Å; A54-T58 HydrophobicContact CB-CG2 4.08Å; A54-L59 HydrophobicContact CB-CD2 3.92Å; A54-L59 HydrophobicContact CB-CG 3.98Å; A54-H413 CarbonylContact O-C 3.45Å; A54-H413 WeakPolarHBondContact O-CA 3.45Å; A54-H413 WeakPolarHBondContact O-CB 3.44Å; A54-V414 PolarHBondContact N-O 3.49Å; A54-V414 PolarHBondContact O-N 3.11Å
55	S	96.1	Very high	81.3	Confident	32 Å²	32	56 Å²	56	22%	0.224	34%	0.341	C	S	.	.			trans	-61.3	155.2	167.7	67.9	0	0	0	0	110.5	E57 T58 L59	S55-E57 PolarHBondContact O-N 3.3Å; S55-T58 PolarHBondContact O-N 3.15Å; S55-T58 WeakPolarHBondContact OG-CB 3.41Å; S55-T58 PolarHBondContact OG-N 3.25Å; S55-T58 PolarHBondContact OG-OG1 2.86Å; S55-L59 WeakPolarHBondContact O-CG 3.39Å; S55-L59 PolarHBondContact O-N 3.08Å; S55-L59 VanDerWaalsContact O-N 3.08Å
56	L	95.6	Very high	84	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.058	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-40.9	177.8	179	61.3	0	0	0	110.5	T58 L59 I60 F79 F86 I87 V414	L56-T58 PolarHBondContact O-N 3.14Å; L56-L59 PolarHBondContact O-N 3.05Å; L56-I60 HydrophobicContact CD1-CD1 4.3Å; L56-I60 HydrophobicContact CD1-CG1 4.34Å; L56-I60 HydrophobicContact CG-CD1 3.97Å; L56-I60 HydrophobicContact CG-CG1 4.41Å; L56-I60 VanDerWaalsContact O-CG1 3.28Å; L56-I60 WeakPolarHBondContact O-CG1 3.28Å; L56-I60 PolarHBondContact O-N 3.01Å; L56-F79 HydrophobicContact CD1-CE2 4.16Å; L56-F79 HydrophobicContact CD1-CZ 4.24Å; L56-F86 HydrophobicContact CD1-CB 4.19Å; L56-F86 HydrophobicContact CD2-CB 4.11Å; L56-I87 HydrophobicContact CD1-CG2 4.46Å; L56-I87 HydrophobicContact CD2-CB 4.41Å; L56-V414 HydrophobicContact CB-CG2 4.37Å
57	E	95.8	Very high	86.7	Confident	95 Å²	95	47.3 Å²	47.3	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-44.2	178.1	-72.8	61.8	-140.3	0	0	112.2	S55 L59 I60 Q61 R95	S55-E57 PolarHBondContact O-N 3.3Å; E57-L59 VanDerWaalsContact C-N 3.35Å; E57-I60 PolarHBondContact O-N 2.9Å; E57-Q61 VanDerWaalsContact O-CG 3.29Å; E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.14Å; E57-R95 IonicContact OE1-NH1 2.61Å; E57-R95 PolarHBondContact OE1-NH1 2.9Å
58	T	96.1	Very high	89.1	Confident	56 Å²	56	47.6 Å²	47.6	34%	0.344	29%	0.288	S	S	.	.	H	α-helix	trans	-65.4	-39.3	176.7	-62.7	0	0	0	0	111.2	A54 S55 L56 Q61 N62	A54-T58 HydrophobicContact CB-CG2 4.08Å; S55-T58 PolarHBondContact O-N 3.15Å; S55-T58 WeakPolarHBondContact OG-CB 3.41Å; S55-T58 PolarHBondContact OG-N 3.25Å; S55-T58 PolarHBondContact OG-OG1 2.86Å; L56-T58 PolarHBondContact O-N 3.14Å; T58-Q61 PolarHBondContact O-N 3.06Å; T58-N62 VanDerWaalsContact O-CG 3.24Å; T58-N62 PolarHBondContact O-N 3.01Å; T58-N62 PolarHBondContact O-OD1 3.22Å
59	L	97.1	Very high	91.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-41.9	175.7	-65.2	174.5	0	0	0	112	I51 A54 S55 L56 E57 Q61 N62 L63 Y75 F79 V414 F416	I51-L59 HydrophobicContact CG2-CD2 4.06Å; A54-L59 HydrophobicContact CB-CD2 3.92Å; A54-L59 HydrophobicContact CB-CG 3.98Å; S55-L59 WeakPolarHBondContact O-CG 3.39Å; S55-L59 PolarHBondContact O-N 3.08Å; S55-L59 VanDerWaalsContact O-N 3.08Å; L56-L59 PolarHBondContact O-N 3.05Å; E57-L59 VanDerWaalsContact C-N 3.35Å; L59-Q61 VanDerWaalsContact C-N 3.31Å; L59-Q61 PolarHBondContact O-N 3.06Å; L59-N62 PolarHBondContact O-N 2.93Å; L59-L63 PolarHBondContact O-N 3.08Å; L59-L63 VanDerWaalsContact O-N 3.07Å; L59-Y75 WeakPolarHBondContact CA-OH 3.37Å; L59-Y75 WeakPolarHBondContact CB-OH 3.38Å; L59-Y75 HydrophobicContact CD2-CE2 4.1Å; L59-Y75 VanDerWaalsContact CD2-OH 3.25Å; L59-Y75 WeakPolarHBondContact CD2-OH 3.48Å; L59-Y75 PolarHBondContact O-OH 3.43Å; L59-F79 HydrophobicContact CB-CD2 3.91Å; L59-F79 HydrophobicContact CB-CE2 3.44Å; L59-F79 VanDerWaalsContact CB-CE2 3.44Å; L59-F79 HydrophobicContact CB-CZ 3.89Å; L59-F79 HydrophobicContact CD1-CD2 4.24Å; L59-F79 HydrophobicContact CD1-CE2 4.03Å; L59-F79 HydrophobicContact CG-CE2 4.35Å; L59-V414 HydrophobicContact CD1-CB 3.63Å; L59-V414 HydrophobicContact CD1-CG1 3.79Å; L59-V414 HydrophobicContact CD1-CG2 4Å; L59-F416 HydrophobicContact CD1-CD2 3.92Å; L59-F416 HydrophobicContact CD1-CE2 4.46Å; L59-F416 HydrophobicContact CD2-CD2 3.85Å; L59-F416 HydrophobicContact CD2-CE2 4.14Å; L59-F416 HydrophobicContact CD2-CG 4.3Å
60	I	97.3	Very high	93.1	Very high	4 Å²	4	46 Å²	46	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-43.4	174.5	-64.2	171.2	0	0	0	110.2	L56 E57 N62 L63 V64 F79 I87 L92 R95 V96 L99	L56-I60 HydrophobicContact CD1-CD1 4.3Å; L56-I60 HydrophobicContact CD1-CG1 4.34Å; L56-I60 HydrophobicContact CG-CD1 3.97Å; L56-I60 HydrophobicContact CG-CG1 4.41Å; L56-I60 VanDerWaalsContact O-CG1 3.28Å; L56-I60 WeakPolarHBondContact O-CG1 3.28Å; L56-I60 PolarHBondContact O-N 3.01Å; E57-I60 PolarHBondContact O-N 2.9Å; I60-N62 VanDerWaalsContact C-N 3.32Å; I60-N62 PolarHBondContact O-N 3.2Å; I60-L63 WeakPolarHBondContact O-CB 3.18Å; I60-L63 PolarHBondContact O-N 3.15Å; I60-L63 VanDerWaalsContact O-N 3.13Å; I60-V64 WeakPolarHBondContact O-CG2 3.47Å; I60-V64 PolarHBondContact O-N 2.61Å; I60-F79 HydrophobicContact CG1-CE1 4.23Å; I60-F79 HydrophobicContact CG1-CZ 3.73Å; I60-I87 HydrophobicContact CD1-CD1 4.25Å; I60-L92 HydrophobicContact CD1-CD1 3.99Å; I60-L92 HydrophobicContact CG1-CD1 3.68Å; I60-L92 HydrophobicContact CG2-CD1 4.31Å; I60-R95 HydrophobicContact CG2-CB 4.37Å; I60-V96 HydrophobicContact CG2-CG2 4.22Å; I60-L99 HydrophobicContact CG2-CD1 3.73Å
61	Q	95.9	Very high	94	Very high	96 Å²	96	40.8 Å²	40.8	45%	0.449	22%	0.217	S	C	.	.	H	α-helix	trans	-60.3	-41.4	176.9	-73.8	171.6	13.3	0	0	112.2	E57 T58 L59 L63 V64 L99	E57-Q61 VanDerWaalsContact O-CG 3.29Å; E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.14Å; T58-Q61 PolarHBondContact O-N 3.06Å; L59-Q61 VanDerWaalsContact C-N 3.31Å; L59-Q61 PolarHBondContact O-N 3.06Å; Q61-L63 VanDerWaalsContact C-N 3.25Å; Q61-L63 PolarHBondContact O-N 3.03Å; Q61-V64 PolarHBondContact O-N 3.4Å; Q61-V64 VanDerWaalsContact O-N 3.11Å; Q61-L99 HydrophobicContact CG-CD1 4.13Å
62	N	95.4	Very high	94.4	Very high	48 Å²	48	44.5 Å²	44.5	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-68.1	-23.5	177.3	-69.1	-10.1	0	0	0	112.9	I51 T58 L59 I60 V64 Y69 Y75	I51-N62 WeakPolarHBondContact CD1-ND2 3.18Å; T58-N62 VanDerWaalsContact O-CG 3.24Å; T58-N62 PolarHBondContact O-N 3.01Å; T58-N62 PolarHBondContact O-OD1 3.22Å; L59-N62 PolarHBondContact O-N 2.93Å; I60-N62 VanDerWaalsContact C-N 3.32Å; I60-N62 PolarHBondContact O-N 3.2Å; N62-V64 VanDerWaalsContact C-N 3.3Å; N62-Y69 WeakPolarHBondContact O-CE1 3.36Å; N62-Y69 PolarHBondContact O-OH 3.04Å; N62-Y75 HydrophobicContact CB-CE1 4.07Å
63	L	96.8	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-71.2	-27	172.1	-172.9	66.8	0	0	0	112.1	L59 I60 Q61 P65 Y75 V76 F79 L80 V96 L126	L59-L63 PolarHBondContact O-N 3.08Å; L59-L63 VanDerWaalsContact O-N 3.07Å; I60-L63 WeakPolarHBondContact O-CB 3.18Å; I60-L63 PolarHBondContact O-N 3.15Å; I60-L63 VanDerWaalsContact O-N 3.13Å; Q61-L63 VanDerWaalsContact C-N 3.25Å; Q61-L63 PolarHBondContact O-N 3.03Å; L63-P65 WeakPolarHBondContact O-CD 3.44Å; L63-Y75 HydrophobicContact CB-CE1 4.47Å; L63-V76 HydrophobicContact CD1-CB 4.5Å; L63-V76 HydrophobicContact CD1-CG1 4.38Å; L63-V76 HydrophobicContact CD1-CG2 4.2Å; L63-F79 HydrophobicContact CB-CD1 4Å; L63-F79 HydrophobicContact CB-CE1 4.09Å; L63-F79 HydrophobicContact CD1-CD1 4.14Å; L63-F79 HydrophobicContact CD2-CD1 3.8Å; L63-F79 HydrophobicContact CD2-CE1 3.84Å; L63-F79 HydrophobicContact CG-CD1 4.18Å; L63-F79 HydrophobicContact CG-CE1 4.46Å; L63-L80 HydrophobicContact CD2-CD2 3.84Å; L63-V96 HydrophobicContact CD2-CG2 3.89Å; L63-L126 HydrophobicContact CD1-CD1 3.85Å; L63-L126 HydrophobicContact CG-CD1 4.29Å; L63-L126 HydrophobicContact CG-CD2 4.21Å
64	V	95.8	Very high	94.5	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	26%	0.257	C	S	.	.	S	Bend	trans	-77.9	117.8	-172	-177.7	0	0	0	0	111.3	I60 Q61 N62 V96 L99 C100	I60-V64 WeakPolarHBondContact O-CG2 3.47Å; I60-V64 PolarHBondContact O-N 2.61Å; Q61-V64 PolarHBondContact O-N 3.4Å; Q61-V64 VanDerWaalsContact O-N 3.11Å; N62-V64 VanDerWaalsContact C-N 3.3Å; V64-V96 HydrophobicContact CG2-CG1 4.2Å; V64-V96 HydrophobicContact CG2-CG2 4.42Å; V64-L99 HydrophobicContact CG1-CB 4.44Å; V64-L99 HydrophobicContact CG2-CB 3.88Å; V64-L99 HydrophobicContact CG2-CD1 3.86Å; V64-C100 VanDerWaalsContact CG1-SG 3.56Å
65	P	94.9	Very high	94.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.257	C	S	.	.			trans	-70.8	152.3	176.5	28.1	-32.9	0	0	0	111.4	L63 Y70 F119 K122 I123 L126	L63-P65 WeakPolarHBondContact O-CD 3.44Å; P65-Y70 HydrophobicContact CB-CD2 3.97Å; P65-F119 HydrophobicContact CG-CE2 4.19Å; P65-F119 WeakPolarHBondContact O-CD2 3.44Å; P65-F119 VanDerWaalsContact O-CE2 3.24Å; P65-F119 WeakPolarHBondContact O-CE2 3.42Å; P65-K122 HydrophobicContact CB-CB 3.74Å; P65-K122 HydrophobicContact CB-CD 4.5Å; P65-K122 HydrophobicContact CG-CB 4.27Å; P65-I123 HydrophobicContact CG-CB 4.24Å; P65-I123 HydrophobicContact CG-CD1 4.16Å; P65-L126 HydrophobicContact CG-CD2 4.43Å
66	T	91.1	Very high	94.5	Very high	37 Å²	37	48.8 Å²	48.8	23%	0.227	25%	0.247	C	C	.	.			trans	-126.8	176	174.2	77.3	0	0	0	0	110.3	D68 Y69 K122	T66-D68 PolarHBondContact O-N 2.89Å; T66-D68 PolarHBondContact OG1-N 3.12Å; T66-Y69 PolarHBondContact N-O 3.45Å; T66-Y69 PolarHBondContact O-N 3.31Å; T66-Y69 WeakPolarHBondContact OG1-CB 3.31Å; T66-Y69 PolarHBondContact OG1-N 3.4Å; T66-Y69 VanDerWaalsContact OG1-N 3.12Å; T66-K122 WeakPolarHBondContact O-CD 3.43Å; T66-K122 WeakPolarHBondContact O-CE 3.37Å; T66-K122 PolarHBondContact O-NZ 3.29Å
67	A	88.3	Confident	94.6	Very high	17 Å²	17	50.2 Å²	50.2	14%	0.14	25%	0.253	C	S	.	.	S	Bend	trans	-51.7	-31	175.9	0	0	0	0	0	113.3	K118 K122	A67-K118 HydrophobicContact CB-CB 3.91Å; A67-K118 HydrophobicContact CB-CD 4.31Å; A67-K122 PolarHBondContact O-NZ 3.16Å
68	D	89.6	Confident	94.6	Very high	140 Å²	140	46 Å²	46	75%	0.749	23%	0.234	S	C	*	.	S	Bend	trans	-118	-5.3	-174	-53.3	-54.2	0	0	0	113.7	T66 K122	T66-D68 PolarHBondContact O-N 2.89Å; T66-D68 PolarHBondContact OG1-N 3.12Å; D68-K122 VanDerWaalsContact C-NZ 3.32Å
69	Y	93.5	Very high	94.6	Very high	93 Å²	93	43.5 Å²	43.5	37%	0.365	22%	0.218	S	C	.	.			trans	-125.9	143.9	-178.6	171.7	-102.2	0	0	0	112.9	N62 T66 P71 K122	N62-Y69 WeakPolarHBondContact O-CE1 3.36Å; N62-Y69 PolarHBondContact O-OH 3.04Å; T66-Y69 PolarHBondContact N-O 3.45Å; T66-Y69 PolarHBondContact O-N 3.31Å; T66-Y69 WeakPolarHBondContact OG1-CB 3.31Å; T66-Y69 PolarHBondContact OG1-N 3.4Å; T66-Y69 VanDerWaalsContact OG1-N 3.12Å; Y69-P71 HydrophobicContact CE1-CB 4.39Å; Y69-K122 VanDerWaalsContact N-NZ 3.19Å; Y69-K122 PolarHBondContact O-NZ 3.29Å
70	Y	95.8	Very high	94.5	Very high	48 Å²	48	43.6 Å²	43.6	19%	0.188	22%	0.219	C	C	.	.			trans	-138.8	134.6	164.6	-172.5	-94.2	0	0	0	108.5	P65 K122 Q125 L126 E129	P65-Y70 HydrophobicContact CB-CD2 3.97Å; Y70-K122 HydrophobicContact CD2-CB 3.99Å; Y70-K122 HydrophobicContact CD2-CG 4.36Å; Y70-K122 WeakPolarHBondContact CE2-O 3.48Å; Y70-Q125 VanDerWaalsContact CE1-NE2 3.34Å; Y70-Q125 HydrophobicContact CE2-CB 4.02Å; Y70-Q125 HydrophobicContact CE2-CG 4.08Å; Y70-Q125 VanDerWaalsContact CZ-CD 3.49Å; Y70-L126 HydrophobicContact CE2-CB 4.25Å; Y70-L126 WeakPolarHBondContact OH-CA 3.49Å; Y70-L126 PolarHBondContact OH-N 3.46Å; Y70-E129 PolarHBondContact OH-OE1 3.4Å; Y70-E129 PolarHBondContact OH-OE2 2.95Å
71	P	94.4	Very high	94.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	22%	0.218	C	C	.	.			trans	-64.4	147	178.5	26.4	-35.7	0	0	0	112.3	Y69 Y75 V76	Y69-P71 HydrophobicContact CE1-CB 4.39Å; P71-Y75 HydrophobicContact CB-CD1 3.98Å; P71-V76 HydrophobicContact CB-CG2 3.82Å; P71-V76 HydrophobicContact CG-CG2 3.51Å
72	E	93.6	Very high	94.2	Very high	138 Å²	138	39 Å²	39	65%	0.645	20%	0.198	S	C	*	.			trans	-60.8	144.1	174.6	-65.5	-176.4	-179.7	0	0	111.5	A74 Y75 V76	E72-A74 VanDerWaalsContact C-N 3.25Å; E72-A74 PolarHBondContact O-N 3.46Å; E72-Y75 WeakPolarHBondContact O-CA 3.32Å; E72-Y75 VanDerWaalsContact O-CB 3.3Å; E72-Y75 WeakPolarHBondContact O-CB 3.23Å; E72-Y75 PolarHBondContact O-N 2.95Å; E72-V76 PolarHBondContact O-N 3.33Å
73	K	92.8	Very high	94	Very high	149 Å²	149	36.8 Å²	36.8	65%	0.648	19%	0.186	S	C	*	.	H	α-helix	trans	-56.9	-38.8	-179.2	-67.8	-171.6	174.8	-174.8	0	113	Y75 V76 F77	K73-Y75 VanDerWaalsContact C-N 3.31Å; K73-Y75 PolarHBondContact O-N 2.98Å; K73-V76 PolarHBondContact O-N 3.24Å; K73-F77 WeakPolarHBondContact O-CB 3.34Å; K73-F77 PolarHBondContact O-N 3.08Å
74	A	93.2	Very high	93.7	Very high	65 Å²	65	38.6 Å²	38.6	54%	0.537	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-39.3	176	0	0	0	0	0	111.6	E72 T78	E72-A74 VanDerWaalsContact C-N 3.25Å; E72-A74 PolarHBondContact O-N 3.46Å; A74-T78 WeakPolarHBondContact O-CB 3.38Å; A74-T78 PolarHBondContact O-N 2.86Å; A74-T78 PolarHBondContact O-OG1 3.45Å
75	Y	95.8	Very high	93.3	Very high	22 Å²	22	40.4 Å²	40.4	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-48.4	174.3	-178.2	-90.5	0	0	0	111.7	I51 L59 N62 L63 P71 E72 K73 F77 T78 F79 F416	I51-Y75 HydrophobicContact CD1-CD2 4.37Å; I51-Y75 HydrophobicContact CD1-CE2 3.89Å; L59-Y75 WeakPolarHBondContact CA-OH 3.37Å; L59-Y75 WeakPolarHBondContact CB-OH 3.38Å; L59-Y75 HydrophobicContact CD2-CE2 4.1Å; L59-Y75 VanDerWaalsContact CD2-OH 3.25Å; L59-Y75 WeakPolarHBondContact CD2-OH 3.48Å; L59-Y75 PolarHBondContact O-OH 3.43Å; N62-Y75 HydrophobicContact CB-CE1 4.07Å; L63-Y75 HydrophobicContact CB-CE1 4.47Å; P71-Y75 HydrophobicContact CB-CD1 3.98Å; E72-Y75 WeakPolarHBondContact O-CA 3.32Å; E72-Y75 VanDerWaalsContact O-CB 3.3Å; E72-Y75 WeakPolarHBondContact O-CB 3.23Å; E72-Y75 PolarHBondContact O-N 2.95Å; K73-Y75 VanDerWaalsContact C-N 3.31Å; K73-Y75 PolarHBondContact O-N 2.98Å; Y75-F77 VanDerWaalsContact C-N 3.35Å; Y75-F77 PolarHBondContact O-N 3.45Å; Y75-T78 PolarHBondContact O-N 3Å; Y75-F79 HydrophobicContact CD1-CB 4.47Å; Y75-F79 HydrophobicContact CE1-CB 4.08Å; Y75-F79 HydrophobicContact CE1-CG 4.4Å; Y75-F79 VanDerWaalsContact O-CB 3.31Å; Y75-F79 WeakPolarHBondContact O-CB 3.42Å; Y75-F79 PolarHBondContact O-N 3.39Å; Y75-F416 AromaticContact CD2-CE1 3.59Å; Y75-F416 HydrophobicContact CD2-CE1 3.59Å; Y75-F416 HydrophobicContact CD2-CE2 4.42Å; Y75-F416 AromaticContact CD2-CZ 3.4Å; Y75-F416 HydrophobicContact CD2-CZ 3.4Å; Y75-F416 VanDerWaalsContact CD2-CZ 3.4Å; Y75-F416 AromaticContact CE2-CE1 3.69Å; Y75-F416 HydrophobicContact CE2-CE1 3.69Å; Y75-F416 AromaticContact CE2-CE2 3.9Å; Y75-F416 HydrophobicContact CE2-CE2 3.9Å; Y75-F416 AromaticContact CE2-CZ 3.3Å; Y75-F416 HydrophobicContact CE2-CZ 3.3Å; Y75-F416 HydrophobicContact CG-CZ 4.34Å
76	V	96.7	Very high	93	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	21%	0.211	C	C	.	.	H	α-helix	trans	-55	-51.5	177.7	175.9	0	0	0	0	110.3	L63 P71 E72 K73 L80 L126	L63-V76 HydrophobicContact CD1-CB 4.5Å; L63-V76 HydrophobicContact CD1-CG1 4.38Å; L63-V76 HydrophobicContact CD1-CG2 4.2Å; P71-V76 HydrophobicContact CB-CG2 3.82Å; P71-V76 HydrophobicContact CG-CG2 3.51Å; E72-V76 PolarHBondContact O-N 3.33Å; K73-V76 PolarHBondContact O-N 3.24Å; V76-L80 HydrophobicContact CG1-CD1 3.72Å; V76-L80 HydrophobicContact CG1-CG 4.25Å; V76-L80 WeakPolarHBondContact O-CB 3.17Å; V76-L80 WeakPolarHBondContact O-CG 3.49Å; V76-L80 PolarHBondContact O-N 3.19Å; V76-L126 HydrophobicContact CG1-CD1 3.82Å; V76-L126 HydrophobicContact CG2-CD1 4.24Å
77	F	96.3	Very high	93	Very high	40 Å²	40	40.9 Å²	40.9	18%	0.175	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-50.7	178.1	179.5	-103	0	0	0	111.9	K73 Y75 F79 L81 T133 F134 P241 A423 V426	K73-F77 WeakPolarHBondContact O-CB 3.34Å; K73-F77 PolarHBondContact O-N 3.08Å; Y75-F77 VanDerWaalsContact C-N 3.35Å; Y75-F77 PolarHBondContact O-N 3.45Å; F77-F79 PolarHBondContact O-N 3.4Å; F77-L81 HydrophobicContact CE1-CD2 4.02Å; F77-L81 HydrophobicContact CZ-CD2 4.14Å; F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.35Å; F77-T133 HydrophobicContact CD2-CG2 3.72Å; F77-T133 HydrophobicContact CE2-CG2 3.83Å; F77-F134 HydrophobicContact CE2-CZ 4.42Å; F77-P241 HydrophobicContact CE2-CB 4.33Å; F77-P241 HydrophobicContact CZ-CB 4.39Å; F77-A423 HydrophobicContact CD1-CB 3.92Å; F77-A423 HydrophobicContact CE1-CB 3.92Å; F77-A423 WeakPolarHBondContact CE1-O 3.4Å; F77-V426 HydrophobicContact CZ-CB 4.46Å; F77-V426 HydrophobicContact CZ-CG1 4.06Å
78	T	95.9	Very high	93.2	Very high	8 Å²	8	43.4 Å²	43.4	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-48.6	-178	-60.9	0	0	0	0	112	A74 Y75 S82 F416 F419 V420 A423	A74-T78 WeakPolarHBondContact O-CB 3.38Å; A74-T78 PolarHBondContact O-N 2.86Å; A74-T78 PolarHBondContact O-OG1 3.45Å; Y75-T78 PolarHBondContact O-N 3Å; T78-S82 WeakPolarHBondContact O-CB 3.41Å; T78-S82 PolarHBondContact O-N 3.01Å; T78-S82 PolarHBondContact O-OG 3.11Å; T78-F416 HydrophobicContact CG2-CE1 3.95Å; T78-F416 HydrophobicContact CG2-CE2 3.98Å; T78-F416 HydrophobicContact CG2-CZ 3.56Å; T78-F419 HydrophobicContact CG2-CB 3.92Å; T78-F419 WeakPolarHBondContact CG2-O 3.37Å; T78-V420 HydrophobicContact CG2-CG2 4.07Å; T78-A423 HydrophobicContact CG2-CB 3.95Å; T78-A423 VanDerWaalsContact OG1-CB 3.23Å; T78-A423 WeakPolarHBondContact OG1-CB 3.45Å
79	F	96.3	Very high	93.4	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-70.9	-46.9	-177.5	-177	-117.1	0	0	0	111	L56 L59 I60 L63 Y75 F77 L81 S82 A83 L92 F416	L56-F79 HydrophobicContact CD1-CE2 4.16Å; L56-F79 HydrophobicContact CD1-CZ 4.24Å; L59-F79 HydrophobicContact CB-CD2 3.91Å; L59-F79 HydrophobicContact CB-CE2 3.44Å; L59-F79 VanDerWaalsContact CB-CE2 3.44Å; L59-F79 HydrophobicContact CB-CZ 3.89Å; L59-F79 HydrophobicContact CD1-CD2 4.24Å; L59-F79 HydrophobicContact CD1-CE2 4.03Å; L59-F79 HydrophobicContact CG-CE2 4.35Å; I60-F79 HydrophobicContact CG1-CE1 4.23Å; I60-F79 HydrophobicContact CG1-CZ 3.73Å; L63-F79 HydrophobicContact CB-CD1 4Å; L63-F79 HydrophobicContact CB-CE1 4.09Å; L63-F79 HydrophobicContact CD1-CD1 4.14Å; L63-F79 HydrophobicContact CD2-CD1 3.8Å; L63-F79 HydrophobicContact CD2-CE1 3.84Å; L63-F79 HydrophobicContact CG-CD1 4.18Å; L63-F79 HydrophobicContact CG-CE1 4.46Å; Y75-F79 HydrophobicContact CD1-CB 4.47Å; Y75-F79 HydrophobicContact CE1-CB 4.08Å; Y75-F79 HydrophobicContact CE1-CG 4.4Å; Y75-F79 VanDerWaalsContact O-CB 3.31Å; Y75-F79 WeakPolarHBondContact O-CB 3.42Å; Y75-F79 PolarHBondContact O-N 3.39Å; F77-F79 PolarHBondContact O-N 3.4Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 3.37Å; F79-S82 PolarHBondContact O-N 2.77Å; F79-S82 PolarHBondContact O-OG 3.44Å; F79-A83 HydrophobicContact CD2-CB 4.42Å; F79-A83 HydrophobicContact CE1-CB 4.49Å; F79-A83 HydrophobicContact CE2-CB 4.13Å; F79-A83 HydrophobicContact CZ-CB 4.17Å; F79-A83 WeakPolarHBondContact O-CA 3.41Å; F79-A83 WeakPolarHBondContact O-CB 3.42Å; F79-A83 PolarHBondContact O-N 3.38Å; F79-L92 HydrophobicContact CE1-CD1 4.05Å; F79-L92 HydrophobicContact CE1-CD2 4.41Å; F79-L92 HydrophobicContact CZ-CD1 4.25Å; F79-F416 HydrophobicContact CB-CE2 4.01Å; F79-F416 HydrophobicContact CB-CZ 4.23Å; F79-F416 HydrophobicContact CD2-CE2 4.1Å
80	L	96.1	Very high	93.5	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-39.6	176.5	-69.3	-177	0	0	0	111.7	L63 V76 R84 L92 W130 F134	L63-L80 HydrophobicContact CD2-CD2 3.84Å; V76-L80 HydrophobicContact CG1-CD1 3.72Å; V76-L80 HydrophobicContact CG1-CG 4.25Å; V76-L80 WeakPolarHBondContact O-CB 3.17Å; V76-L80 WeakPolarHBondContact O-CG 3.49Å; V76-L80 PolarHBondContact O-N 3.19Å; L80-R84 PolarHBondContact O-NH1 3.41Å; L80-L92 HydrophobicContact CD2-CD2 4.14Å; L80-W130 HydrophobicContact CD1-CB 3.96Å; L80-W130 HydrophobicContact CD1-CD2 3.82Å; L80-W130 HydrophobicContact CD1-CE3 4.25Å; L80-W130 HydrophobicContact CD1-CG 3.69Å; L80-W130 HydrophobicContact CD2-CD2 3.64Å; L80-W130 HydrophobicContact CD2-CE3 3.66Å; L80-W130 HydrophobicContact CD2-CG 4.37Å; L80-W130 HydrophobicContact CD2-CH2 3.82Å; L80-W130 HydrophobicContact CD2-CZ2 3.76Å; L80-W130 HydrophobicContact CD2-CZ3 3.76Å; L80-W130 HydrophobicContact CG-CD2 4.38Å; L80-F134 HydrophobicContact CB-CD2 4.1Å; L80-F134 HydrophobicContact CB-CE2 3.42Å; L80-F134 VanDerWaalsContact CB-CE2 3.42Å; L80-F134 HydrophobicContact CB-CZ 4.14Å; L80-F134 HydrophobicContact CD1-CD2 4.33Å; L80-F134 HydrophobicContact CD1-CE2 4.16Å; L80-F134 HydrophobicContact CG-CE2 4.46Å
81	L	93.8	Very high	93.5	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-54.7	175.7	-178.2	61.3	0	0	0	111.5	F77 F79 R84 F134 P241 V245 A423 V426	F77-L81 HydrophobicContact CE1-CD2 4.02Å; F77-L81 HydrophobicContact CZ-CD2 4.14Å; F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.35Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 3.37Å; L81-R84 VanDerWaalsContact CA-NH1 3.3Å; L81-R84 PolarHBondContact O-NH1 2.92Å; L81-F134 HydrophobicContact CB-CZ 4.04Å; L81-F134 HydrophobicContact CD1-CE1 4.02Å; L81-F134 HydrophobicContact CD1-CZ 4.31Å; L81-P241 HydrophobicContact CD1-CB 4.11Å; L81-P241 WeakPolarHBondContact CD1-O 3.49Å; L81-V245 HydrophobicContact CD1-CG2 3.49Å; L81-V245 VanDerWaalsContact CD1-CG2 3.49Å; L81-V245 HydrophobicContact CD2-CG2 4.45Å; L81-V245 HydrophobicContact CG-CG2 3.67Å; L81-A423 HydrophobicContact CD2-CB 4.17Å; L81-V426 HydrophobicContact CD2-CB 4.04Å; L81-V426 HydrophobicContact CD2-CG1 4.18Å; L81-V426 HydrophobicContact CD2-CG2 4.21Å
82	S	91.8	Very high	93.6	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-83.1	-24.9	-171.2	58.6	0	0	0	0	114.8	T78 F79 R84 L85	T78-S82 WeakPolarHBondContact O-CB 3.41Å; T78-S82 PolarHBondContact O-N 3.01Å; T78-S82 PolarHBondContact O-OG 3.11Å; F79-S82 PolarHBondContact O-N 2.77Å; F79-S82 PolarHBondContact O-OG 3.44Å; S82-R84 PolarHBondContact O-N 3.23Å; S82-L85 WeakPolarHBondContact O-CB 3.39Å; S82-L85 PolarHBondContact O-N 3.17Å
83	A	92.6	Very high	93.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-26.5	-178.3	0	0	0	0	0	112.8	F79 L85 F86 I87 L92	F79-A83 HydrophobicContact CD2-CB 4.42Å; F79-A83 HydrophobicContact CE1-CB 4.49Å; F79-A83 HydrophobicContact CE2-CB 4.13Å; F79-A83 HydrophobicContact CZ-CB 4.17Å; F79-A83 WeakPolarHBondContact O-CA 3.41Å; F79-A83 WeakPolarHBondContact O-CB 3.42Å; F79-A83 PolarHBondContact O-N 3.38Å; A83-L85 PolarHBondContact O-N 3.18Å; A83-F86 PolarHBondContact O-N 3.26Å; A83-I87 HydrophobicContact CB-CG2 4.1Å; A83-I87 WeakPolarHBondContact O-CG2 3.39Å; A83-I87 PolarHBondContact O-N 3.24Å; A83-I87 VanDerWaalsContact O-O 3.1Å; A83-L92 HydrophobicContact CB-CD2 3.74Å
84	R	90.4	Very high	94.1	Very high	39 Å²	39	24.4 Å²	24.4	15%	0.147	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.6	175.3	-61.3	-173.3	-179.7	71.1	14.8	114.1	L80 L81 S82 F86 P89 F134 D137	L80-R84 PolarHBondContact O-NH1 3.41Å; L81-R84 VanDerWaalsContact CA-NH1 3.3Å; L81-R84 PolarHBondContact O-NH1 2.92Å; S82-R84 PolarHBondContact O-N 3.23Å; R84-F86 VanDerWaalsContact C-N 3.31Å; R84-P89 HydrophobicContact CG-CG 4.25Å; R84-F134 VanDerWaalsContact CZ-CD1 3.44Å; R84-F134 VanDerWaalsContact NH2-CB 3.3Å; R84-D137 IonicContact CZ-OD1 2.81Å; R84-D137 IonicContact CZ-OD2 2.86Å; R84-D137 IonicContact NE-OD1 3.23Å; R84-D137 PolarHBondContact NE-OD1 2.93Å; R84-D137 IonicContact NE-OD2 3.61Å; R84-D137 IonicContact NH2-OD1 3.96Å; R84-D137 IonicContact NH2-OD2 2.71Å; R84-D137 PolarHBondContact NH2-OD2 3.3Å
85	L	86.8	Confident	94.3	Very high	39 Å²	39	25.3 Å²	25.3	20%	0.204	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-12	174.5	-61.3	177.5	0	0	0	113.3	S82 A83 V245 V249 F419	S82-L85 WeakPolarHBondContact O-CB 3.39Å; S82-L85 PolarHBondContact O-N 3.17Å; A83-L85 PolarHBondContact O-N 3.18Å; L85-V245 HydrophobicContact CD1-CG1 4.12Å; L85-V245 HydrophobicContact CD2-CG1 3.51Å; L85-V245 HydrophobicContact CG-CG1 3.67Å; L85-V249 HydrophobicContact CD2-CG2 3.75Å; L85-F419 HydrophobicContact CD1-CE1 3.47Å; L85-F419 VanDerWaalsContact CD1-CE1 3.47Å; L85-F419 HydrophobicContact CD1-CZ 3.85Å
86	F	88.8	Confident	94.3	Very high	42 Å²	42	24.3 Å²	24.3	18%	0.184	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-29	-171.1	-53.4	-69.1	0	0	0	113.6	L56 A83 R84 N407 R408 V414 F419	L56-F86 HydrophobicContact CD1-CB 4.19Å; L56-F86 HydrophobicContact CD2-CB 4.11Å; A83-F86 PolarHBondContact O-N 3.26Å; R84-F86 VanDerWaalsContact C-N 3.31Å; F86-N407 HydrophobicContact CE1-CB 3.9Å; F86-N407 HydrophobicContact CZ-CB 3.89Å; F86-R408 HydrophobicContact CE1-CG 4.14Å; F86-V414 HydrophobicContact CD2-CG1 4.43Å; F86-V414 HydrophobicContact CD2-CG2 4.41Å; F86-V414 HydrophobicContact CE1-CG2 4.37Å; F86-V414 HydrophobicContact CE2-CG1 3.66Å; F86-V414 HydrophobicContact CE2-CG2 4.27Å; F86-V414 HydrophobicContact CZ-CG1 3.78Å; F86-V414 HydrophobicContact CZ-CG2 4.24Å; F86-F419 HydrophobicContact CE2-CD2 4.36Å; F86-F419 AromaticContact CE2-CE2 3.5Å; F86-F419 HydrophobicContact CE2-CE2 3.5Å; F86-F419 VanDerWaalsContact CE2-CE2 3.5Å; F86-F419 AromaticContact CE2-CZ 3.65Å; F86-F419 HydrophobicContact CE2-CZ 3.65Å; F86-F419 AromaticContact CZ-CE2 3.46Å; F86-F419 HydrophobicContact CZ-CE2 3.46Å; F86-F419 VanDerWaalsContact CZ-CE2 3.46Å; F86-F419 AromaticContact CZ-CZ 3.49Å; F86-F419 HydrophobicContact CZ-CZ 3.49Å; F86-F419 VanDerWaalsContact CZ-CZ 3.49Å
87	I	90.6	Very high	94.3	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.026	13%	0.126	C	C	.	.	S	Bend	trans	-151.3	133.8	-175	-175.2	166.8	0	0	0	110	L56 I60 A83 E91 L92	L56-I87 HydrophobicContact CD1-CG2 4.46Å; L56-I87 HydrophobicContact CD2-CB 4.41Å; I60-I87 HydrophobicContact CD1-CD1 4.25Å; A83-I87 HydrophobicContact CB-CG2 4.1Å; A83-I87 WeakPolarHBondContact O-CG2 3.39Å; A83-I87 PolarHBondContact O-N 3.24Å; A83-I87 VanDerWaalsContact O-O 3.1Å; I87-E91 HydrophobicContact CD1-CB 4.2Å; I87-E91 HydrophobicContact CD1-CG 4Å; I87-E91 HydrophobicContact CG1-CB 3.9Å; I87-E91 HydrophobicContact CG1-CG 4.11Å; I87-L92 HydrophobicContact CD1-CB 4.18Å; I87-L92 HydrophobicContact CG1-CB 4.23Å; I87-L92 HydrophobicContact CG2-CB 4.03Å; I87-L92 HydrophobicContact CG2-CD1 4.18Å; I87-L92 HydrophobicContact CG2-CD2 4.47Å; I87-L92 HydrophobicContact CG2-CG 4.45Å
88	P	92.3	Very high	94.3	Very high	69 Å²	69	27 Å²	27	45%	0.448	14%	0.138	S	C	.	.			trans	-59.6	143.6	173.6	-24.6	34.9	0	0	0	112	S90 E91 L92	P88-S90 VanDerWaalsContact C-N 3.32Å; P88-S90 PolarHBondContact O-N 3.02Å; P88-E91 HydrophobicContact CB-CB 4.38Å; P88-E91 PolarHBondContact O-N 2.91Å; P88-E91 VanDerWaalsContact O-N 3.1Å; P88-L92 PolarHBondContact O-N 2.89Å
89	P	94.6	Very high	94.3	Very high	31 Å²	31	28.4 Å²	28.4	20%	0.201	15%	0.145	C	C	.	.	H	α-helix	trans	-53.7	-41.4	-178.4	-29.3	35.4	0	0	0	114.8	R84 L92 L93 W130 D137 M143	R84-P89 HydrophobicContact CG-CG 4.25Å; P89-L92 PolarHBondContact O-N 3.07Å; P89-L93 PolarHBondContact O-N 3.44Å; P89-W130 HydrophobicContact CB-CZ2 4.43Å; P89-D137 HydrophobicContact CB-CB 4.12Å; P89-M143 HydrophobicContact CB-CE 4.43Å; P89-M143 HydrophobicContact CB-SD 4.22Å; P89-M143 VanDerWaalsContact O-SD 3.38Å
90	S	95.3	Very high	94.3	Very high	23 Å²	23	28.3 Å²	28.3	16%	0.161	15%	0.145	C	C	.	.	H	α-helix	trans	-67.4	-38.2	178.5	44.8	0	0	0	0	113.2	P88 S94 D140 M143	P88-S90 VanDerWaalsContact C-N 3.32Å; P88-S90 PolarHBondContact O-N 3.02Å; S90-S94 WeakPolarHBondContact O-CB 3.31Å; S90-S94 PolarHBondContact O-N 3.49Å; S90-D140 VanDerWaalsContact CB-OD2 3.32Å; S90-D140 WeakPolarHBondContact CB-OD2 3.49Å; S90-D140 PolarHBondContact OG-OD2 3.01Å; S90-M143 WeakPolarHBondContact CA-SD 3.22Å; S90-M143 PolarHBondContact N-SD 3.37Å
91	E	95.8	Very high	94.2	Very high	83 Å²	83	29.7 Å²	29.7	39%	0.388	15%	0.152	S	C	.	.	H	α-helix	trans	-67	-41.4	172.8	-166.5	-172.3	149.5	0	0	111.4	I87 P88 S94 R95	I87-E91 HydrophobicContact CD1-CB 4.2Å; I87-E91 HydrophobicContact CD1-CG 4Å; I87-E91 HydrophobicContact CG1-CB 3.9Å; I87-E91 HydrophobicContact CG1-CG 4.11Å; P88-E91 HydrophobicContact CB-CB 4.38Å; P88-E91 PolarHBondContact O-N 2.91Å; P88-E91 VanDerWaalsContact O-N 3.1Å; E91-S94 WeakPolarHBondContact O-CB 3.5Å; E91-S94 PolarHBondContact O-N 3.04Å; E91-R95 WeakPolarHBondContact O-CG 3.39Å; E91-R95 PolarHBondContact O-N 3.44Å; E91-R95 IonicContact OE1-CZ 3.35Å; E91-R95 IonicContact OE1-NE 3.19Å; E91-R95 PolarHBondContact OE1-NE 3.49Å; E91-R95 IonicContact OE1-NH2 2.92Å; E91-R95 PolarHBondContact OE1-NH2 3.16Å
92	L	97.2	Very high	94.1	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-59.4	-48.4	175.9	177.8	61.3	0	0	0	111.4	I60 F79 L80 A83 I87 P88 P89 S94 R95 V96 W130	I60-L92 HydrophobicContact CD1-CD1 3.99Å; I60-L92 HydrophobicContact CG1-CD1 3.68Å; I60-L92 HydrophobicContact CG2-CD1 4.31Å; F79-L92 HydrophobicContact CE1-CD1 4.05Å; F79-L92 HydrophobicContact CE1-CD2 4.41Å; F79-L92 HydrophobicContact CZ-CD1 4.25Å; L80-L92 HydrophobicContact CD2-CD2 4.14Å; A83-L92 HydrophobicContact CB-CD2 3.74Å; I87-L92 HydrophobicContact CD1-CB 4.18Å; I87-L92 HydrophobicContact CG1-CB 4.23Å; I87-L92 HydrophobicContact CG2-CB 4.03Å; I87-L92 HydrophobicContact CG2-CD1 4.18Å; I87-L92 HydrophobicContact CG2-CD2 4.47Å; I87-L92 HydrophobicContact CG2-CG 4.45Å; P88-L92 PolarHBondContact O-N 2.89Å; P89-L92 PolarHBondContact O-N 3.07Å; L92-S94 VanDerWaalsContact C-N 3.33Å; L92-S94 PolarHBondContact O-N 2.97Å; L92-R95 PolarHBondContact O-N 3Å; L92-V96 HydrophobicContact CD1-CG2 4.4Å; L92-V96 WeakPolarHBondContact O-CG2 3.46Å; L92-V96 PolarHBondContact O-N 3.24Å; L92-W130 HydrophobicContact CB-CH2 4.13Å; L92-W130 HydrophobicContact CD2-CH2 3.62Å; L92-W130 HydrophobicContact CD2-CZ2 3.99Å; L92-W130 HydrophobicContact CG-CH2 3.69Å; L92-W130 HydrophobicContact CG-CZ2 4.45Å; L92-W130 HydrophobicContact CG-CZ3 4.5Å
93	L	97.6	Very high	94.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-39.9	178.8	-177.2	58.5	0	0	0	111.4	P89 R95 V96 C97 L127 W130 F138 M143 H146	P89-L93 PolarHBondContact O-N 3.44Å; L93-R95 PolarHBondContact O-N 3.38Å; L93-V96 PolarHBondContact O-N 3.26Å; L93-C97 WeakPolarHBondContact O-CB 3.47Å; L93-C97 PolarHBondContact O-N 3.17Å; L93-C97 PolarHBondContact O-SG 2.93Å; L93-L127 HydrophobicContact CD1-CD2 3.73Å; L93-W130 HydrophobicContact CB-CH2 3.94Å; L93-W130 HydrophobicContact CB-CZ3 4.18Å; L93-W130 HydrophobicContact CD1-CE3 4.31Å; L93-W130 HydrophobicContact CD1-CH2 4.5Å; L93-W130 HydrophobicContact CD1-CZ3 3.88Å; L93-F138 HydrophobicContact CD2-CE1 4.48Å; L93-M143 HydrophobicContact CB-CE 4.09Å; L93-M143 HydrophobicContact CB-SD 3.78Å; L93-M143 HydrophobicContact CD2-CB 4.42Å; L93-M143 HydrophobicContact CD2-CE 3.63Å; L93-M143 WeakPolarHBondContact CD2-O 3.35Å; L93-M143 HydrophobicContact CD2-SD 3.73Å; L93-M143 HydrophobicContact CG-CE 4.46Å; L93-M143 HydrophobicContact CG-SD 4.41Å; L93-H146 HydrophobicContact CD2-CB 3.81Å; L93-H146 HydrophobicContact CG-CB 3.82Å
94	S	97.5	Very high	94.1	Very high	30 Å²	30	40.1 Å²	40.1	21%	0.21	20%	0.198	C	C	.	.	H	α-helix	trans	-56.4	-49.4	173.2	-168.7	0	0	0	0	111.6	S90 E91 L92 V96 C97 E98	S90-S94 WeakPolarHBondContact O-CB 3.31Å; S90-S94 PolarHBondContact O-N 3.49Å; E91-S94 WeakPolarHBondContact O-CB 3.5Å; E91-S94 PolarHBondContact O-N 3.04Å; L92-S94 VanDerWaalsContact C-N 3.33Å; L92-S94 PolarHBondContact O-N 2.97Å; S94-V96 PolarHBondContact O-N 3.44Å; S94-C97 PolarHBondContact O-N 3.37Å; S94-E98 WeakPolarHBondContact O-CG 3.41Å; S94-E98 PolarHBondContact O-N 3.03Å
95	R	97.8	Very high	94.1	Very high	84 Å²	84	42.2 Å²	42.2	32%	0.317	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-40.4	178.8	-69	-173.4	-171.7	-156.8	7.1	112.4	E57 I60 E91 L92 L93 E98 L99	E57-R95 IonicContact OE1-NH1 2.61Å; E57-R95 PolarHBondContact OE1-NH1 2.9Å; I60-R95 HydrophobicContact CG2-CB 4.37Å; E91-R95 WeakPolarHBondContact O-CG 3.39Å; E91-R95 PolarHBondContact O-N 3.44Å; E91-R95 IonicContact OE1-CZ 3.35Å; E91-R95 IonicContact OE1-NE 3.19Å; E91-R95 PolarHBondContact OE1-NE 3.49Å; E91-R95 IonicContact OE1-NH2 2.92Å; E91-R95 PolarHBondContact OE1-NH2 3.16Å; L92-R95 PolarHBondContact O-N 3Å; L93-R95 PolarHBondContact O-N 3.38Å; R95-E98 PolarHBondContact O-N 2.98Å; R95-L99 WeakPolarHBondContact O-CB 3.26Å; R95-L99 WeakPolarHBondContact O-CG 3.4Å; R95-L99 PolarHBondContact O-N 2.72Å
96	V	97.3	Very high	94.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-49.3	174.2	168.1	0	0	0	0	110.4	I60 L63 V64 L92 L93 S94 E98 L99 C100 L126	I60-V96 HydrophobicContact CG2-CG2 4.22Å; L63-V96 HydrophobicContact CD2-CG2 3.89Å; V64-V96 HydrophobicContact CG2-CG1 4.2Å; V64-V96 HydrophobicContact CG2-CG2 4.42Å; L92-V96 HydrophobicContact CD1-CG2 4.4Å; L92-V96 WeakPolarHBondContact O-CG2 3.46Å; L92-V96 PolarHBondContact O-N 3.24Å; L93-V96 PolarHBondContact O-N 3.26Å; S94-V96 PolarHBondContact O-N 3.44Å; V96-E98 PolarHBondContact O-N 3.38Å; V96-L99 PolarHBondContact O-N 2.87Å; V96-C100 PolarHBondContact O-N 3.24Å; V96-C100 PolarHBondContact O-SG 3.49Å; V96-L126 HydrophobicContact CG1-CD2 4.33Å
97	C	96.4	Very high	94.3	Very high	10 Å²	10	44.1 Å²	44.1	7%	0.068	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-43.9	178	-71.2	0	0	0	0	112.2	L93 S94 L99 C100 I101	L93-C97 WeakPolarHBondContact O-CB 3.47Å; L93-C97 PolarHBondContact O-N 3.17Å; L93-C97 PolarHBondContact O-SG 2.93Å; S94-C97 PolarHBondContact O-N 3.37Å; C97-L99 VanDerWaalsContact C-N 3.35Å; C97-L99 PolarHBondContact O-N 3.31Å; C97-C100 WeakPolarHBondContact O-CB 3.31Å; C97-C100 PolarHBondContact O-N 3.27Å; C97-I101 WeakPolarHBondContact O-CD1 3.4Å; C97-I101 VanDerWaalsContact O-CG1 3.26Å; C97-I101 WeakPolarHBondContact O-CG1 3.45Å; C97-I101 PolarHBondContact O-N 3.46Å
98	E	96.1	Very high	94.2	Very high	90 Å²	90	48.8 Å²	48.8	42%	0.421	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-42.2	176.1	-75.3	176.6	-149.7	0	0	112.6	S94 R95 V96 I101 K102	S94-E98 WeakPolarHBondContact O-CG 3.41Å; S94-E98 PolarHBondContact O-N 3.03Å; R95-E98 PolarHBondContact O-N 2.98Å; V96-E98 PolarHBondContact O-N 3.38Å; E98-I101 PolarHBondContact O-N 3.46Å; E98-K102 WeakPolarHBondContact O-CB 3.34Å; E98-K102 WeakPolarHBondContact O-CG 3.48Å; E98-K102 PolarHBondContact O-N 3.46Å
99	L	96.1	Very high	93.9	Very high	39 Å²	39	51.4 Å²	51.4	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-41.9	175.8	-74.8	172.9	0	0	0	111.5	I60 Q61 V64 R95 V96 C97 I101 K102 Q103	I60-L99 HydrophobicContact CG2-CD1 3.73Å; Q61-L99 HydrophobicContact CG-CD1 4.13Å; V64-L99 HydrophobicContact CG1-CB 4.44Å; V64-L99 HydrophobicContact CG2-CB 3.88Å; V64-L99 HydrophobicContact CG2-CD1 3.86Å; R95-L99 WeakPolarHBondContact O-CB 3.26Å; R95-L99 WeakPolarHBondContact O-CG 3.4Å; R95-L99 PolarHBondContact O-N 2.72Å; V96-L99 PolarHBondContact O-N 2.87Å; C97-L99 VanDerWaalsContact C-N 3.35Å; C97-L99 PolarHBondContact O-N 3.31Å; L99-I101 VanDerWaalsContact C-N 3.34Å; L99-I101 PolarHBondContact O-N 2.94Å; L99-K102 PolarHBondContact O-N 3.41Å; L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.26Å; L99-Q103 VanDerWaalsContact O-CG 3.25Å; L99-Q103 WeakPolarHBondContact O-CG 3.22Å; L99-Q103 PolarHBondContact O-N 3.34Å
100	C	95.2	Very high	93.5	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.1	-49.3	172.5	-67.7	0	0	0	0	111.2	V64 V96 C97 K102 Q104 F119 I150	V64-C100 VanDerWaalsContact CG1-SG 3.56Å; V96-C100 PolarHBondContact O-N 3.24Å; V96-C100 PolarHBondContact O-SG 3.49Å; C97-C100 WeakPolarHBondContact O-CB 3.31Å; C97-C100 PolarHBondContact O-N 3.27Å; C100-K102 PolarHBondContact O-N 2.89Å; C100-Q104 WeakPolarHBondContact O-CB 3.3Å; C100-Q104 VanDerWaalsContact O-CG 3.3Å; C100-Q104 WeakPolarHBondContact O-CG 3.22Å; C100-Q104 PolarHBondContact O-N 2.97Å; C100-F119 HydrophobicContact CB-CE1 4.49Å; C100-F119 HydrophobicContact CB-CE2 4.39Å; C100-F119 HydrophobicContact CB-CZ 3.68Å; C100-I150 HydrophobicContact CB-CD1 3.87Å
101	I	93.8	Very high	93.1	Very high	31 Å²	31	56.7 Å²	56.7	16%	0.159	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-48.3	-179.6	-69	162.8	0	0	0	110.8	C97 E98 L99 Q105 L106 D107 I150	C97-I101 WeakPolarHBondContact O-CD1 3.4Å; C97-I101 VanDerWaalsContact O-CG1 3.26Å; C97-I101 WeakPolarHBondContact O-CG1 3.45Å; C97-I101 PolarHBondContact O-N 3.46Å; E98-I101 PolarHBondContact O-N 3.46Å; L99-I101 VanDerWaalsContact C-N 3.34Å; L99-I101 PolarHBondContact O-N 2.94Å; I101-Q105 VanDerWaalsContact O-CA 3.31Å; I101-Q105 WeakPolarHBondContact O-CA 3.46Å; I101-Q105 PolarHBondContact O-N 3.06Å; I101-L106 HydrophobicContact CG1-CB 4.47Å; I101-L106 HydrophobicContact CG1-CD1 4.17Å; I101-L106 HydrophobicContact CG2-CB 4.47Å; I101-L106 PolarHBondContact O-N 3.37Å; I101-D107 HydrophobicContact CG2-CB 4.46Å; I101-D107 WeakPolarHBondContact CG2-OD2 3.47Å; I101-I150 HydrophobicContact CG1-CD1 4.08Å
102	K	93.3	Very high	92.9	Very high	146 Å²	146	56.8 Å²	56.8	64%	0.635	30%	0.298	S	S	*	.	H	α-helix	trans	-65.7	-50	-179.1	-72.3	171	-177.7	165.6	0	112.3	E98 L99 C100 Q105	E98-K102 WeakPolarHBondContact O-CB 3.34Å; E98-K102 WeakPolarHBondContact O-CG 3.48Å; E98-K102 PolarHBondContact O-N 3.46Å; L99-K102 PolarHBondContact O-N 3.41Å; C100-K102 PolarHBondContact O-N 2.89Å; K102-Q105 PolarHBondContact O-N 3.43Å
103	Q	91.4	Very high	92.6	Very high	70 Å²	70	59.8 Å²	59.8	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-71.9	-36.2	-175.1	-67.6	177.7	8.1	0	0	112.8	L99 K115	L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.26Å; L99-Q103 VanDerWaalsContact O-CG 3.25Å; L99-Q103 WeakPolarHBondContact O-CG 3.22Å; L99-Q103 PolarHBondContact O-N 3.34Å; Q103-K115 PolarHBondContact O-NZ 3.3Å
104	Q	91	Very high	92.3	Very high	7 Å²	7	62.6 Å²	62.6	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-92.9	-0.8	-180	-49.2	-52	-43.3	0	0	112.9	C100 L106 F119	C100-Q104 WeakPolarHBondContact O-CB 3.3Å; C100-Q104 VanDerWaalsContact O-CG 3.3Å; C100-Q104 WeakPolarHBondContact O-CG 3.22Å; C100-Q104 PolarHBondContact O-N 2.97Å; Q104-L106 VanDerWaalsContact C-N 3.28Å; Q104-L106 HydrophobicContact CB-CD2 3.68Å; Q104-L106 HydrophobicContact CB-CG 3.91Å; Q104-L106 PolarHBondContact O-N 3.48Å; Q104-F119 HydrophobicContact CB-CD1 4.34Å; Q104-F119 HydrophobicContact CG-CB 4.38Å; Q104-F119 HydrophobicContact CG-CD1 3.86Å; Q104-F119 HydrophobicContact CG-CD2 3.67Å; Q104-F119 HydrophobicContact CG-CE1 4.01Å; Q104-F119 HydrophobicContact CG-CE2 3.83Å; Q104-F119 HydrophobicContact CG-CG 3.68Å; Q104-F119 HydrophobicContact CG-CZ 4Å
105	Q	91.1	Very high	91.9	Very high	84 Å²	84	63.9 Å²	63.9	39%	0.393	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	40.5	177	-63.8	176.4	-4.1	0	0	112.6	I101 K102 D107 Q108	I101-Q105 VanDerWaalsContact O-CA 3.31Å; I101-Q105 WeakPolarHBondContact O-CA 3.46Å; I101-Q105 PolarHBondContact O-N 3.06Å; K102-Q105 PolarHBondContact O-N 3.43Å; Q105-D107 PolarHBondContact O-N 2.92Å; Q105-D107 VanDerWaalsContact O-N 3.16Å; Q105-Q108 HydrophobicContact CB-CB 4.29Å; Q105-Q108 HydrophobicContact CB-CG 3.84Å; Q105-Q108 HydrophobicContact CG-CG 4.43Å; Q105-Q108 VanDerWaalsContact CG-NE2 3.33Å; Q105-Q108 WeakPolarHBondContact O-CB 3.32Å; Q105-Q108 PolarHBondContact O-N 2.71Å; Q105-Q108 VanDerWaalsContact OE1-OE1 3.06Å
106	L	89.6	Confident	91.6	Very high	11 Å²	11	60 Å²	60	6%	0.058	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.3	-171.5	-57.5	-177.5	0	0	0	114.1	I101 Q104 L111 V116 F119 I150 R153 I154	I101-L106 HydrophobicContact CG1-CB 4.47Å; I101-L106 HydrophobicContact CG1-CD1 4.17Å; I101-L106 HydrophobicContact CG2-CB 4.47Å; I101-L106 PolarHBondContact O-N 3.37Å; Q104-L106 VanDerWaalsContact C-N 3.28Å; Q104-L106 HydrophobicContact CB-CD2 3.68Å; Q104-L106 HydrophobicContact CB-CG 3.91Å; Q104-L106 PolarHBondContact O-N 3.48Å; L106-L111 HydrophobicContact CD2-CD1 4.41Å; L106-V116 HydrophobicContact CD2-CG2 3.68Å; L106-F119 HydrophobicContact CD1-CE1 4.24Å; L106-I150 HydrophobicContact CD1-CD1 3.68Å; L106-R153 HydrophobicContact CB-CB 4.4Å; L106-R153 HydrophobicContact CD1-CB 4.44Å; L106-I154 HydrophobicContact CD1-CG2 4.05Å; L106-I154 HydrophobicContact CD2-CG2 4.14Å
107	D	90.4	Very high	91.5	Very high	110 Å²	110	66.6 Å²	66.6	59%	0.588	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.7	175.7	-85.6	-44.7	0	0	0	113.6	I101 Q105 R153	I101-D107 HydrophobicContact CG2-CB 4.46Å; I101-D107 WeakPolarHBondContact CG2-OD2 3.47Å; Q105-D107 PolarHBondContact O-N 2.92Å; Q105-D107 VanDerWaalsContact O-N 3.16Å; D107-R153 IonicContact OD1-CZ 3.65Å; D107-R153 IonicContact OD1-NH1 3.85Å; D107-R153 PolarHBondContact OD1-NH1 2.88Å; D107-R153 IonicContact OD1-NH2 3.83Å; D107-R153 IonicContact OD2-CZ 3.75Å; D107-R153 IonicContact OD2-NH1 2.68Å; D107-R153 PolarHBondContact OD2-NH1 2.88Å; D107-R153 IonicContact OD2-NH2 3.72Å
108	Q	88.3	Confident	91.3	Very high	103 Å²	103	72.2 Å²	72.2	48%	0.481	38%	0.375	S	S	.	.			trans	-79.1	144.8	-179.8	-68.5	-170.2	10.8	0	0	111.8	Q105 P110 L111	Q105-Q108 HydrophobicContact CB-CB 4.29Å; Q105-Q108 HydrophobicContact CB-CG 3.84Å; Q105-Q108 HydrophobicContact CG-CG 4.43Å; Q105-Q108 VanDerWaalsContact CG-NE2 3.33Å; Q105-Q108 WeakPolarHBondContact O-CB 3.32Å; Q105-Q108 PolarHBondContact O-N 2.71Å; Q105-Q108 VanDerWaalsContact OE1-OE1 3.06Å; Q108-P110 CarbonylContact O-C 3.59Å; Q108-L111 PolarHBondContact O-N 3.27Å
109	S	86.3	Confident	91.3	Very high	123 Å²	123	68 Å²	68	86%	0.86	36%	0.355	S	S	*	.	S	Bend	trans	-121.7	117.6	172.2	177	0	0	0	0	109.1
110	P	86.3	Confident	91.2	Very high	120 Å²	120	66.1 Å²	66.1	78%	0.779	35%	0.345	S	S	*	.	S	Bend	cis	-77	147.3	2.7	32.1	-34.5	0	0	0	113.1	Q108	Q108-P110 CarbonylContact O-C 3.59Å
111	L	87.8	Confident	91.2	Very high	45 Å²	45	69.5 Å²	69.5	24%	0.236	37%	0.367	C	S	.	.			trans	-75.3	133.3	175.9	-176.4	66.4	0	0	0	110.8	L106 Q108 T113 V116 C157	L106-L111 HydrophobicContact CD2-CD1 4.41Å; Q108-L111 PolarHBondContact O-N 3.27Å; L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.29Å; L111-V116 HydrophobicContact CD1-CG2 3.89Å; L111-V116 HydrophobicContact CD2-CG2 4.17Å; L111-V116 HydrophobicContact CG-CG2 4Å; L111-C157 VanDerWaalsContact CD2-SG 3.57Å
112	D	90.6	Very high	91.3	Very high	86 Å²	86	70 Å²	70	46%	0.46	37%	0.368	S	S	.	.			trans	-73.9	86.7	172.3	-175.4	-12.5	0	0	0	110.9	A114 K115 V116	D112-A114 PolarHBondContact O-N 2.93Å; D112-A114 PolarHBondContact OD1-N 3.46Å; D112-A114 VanDerWaalsContact OD1-N 3.15Å; D112-K115 HydrophobicContact CB-CB 4.06Å; D112-K115 VanDerWaalsContact CG-CB 3.48Å; D112-K115 PolarHBondContact O-N 3.06Å; D112-K115 PolarHBondContact OD1-N 3.1Å; D112-K115 VanDerWaalsContact OD1-N 3.08Å; D112-K115 WeakPolarHBondContact OD2-CB 3.42Å; D112-V116 WeakPolarHBondContact O-CG2 3.24Å; D112-V116 PolarHBondContact O-N 3.46Å
113	T	90.3	Very high	91.5	Very high	66 Å²	66	63.1 Å²	63.1	41%	0.405	34%	0.338	S	S	.	.	H	α-helix	trans	-59.2	-30.4	-178.4	60.2	0	0	0	0	113.6	L111 R117	L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.29Å; T113-R117 WeakPolarHBondContact O-CB 3.44Å; T113-R117 VanDerWaalsContact O-CG 3.28Å; T113-R117 WeakPolarHBondContact O-CG 3.4Å; T113-R117 PolarHBondContact O-N 2.97Å
114	A	91.2	Very high	91.7	Very high	60 Å²	60	60.2 Å²	60.2	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-71.7	-43.5	-179.9	0	0	0	0	0	111	D112 R117 K118	D112-A114 PolarHBondContact O-N 2.93Å; D112-A114 PolarHBondContact OD1-N 3.46Å; D112-A114 VanDerWaalsContact OD1-N 3.15Å; A114-R117 PolarHBondContact O-N 3.45Å; A114-K118 PolarHBondContact O-N 3.03Å
115	K	90.5	Very high	91.9	Very high	57 Å²	57	63.5 Å²	63.5	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-63.5	-45.1	173.8	-175.3	177.2	175	-173.1	0	111.5	Q103 D112 R117 K118 F119	Q103-K115 PolarHBondContact O-NZ 3.3Å; D112-K115 HydrophobicContact CB-CB 4.06Å; D112-K115 VanDerWaalsContact CG-CB 3.48Å; D112-K115 PolarHBondContact O-N 3.06Å; D112-K115 PolarHBondContact OD1-N 3.1Å; D112-K115 VanDerWaalsContact OD1-N 3.08Å; D112-K115 WeakPolarHBondContact OD2-CB 3.42Å; K115-R117 VanDerWaalsContact C-N 3.31Å; K115-R117 PolarHBondContact O-N 3.36Å; K115-K118 PolarHBondContact O-N 2.75Å; K115-F119 PolarHBondContact O-N 3Å; K115-F119 VanDerWaalsContact O-N 3.11Å
116	V	91.8	Very high	92.2	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-38.6	178.2	175.7	0	0	0	0	111.7	L106 L111 D112 K118 F119 G120 I154 C157	L106-V116 HydrophobicContact CD2-CG2 3.68Å; L111-V116 HydrophobicContact CD1-CG2 3.89Å; L111-V116 HydrophobicContact CD2-CG2 4.17Å; L111-V116 HydrophobicContact CG-CG2 4Å; D112-V116 WeakPolarHBondContact O-CG2 3.24Å; D112-V116 PolarHBondContact O-N 3.46Å; V116-K118 VanDerWaalsContact C-N 3.29Å; V116-K118 PolarHBondContact O-N 3.27Å; V116-F119 PolarHBondContact O-N 3.08Å; V116-G120 PolarHBondContact O-N 3.25Å; V116-I154 HydrophobicContact CG1-CB 3.8Å; V116-I154 HydrophobicContact CG1-CG2 3.82Å; V116-C157 HydrophobicContact CB-CB 4.44Å; V116-C157 HydrophobicContact CG1-CB 3.95Å
117	R	93.7	Very high	92.5	Very high	140 Å²	140	59 Å²	59	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-28.6	177.7	-78.7	175.5	-178.5	160.6	2.5	114.3	T113 A114 K115 P121 C157 Y161	T113-R117 WeakPolarHBondContact O-CB 3.44Å; T113-R117 VanDerWaalsContact O-CG 3.28Å; T113-R117 WeakPolarHBondContact O-CG 3.4Å; T113-R117 PolarHBondContact O-N 2.97Å; A114-R117 PolarHBondContact O-N 3.45Å; K115-R117 VanDerWaalsContact C-N 3.31Å; K115-R117 PolarHBondContact O-N 3.36Å; R117-P121 WeakPolarHBondContact O-CD 3.32Å; R117-C157 HydrophobicContact CG-CB 4.4Å; R117-C157 PolarHBondContact NE-O 3.31Å; R117-C157 PolarHBondContact NH2-O 2.91Å; R117-Y161 WeakPolarHBondContact CA-OH 3.47Å
118	K	93.8	Very high	92.8	Very high	128 Å²	128	55.5 Å²	55.5	56%	0.557	30%	0.301	S	S	*	.	H	α-helix	trans	-77.7	-35.1	172.9	-67.3	-178.6	176.8	-175.5	0	112.3	A67 A114 K115 V116	A67-K118 HydrophobicContact CB-CB 3.91Å; A67-K118 HydrophobicContact CB-CD 4.31Å; A114-K118 PolarHBondContact O-N 3.03Å; K115-K118 PolarHBondContact O-N 2.75Å; V116-K118 VanDerWaalsContact C-N 3.29Å; V116-K118 PolarHBondContact O-N 3.27Å
119	F	94.8	Very high	93.1	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-79.2	-41.9	-178.8	164.7	-104.8	0	0	0	113.4	P65 C100 Q104 L106 K115 V116 K122 I123 I154	P65-F119 HydrophobicContact CG-CE2 4.19Å; P65-F119 WeakPolarHBondContact O-CD2 3.44Å; P65-F119 VanDerWaalsContact O-CE2 3.24Å; P65-F119 WeakPolarHBondContact O-CE2 3.42Å; C100-F119 HydrophobicContact CB-CE1 4.49Å; C100-F119 HydrophobicContact CB-CE2 4.39Å; C100-F119 HydrophobicContact CB-CZ 3.68Å; Q104-F119 HydrophobicContact CB-CD1 4.34Å; Q104-F119 HydrophobicContact CG-CB 4.38Å; Q104-F119 HydrophobicContact CG-CD1 3.86Å; Q104-F119 HydrophobicContact CG-CD2 3.67Å; Q104-F119 HydrophobicContact CG-CE1 4.01Å; Q104-F119 HydrophobicContact CG-CE2 3.83Å; Q104-F119 HydrophobicContact CG-CG 3.68Å; Q104-F119 HydrophobicContact CG-CZ 4Å; L106-F119 HydrophobicContact CD1-CE1 4.24Å; K115-F119 PolarHBondContact O-N 3Å; K115-F119 VanDerWaalsContact O-N 3.11Å; V116-F119 PolarHBondContact O-N 3.08Å; F119-K122 WeakPolarHBondContact O-CB 3.42Å; F119-K122 PolarHBondContact O-N 3.37Å; F119-I123 HydrophobicContact CD1-CG2 4.2Å; F119-I123 HydrophobicContact CE1-CB 4.06Å; F119-I123 HydrophobicContact CE1-CG2 3.63Å; F119-I123 HydrophobicContact CE2-CB 3.86Å; F119-I123 HydrophobicContact CE2-CG2 4.28Å; F119-I123 HydrophobicContact CZ-CB 3.53Å; F119-I123 HydrophobicContact CZ-CD1 4.49Å; F119-I123 HydrophobicContact CZ-CG1 3.93Å; F119-I123 HydrophobicContact CZ-CG2 3.67Å; F119-I123 PolarHBondContact O-N 3.16Å; F119-I123 VanDerWaalsContact O-N 3.1Å; F119-I154 HydrophobicContact CD1-CG2 4.43Å; F119-I154 HydrophobicContact CE1-CG2 4.25Å
120	G	94.6	Very high	93.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-50.8	-50	-173	0	0	0	0	0	114.7	V116 K122 I123 L124	V116-G120 PolarHBondContact O-N 3.25Å; G120-K122 VanDerWaalsContact C-N 3.26Å; G120-K122 PolarHBondContact O-N 3.07Å; G120-I123 VanDerWaalsContact O-CG2 3.22Å; G120-I123 WeakPolarHBondContact O-CG2 3.34Å; G120-I123 PolarHBondContact O-N 3.25Å; G120-L124 WeakPolarHBondContact O-CB 3.38Å; G120-L124 WeakPolarHBondContact O-CG 3.46Å; G120-L124 PolarHBondContact O-N 3.31Å
121	P	95.1	Very high	94.1	Very high	71 Å²	71	40.8 Å²	40.8	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-60.2	-34.2	177.2	-25.7	35.7	0	0	0	113.4	R117 Q125 Y161	R117-P121 WeakPolarHBondContact O-CD 3.32Å; P121-Q125 WeakPolarHBondContact O-CB 3.31Å; P121-Q125 PolarHBondContact O-N 3.46Å; P121-Y161 HydrophobicContact CG-CE1 4.42Å
122	K	96.1	Very high	94.3	Very high	43 Å²	43	43 Å²	43	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-75.8	-41.6	-177.6	-65.2	-179.7	-178.2	-173.4	0	112.6	P65 T66 A67 D68 Y69 Y70 F119 G120 L124 Q125 L126	P65-K122 HydrophobicContact CB-CB 3.74Å; P65-K122 HydrophobicContact CB-CD 4.5Å; P65-K122 HydrophobicContact CG-CB 4.27Å; T66-K122 WeakPolarHBondContact O-CD 3.43Å; T66-K122 WeakPolarHBondContact O-CE 3.37Å; T66-K122 PolarHBondContact O-NZ 3.29Å; A67-K122 PolarHBondContact O-NZ 3.16Å; D68-K122 VanDerWaalsContact C-NZ 3.32Å; Y69-K122 VanDerWaalsContact N-NZ 3.19Å; Y69-K122 PolarHBondContact O-NZ 3.29Å; Y70-K122 HydrophobicContact CD2-CB 3.99Å; Y70-K122 HydrophobicContact CD2-CG 4.36Å; Y70-K122 WeakPolarHBondContact CE2-O 3.48Å; F119-K122 WeakPolarHBondContact O-CB 3.42Å; F119-K122 PolarHBondContact O-N 3.37Å; G120-K122 VanDerWaalsContact C-N 3.26Å; G120-K122 PolarHBondContact O-N 3.07Å; K122-L124 VanDerWaalsContact C-N 3.32Å; K122-Q125 WeakPolarHBondContact O-CB 3.41Å; K122-Q125 PolarHBondContact O-N 2.99Å; K122-L126 PolarHBondContact O-N 2.9Å
123	I	96.1	Very high	94.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.8	-38	173.5	-172.2	58.4	0	0	0	110.9	P65 F119 G120 Q125 L126 L127 I150 I154	P65-I123 HydrophobicContact CG-CB 4.24Å; P65-I123 HydrophobicContact CG-CD1 4.16Å; F119-I123 HydrophobicContact CD1-CG2 4.2Å; F119-I123 HydrophobicContact CE1-CB 4.06Å; F119-I123 HydrophobicContact CE1-CG2 3.63Å; F119-I123 HydrophobicContact CE2-CB 3.86Å; F119-I123 HydrophobicContact CE2-CG2 4.28Å; F119-I123 HydrophobicContact CZ-CB 3.53Å; F119-I123 HydrophobicContact CZ-CD1 4.49Å; F119-I123 HydrophobicContact CZ-CG1 3.93Å; F119-I123 HydrophobicContact CZ-CG2 3.67Å; F119-I123 PolarHBondContact O-N 3.16Å; F119-I123 VanDerWaalsContact O-N 3.1Å; G120-I123 VanDerWaalsContact O-CG2 3.22Å; G120-I123 WeakPolarHBondContact O-CG2 3.34Å; G120-I123 PolarHBondContact O-N 3.25Å; I123-Q125 VanDerWaalsContact C-N 3.31Å; I123-Q125 PolarHBondContact O-N 3.09Å; I123-L126 HydrophobicContact CD1-CD2 4.17Å; I123-L126 PolarHBondContact O-N 3.48Å; I123-L127 HydrophobicContact CD1-CG 4.39Å; I123-L127 HydrophobicContact CG1-CD1 4.25Å; I123-L127 HydrophobicContact CG1-CG 4.4Å; I123-L127 VanDerWaalsContact O-CG 3.26Å; I123-L127 WeakPolarHBondContact O-CG 3.35Å; I123-L127 PolarHBondContact O-N 3.01Å; I123-I150 HydrophobicContact CG1-CG1 4.35Å; I123-I154 HydrophobicContact CG2-CD1 4.02Å
124	L	95.6	Very high	94.6	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-40	172.3	-81.6	168.6	0	0	0	112.2	G120 K122 T128 I151 Y161 T164	G120-L124 WeakPolarHBondContact O-CB 3.38Å; G120-L124 WeakPolarHBondContact O-CG 3.46Å; G120-L124 PolarHBondContact O-N 3.31Å; K122-L124 VanDerWaalsContact C-N 3.32Å; L124-T128 WeakPolarHBondContact O-CB 3.5Å; L124-T128 PolarHBondContact O-N 3.02Å; L124-T128 PolarHBondContact O-OG1 2.99Å; L124-I151 HydrophobicContact CD2-CD1 3.44Å; L124-I151 VanDerWaalsContact CD2-CD1 3.44Å; L124-I151 HydrophobicContact CD2-CG1 4.39Å; L124-I151 HydrophobicContact CG-CD1 3.97Å; L124-Y161 HydrophobicContact CD1-CD1 3.45Å; L124-Y161 VanDerWaalsContact CD1-CD1 3.45Å; L124-Y161 HydrophobicContact CD1-CE1 4.23Å; L124-Y161 HydrophobicContact CD1-CG 3.98Å; L124-T164 HydrophobicContact CD1-CG2 4.32Å; L124-T164 HydrophobicContact CD2-CG2 4.04Å
125	Q	96.1	Very high	94.7	Very high	76 Å²	76	35 Å²	35	36%	0.355	17%	0.166	S	C	.	.	H	α-helix	trans	-61	-49.9	174.6	-173.8	-172.6	-21.8	0	0	111.3	Y70 P121 K122 I123 L127 T128 E129	Y70-Q125 VanDerWaalsContact CE1-NE2 3.34Å; Y70-Q125 HydrophobicContact CE2-CB 4.02Å; Y70-Q125 HydrophobicContact CE2-CG 4.08Å; Y70-Q125 VanDerWaalsContact CZ-CD 3.49Å; P121-Q125 WeakPolarHBondContact O-CB 3.31Å; P121-Q125 PolarHBondContact O-N 3.46Å; K122-Q125 WeakPolarHBondContact O-CB 3.41Å; K122-Q125 PolarHBondContact O-N 2.99Å; I123-Q125 VanDerWaalsContact C-N 3.31Å; I123-Q125 PolarHBondContact O-N 3.09Å; Q125-L127 PolarHBondContact O-N 3.45Å; Q125-T128 PolarHBondContact O-N 3.29Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.39Å; Q125-E129 PolarHBondContact NE2-OE1 3.24Å; Q125-E129 WeakPolarHBondContact O-CG 3.27Å; Q125-E129 PolarHBondContact O-N 3.46Å
126	L	97.4	Very high	94.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-45.8	178.3	175.2	64.8	0	0	0	111.9	L63 P65 Y70 V76 V96 K122 I123 T128 E129 W130	L63-L126 HydrophobicContact CD1-CD1 3.85Å; L63-L126 HydrophobicContact CG-CD1 4.29Å; L63-L126 HydrophobicContact CG-CD2 4.21Å; P65-L126 HydrophobicContact CG-CD2 4.43Å; Y70-L126 HydrophobicContact CE2-CB 4.25Å; Y70-L126 WeakPolarHBondContact OH-CA 3.49Å; Y70-L126 PolarHBondContact OH-N 3.46Å; V76-L126 HydrophobicContact CG1-CD1 3.82Å; V76-L126 HydrophobicContact CG2-CD1 4.24Å; V96-L126 HydrophobicContact CG1-CD2 4.33Å; K122-L126 PolarHBondContact O-N 2.9Å; I123-L126 HydrophobicContact CD1-CD2 4.17Å; I123-L126 PolarHBondContact O-N 3.48Å; L126-T128 VanDerWaalsContact C-N 3.34Å; L126-E129 PolarHBondContact O-N 3.25Å; L126-W130 PolarHBondContact O-N 2.98Å
127	L	96.8	Very high	94.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-38.8	178.6	-65.1	175.9	0	0	0	111.6	L93 I123 Q125 W130 T131 L147 I150 M168	L93-L127 HydrophobicContact CD1-CD2 3.73Å; I123-L127 HydrophobicContact CD1-CG 4.39Å; I123-L127 HydrophobicContact CG1-CD1 4.25Å; I123-L127 HydrophobicContact CG1-CG 4.4Å; I123-L127 VanDerWaalsContact O-CG 3.26Å; I123-L127 WeakPolarHBondContact O-CG 3.35Å; I123-L127 PolarHBondContact O-N 3.01Å; Q125-L127 PolarHBondContact O-N 3.45Å; L127-W130 PolarHBondContact O-N 2.9Å; L127-T131 VanDerWaalsContact O-CG2 3.3Å; L127-T131 WeakPolarHBondContact O-CG2 3.42Å; L127-T131 PolarHBondContact O-N 3.3Å; L127-T131 PolarHBondContact O-OG1 3.43Å; L127-L147 HydrophobicContact CB-CD1 3.98Å; L127-L147 HydrophobicContact CD1-CD1 3.99Å; L127-L147 HydrophobicContact CD1-CG 4.42Å; L127-L147 HydrophobicContact CD2-CD1 4.14Å; L127-L147 HydrophobicContact CG-CD1 4.25Å; L127-I150 HydrophobicContact CD1-CG2 3.83Å; L127-M168 HydrophobicContact CB-SD 4.34Å
128	T	95.6	Very high	94.7	Very high	35 Å²	35	28.1 Å²	28.1	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-51.2	175	-57.5	0	0	0	0	110.2	L124 Q125 L126 W130 T131 E132	L124-T128 WeakPolarHBondContact O-CB 3.5Å; L124-T128 PolarHBondContact O-N 3.02Å; L124-T128 PolarHBondContact O-OG1 2.99Å; Q125-T128 PolarHBondContact O-N 3.29Å; L126-T128 VanDerWaalsContact C-N 3.34Å; T128-W130 VanDerWaalsContact C-N 3.28Å; T128-W130 PolarHBondContact O-N 3.01Å; T128-T131 PolarHBondContact O-N 3.45Å; T128-T131 PolarHBondContact O-OG1 3.23Å; T128-E132 HydrophobicContact CG2-CG 4.32Å; T128-E132 WeakPolarHBondContact O-CB 3.49Å; T128-E132 WeakPolarHBondContact O-CG 3.3Å; T128-E132 PolarHBondContact O-N 2.91Å
129	E	95.6	Very high	94.6	Very high	30 Å²	30	27.5 Å²	27.5	14%	0.14	14%	0.139	C	C	.	.	H	α-helix	trans	-56.7	-41	177.5	-72.8	177.3	-169.6	0	0	111.7	Y70 Q125 L126 T133	Y70-E129 PolarHBondContact OH-OE1 3.4Å; Y70-E129 PolarHBondContact OH-OE2 2.95Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.39Å; Q125-E129 PolarHBondContact NE2-OE1 3.24Å; Q125-E129 WeakPolarHBondContact O-CG 3.27Å; Q125-E129 PolarHBondContact O-N 3.46Å; L126-E129 PolarHBondContact O-N 3.25Å; E129-T133 WeakPolarHBondContact O-CB 3.48Å; E129-T133 PolarHBondContact O-N 2.94Å; E129-T133 PolarHBondContact O-OG1 3.34Å
130	W	96.7	Very high	94.4	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-48.9	175.6	-158.9	-25.1	0	0	0	112	L80 P89 L92 L93 L126 L127 T128 E132 T133 F134 D137 F138 M143	L80-W130 HydrophobicContact CD1-CB 3.96Å; L80-W130 HydrophobicContact CD1-CD2 3.82Å; L80-W130 HydrophobicContact CD1-CE3 4.25Å; L80-W130 HydrophobicContact CD1-CG 3.69Å; L80-W130 HydrophobicContact CD2-CD2 3.64Å; L80-W130 HydrophobicContact CD2-CE3 3.66Å; L80-W130 HydrophobicContact CD2-CG 4.37Å; L80-W130 HydrophobicContact CD2-CH2 3.82Å; L80-W130 HydrophobicContact CD2-CZ2 3.76Å; L80-W130 HydrophobicContact CD2-CZ3 3.76Å; L80-W130 HydrophobicContact CG-CD2 4.38Å; P89-W130 HydrophobicContact CB-CZ2 4.43Å; L92-W130 HydrophobicContact CB-CH2 4.13Å; L92-W130 HydrophobicContact CD2-CH2 3.62Å; L92-W130 HydrophobicContact CD2-CZ2 3.99Å; L92-W130 HydrophobicContact CG-CH2 3.69Å; L92-W130 HydrophobicContact CG-CZ2 4.45Å; L92-W130 HydrophobicContact CG-CZ3 4.5Å; L93-W130 HydrophobicContact CB-CH2 3.94Å; L93-W130 HydrophobicContact CB-CZ3 4.18Å; L93-W130 HydrophobicContact CD1-CE3 4.31Å; L93-W130 HydrophobicContact CD1-CH2 4.5Å; L93-W130 HydrophobicContact CD1-CZ3 3.88Å; L126-W130 PolarHBondContact O-N 2.98Å; L127-W130 PolarHBondContact O-N 2.9Å; T128-W130 VanDerWaalsContact C-N 3.28Å; T128-W130 PolarHBondContact O-N 3.01Å; W130-E132 VanDerWaalsContact C-N 3.28Å; W130-E132 PolarHBondContact O-N 3.25Å; W130-T133 PolarHBondContact O-N 3Å; W130-F134 AromaticContact CD1-CD2 3.92Å; W130-F134 PolarHBondContact O-N 2.92Å; W130-D137 PolarHBondContact NE1-OD2 3.39Å; W130-F138 HydrophobicContact CB-CZ 4.37Å; W130-F138 AromaticContact CD1-CE2 3.85Å; W130-F138 HydrophobicContact CG-CE2 4.22Å; W130-F138 HydrophobicContact CG-CZ 4.19Å; W130-M143 HydrophobicContact CZ2-CE 3.95Å
131	T	95.4	Very high	94.2	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-32.7	178.6	60.2	0	0	0	0	113.2	L127 T128 P135 F138 L147 M168 L172	L127-T131 VanDerWaalsContact O-CG2 3.3Å; L127-T131 WeakPolarHBondContact O-CG2 3.42Å; L127-T131 PolarHBondContact O-N 3.3Å; L127-T131 PolarHBondContact O-OG1 3.43Å; T128-T131 PolarHBondContact O-N 3.45Å; T128-T131 PolarHBondContact O-OG1 3.23Å; T131-P135 WeakPolarHBondContact O-CA 3.25Å; T131-F138 HydrophobicContact CG2-CD1 4.13Å; T131-F138 HydrophobicContact CG2-CD2 4.04Å; T131-F138 HydrophobicContact CG2-CE1 3.67Å; T131-F138 HydrophobicContact CG2-CE2 3.59Å; T131-F138 HydrophobicContact CG2-CG 4.31Å; T131-F138 HydrophobicContact CG2-CZ 3.38Å; T131-L147 HydrophobicContact CG2-CD1 4.43Å; T131-M168 HydrophobicContact CG2-CE 4.45Å; T131-M168 HydrophobicContact CG2-CG 4.17Å; T131-M168 HydrophobicContact CG2-SD 4.01Å; T131-M168 WeakPolarHBondContact OG1-CG 3.45Å; T131-L172 HydrophobicContact CG2-CD2 4.25Å
132	E	92.8	Very high	94.2	Very high	92 Å²	92	41.7 Å²	41.7	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-80.8	-33.8	178.5	-70	-177.3	166.6	0	0	112.4	T128 W130 R175	T128-E132 HydrophobicContact CG2-CG 4.32Å; T128-E132 WeakPolarHBondContact O-CB 3.49Å; T128-E132 WeakPolarHBondContact O-CG 3.3Å; T128-E132 PolarHBondContact O-N 2.91Å; W130-E132 VanDerWaalsContact C-N 3.28Å; W130-E132 PolarHBondContact O-N 3.25Å; E132-R175 VanDerWaalsContact O-CZ 3.24Å; E132-R175 PolarHBondContact O-NH1 3.29Å; E132-R175 PolarHBondContact O-NH2 3.06Å; E132-R175 VanDerWaalsContact O-NH2 3.09Å
133	T	93.1	Very high	94.2	Very high	38 Å²	38	39.7 Å²	39.7	23%	0.233	19%	0.19	C	C	.	.	H	α-helix	trans	-81.5	-42.4	-179	-52.8	0	0	0	0	111.8	F77 E129 W130 P135 P241	F77-T133 HydrophobicContact CD2-CG2 3.72Å; F77-T133 HydrophobicContact CE2-CG2 3.83Å; E129-T133 WeakPolarHBondContact O-CB 3.48Å; E129-T133 PolarHBondContact O-N 2.94Å; E129-T133 PolarHBondContact O-OG1 3.34Å; W130-T133 PolarHBondContact O-N 3Å; T133-P135 VanDerWaalsContact C-CD 3.49Å; T133-P135 WeakPolarHBondContact O-CD 3.3Å; T133-P241 HydrophobicContact CG2-CG 4.39Å
134	F	94	Very high	94.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.199	C	C	.	.			trans	-129.3	63.5	-173.9	-52.4	-80.7	0	0	0	111.8	F77 L80 L81 R84 W130 S136 D137 P241 E242	F77-F134 HydrophobicContact CE2-CZ 4.42Å; L80-F134 HydrophobicContact CB-CD2 4.1Å; L80-F134 HydrophobicContact CB-CE2 3.42Å; L80-F134 VanDerWaalsContact CB-CE2 3.42Å; L80-F134 HydrophobicContact CB-CZ 4.14Å; L80-F134 HydrophobicContact CD1-CD2 4.33Å; L80-F134 HydrophobicContact CD1-CE2 4.16Å; L80-F134 HydrophobicContact CG-CE2 4.46Å; L81-F134 HydrophobicContact CB-CZ 4.04Å; L81-F134 HydrophobicContact CD1-CE1 4.02Å; L81-F134 HydrophobicContact CD1-CZ 4.31Å; R84-F134 VanDerWaalsContact CZ-CD1 3.44Å; R84-F134 VanDerWaalsContact NH2-CB 3.3Å; W130-F134 AromaticContact CD1-CD2 3.92Å; W130-F134 PolarHBondContact O-N 2.92Å; F134-S136 PolarHBondContact O-N 3.33Å; F134-S136 VanDerWaalsContact O-N 3.17Å; F134-D137 WeakPolarHBondContact CB-OD2 3.47Å; F134-D137 PolarHBondContact O-N 3.28Å; F134-P241 HydrophobicContact CD1-CG 3.74Å; F134-P241 HydrophobicContact CE1-CB 4Å; F134-P241 HydrophobicContact CE1-CG 3.49Å; F134-P241 VanDerWaalsContact CE1-CG 3.49Å; F134-P241 HydrophobicContact CZ-CG 4.34Å; F134-E242 HydrophobicContact CD1-CB 4.3Å
135	P	93.4	Very high	94.2	Very high	4 Å²	4	41.9 Å²	41.9	3%	0.026	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-58.1	-32.8	-177.7	25.9	-36.8	0	0	0	112.5	T131 T133 D137 F138 L172 R175 L176 M179	T131-P135 WeakPolarHBondContact O-CA 3.25Å; T133-P135 VanDerWaalsContact C-CD 3.49Å; T133-P135 WeakPolarHBondContact O-CD 3.3Å; P135-D137 PolarHBondContact O-N 3.17Å; P135-F138 PolarHBondContact O-N 2.95Å; P135-F138 VanDerWaalsContact O-N 3.09Å; P135-L172 HydrophobicContact CB-CD1 3.81Å; P135-R175 HydrophobicContact CB-CG 4.44Å; P135-L176 HydrophobicContact CB-CD2 4.41Å; P135-L176 WeakPolarHBondContact O-CD2 3.32Å; P135-M179 HydrophobicContact CB-SD 4.26Å; P135-M179 HydrophobicContact CG-CE 4.28Å; P135-M179 HydrophobicContact CG-SD 3.82Å
136	S	89.9	Confident	94.2	Very high	30 Å²	30	40.1 Å²	40.1	21%	0.21	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-57.9	-32.3	180	-51.5	0	0	0	0	113.7	F134 F138 R139 M179 E242	F134-S136 PolarHBondContact O-N 3.33Å; F134-S136 VanDerWaalsContact O-N 3.17Å; S136-F138 PolarHBondContact O-N 3.19Å; S136-R139 WeakPolarHBondContact O-CB 3.39Å; S136-R139 WeakPolarHBondContact O-CG 3.35Å; S136-R139 PolarHBondContact O-N 2.89Å; S136-R139 VanDerWaalsContact O-N 3.16Å; S136-M179 WeakPolarHBondContact OG-CE 3.42Å; S136-E242 WeakPolarHBondContact CB-OE1 3.4Å; S136-E242 PolarHBondContact OG-OE1 2.84Å
137	D	92.3	Very high	94.1	Very high	18 Å²	18	40.1 Å²	40.1	10%	0.096	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-60.6	-32.9	179	-69	-16.4	0	0	0	110.7	R84 P89 W130 F134 P135 R139 D140 M143	R84-D137 IonicContact CZ-OD1 2.81Å; R84-D137 IonicContact CZ-OD2 2.86Å; R84-D137 IonicContact NE-OD1 3.23Å; R84-D137 PolarHBondContact NE-OD1 2.93Å; R84-D137 IonicContact NE-OD2 3.61Å; R84-D137 IonicContact NH2-OD1 3.96Å; R84-D137 IonicContact NH2-OD2 2.71Å; R84-D137 PolarHBondContact NH2-OD2 3.3Å; P89-D137 HydrophobicContact CB-CB 4.12Å; W130-D137 PolarHBondContact NE1-OD2 3.39Å; F134-D137 WeakPolarHBondContact CB-OD2 3.47Å; F134-D137 PolarHBondContact O-N 3.28Å; P135-D137 PolarHBondContact O-N 3.17Å; D137-R139 PolarHBondContact O-N 3.41Å; D137-D140 PolarHBondContact O-N 3.4Å; D137-M143 HydrophobicContact CB-CE 4.08Å; D137-M143 WeakPolarHBondContact O-CG 3.45Å
138	F	94.3	Very high	94	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.031	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-85.5	11.7	-177.5	-59.7	-96.2	0	0	0	114	L93 W130 T131 P135 S136 M143 V144 L147 L172	L93-F138 HydrophobicContact CD2-CE1 4.48Å; W130-F138 HydrophobicContact CB-CZ 4.37Å; W130-F138 AromaticContact CD1-CE2 3.85Å; W130-F138 HydrophobicContact CG-CE2 4.22Å; W130-F138 HydrophobicContact CG-CZ 4.19Å; T131-F138 HydrophobicContact CG2-CD1 4.13Å; T131-F138 HydrophobicContact CG2-CD2 4.04Å; T131-F138 HydrophobicContact CG2-CE1 3.67Å; T131-F138 HydrophobicContact CG2-CE2 3.59Å; T131-F138 HydrophobicContact CG2-CG 4.31Å; T131-F138 HydrophobicContact CG2-CZ 3.38Å; P135-F138 PolarHBondContact O-N 2.95Å; P135-F138 VanDerWaalsContact O-N 3.09Å; S136-F138 PolarHBondContact O-N 3.19Å; F138-M143 HydrophobicContact CD1-CB 3.73Å; F138-M143 HydrophobicContact CD1-CE 4.34Å; F138-M143 HydrophobicContact CE1-CB 4.16Å; F138-M143 HydrophobicContact CE1-CE 3.86Å; F138-M143 HydrophobicContact CE2-CE 4.09Å; F138-M143 HydrophobicContact CG-CB 4.28Å; F138-M143 HydrophobicContact CZ-CE 3.72Å; F138-V144 HydrophobicContact CB-CG2 4.43Å; F138-V144 HydrophobicContact CD1-CG2 4.47Å; F138-L147 HydrophobicContact CE1-CD1 4.08Å; F138-L172 HydrophobicContact CB-CD1 4.15Å; F138-L172 HydrophobicContact CB-CD2 3.49Å; F138-L172 VanDerWaalsContact CB-CD2 3.49Å; F138-L172 HydrophobicContact CB-CG 4.33Å; F138-L172 HydrophobicContact CD1-CD2 4.12Å; F138-L172 HydrophobicContact CD2-CD1 4.5Å; F138-L172 HydrophobicContact CD2-CD2 4.42Å; F138-L172 HydrophobicContact CG-CD2 3.77Å
139	R	90.6	Very high	94	Very high	115 Å²	115	47.6 Å²	47.6	43%	0.434	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-68.6	-22.8	159.2	-66.7	-176.5	179.5	-173	0.9	111.3	S136 D137 L176 E183	S136-R139 WeakPolarHBondContact O-CB 3.39Å; S136-R139 WeakPolarHBondContact O-CG 3.35Å; S136-R139 PolarHBondContact O-N 2.89Å; S136-R139 VanDerWaalsContact O-N 3.16Å; D137-R139 PolarHBondContact O-N 3.41Å; R139-L176 HydrophobicContact CG-CD2 3.76Å; R139-E183 IonicContact CZ-OE1 2.67Å; R139-E183 IonicContact NH1-OE1 3.83Å; R139-E183 PolarHBondContact NH1-OE1 2.89Å; R139-E183 IonicContact NH1-OE2 3.65Å; R139-E183 IonicContact NH2-OE1 2.96Å; R139-E183 PolarHBondContact NH2-OE1 3.36Å
140	D	90.1	Very high	93.9	Very high	59 Å²	59	46.2 Å²	46.2	32%	0.316	23%	0.228	S	C	.	.	S	Bend	trans	-77.2	119.1	170.8	-175.7	-7.1	0	0	0	110.1	S90 D137 K142 M143	S90-D140 VanDerWaalsContact CB-OD2 3.32Å; S90-D140 WeakPolarHBondContact CB-OD2 3.49Å; S90-D140 PolarHBondContact OG-OD2 3.01Å; D137-D140 PolarHBondContact O-N 3.4Å; D140-K142 PolarHBondContact O-N 2.77Å; D140-K142 VanDerWaalsContact OD1-CB 3.31Å; D140-K142 WeakPolarHBondContact OD1-CB 3.07Å; D140-K142 WeakPolarHBondContact OD1-CG 3.34Å; D140-K142 PolarHBondContact OD1-N 3.15Å; D140-M143 HydrophobicContact CB-CG 4.15Å; D140-M143 WeakPolarHBondContact O-CB 3.47Å; D140-M143 PolarHBondContact O-N 2.87Å
141	E	92.4	Very high	93.8	Very high	171 Å²	171	46.1 Å²	46.1	80%	0.799	23%	0.228	S	C	*	.	H	α-helix	trans	-59.6	-27	178.5	-66	-173.3	168.1	0	0	112.7	M143 V144 G145	E141-M143 VanDerWaalsContact C-N 3.31Å; E141-M143 PolarHBondContact O-N 3.44Å; E141-V144 PolarHBondContact O-N 2.87Å; E141-G145 PolarHBondContact O-N 3.07Å
142	K	95.1	Very high	93.7	Very high	138 Å²	138	52 Å²	52	60%	0.6	26%	0.255	S	S	*	.	H	α-helix	trans	-62.2	-39.5	175.6	-64.2	177.5	-179.4	177.2	0	111.7	D140 V144 G145 H146	D140-K142 PolarHBondContact O-N 2.77Å; D140-K142 VanDerWaalsContact OD1-CB 3.31Å; D140-K142 WeakPolarHBondContact OD1-CB 3.07Å; D140-K142 WeakPolarHBondContact OD1-CG 3.34Å; D140-K142 PolarHBondContact OD1-N 3.15Å; K142-V144 VanDerWaalsContact C-N 3.32Å; K142-V144 PolarHBondContact O-N 3.38Å; K142-G145 PolarHBondContact O-N 3.42Å; K142-G145 VanDerWaalsContact O-N 3.16Å; K142-H146 PolarHBondContact O-CD2 3.12Å; K142-H146 PolarHBondContact O-N 3Å
143	M	95.8	Very high	93.7	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-46.1	176.5	-71.9	-68.9	-71.2	0	0	111.1	P89 S90 L93 W130 D137 F138 D140 E141 G145 H146 L147	P89-M143 HydrophobicContact CB-CE 4.43Å; P89-M143 HydrophobicContact CB-SD 4.22Å; P89-M143 VanDerWaalsContact O-SD 3.38Å; S90-M143 WeakPolarHBondContact CA-SD 3.22Å; S90-M143 PolarHBondContact N-SD 3.37Å; L93-M143 HydrophobicContact CB-CE 4.09Å; L93-M143 HydrophobicContact CB-SD 3.78Å; L93-M143 HydrophobicContact CD2-CB 4.42Å; L93-M143 HydrophobicContact CD2-CE 3.63Å; L93-M143 WeakPolarHBondContact CD2-O 3.35Å; L93-M143 HydrophobicContact CD2-SD 3.73Å; L93-M143 HydrophobicContact CG-CE 4.46Å; L93-M143 HydrophobicContact CG-SD 4.41Å; W130-M143 HydrophobicContact CZ2-CE 3.95Å; D137-M143 HydrophobicContact CB-CE 4.08Å; D137-M143 WeakPolarHBondContact O-CG 3.45Å; F138-M143 HydrophobicContact CD1-CB 3.73Å; F138-M143 HydrophobicContact CD1-CE 4.34Å; F138-M143 HydrophobicContact CE1-CB 4.16Å; F138-M143 HydrophobicContact CE1-CE 3.86Å; F138-M143 HydrophobicContact CE2-CE 4.09Å; F138-M143 HydrophobicContact CG-CB 4.28Å; F138-M143 HydrophobicContact CZ-CE 3.72Å; D140-M143 HydrophobicContact CB-CG 4.15Å; D140-M143 WeakPolarHBondContact O-CB 3.47Å; D140-M143 PolarHBondContact O-N 2.87Å; E141-M143 VanDerWaalsContact C-N 3.31Å; E141-M143 PolarHBondContact O-N 3.44Å; M143-G145 VanDerWaalsContact C-N 3.32Å; M143-G145 PolarHBondContact O-N 2.71Å; M143-H146 PolarHBondContact O-N 3.35Å; M143-L147 WeakPolarHBondContact O-CB 3.4Å; M143-L147 PolarHBondContact O-N 2.86Å
144	V	94.9	Very high	93.7	Very high	31 Å²	31	49.6 Å²	49.6	19%	0.188	24%	0.238	C	C	.	.	H	α-helix	trans	-67.2	-34.3	177.5	-179.8	0	0	0	0	111.4	F138 E141 K142 L147 K148 L169	F138-V144 HydrophobicContact CB-CG2 4.43Å; F138-V144 HydrophobicContact CD1-CG2 4.47Å; E141-V144 PolarHBondContact O-N 2.87Å; K142-V144 VanDerWaalsContact C-N 3.32Å; K142-V144 PolarHBondContact O-N 3.38Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; V144-K148 HydrophobicContact CG1-CD 4.33Å; V144-K148 WeakPolarHBondContact O-CG 3.4Å; V144-K148 PolarHBondContact O-N 3.04Å; V144-L169 HydrophobicContact CG1-CD2 4.1Å
145	G	96.4	Very high	93.5	Very high	26 Å²	26	49.9 Å²	49.9	27%	0.268	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-57	172.6	0	0	0	0	0	112.2	E141 K142 M143 L147 K148 D149	E141-G145 PolarHBondContact O-N 3.07Å; K142-G145 PolarHBondContact O-N 3.42Å; K142-G145 VanDerWaalsContact O-N 3.16Å; M143-G145 VanDerWaalsContact C-N 3.32Å; M143-G145 PolarHBondContact O-N 2.71Å; G145-L147 VanDerWaalsContact C-N 3.25Å; G145-L147 PolarHBondContact O-N 3.27Å; G145-K148 PolarHBondContact O-N 2.92Å; G145-D149 VanDerWaalsContact O-CG 3.26Å; G145-D149 PolarHBondContact O-N 3.12Å
146	H	96.5	Very high	93.3	Very high	39 Å²	39	54.9 Å²	54.9	18%	0.181	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-38.9	179.6	-64.1	-48.4	0	0	0	113	L93 K142 M143 D149 I150	L93-H146 HydrophobicContact CD2-CB 3.81Å; L93-H146 HydrophobicContact CG-CB 3.82Å; K142-H146 PolarHBondContact O-CD2 3.12Å; K142-H146 PolarHBondContact O-N 3Å; M143-H146 PolarHBondContact O-N 3.35Å; H146-D149 PolarHBondContact O-N 3.47Å; H146-I150 PolarHBondContact O-N 3.01Å; H146-I150 VanDerWaalsContact O-N 3.12Å
147	L	94.3	Very high	93.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-44.7	174.8	-174.8	112.5	0	0	0	112.3	L127 T131 F138 M143 V144 G145 I150 I151 L165 M168 L169	L127-L147 HydrophobicContact CB-CD1 3.98Å; L127-L147 HydrophobicContact CD1-CD1 3.99Å; L127-L147 HydrophobicContact CD1-CG 4.42Å; L127-L147 HydrophobicContact CD2-CD1 4.14Å; L127-L147 HydrophobicContact CG-CD1 4.25Å; T131-L147 HydrophobicContact CG2-CD1 4.43Å; F138-L147 HydrophobicContact CE1-CD1 4.08Å; M143-L147 WeakPolarHBondContact O-CB 3.4Å; M143-L147 PolarHBondContact O-N 2.86Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; G145-L147 VanDerWaalsContact C-N 3.25Å; G145-L147 PolarHBondContact O-N 3.27Å; L147-I150 WeakPolarHBondContact O-CG2 3.48Å; L147-I151 VanDerWaalsContact O-CG1 3.31Å; L147-I151 WeakPolarHBondContact O-CG1 3.45Å; L147-I151 PolarHBondContact O-N 3.16Å; L147-L165 HydrophobicContact CD2-CD1 3.22Å; L147-L165 HydrophobicContact CD2-CG 4.41Å; L147-L165 HydrophobicContact CG-CD1 3.69Å; L147-M168 HydrophobicContact CD1-CE 3.4Å; L147-M168 HydrophobicContact CD1-SD 4.49Å; L147-M168 HydrophobicContact CD2-CE 3.66Å; L147-M168 HydrophobicContact CG-CE 3.84Å; L147-L169 HydrophobicContact CD2-CD1 4.29Å; L147-L169 HydrophobicContact CD2-CD2 3.52Å; L147-L169 HydrophobicContact CD2-CG 3.97Å
148	K	95.2	Very high	93.2	Very high	100 Å²	100	56 Å²	56	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-68.5	-39.3	176.6	-73.3	174.1	179.1	176.4	0	111.7	V144 G145 I151 H152 L165	V144-K148 HydrophobicContact CG1-CD 4.33Å; V144-K148 WeakPolarHBondContact O-CG 3.4Å; V144-K148 PolarHBondContact O-N 3.04Å; G145-K148 PolarHBondContact O-N 2.92Å; K148-I151 PolarHBondContact O-N 3.48Å; K148-H152 WeakPolarHBondContact O-CB 3.22Å; K148-H152 PolarHBondContact O-N 3.03Å; K148-L165 HydrophobicContact CG-CD2 4.34Å
149	D	95.2	Very high	92.9	Very high	93 Å²	93	63.8 Å²	63.8	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-45.7	-178	-70	-12.5	0	0	0	111.9	G145 H146 H152 R153	G145-D149 VanDerWaalsContact O-CG 3.26Å; G145-D149 PolarHBondContact O-N 3.12Å; H146-D149 PolarHBondContact O-N 3.47Å; D149-H152 PolarHBondContact O-N 3.3Å; D149-R153 WeakPolarHBondContact O-CD 3.36Å; D149-R153 WeakPolarHBondContact O-CG 3.45Å; D149-R153 PolarHBondContact O-N 2.74Å
150	I	94.4	Very high	93	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-37.7	178.9	-164.7	67.4	0	0	0	111.7	C100 I101 L106 I123 L127 H146 L147 R153 I154	C100-I150 HydrophobicContact CB-CD1 3.87Å; I101-I150 HydrophobicContact CG1-CD1 4.08Å; L106-I150 HydrophobicContact CD1-CD1 3.68Å; I123-I150 HydrophobicContact CG1-CG1 4.35Å; L127-I150 HydrophobicContact CD1-CG2 3.83Å; H146-I150 PolarHBondContact O-N 3.01Å; H146-I150 VanDerWaalsContact O-N 3.12Å; L147-I150 WeakPolarHBondContact O-CG2 3.48Å; I150-R153 PolarHBondContact O-N 3.18Å; I150-I154 PolarHBondContact O-N 3.35Å
151	I	93.8	Very high	93.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-39.5	177.5	-61.4	-52.3	0	0	0	111.8	L124 L147 K148 R153 I154 A155 W162 L165	L124-I151 HydrophobicContact CD2-CD1 3.44Å; L124-I151 VanDerWaalsContact CD2-CD1 3.44Å; L124-I151 HydrophobicContact CD2-CG1 4.39Å; L124-I151 HydrophobicContact CG-CD1 3.97Å; L147-I151 VanDerWaalsContact O-CG1 3.31Å; L147-I151 WeakPolarHBondContact O-CG1 3.45Å; L147-I151 PolarHBondContact O-N 3.16Å; K148-I151 PolarHBondContact O-N 3.48Å; I151-R153 PolarHBondContact O-N 3.39Å; I151-R153 VanDerWaalsContact O-N 3.16Å; I151-I154 HydrophobicContact CD1-CD1 3.8Å; I151-I154 HydrophobicContact CD1-CG1 4.27Å; I151-I154 PolarHBondContact O-N 3.25Å; I151-I154 VanDerWaalsContact O-N 3.14Å; I151-A155 HydrophobicContact CG2-CB 4.49Å; I151-A155 WeakPolarHBondContact O-CB 3.39Å; I151-A155 PolarHBondContact O-N 3.26Å; I151-W162 HydrophobicContact CG2-CD2 4.03Å; I151-W162 HydrophobicContact CG2-CE3 3.88Å; I151-W162 HydrophobicContact CG2-CH2 4.34Å; I151-W162 HydrophobicContact CG2-CZ3 4.07Å; I151-L165 HydrophobicContact CB-CD2 3.93Å; I151-L165 HydrophobicContact CG1-CB 4.32Å; I151-L165 HydrophobicContact CG1-CD1 3.8Å; I151-L165 HydrophobicContact CG1-CD2 4.06Å; I151-L165 HydrophobicContact CG1-CG 4.26Å; I151-L165 HydrophobicContact CG2-CB 4.19Å; I151-L165 HydrophobicContact CG2-CD2 3.9Å
152	H	93.6	Very high	93.2	Very high	129 Å²	129	54.3 Å²	54.3	60%	0.597	28%	0.275	S	S	*	.	H	α-helix	trans	-57.3	-32.3	176.5	-167.4	83.6	0	0	0	112.5	K148 D149 P156 W162	K148-H152 WeakPolarHBondContact O-CB 3.22Å; K148-H152 PolarHBondContact O-N 3.03Å; D149-H152 PolarHBondContact O-N 3.3Å; H152-P156 WeakPolarHBondContact O-CD 3.2Å; H152-W162 HydrophobicContact CB-CH2 4.14Å; H152-W162 HydrophobicContact CB-CZ2 4Å; H152-W162 AromaticContact ND1-CZ2 3.64Å
153	R	92.8	Very high	93.1	Very high	80 Å²	80	54.3 Å²	54.3	30%	0.302	28%	0.275	S	S	.	.	H	α-helix	trans	-76.7	-32	179.6	-66	162.9	174.2	-77.6	4.9	113.7	L106 D107 D149 I150 I151	L106-R153 HydrophobicContact CB-CB 4.4Å; L106-R153 HydrophobicContact CD1-CB 4.44Å; D107-R153 IonicContact OD1-CZ 3.65Å; D107-R153 IonicContact OD1-NH1 3.85Å; D107-R153 PolarHBondContact OD1-NH1 2.88Å; D107-R153 IonicContact OD1-NH2 3.83Å; D107-R153 IonicContact OD2-CZ 3.75Å; D107-R153 IonicContact OD2-NH1 2.68Å; D107-R153 PolarHBondContact OD2-NH1 2.88Å; D107-R153 IonicContact OD2-NH2 3.72Å; D149-R153 WeakPolarHBondContact O-CD 3.36Å; D149-R153 WeakPolarHBondContact O-CG 3.45Å; D149-R153 PolarHBondContact O-N 2.74Å; I150-R153 PolarHBondContact O-N 3.18Å; I151-R153 PolarHBondContact O-N 3.39Å; I151-R153 VanDerWaalsContact O-N 3.16Å
154	I	92.4	Very high	93	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-97	-23.7	-177.8	64.5	168.8	0	0	0	113.4	L106 V116 F119 I123 I150 I151 C157 Y161	L106-I154 HydrophobicContact CD1-CG2 4.05Å; L106-I154 HydrophobicContact CD2-CG2 4.14Å; V116-I154 HydrophobicContact CG1-CB 3.8Å; V116-I154 HydrophobicContact CG1-CG2 3.82Å; F119-I154 HydrophobicContact CD1-CG2 4.43Å; F119-I154 HydrophobicContact CE1-CG2 4.25Å; I123-I154 HydrophobicContact CG2-CD1 4.02Å; I150-I154 PolarHBondContact O-N 3.35Å; I151-I154 HydrophobicContact CD1-CD1 3.8Å; I151-I154 HydrophobicContact CD1-CG1 4.27Å; I151-I154 PolarHBondContact O-N 3.25Å; I151-I154 VanDerWaalsContact O-N 3.14Å; I154-C157 VanDerWaalsContact O-CB 3.32Å; I154-C157 WeakPolarHBondContact O-CB 3.38Å; I154-C157 PolarHBondContact O-N 3.19Å; I154-Y161 HydrophobicContact CB-CD2 4.1Å; I154-Y161 HydrophobicContact CB-CE2 4.29Å; I154-Y161 HydrophobicContact CD1-CD2 3.76Å; I154-Y161 HydrophobicContact CD1-CE2 4.2Å; I154-Y161 HydrophobicContact CD1-CG 4.11Å; I154-Y161 HydrophobicContact CG1-CD2 3.73Å; I154-Y161 HydrophobicContact CG1-CE2 4.32Å; I154-Y161 HydrophobicContact CG1-CG 4.38Å; I154-Y161 WeakPolarHBondContact O-CD2 3.33Å
155	A	89.6	Confident	92.9	Very high	5 Å²	5	55.3 Å²	55.3	4%	0.041	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-59.4	-30.9	-176.2	0	0	0	0	0	115.9	I151 C157 D158 W162	I151-A155 HydrophobicContact CG2-CB 4.49Å; I151-A155 WeakPolarHBondContact O-CB 3.39Å; I151-A155 PolarHBondContact O-N 3.26Å; A155-C157 PolarHBondContact O-N 3.22Å; A155-C157 VanDerWaalsContact O-N 3.08Å; A155-D158 CarbonylContact O-C 3.22Å; A155-D158 PolarHBondContact O-N 2.9Å; A155-D158 VanDerWaalsContact O-N 3.11Å; A155-D158 VanDerWaalsContact O-O 3.12Å; A155-W162 HydrophobicContact CB-CD2 4.33Å; A155-W162 HydrophobicContact CB-CG 4.1Å; A155-W162 HydrophobicContact CB-CZ2 4.41Å
156	P	89.6	Confident	92.8	Very high	109 Å²	109	58 Å²	58	71%	0.708	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-58.7	-20	173.2	-26.7	36.3	0	0	0	114	H152	H152-P156 WeakPolarHBondContact O-CD 3.2Å
157	C	89.1	Confident	92.7	Very high	7 Å²	7	60.7 Å²	60.7	5%	0.047	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-83.8	-26.5	178.4	-62.3	0	0	0	0	113.6	L111 V116 R117 I154 A155	L111-C157 VanDerWaalsContact CD2-SG 3.57Å; V116-C157 HydrophobicContact CB-CB 4.44Å; V116-C157 HydrophobicContact CG1-CB 3.95Å; R117-C157 HydrophobicContact CG-CB 4.4Å; R117-C157 PolarHBondContact NE-O 3.31Å; R117-C157 PolarHBondContact NH2-O 2.91Å; I154-C157 VanDerWaalsContact O-CB 3.32Å; I154-C157 WeakPolarHBondContact O-CB 3.38Å; I154-C157 PolarHBondContact O-N 3.19Å; A155-C157 PolarHBondContact O-N 3.22Å; A155-C157 VanDerWaalsContact O-N 3.08Å
158	D	90.3	Very high	92.8	Very high	66 Å²	66	61.2 Å²	61.2	35%	0.353	31%	0.305	S	S	.	.			trans	-163.6	116.9	-178.5	-169	-19.2	0	0	0	110.9	A155 A160 Y161	A155-D158 CarbonylContact O-C 3.22Å; A155-D158 PolarHBondContact O-N 2.9Å; A155-D158 VanDerWaalsContact O-N 3.11Å; A155-D158 VanDerWaalsContact O-O 3.12Å; D158-A160 PolarHBondContact O-N 3.1Å; D158-A160 WeakPolarHBondContact OD1-CB 3.4Å; D158-A160 PolarHBondContact OD1-N 2.65Å; D158-Y161 HydrophobicContact CB-CD1 4.4Å; D158-Y161 HydrophobicContact CB-CD2 3.98Å; D158-Y161 HydrophobicContact CB-CE1 4.06Å; D158-Y161 HydrophobicContact CB-CE2 3.63Å; D158-Y161 HydrophobicContact CB-CG 4.36Å; D158-Y161 WeakPolarHBondContact O-CD2 3.33Å; D158-Y161 PolarHBondContact O-N 2.95Å
159	E	88.8	Confident	92.7	Very high	169 Å²	169	58 Å²	58	79%	0.79	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.5	179.1	-66.3	-175.2	170.6	0	0	113.1	Y161 W162	E159-Y161 PolarHBondContact O-N 3.09Å; E159-Y161 VanDerWaalsContact O-N 3.15Å; E159-W162 PolarHBondContact O-N 2.88Å
160	A	92.6	Very high	92.7	Very high	46 Å²	46	59.2 Å²	59.2	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-26.5	177.9	0	0	0	0	0	112.4	D158 W162 K163 T164	D158-A160 PolarHBondContact O-N 3.1Å; D158-A160 WeakPolarHBondContact OD1-CB 3.4Å; D158-A160 PolarHBondContact OD1-N 2.65Å; A160-W162 PolarHBondContact O-N 3.32Å; A160-K163 WeakPolarHBondContact O-CB 3.31Å; A160-K163 PolarHBondContact O-N 3.45Å; A160-K163 VanDerWaalsContact O-N 3.14Å; A160-T164 PolarHBondContact O-N 3.17Å; A160-T164 PolarHBondContact O-OG1 2.7Å
161	Y	93.3	Very high	92.8	Very high	11 Å²	11	65.3 Å²	65.3	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-38.4	179.1	-58.3	-24.5	0	0	0	112.6	R117 P121 L124 I154 D158 E159 K163 T164 L165	R117-Y161 WeakPolarHBondContact CA-OH 3.47Å; P121-Y161 HydrophobicContact CG-CE1 4.42Å; L124-Y161 HydrophobicContact CD1-CD1 3.45Å; L124-Y161 VanDerWaalsContact CD1-CD1 3.45Å; L124-Y161 HydrophobicContact CD1-CE1 4.23Å; L124-Y161 HydrophobicContact CD1-CG 3.98Å; I154-Y161 HydrophobicContact CB-CD2 4.1Å; I154-Y161 HydrophobicContact CB-CE2 4.29Å; I154-Y161 HydrophobicContact CD1-CD2 3.76Å; I154-Y161 HydrophobicContact CD1-CE2 4.2Å; I154-Y161 HydrophobicContact CD1-CG 4.11Å; I154-Y161 HydrophobicContact CG1-CD2 3.73Å; I154-Y161 HydrophobicContact CG1-CE2 4.32Å; I154-Y161 HydrophobicContact CG1-CG 4.38Å; I154-Y161 WeakPolarHBondContact O-CD2 3.33Å; D158-Y161 HydrophobicContact CB-CD1 4.4Å; D158-Y161 HydrophobicContact CB-CD2 3.98Å; D158-Y161 HydrophobicContact CB-CE1 4.06Å; D158-Y161 HydrophobicContact CB-CE2 3.63Å; D158-Y161 HydrophobicContact CB-CG 4.36Å; D158-Y161 WeakPolarHBondContact O-CD2 3.33Å; D158-Y161 PolarHBondContact O-N 2.95Å; E159-Y161 PolarHBondContact O-N 3.09Å; E159-Y161 VanDerWaalsContact O-N 3.15Å; Y161-K163 VanDerWaalsContact C-N 3.33Å; Y161-T164 PolarHBondContact O-N 2.67Å; Y161-L165 WeakPolarHBondContact O-CB 3.46Å; Y161-L165 PolarHBondContact O-N 3.11Å
162	W	92.7	Very high	92.8	Very high	89 Å²	89	65.9 Å²	65.9	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-38.8	173.2	-83.8	125.7	0	0	0	112.1	I151 H152 A155 E159 A160 L165 N166	I151-W162 HydrophobicContact CG2-CD2 4.03Å; I151-W162 HydrophobicContact CG2-CE3 3.88Å; I151-W162 HydrophobicContact CG2-CH2 4.34Å; I151-W162 HydrophobicContact CG2-CZ3 4.07Å; H152-W162 HydrophobicContact CB-CH2 4.14Å; H152-W162 HydrophobicContact CB-CZ2 4Å; H152-W162 AromaticContact ND1-CZ2 3.64Å; A155-W162 HydrophobicContact CB-CD2 4.33Å; A155-W162 HydrophobicContact CB-CG 4.1Å; A155-W162 HydrophobicContact CB-CZ2 4.41Å; E159-W162 PolarHBondContact O-N 2.88Å; A160-W162 PolarHBondContact O-N 3.32Å; W162-L165 HydrophobicContact CE3-CD2 3.51Å; W162-L165 HydrophobicContact CH2-CD2 4.37Å; W162-L165 HydrophobicContact CZ3-CD2 3.26Å; W162-L165 PolarHBondContact O-N 2.91Å; W162-N166 WeakPolarHBondContact O-CB 3.21Å; W162-N166 VanDerWaalsContact O-CG 3.3Å; W162-N166 PolarHBondContact O-N 2.69Å; W162-N166 PolarHBondContact O-ND2 3.43Å; W162-N166 VanDerWaalsContact O-ND2 3.15Å
163	K	93.4	Very high	92.8	Very high	139 Å²	139	63 Å²	63	60%	0.604	32%	0.318	S	S	*	.	H	α-helix	trans	-61.8	-47	178	-171.6	-179.8	179.2	-178.2	0	110.9	A160 Y161 N166 Q167	A160-K163 WeakPolarHBondContact O-CB 3.31Å; A160-K163 PolarHBondContact O-N 3.45Å; A160-K163 VanDerWaalsContact O-N 3.14Å; Y161-K163 VanDerWaalsContact C-N 3.33Å; K163-N166 PolarHBondContact O-N 3.07Å; K163-Q167 WeakPolarHBondContact O-CG 3.31Å; K163-Q167 PolarHBondContact O-N 2.98Å; K163-Q167 VanDerWaalsContact O-N 3.08Å
164	T	93.7	Very high	92.8	Very high	51 Å²	51	65.2 Å²	65.2	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-44.7	176.7	-55.8	0	0	0	0	111.6	L124 A160 Y161 N166 Q167 M168	L124-T164 HydrophobicContact CD1-CG2 4.32Å; L124-T164 HydrophobicContact CD2-CG2 4.04Å; A160-T164 PolarHBondContact O-N 3.17Å; A160-T164 PolarHBondContact O-OG1 2.7Å; Y161-T164 PolarHBondContact O-N 2.67Å; T164-N166 PolarHBondContact O-N 3.38Å; T164-Q167 PolarHBondContact O-N 3.23Å; T164-M168 WeakPolarHBondContact O-CB 3.38Å; T164-M168 PolarHBondContact O-N 3.04Å
165	L	93.7	Very high	92.7	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-57.1	-49.8	176.7	-177.7	68.2	0	0	0	112.1	L147 K148 I151 Y161 W162 Q167 M168 L169	L147-L165 HydrophobicContact CD2-CD1 3.22Å; L147-L165 HydrophobicContact CD2-CG 4.41Å; L147-L165 HydrophobicContact CG-CD1 3.69Å; K148-L165 HydrophobicContact CG-CD2 4.34Å; I151-L165 HydrophobicContact CB-CD2 3.93Å; I151-L165 HydrophobicContact CG1-CB 4.32Å; I151-L165 HydrophobicContact CG1-CD1 3.8Å; I151-L165 HydrophobicContact CG1-CD2 4.06Å; I151-L165 HydrophobicContact CG1-CG 4.26Å; I151-L165 HydrophobicContact CG2-CB 4.19Å; I151-L165 HydrophobicContact CG2-CD2 3.9Å; Y161-L165 WeakPolarHBondContact O-CB 3.46Å; Y161-L165 PolarHBondContact O-N 3.11Å; W162-L165 HydrophobicContact CE3-CD2 3.51Å; W162-L165 HydrophobicContact CH2-CD2 4.37Å; W162-L165 HydrophobicContact CZ3-CD2 3.26Å; W162-L165 PolarHBondContact O-N 2.91Å; L165-Q167 VanDerWaalsContact C-N 3.32Å; L165-Q167 PolarHBondContact O-N 3.32Å; L165-M168 HydrophobicContact CD1-CE 3.51Å; L165-M168 PolarHBondContact O-N 2.75Å; L165-L169 HydrophobicContact CD1-CD1 4.34Å; L165-L169 HydrophobicContact CD1-CG 4.35Å; L165-L169 HydrophobicContact CD2-CD1 4.4Å; L165-L169 HydrophobicContact CG-CD1 4.05Å; L165-L169 HydrophobicContact CG-CG 4.4Å; L165-L169 WeakPolarHBondContact O-CB 3.4Å; L165-L169 WeakPolarHBondContact O-CG 3.45Å; L165-L169 PolarHBondContact O-N 3.13Å
166	N	93.8	Very high	92.7	Very high	83 Å²	83	70.9 Å²	70.9	44%	0.444	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-40.2	-177.9	-73.6	-32.7	0	0	0	111.4	W162 K163 T164 Q170	W162-N166 WeakPolarHBondContact O-CB 3.21Å; W162-N166 VanDerWaalsContact O-CG 3.3Å; W162-N166 PolarHBondContact O-N 2.69Å; W162-N166 PolarHBondContact O-ND2 3.43Å; W162-N166 VanDerWaalsContact O-ND2 3.15Å; K163-N166 PolarHBondContact O-N 3.07Å; T164-N166 PolarHBondContact O-N 3.38Å; N166-Q170 WeakPolarHBondContact O-CB 3.16Å; N166-Q170 VanDerWaalsContact O-CG 3.23Å; N166-Q170 WeakPolarHBondContact O-CG 3.41Å; N166-Q170 PolarHBondContact O-N 2.77Å
167	Q	95.1	Very high	92.7	Very high	96 Å²	96	67.9 Å²	67.9	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-44.7	174.8	-72.4	176.3	-7.3	0	0	112	K163 T164 L165 Q170 K171	K163-Q167 WeakPolarHBondContact O-CG 3.31Å; K163-Q167 PolarHBondContact O-N 2.98Å; K163-Q167 VanDerWaalsContact O-N 3.08Å; T164-Q167 PolarHBondContact O-N 3.23Å; L165-Q167 VanDerWaalsContact C-N 3.32Å; L165-Q167 PolarHBondContact O-N 3.32Å; Q167-Q170 PolarHBondContact O-N 3.37Å; Q167-K171 WeakPolarHBondContact O-CG 3.32Å; Q167-K171 PolarHBondContact O-N 3.43Å
168	M	95	Very high	92.6	Very high	10 Å²	10	73.1 Å²	73.1	5%	0.049	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-44.9	178.4	178.2	-173.3	70.2	0	0	111.7	L127 T131 L147 T164 L165 Q170 K171 L172	L127-M168 HydrophobicContact CB-SD 4.34Å; T131-M168 HydrophobicContact CG2-CE 4.45Å; T131-M168 HydrophobicContact CG2-CG 4.17Å; T131-M168 HydrophobicContact CG2-SD 4.01Å; T131-M168 WeakPolarHBondContact OG1-CG 3.45Å; L147-M168 HydrophobicContact CD1-CE 3.4Å; L147-M168 HydrophobicContact CD1-SD 4.49Å; L147-M168 HydrophobicContact CD2-CE 3.66Å; L147-M168 HydrophobicContact CG-CE 3.84Å; T164-M168 WeakPolarHBondContact O-CB 3.38Å; T164-M168 PolarHBondContact O-N 3.04Å; L165-M168 HydrophobicContact CD1-CE 3.51Å; L165-M168 PolarHBondContact O-N 2.75Å; M168-Q170 VanDerWaalsContact C-N 3.35Å; M168-Q170 PolarHBondContact O-N 3.07Å; M168-K171 PolarHBondContact O-N 3.27Å; M168-L172 VanDerWaalsContact O-CB 3.31Å; M168-L172 WeakPolarHBondContact O-CB 3.5Å; M168-L172 PolarHBondContact O-N 3.49Å
169	L	94.7	Very high	92.3	Very high	33 Å²	33	71.7 Å²	71.7	17%	0.173	36%	0.358	C	S	.	.	H	α-helix	trans	-62.9	-39.1	175.4	-74.5	178.8	0	0	0	112.5	V144 L147 L165 L172 S173	V144-L169 HydrophobicContact CG1-CD2 4.1Å; L147-L169 HydrophobicContact CD2-CD1 4.29Å; L147-L169 HydrophobicContact CD2-CD2 3.52Å; L147-L169 HydrophobicContact CD2-CG 3.97Å; L165-L169 HydrophobicContact CD1-CD1 4.34Å; L165-L169 HydrophobicContact CD1-CG 4.35Å; L165-L169 HydrophobicContact CD2-CD1 4.4Å; L165-L169 HydrophobicContact CG-CD1 4.05Å; L165-L169 HydrophobicContact CG-CG 4.4Å; L165-L169 WeakPolarHBondContact O-CB 3.4Å; L165-L169 WeakPolarHBondContact O-CG 3.45Å; L165-L169 PolarHBondContact O-N 3.13Å; L169-L172 HydrophobicContact CD2-CD2 4.42Å; L169-L172 PolarHBondContact O-N 3.4Å; L169-S173 WeakPolarHBondContact O-CB 3.28Å; L169-S173 PolarHBondContact O-N 3.46Å; L169-S173 PolarHBondContact O-OG 3.46Å
170	Q	95.1	Very high	92	Very high	118 Å²	118	66 Å²	66	55%	0.551	34%	0.337	S	S	*	.	H	α-helix	trans	-62.1	-50.7	174.3	-78.2	176.1	-8.7	0	0	111.3	N166 Q167 M168 L172 S173 Q174	N166-Q170 WeakPolarHBondContact O-CB 3.16Å; N166-Q170 VanDerWaalsContact O-CG 3.23Å; N166-Q170 WeakPolarHBondContact O-CG 3.41Å; N166-Q170 PolarHBondContact O-N 2.77Å; Q167-Q170 PolarHBondContact O-N 3.37Å; M168-Q170 VanDerWaalsContact C-N 3.35Å; M168-Q170 PolarHBondContact O-N 3.07Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; Q170-L172 PolarHBondContact O-N 3.29Å; Q170-S173 PolarHBondContact O-N 3.27Å; Q170-S173 PolarHBondContact O-OG 3.08Å; Q170-Q174 WeakPolarHBondContact O-CG 3.37Å; Q170-Q174 PolarHBondContact O-N 3.47Å
171	K	95	Very high	91.4	Very high	130 Å²	130	69.7 Å²	69.7	57%	0.565	35%	0.346	S	S	*	.	H	α-helix	trans	-57.8	-45.2	176.6	-73.4	178.8	178.7	-175.3	0	112	Q167 M168 Q174 R175	Q167-K171 WeakPolarHBondContact O-CG 3.32Å; Q167-K171 PolarHBondContact O-N 3.43Å; M168-K171 PolarHBondContact O-N 3.27Å; K171-Q174 PolarHBondContact O-N 3.04Å; K171-R175 WeakPolarHBondContact O-CB 3.39Å; K171-R175 PolarHBondContact O-N 3.21Å
172	L	94.6	Very high	90.4	Very high	11 Å²	11	69.7 Å²	69.7	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-46.8	177.2	174.5	63.5	0	0	0	111.4	T131 P135 F138 M168 L169 Q170 Q174 R175 L176	T131-L172 HydrophobicContact CG2-CD2 4.25Å; P135-L172 HydrophobicContact CB-CD1 3.81Å; F138-L172 HydrophobicContact CB-CD1 4.15Å; F138-L172 HydrophobicContact CB-CD2 3.49Å; F138-L172 VanDerWaalsContact CB-CD2 3.49Å; F138-L172 HydrophobicContact CB-CG 4.33Å; F138-L172 HydrophobicContact CD1-CD2 4.12Å; F138-L172 HydrophobicContact CD2-CD1 4.5Å; F138-L172 HydrophobicContact CD2-CD2 4.42Å; F138-L172 HydrophobicContact CG-CD2 3.77Å; M168-L172 VanDerWaalsContact O-CB 3.31Å; M168-L172 WeakPolarHBondContact O-CB 3.5Å; M168-L172 PolarHBondContact O-N 3.49Å; L169-L172 HydrophobicContact CD2-CD2 4.42Å; L169-L172 PolarHBondContact O-N 3.4Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; Q170-L172 PolarHBondContact O-N 3.29Å; L172-Q174 PolarHBondContact O-N 3.42Å; L172-R175 PolarHBondContact O-N 2.99Å; L172-L176 HydrophobicContact CD1-CD1 3.96Å; L172-L176 HydrophobicContact CD1-CG 4.06Å; L172-L176 HydrophobicContact CG-CD1 3.99Å; L172-L176 HydrophobicContact CG-CG 4.46Å; L172-L176 WeakPolarHBondContact O-CB 3.06Å; L172-L176 WeakPolarHBondContact O-CG 3.48Å; L172-L176 PolarHBondContact O-N 3.28Å
173	S	93.4	Very high	89.4	Confident	68 Å²	68	68.2 Å²	68.2	48%	0.476	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-41.2	179.1	71.5	0	0	0	0	112.6	L169 Q170 A177	L169-S173 WeakPolarHBondContact O-CB 3.28Å; L169-S173 PolarHBondContact O-N 3.46Å; L169-S173 PolarHBondContact O-OG 3.46Å; Q170-S173 PolarHBondContact O-N 3.27Å; Q170-S173 PolarHBondContact O-OG 3.08Å; S173-A177 WeakPolarHBondContact O-CB 3.44Å; S173-A177 PolarHBondContact O-N 3.4Å
174	Q	93.3	Very high	88.5	Confident	127 Å²	127	67 Å²	67	59%	0.593	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-44.7	175.6	-70.3	173	14.2	0	0	111	Q170 K171 L172 A177 L178	Q170-Q174 WeakPolarHBondContact O-CG 3.37Å; Q170-Q174 PolarHBondContact O-N 3.47Å; K171-Q174 PolarHBondContact O-N 3.04Å; L172-Q174 PolarHBondContact O-N 3.42Å; Q174-A177 PolarHBondContact O-N 2.85Å; Q174-L178 WeakPolarHBondContact O-CG 3.29Å; Q174-L178 PolarHBondContact O-N 3.37Å
175	R	90.3	Very high	87.3	Confident	96 Å²	96	67.8 Å²	67.8	36%	0.362	35%	0.351	S	S	.	.	H	α-helix	trans	-64.9	-44.2	179.1	-172.5	167.7	179.5	-175.9	-12.3	112.3	E132 P135 K171 L172 A177 L178 M179	E132-R175 VanDerWaalsContact O-CZ 3.24Å; E132-R175 PolarHBondContact O-NH1 3.29Å; E132-R175 PolarHBondContact O-NH2 3.06Å; E132-R175 VanDerWaalsContact O-NH2 3.09Å; P135-R175 HydrophobicContact CB-CG 4.44Å; K171-R175 WeakPolarHBondContact O-CB 3.39Å; K171-R175 PolarHBondContact O-N 3.21Å; L172-R175 PolarHBondContact O-N 2.99Å; R175-A177 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 3.06Å; R175-L178 PolarHBondContact O-N 3.12Å; R175-M179 HydrophobicContact CG-SD 4.22Å; R175-M179 VanDerWaalsContact O-CG 3.27Å; R175-M179 WeakPolarHBondContact O-CG 3.49Å; R175-M179 PolarHBondContact O-N 2.74Å
176	L	90.3	Very high	86.1	Confident	28 Å²	28	69.3 Å²	69.3	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-40.8	175.7	-75	174.9	0	0	0	111.8	P135 R139 L172 M179 S180	P135-L176 HydrophobicContact CB-CD2 4.41Å; P135-L176 WeakPolarHBondContact O-CD2 3.32Å; R139-L176 HydrophobicContact CG-CD2 3.76Å; L172-L176 HydrophobicContact CD1-CD1 3.96Å; L172-L176 HydrophobicContact CD1-CG 4.06Å; L172-L176 HydrophobicContact CG-CD1 3.99Å; L172-L176 HydrophobicContact CG-CG 4.46Å; L172-L176 WeakPolarHBondContact O-CB 3.06Å; L172-L176 WeakPolarHBondContact O-CG 3.48Å; L172-L176 PolarHBondContact O-N 3.28Å; L176-M179 HydrophobicContact CD2-SD 4.37Å; L176-M179 PolarHBondContact O-N 2.85Å; L176-S180 PolarHBondContact O-N 3.12Å; L176-S180 PolarHBondContact O-OG 3.29Å
177	A	89.9	Confident	84.9	Confident	47 Å²	47	69.3 Å²	69.3	39%	0.388	36%	0.361	S	S	.	.	H	α-helix	trans	-63.2	-43	175.8	0	0	0	0	0	112.4	S173 Q174 R175 S180 Q181	S173-A177 WeakPolarHBondContact O-CB 3.44Å; S173-A177 PolarHBondContact O-N 3.4Å; Q174-A177 PolarHBondContact O-N 2.85Å; R175-A177 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 3.06Å; A177-S180 PolarHBondContact O-N 2.93Å; A177-Q181 WeakPolarHBondContact O-CG 3.22Å; A177-Q181 PolarHBondContact O-N 3.28Å; A177-Q181 VanDerWaalsContact O-N 3.08Å
178	L	86.1	Confident	83.6	Confident	117 Å²	117	70.4 Å²	70.4	61%	0.613	37%	0.365	S	S	*	.	H	α-helix	trans	-61.7	-43.9	175.3	-71.9	170.7	0	0	0	111.7	Q174 R175 S180 Q181 G182	Q174-L178 WeakPolarHBondContact O-CG 3.29Å; Q174-L178 PolarHBondContact O-N 3.37Å; R175-L178 PolarHBondContact O-N 3.12Å; L178-S180 PolarHBondContact O-N 3.04Å; L178-Q181 PolarHBondContact O-N 2.66Å; L178-G182 PolarHBondContact O-N 3.35Å
179	M	83.8	Confident	82.2	Confident	35 Å²	35	72.9 Å²	72.9	17%	0.172	38%	0.38	C	S	.	.	H	α-helix	trans	-59.8	-44.6	176.6	-68.1	168.1	71.5	0	0	111.7	P135 S136 R175 L176 Q181 G182 E183	P135-M179 HydrophobicContact CB-SD 4.26Å; P135-M179 HydrophobicContact CG-CE 4.28Å; P135-M179 HydrophobicContact CG-SD 3.82Å; S136-M179 WeakPolarHBondContact OG-CE 3.42Å; R175-M179 HydrophobicContact CG-SD 4.22Å; R175-M179 VanDerWaalsContact O-CG 3.27Å; R175-M179 WeakPolarHBondContact O-CG 3.49Å; R175-M179 PolarHBondContact O-N 2.74Å; L176-M179 HydrophobicContact CD2-SD 4.37Å; L176-M179 PolarHBondContact O-N 2.85Å; M179-Q181 PolarHBondContact O-N 3.26Å; M179-G182 PolarHBondContact O-N 2.84Å; M179-E183 WeakPolarHBondContact O-CG 3.31Å; M179-E183 PolarHBondContact O-N 3.35Å
180	S	83.3	Confident	80.6	Confident	51 Å²	51	73.3 Å²	73.3	36%	0.357	39%	0.386	S	S	.	.	H	α-helix	trans	-64.1	-37.1	177.4	-64.8	0	0	0	0	113.2	L176 A177 L178 E184	L176-S180 PolarHBondContact O-N 3.12Å; L176-S180 PolarHBondContact O-OG 3.29Å; A177-S180 PolarHBondContact O-N 2.93Å; L178-S180 PolarHBondContact O-N 3.04Å; S180-E184 PolarHBondContact O-N 3.2Å
181	Q	79.8	Confident	79.1	Confident	122 Å²	122	72.8 Å²	72.8	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-68	-37.4	175.3	-70.2	178.1	27.2	0	0	112.7	A177 L178 M179 E184 S185	A177-Q181 WeakPolarHBondContact O-CG 3.22Å; A177-Q181 PolarHBondContact O-N 3.28Å; A177-Q181 VanDerWaalsContact O-N 3.08Å; L178-Q181 PolarHBondContact O-N 2.66Å; M179-Q181 PolarHBondContact O-N 3.26Å; Q181-E184 PolarHBondContact O-N 2.78Å; Q181-S185 PolarHBondContact O-N 3.23Å; Q181-S185 VanDerWaalsContact O-N 3.16Å; Q181-S185 PolarHBondContact O-OG 3.17Å
182	G	72	Confident	77.4	Confident	12 Å²	12	71.2 Å²	71.2	12%	0.124	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-46.9	173.8	0	0	0	0	0	112	L178 M179 E184 S185 I186	L178-G182 PolarHBondContact O-N 3.35Å; M179-G182 PolarHBondContact O-N 2.84Å; G182-E184 VanDerWaalsContact C-N 3.33Å; G182-E184 PolarHBondContact O-N 3.44Å; G182-S185 PolarHBondContact O-N 2.94Å; G182-S185 VanDerWaalsContact O-N 3.12Å; G182-I186 WeakPolarHBondContact O-CG1 3.12Å; G182-I186 PolarHBondContact O-N 3.32Å
183	E	72.5	Confident	75.7	Confident	58 Å²	58	72 Å²	72	27%	0.271	39%	0.392	S	S	.	.	H	α-helix	trans	-54.7	-45.9	176.2	-73.1	171.8	-156.4	0	0	111.8	R139 M179 S185 V187	R139-E183 IonicContact CZ-OE1 2.67Å; R139-E183 IonicContact NH1-OE1 3.83Å; R139-E183 PolarHBondContact NH1-OE1 2.89Å; R139-E183 IonicContact NH1-OE2 3.65Å; R139-E183 IonicContact NH2-OE1 2.96Å; R139-E183 PolarHBondContact NH2-OE1 3.36Å; M179-E183 WeakPolarHBondContact O-CG 3.31Å; M179-E183 PolarHBondContact O-N 3.35Å; E183-S185 PolarHBondContact O-N 3.34Å; E183-V187 VanDerWaalsContact O-CG2 3.31Å; E183-V187 WeakPolarHBondContact O-CG2 3.41Å; E183-V187 PolarHBondContact O-N 3.23Å
184	E	72.6	Confident	74	Confident	114 Å²	114	71.6 Å²	71.6	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-38.8	177.4	-73	-172.9	-168.1	0	0	113.4	S180 Q181 G182 V187 K188	S180-E184 PolarHBondContact O-N 3.2Å; Q181-E184 PolarHBondContact O-N 2.78Å; G182-E184 VanDerWaalsContact C-N 3.33Å; G182-E184 PolarHBondContact O-N 3.44Å; E184-V187 PolarHBondContact O-N 3.45Å; E184-K188 WeakPolarHBondContact O-CG 3.21Å; E184-K188 PolarHBondContact O-N 3.2Å; E184-K188 IonicContact OE2-NZ 3.03Å
185	S	69.8	Low	72.2	Confident	66 Å²	66	67.9 Å²	67.9	46%	0.462	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-43.6	-178.6	-60	0	0	0	0	111	Q181 G182 E183 V187 K188 V189	Q181-S185 PolarHBondContact O-N 3.23Å; Q181-S185 VanDerWaalsContact O-N 3.16Å; Q181-S185 PolarHBondContact O-OG 3.17Å; G182-S185 PolarHBondContact O-N 2.94Å; G182-S185 VanDerWaalsContact O-N 3.12Å; E183-S185 PolarHBondContact O-N 3.34Å; S185-V187 VanDerWaalsContact C-N 3.33Å; S185-V187 PolarHBondContact O-N 2.87Å; S185-K188 PolarHBondContact O-N 2.97Å; S185-V189 WeakPolarHBondContact O-CG2 3.25Å; S185-V189 PolarHBondContact O-N 3.41Å
186	I	68.2	Low	70.5	Confident	33 Å²	33	65.6 Å²	65.6	17%	0.169	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-43.8	175	-67.6	166.4	0	0	0	111.1	G182 V189 S190 A274	G182-I186 WeakPolarHBondContact O-CG1 3.12Å; G182-I186 PolarHBondContact O-N 3.32Å; I186-V189 PolarHBondContact O-N 3.33Å; I186-S190 WeakPolarHBondContact O-CB 3.41Å; I186-S190 PolarHBondContact O-N 3.13Å; I186-A274 HydrophobicContact CD1-CB 4.46Å; I186-A274 HydrophobicContact CG2-CB 3.64Å
187	V	67.9	Low	68.6	Low	84 Å²	84	65.9 Å²	65.9	51%	0.509	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-45.2	178.7	173.4	0	0	0	0	111.1	E183 E184 S185 V189 S190 L191	E183-V187 VanDerWaalsContact O-CG2 3.31Å; E183-V187 WeakPolarHBondContact O-CG2 3.41Å; E183-V187 PolarHBondContact O-N 3.23Å; E184-V187 PolarHBondContact O-N 3.45Å; S185-V187 VanDerWaalsContact C-N 3.33Å; S185-V187 PolarHBondContact O-N 2.87Å; V187-V189 PolarHBondContact O-N 3.22Å; V187-S190 PolarHBondContact O-N 2.97Å; V187-L191 HydrophobicContact CG1-CD1 3.9Å; V187-L191 HydrophobicContact CG1-CG 4.39Å; V187-L191 VanDerWaalsContact O-CG 3.31Å; V187-L191 WeakPolarHBondContact O-CG 3.2Å; V187-L191 PolarHBondContact O-N 3.41Å
188	K	68.1	Low	66.7	Low	119 Å²	119	69.6 Å²	69.6	52%	0.517	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-44.4	178	-72.8	167.6	-173.5	160.8	0	111.9	E184 S185 L191 N192	E184-K188 WeakPolarHBondContact O-CG 3.21Å; E184-K188 PolarHBondContact O-N 3.2Å; E184-K188 IonicContact OE2-NZ 3.03Å; S185-K188 PolarHBondContact O-N 2.97Å; K188-L191 PolarHBondContact O-N 2.92Å; K188-N192 VanDerWaalsContact O-CG 3.24Å; K188-N192 PolarHBondContact O-N 3.29Å; K188-N192 PolarHBondContact O-ND2 3.22Å
189	V	65.8	Low	64.9	Low	61 Å²	61	70.1 Å²	70.1	37%	0.37	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-42.7	177.3	174.5	0	0	0	0	111.3	S185 I186 V187 L191 N192 A193	S185-V189 WeakPolarHBondContact O-CG2 3.25Å; S185-V189 PolarHBondContact O-N 3.41Å; I186-V189 PolarHBondContact O-N 3.33Å; V187-V189 PolarHBondContact O-N 3.22Å; V189-L191 PolarHBondContact O-N 2.68Å; V189-N192 PolarHBondContact O-N 2.94Å; V189-A193 WeakPolarHBondContact O-CB 3.38Å; V189-A193 PolarHBondContact O-N 3.06Å
190	S	61.4	Low	63.3	Low	43 Å²	43	70.2 Å²	70.2	30%	0.301	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-40.6	179.4	-160.7	0	0	0	0	112.9	I186 V187 A193 S194	I186-S190 WeakPolarHBondContact O-CB 3.41Å; I186-S190 PolarHBondContact O-N 3.13Å; V187-S190 PolarHBondContact O-N 2.97Å; S190-A193 PolarHBondContact O-N 3.43Å; S190-S194 PolarHBondContact O-N 3.43Å; S190-S194 VanDerWaalsContact O-N 3.13Å; S190-S194 PolarHBondContact O-OG 2.89Å
191	L	62.3	Low	61.6	Low	107 Å²	107	70.8 Å²	70.8	56%	0.56	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-39.1	174.7	-69.6	170.6	0	0	0	111.9	V187 K188 V189 S194 S195	V187-L191 HydrophobicContact CG1-CD1 3.9Å; V187-L191 HydrophobicContact CG1-CG 4.39Å; V187-L191 VanDerWaalsContact O-CG 3.31Å; V187-L191 WeakPolarHBondContact O-CG 3.2Å; V187-L191 PolarHBondContact O-N 3.41Å; K188-L191 PolarHBondContact O-N 2.92Å; V189-L191 PolarHBondContact O-N 2.68Å; L191-S194 WeakPolarHBondContact CA-OG 3.47Å; L191-S194 PolarHBondContact O-OG 2.91Å; L191-S195 PolarHBondContact O-N 3.48Å
192	N	60.6	Low	59.8	Low	97 Å²	97	68.4 Å²	68.4	52%	0.519	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-45.2	176.1	-71.2	-17.2	0	0	0	111.4	K188 V189 S194 S195 I196	K188-N192 VanDerWaalsContact O-CG 3.24Å; K188-N192 PolarHBondContact O-N 3.29Å; K188-N192 PolarHBondContact O-ND2 3.22Å; V189-N192 PolarHBondContact O-N 2.94Å; N192-S194 PolarHBondContact O-N 3.39Å; N192-S195 PolarHBondContact O-N 2.81Å; N192-S195 PolarHBondContact O-OG 2.9Å; N192-I196 WeakPolarHBondContact O-CD1 3.46Å; N192-I196 VanDerWaalsContact O-CG1 3.26Å; N192-I196 WeakPolarHBondContact O-CG1 3.35Å; N192-I196 PolarHBondContact O-N 3.47Å; N192-I196 VanDerWaalsContact O-N 3.1Å
193	A	58.2	Low	58.5	Low	26 Å²	26	72.7 Å²	72.7	22%	0.215	41%	0.405	C	S	.	.	H	α-helix	trans	-61.4	-41.5	-179.9	0	0	0	0	0	113	V189 S190 I196 S197	V189-A193 WeakPolarHBondContact O-CB 3.38Å; V189-A193 PolarHBondContact O-N 3.06Å; S190-A193 PolarHBondContact O-N 3.43Å; A193-I196 PolarHBondContact O-N 3.12Å; A193-S197 PolarHBondContact O-N 3.31Å; A193-S197 VanDerWaalsContact O-N 3.12Å
194	S	57.1	Low	57.3	Low	61 Å²	61	75.3 Å²	75.3	43%	0.427	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-43.7	175.3	43.1	0	0	0	0	112	S190 L191 N192 I196 S197 D198	S190-S194 PolarHBondContact O-N 3.43Å; S190-S194 VanDerWaalsContact O-N 3.13Å; S190-S194 PolarHBondContact O-OG 2.89Å; L191-S194 WeakPolarHBondContact CA-OG 3.47Å; L191-S194 PolarHBondContact O-OG 2.91Å; N192-S194 PolarHBondContact O-N 3.39Å; S194-I196 VanDerWaalsContact C-N 3.26Å; S194-I196 PolarHBondContact O-N 2.69Å; S194-S197 PolarHBondContact O-N 2.89Å; S194-D198 PolarHBondContact O-N 3.22Å
195	S	55.9	Low	55.8	Low	48 Å²	48	76.3 Å²	76.3	34%	0.336	43%	0.43	S	S	.	.	H	α-helix	trans	-63.5	-28.1	176.8	80.1	0	0	0	0	114.3	L191 N192 K199	L191-S195 PolarHBondContact O-N 3.48Å; N192-S195 PolarHBondContact O-N 2.81Å; N192-S195 PolarHBondContact O-OG 2.9Å; S195-K199 WeakPolarHBondContact O-CG 3.48Å
196	I	55.1	Low	54.1	Low	49 Å²	49	81.4 Å²	81.4	25%	0.251	44%	0.444	S	S	.	.	H	α-helix	trans	-80.6	-39.2	179.7	-67.7	165.6	0	0	0	110.8	N192 A193 S194 D198 K199 L200 P453	N192-I196 WeakPolarHBondContact O-CD1 3.46Å; N192-I196 VanDerWaalsContact O-CG1 3.26Å; N192-I196 WeakPolarHBondContact O-CG1 3.35Å; N192-I196 PolarHBondContact O-N 3.47Å; N192-I196 VanDerWaalsContact O-N 3.1Å; A193-I196 PolarHBondContact O-N 3.12Å; S194-I196 VanDerWaalsContact C-N 3.26Å; S194-I196 PolarHBondContact O-N 2.69Å; I196-D198 VanDerWaalsContact C-N 3.32Å; I196-D198 PolarHBondContact O-N 3.49Å; I196-K199 PolarHBondContact O-N 3.32Å; I196-L200 PolarHBondContact O-N 3.3Å; I196-P453 HydrophobicContact CG2-CB 3.51Å
197	S	51.1	Low	52.7	Low	33 Å²	33	85.3 Å²	85.3	23%	0.231	47%	0.471	C	S	.	.	H	α-helix	trans	-57.1	-44.5	175.5	-174.1	0	0	0	0	111.8	A193 S194 K199 L200	A193-S197 PolarHBondContact O-N 3.31Å; A193-S197 VanDerWaalsContact O-N 3.12Å; S194-S197 PolarHBondContact O-N 2.89Å; S197-K199 VanDerWaalsContact C-N 3.34Å; S197-K199 PolarHBondContact O-N 3.28Å; S197-L200 PolarHBondContact O-N 2.94Å
198	D	48.9	Very low	51.2	Low	125 Å²	125	84.2 Å²	84.2	67%	0.668	47%	0.466	S	S	*	.	H	α-helix	trans	-65.3	-35.7	179	-73.5	-22.2	0	0	0	112.9	S194 I196 L200	S194-D198 PolarHBondContact O-N 3.22Å; I196-D198 VanDerWaalsContact C-N 3.32Å; I196-D198 PolarHBondContact O-N 3.49Å; D198-L200 VanDerWaalsContact C-N 3.34Å; D198-L200 PolarHBondContact O-N 3.27Å
199	K	48.3	Very low	49.9	Very low	129 Å²	129	84.2 Å²	84.2	56%	0.561	48%	0.478	S	S	*	.	H	α-helix	trans	-68.4	-33.7	178.8	-74.7	175.1	-178	176.1	0	112.1	S195 I196 S197 V201 A202 F203	S195-K199 WeakPolarHBondContact O-CG 3.48Å; I196-K199 PolarHBondContact O-N 3.32Å; S197-K199 VanDerWaalsContact C-N 3.34Å; S197-K199 PolarHBondContact O-N 3.28Å; K199-V201 VanDerWaalsContact C-N 3.32Å; K199-V201 PolarHBondContact O-N 3.29Å; K199-A202 WeakPolarHBondContact O-CB 3.42Å; K199-A202 PolarHBondContact O-N 3.48Å; K199-A202 VanDerWaalsContact O-N 3.09Å; K199-F203 HydrophobicContact CB-CD2 4.46Å; K199-F203 HydrophobicContact CB-CE2 4.12Å; K199-F203 WeakPolarHBondContact O-CD2 3.47Å
200	L	50.3	Low	49	Very low	36 Å²	36	88.9 Å²	88.9	19%	0.188	50%	0.499	C	S	.	.	H	α-helix	trans	-71.9	-25.4	-174.7	-159.9	57	0	0	0	113.6	I196 S197 D198 A202 F203 P453 I454 F455	I196-L200 PolarHBondContact O-N 3.3Å; S197-L200 PolarHBondContact O-N 2.94Å; D198-L200 VanDerWaalsContact C-N 3.34Å; D198-L200 PolarHBondContact O-N 3.27Å; L200-A202 PolarHBondContact O-N 2.97Å; L200-F203 HydrophobicContact CD1-CB 4.47Å; L200-F203 PolarHBondContact O-N 3.42Å; L200-P453 HydrophobicContact CD2-CB 3.83Å; L200-I454 WeakPolarHBondContact CD2-O 3.3Å; L200-F455 HydrophobicContact CD1-CE1 4.28Å; L200-F455 HydrophobicContact CD2-CD1 3.35Å; L200-F455 HydrophobicContact CD2-CE1 3.78Å; L200-F455 HydrophobicContact CG-CD1 3.93Å; L200-F455 HydrophobicContact CG-CE1 4.06Å
201	V	47.4	Very low	48.8	Very low	64 Å²	64	91 Å²	91	39%	0.388	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.2	170.4	-179.7	0	0	0	0	111.6	K199	K199-V201 VanDerWaalsContact C-N 3.32Å; K199-V201 PolarHBondContact O-N 3.29Å
202	A	42.7	Very low	49.2	Very low	71 Å²	71	92.4 Å²	92.4	59%	0.587	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-15.5	178.3	0	0	0	0	0	114.3	K199 L200 K204	K199-A202 WeakPolarHBondContact O-CB 3.42Å; K199-A202 PolarHBondContact O-N 3.48Å; K199-A202 VanDerWaalsContact O-N 3.09Å; L200-A202 PolarHBondContact O-N 2.97Å; A202-K204 PolarHBondContact O-N 3.37Å
203	F	43.9	Very low	50.2	Low	102 Å²	102	91.1 Å²	91.1	45%	0.447	50%	0.499	S	S	.	.			trans	-90.8	67.8	-172.1	-83.8	-72	0	0	0	113.5	K199 L200 P208	K199-F203 HydrophobicContact CB-CD2 4.46Å; K199-F203 HydrophobicContact CB-CE2 4.12Å; K199-F203 WeakPolarHBondContact O-CD2 3.47Å; L200-F203 HydrophobicContact CD1-CB 4.47Å; L200-F203 PolarHBondContact O-N 3.42Å; F203-P208 HydrophobicContact CD1-CG 4.32Å; F203-P208 HydrophobicContact CE1-CG 4.47Å
204	K	48.3	Very low	51.7	Low	114 Å²	114	90 Å²	90	50%	0.496	49%	0.49	S	S	.	.			trans	-142.1	32.2	165.6	-77	-158.7	-177.4	-176.4	0	116.3	A202 E466	A202-K204 PolarHBondContact O-N 3.37Å; K204-E466 IonicContact NZ-OE1 3.75Å; K204-E466 PolarHBondContact NZ-OE1 3.48Å; K204-E466 IonicContact NZ-OE2 3.57Å; K204-E466 PolarHBondContact NZ-OE2 2.88Å
205	T	40.6	Very low	53.4	Low	135 Å²	135	89.3 Å²	89.3	83%	0.828	48%	0.481	S	S	*	.	S	Bend	trans	-98.1	-12.1	159.6	48.7	0	0	0	0	113.9
206	K	34.2	Very low	55.1	Low	173 Å²	173	90.3 Å²	90.3	75%	0.752	49%	0.487	S	S	*	.	S	Bend	trans	-168.5	140.5	163.8	-102.5	160.1	-172.7	-178.3	0	109.2
207	P	38.7	Very low	56.8	Low	115 Å²	115	90.1 Å²	90.1	75%	0.747	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-64.8	129.4	172	25.7	-29.8	0	0	0	108.9
208	P	37.4	Very low	58.9	Low	61 Å²	61	89 Å²	89	40%	0.396	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-59.9	141.2	176	22.3	-29.5	0	0	0	109.9	F203 I210	F203-P208 HydrophobicContact CD1-CG 4.32Å; F203-P208 HydrophobicContact CE1-CG 4.47Å; P208-I210 PolarHBondContact O-N 2.93Å
209	P	39.9	Very low	61.1	Low	118 Å²	118	89.2 Å²	89.2	77%	0.766	48%	0.48	S	S	*	.	S	Bend	trans	-72.2	123.6	179.7	29.7	-30.2	0	0	0	108.1
210	I	46.8	Very low	63.4	Low	160 Å²	160	85.7 Å²	85.7	82%	0.821	47%	0.467	S	S	*	.			trans	81.1	69.9	175.9	-41.7	156.9	0	0	0	113.5	P208	P208-I210 PolarHBondContact O-N 2.93Å
211	Q	57.7	Low	65.7	Low	88 Å²	88	85 Å²	85	41%	0.411	46%	0.464	S	S	.	.			trans	-103.7	112.4	148	-169.5	141.5	75.8	0	0	106.6	D213 P453	Q211-D213 PolarHBondContact O-N 3.21Å; Q211-P453 VanDerWaalsContact CD-CG 3.48Å
212	K	69.4	Low	68.1	Low	135 Å²	135	86.6 Å²	86.6	59%	0.587	46%	0.464	S	S	*	.			trans	-67.3	124.3	170.8	-75.6	-172.7	-179.5	-176.9	0	107.3	S216 I217 Y448	K212-S216 WeakPolarHBondContact CA-OG 3.38Å; K212-S216 VanDerWaalsContact CB-OG 3.3Å; K212-S216 WeakPolarHBondContact CB-OG 3.35Å; K212-I217 HydrophobicContact CB-CD1 3.93Å; K212-I217 HydrophobicContact CB-CG1 3.9Å; K212-I217 HydrophobicContact CD-CG1 4.27Å; K212-Y448 WeakPolarHBondContact O-CE2 3.29Å; K212-Y448 PolarHBondContact O-OH 2.94Å
213	D	82.4	Confident	70.8	Confident	71 Å²	71	85.2 Å²	85.2	38%	0.38	45%	0.449	S	S	.	.			trans	-76.2	164.5	172.8	59.5	41	0	0	0	110.7	Q211 L215 S216 I217	Q211-D213 PolarHBondContact O-N 3.21Å; D213-L215 VanDerWaalsContact C-N 3.26Å; D213-L215 PolarHBondContact O-N 3.35Å; D213-L215 PolarHBondContact OD1-N 3.29Å; D213-S216 PolarHBondContact N-OG 2.82Å; D213-S216 VanDerWaalsContact N-OG 3.15Å; D213-S216 PolarHBondContact O-N 2.77Å; D213-S216 VanDerWaalsContact O-N 3.07Å; D213-S216 PolarHBondContact O-OG 3.05Å; D213-S216 VanDerWaalsContact OD1-CB 3.26Å; D213-S216 WeakPolarHBondContact OD1-CB 3.47Å; D213-S216 PolarHBondContact OD1-N 3.23Å; D213-S216 PolarHBondContact OD1-OG 3.25Å; D213-I217 PolarHBondContact O-N 3.39Å
214	M	89.9	Confident	73.4	Confident	3 Å²	3	80.4 Å²	80.4	2%	0.015	43%	0.427	C	S	.	.	H	α-helix	trans	-54.1	-44.4	-178.3	179.5	64.3	80	0	0	111.7	S216 I217 C218 L224 L285 E289 F305 F306 Y448 L449	M214-S216 PolarHBondContact O-N 3.45Å; M214-I217 PolarHBondContact O-N 2.83Å; M214-C218 CarbonylContact O-C 3.54Å; M214-C218 PolarHBondContact O-N 3.42Å; M214-C218 VanDerWaalsContact O-O 3.08Å; M214-L224 HydrophobicContact CE-CD1 4.12Å; M214-L224 HydrophobicContact CE-CD2 4.16Å; M214-L224 HydrophobicContact CG-CD2 4.13Å; M214-L224 HydrophobicContact SD-CD1 3.98Å; M214-L224 HydrophobicContact SD-CD2 3.97Å; M214-L285 HydrophobicContact CE-CD2 4.24Å; M214-E289 HydrophobicContact CB-CG 4.14Å; M214-E289 WeakPolarHBondContact CB-OE2 3.39Å; M214-E289 PolarHBondContact N-OE2 2.78Å; M214-F305 HydrophobicContact CG-CE1 4.02Å; M214-F306 HydrophobicContact CG-CZ 4.48Å; M214-Y448 HydrophobicContact CB-CE1 4.04Å; M214-Y448 HydrophobicContact CE-CD1 3.58Å; M214-Y448 HydrophobicContact CE-CE1 3.67Å; M214-Y448 HydrophobicContact SD-CD1 3.89Å; M214-Y448 HydrophobicContact SD-CE1 4.06Å; M214-L449 HydrophobicContact CE-CD2 3.87Å
215	L	92.2	Very high	75.8	Confident	46 Å²	46	75 Å²	75	24%	0.241	40%	0.404	C	S	.	.	H	α-helix	trans	-66.1	-24.2	-177.6	-69.6	179.3	0	0	0	113.5	D213 I217 C218 T301 V302 F305	D213-L215 VanDerWaalsContact C-N 3.26Å; D213-L215 PolarHBondContact O-N 3.35Å; D213-L215 PolarHBondContact OD1-N 3.29Å; L215-I217 VanDerWaalsContact C-N 3.34Å; L215-C218 WeakPolarHBondContact CA-O 3.49Å; L215-T301 HydrophobicContact CD1-CG2 4.14Å; L215-V302 HydrophobicContact CD1-CG2 3.7Å; L215-V302 HydrophobicContact CG-CG2 4.45Å; L215-F305 HydrophobicContact CD2-CB 3.96Å; L215-F305 HydrophobicContact CD2-CD1 3.76Å; L215-F305 HydrophobicContact CD2-CD2 3.64Å; L215-F305 HydrophobicContact CD2-CE1 4.09Å; L215-F305 HydrophobicContact CD2-CE2 3.99Å; L215-F305 HydrophobicContact CD2-CG 3.51Å; L215-F305 HydrophobicContact CD2-CZ 4.2Å
216	S	91.3	Very high	78.6	Confident	68 Å²	68	70.7 Å²	70.7	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-78.2	-19.6	173.5	74.4	0	0	0	0	113.5	K212 D213 M214	K212-S216 WeakPolarHBondContact CA-OG 3.38Å; K212-S216 VanDerWaalsContact CB-OG 3.3Å; K212-S216 WeakPolarHBondContact CB-OG 3.35Å; D213-S216 PolarHBondContact N-OG 2.82Å; D213-S216 VanDerWaalsContact N-OG 3.15Å; D213-S216 PolarHBondContact O-N 2.77Å; D213-S216 VanDerWaalsContact O-N 3.07Å; D213-S216 PolarHBondContact O-OG 3.05Å; D213-S216 VanDerWaalsContact OD1-CB 3.26Å; D213-S216 WeakPolarHBondContact OD1-CB 3.47Å; D213-S216 PolarHBondContact OD1-N 3.23Å; D213-S216 PolarHBondContact OD1-OG 3.25Å; M214-S216 PolarHBondContact O-N 3.45Å
217	I	92.1	Very high	81.6	Confident	46 Å²	46	62.5 Å²	62.5	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-97.4	-45.6	179.1	-60.1	171.5	0	0	0	110	K212 D213 M214 L215 I445 Y448	K212-I217 HydrophobicContact CB-CD1 3.93Å; K212-I217 HydrophobicContact CB-CG1 3.9Å; K212-I217 HydrophobicContact CD-CG1 4.27Å; D213-I217 PolarHBondContact O-N 3.39Å; M214-I217 PolarHBondContact O-N 2.83Å; L215-I217 VanDerWaalsContact C-N 3.34Å; I217-I445 HydrophobicContact CG2-CG1 4.13Å; I217-Y448 HydrophobicContact CD1-CD1 4.07Å; I217-Y448 HydrophobicContact CD1-CD2 3.04Å; I217-Y448 HydrophobicContact CD1-CE1 4.43Å; I217-Y448 HydrophobicContact CD1-CE2 3.47Å; I217-Y448 VanDerWaalsContact CD1-CE2 3.47Å; I217-Y448 HydrophobicContact CD1-CG 3.36Å
218	C	94.8	Very high	84.5	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.054	30%	0.304	C	S	.	.			trans	-140.5	113	177.9	-176	0	0	0	0	110	M214 L215 D220 F305 I445	M214-C218 CarbonylContact O-C 3.54Å; M214-C218 PolarHBondContact O-N 3.42Å; M214-C218 VanDerWaalsContact O-O 3.08Å; L215-C218 WeakPolarHBondContact CA-O 3.49Å; C218-D220 PolarHBondContact SG-O 3.25Å; C218-F305 WeakPolarHBondContact O-CZ 3.22Å; C218-I445 HydrophobicContact CB-CD1 3.61Å; C218-I445 HydrophobicContact CB-CG1 3.91Å
219	N	94.4	Very high	87.4	Confident	130 Å²	130	54.2 Å²	54.2	70%	0.695	29%	0.285	S	S	*	.			trans	-102.3	0.2	175.3	63.1	4.8	0	0	0	112.9
220	D	98	Very high	90.1	Very high	55 Å²	55	49.5 Å²	49.5	29%	0.294	25%	0.253	S	S	.	.			trans	-102.4	113	177.6	176.6	42.1	0	0	0	111.1	C218 Y222 T223 L224	C218-D220 PolarHBondContact SG-O 3.25Å; D220-Y222 PolarHBondContact O-N 3.2Å; D220-Y222 WeakPolarHBondContact OD1-CD2 3.04Å; D220-Y222 PolarHBondContact OD1-N 2.93Å; D220-T223 PolarHBondContact O-N 2.94Å; D220-T223 VanDerWaalsContact OD2-CB 3.31Å; D220-T223 WeakPolarHBondContact OD2-CB 3.45Å; D220-T223 PolarHBondContact OD2-N 3.42Å; D220-T223 PolarHBondContact OD2-OG1 3.35Å; D220-L224 PolarHBondContact O-N 2.89Å; D220-L224 VanDerWaalsContact O-N 3.15Å
221	P	98.2	Very high	92.5	Very high	21 Å²	21	41.9 Å²	41.9	14%	0.136	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-27.4	-177	25	-34.4	0	0	0	113	A225 F305 D308 V309	P221-A225 WeakPolarHBondContact O-CB 3.35Å; P221-A225 PolarHBondContact O-N 3.13Å; P221-F305 HydrophobicContact CB-CD2 4.16Å; P221-F305 HydrophobicContact CB-CE2 4.04Å; P221-D308 HydrophobicContact CB-CB 3.81Å; P221-D308 HydrophobicContact CG-CB 3.89Å; P221-V309 HydrophobicContact CB-CB 4.49Å; P221-V309 HydrophobicContact CB-CG2 3.64Å
222	Y	98.2	Very high	94.4	Very high	98 Å²	98	37.7 Å²	37.7	38%	0.384	19%	0.194	S	C	.	.	H	α-helix	trans	-68.6	-49	178.1	-65.3	-92.4	0	0	0	111	D220 L224 A225 Q226 R311 E312	D220-Y222 PolarHBondContact O-N 3.2Å; D220-Y222 WeakPolarHBondContact OD1-CD2 3.04Å; D220-Y222 PolarHBondContact OD1-N 2.93Å; Y222-L224 VanDerWaalsContact C-N 3.33Å; Y222-L224 PolarHBondContact O-N 2.74Å; Y222-A225 PolarHBondContact O-N 3.47Å; Y222-Q226 VanDerWaalsContact O-CG 3.29Å; Y222-Q226 WeakPolarHBondContact O-CG 3.47Å; Y222-Q226 PolarHBondContact O-N 3.5Å; Y222-R311 PolarHBondContact OH-NH2 3.29Å; Y222-E312 HydrophobicContact CD1-CB 4.34Å; Y222-E312 VanDerWaalsContact CD1-CD 3.42Å; Y222-E312 HydrophobicContact CD1-CG 3.71Å; Y222-E312 WeakPolarHBondContact CD1-OE2 3.43Å; Y222-E312 HydrophobicContact CE1-CG 4.29Å; Y222-E312 VanDerWaalsContact CE1-OE2 3.28Å; Y222-E312 WeakPolarHBondContact CE1-OE2 3.36Å; Y222-E312 HydrophobicContact CG-CG 4.44Å
223	T	98.4	Very high	95.6	Very high	42 Å²	42	31.8 Å²	31.8	26%	0.258	17%	0.169	S	C	.	.	H	α-helix	trans	-57.6	-45.7	175.3	-59.4	0	0	0	0	110.9	D220 A225 Q226 Q227 I445	D220-T223 PolarHBondContact O-N 2.94Å; D220-T223 VanDerWaalsContact OD2-CB 3.31Å; D220-T223 WeakPolarHBondContact OD2-CB 3.45Å; D220-T223 PolarHBondContact OD2-N 3.42Å; D220-T223 PolarHBondContact OD2-OG1 3.35Å; T223-A225 PolarHBondContact O-N 3.31Å; T223-Q226 WeakPolarHBondContact O-CB 3.48Å; T223-Q226 PolarHBondContact O-N 3.1Å; T223-Q227 WeakPolarHBondContact O-CG 3.4Å; T223-Q227 PolarHBondContact O-N 3.42Å; T223-I445 HydrophobicContact CG2-CD1 3.64Å
224	L	98.6	Very high	96.1	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-41.9	178.5	-175.9	59.1	0	0	0	112.5	M214 D220 Y222 Q226 Q227 L228 F305 F306 V309 I445 L449	M214-L224 HydrophobicContact CE-CD1 4.12Å; M214-L224 HydrophobicContact CE-CD2 4.16Å; M214-L224 HydrophobicContact CG-CD2 4.13Å; M214-L224 HydrophobicContact SD-CD1 3.98Å; M214-L224 HydrophobicContact SD-CD2 3.97Å; D220-L224 PolarHBondContact O-N 2.89Å; D220-L224 VanDerWaalsContact O-N 3.15Å; Y222-L224 VanDerWaalsContact C-N 3.33Å; Y222-L224 PolarHBondContact O-N 2.74Å; L224-Q226 VanDerWaalsContact C-N 3.29Å; L224-Q226 PolarHBondContact O-N 3.43Å; L224-Q227 PolarHBondContact O-N 3.34Å; L224-L228 HydrophobicContact CG-CD1 4.41Å; L224-L228 WeakPolarHBondContact O-CG 3.26Å; L224-L228 PolarHBondContact O-N 3.44Å; L224-F305 HydrophobicContact CB-CZ 4.19Å; L224-F305 HydrophobicContact CD2-CE1 3.44Å; L224-F305 VanDerWaalsContact CD2-CE1 3.44Å; L224-F305 HydrophobicContact CD2-CZ 3.66Å; L224-F306 HydrophobicContact CD2-CE1 4.12Å; L224-V309 HydrophobicContact CB-CG1 4.48Å; L224-V309 HydrophobicContact CB-CG2 4.22Å; L224-V309 HydrophobicContact CD2-CG1 4.29Å; L224-V309 HydrophobicContact CD2-CG2 3.91Å; L224-V309 HydrophobicContact CG-CG1 4.23Å; L224-V309 HydrophobicContact CG-CG2 4.38Å; L224-I445 HydrophobicContact CD1-CG2 3.73Å; L224-L449 HydrophobicContact CD1-CD1 4.27Å; L224-L449 HydrophobicContact CD1-CD2 4.13Å; L224-L449 HydrophobicContact CD1-CG 4.46Å
225	A	98.8	Very high	96.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-38.5	176.3	0	0	0	0	0	112.2	P221 Y222 T223 L228 T229 V309 E312 I316	P221-A225 WeakPolarHBondContact O-CB 3.35Å; P221-A225 PolarHBondContact O-N 3.13Å; Y222-A225 PolarHBondContact O-N 3.47Å; T223-A225 PolarHBondContact O-N 3.31Å; A225-L228 PolarHBondContact O-N 3.39Å; A225-T229 PolarHBondContact O-N 2.95Å; A225-T229 PolarHBondContact O-OG1 2.91Å; A225-V309 HydrophobicContact CB-CG1 4.21Å; A225-E312 HydrophobicContact CB-CB 3.72Å; A225-E312 HydrophobicContact CB-CG 3.72Å; A225-I316 HydrophobicContact CB-CD1 4.12Å
226	Q	98.6	Very high	96.3	Very high	45 Å²	45	32.3 Å²	32.3	21%	0.21	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-42.9	174.7	-67.7	171.1	6.1	0	0	112.2	Y222 T223 L224 T229 H230 I316 F439	Y222-Q226 VanDerWaalsContact O-CG 3.29Å; Y222-Q226 WeakPolarHBondContact O-CG 3.47Å; Y222-Q226 PolarHBondContact O-N 3.5Å; T223-Q226 WeakPolarHBondContact O-CB 3.48Å; T223-Q226 PolarHBondContact O-N 3.1Å; L224-Q226 VanDerWaalsContact C-N 3.29Å; L224-Q226 PolarHBondContact O-N 3.43Å; Q226-T229 WeakPolarHBondContact O-CB 3.39Å; Q226-T229 PolarHBondContact O-N 3.47Å; Q226-H230 PolarHBondContact O-CD2 3.42Å; Q226-H230 PolarHBondContact O-N 3.01Å; Q226-I316 HydrophobicContact CG-CD1 4.34Å; Q226-F439 HydrophobicContact CB-CB 3.78Å; Q226-F439 HydrophobicContact CB-CD1 4.25Å; Q226-F439 HydrophobicContact CB-CD2 3.75Å; Q226-F439 HydrophobicContact CB-CE2 4.4Å; Q226-F439 HydrophobicContact CB-CG 3.66Å; Q226-F439 HydrophobicContact CG-CB 4.06Å; Q226-F439 HydrophobicContact CG-CD1 3.59Å; Q226-F439 HydrophobicContact CG-CD2 3.78Å; Q226-F439 HydrophobicContact CG-CE1 3.91Å; Q226-F439 HydrophobicContact CG-CE2 4.09Å; Q226-F439 HydrophobicContact CG-CG 3.53Å; Q226-F439 HydrophobicContact CG-CZ 4.15Å
227	Q	98.4	Very high	96.2	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.009	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-36.3	176.5	-58.8	-43.3	-59.6	0	0	112.1	T223 L224 T229 H230 V231 E440 D442 I445 L446 L449	T223-Q227 WeakPolarHBondContact O-CG 3.4Å; T223-Q227 PolarHBondContact O-N 3.42Å; L224-Q227 PolarHBondContact O-N 3.34Å; Q227-T229 VanDerWaalsContact C-N 3.32Å; Q227-H230 WeakPolarHBondContact O-CB 3.29Å; Q227-H230 PolarHBondContact O-N 3.09Å; Q227-V231 WeakPolarHBondContact O-CG2 3.48Å; Q227-V231 PolarHBondContact O-N 3.4Å; Q227-V231 VanDerWaalsContact O-N 3.15Å; Q227-E440 PolarHBondContact NE2-O 2.85Å; Q227-D442 HydrophobicContact CG-CB 4.29Å; Q227-I445 HydrophobicContact CB-CB 4.47Å; Q227-I445 HydrophobicContact CB-CG2 3.79Å; Q227-I445 HydrophobicContact CG-CB 3.96Å; Q227-I445 HydrophobicContact CG-CD1 4.04Å; Q227-I445 HydrophobicContact CG-CG2 3.72Å; Q227-L446 HydrophobicContact CB-CD2 4.18Å; Q227-L449 HydrophobicContact CB-CD1 4.18Å
228	L	98.7	Very high	96.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-44.2	170.6	-70.5	173.6	0	0	0	110.7	L224 A225 H230 V231 E232 W278 L282 V309 I325 L449	L224-L228 HydrophobicContact CG-CD1 4.41Å; L224-L228 WeakPolarHBondContact O-CG 3.26Å; L224-L228 PolarHBondContact O-N 3.44Å; A225-L228 PolarHBondContact O-N 3.39Å; L228-H230 VanDerWaalsContact C-N 3.31Å; L228-H230 PolarHBondContact O-N 3.17Å; L228-V231 PolarHBondContact O-N 2.86Å; L228-V231 VanDerWaalsContact O-N 3.15Å; L228-E232 WeakPolarHBondContact O-CG 3.23Å; L228-E232 PolarHBondContact O-N 3.44Å; L228-W278 HydrophobicContact CD2-CH2 4.15Å; L228-W278 HydrophobicContact CD2-CZ2 3.83Å; L228-L282 HydrophobicContact CD1-CD2 4.5Å; L228-L282 HydrophobicContact CD2-CD1 3.76Å; L228-L282 HydrophobicContact CD2-CD2 3.96Å; L228-V309 HydrophobicContact CD1-CG1 3.83Å; L228-I325 HydrophobicContact CD1-CD1 4.03Å; L228-L449 HydrophobicContact CD2-CD1 3.98Å; L228-L449 HydrophobicContact CD2-CD2 3.76Å
229	T	98.5	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.2	-37.2	175.7	-67.4	0	0	0	0	113.1	A225 Q226 Q227 E232 L233 I316 N318 I386 I388 F439	A225-T229 PolarHBondContact O-N 2.95Å; A225-T229 PolarHBondContact O-OG1 2.91Å; Q226-T229 WeakPolarHBondContact O-CB 3.39Å; Q226-T229 PolarHBondContact O-N 3.47Å; Q227-T229 VanDerWaalsContact C-N 3.32Å; T229-E232 PolarHBondContact O-N 2.9Å; T229-L233 HydrophobicContact CG2-CD1 3.92Å; T229-L233 HydrophobicContact CG2-CG 4.35Å; T229-L233 WeakPolarHBondContact O-CB 3.36Å; T229-L233 WeakPolarHBondContact O-CG 3.46Å; T229-L233 PolarHBondContact O-N 3.17Å; T229-I316 HydrophobicContact CG2-CG2 4.13Å; T229-N318 PolarHBondContact OG1-ND2 3.23Å; T229-I386 HydrophobicContact CG2-CD1 4.1Å; T229-I386 HydrophobicContact CG2-CG2 4.06Å; T229-I388 HydrophobicContact CG2-CD1 4.03Å; T229-F439 HydrophobicContact CG2-CD2 4.31Å; T229-F439 HydrophobicContact CG2-CE2 3.97Å
230	H	97.3	Very high	95.7	Very high	20 Å²	20	25.6 Å²	25.6	9%	0.093	13%	0.132	C	C	.	.	H	α-helix	trans	-56.6	-53.1	170.3	-86.5	-66.4	0	0	0	111.8	Q226 Q227 L228 E232 L233 E234 C437 F439 L446	Q226-H230 PolarHBondContact O-CD2 3.42Å; Q226-H230 PolarHBondContact O-N 3.01Å; Q227-H230 WeakPolarHBondContact O-CB 3.29Å; Q227-H230 PolarHBondContact O-N 3.09Å; L228-H230 VanDerWaalsContact C-N 3.31Å; L228-H230 PolarHBondContact O-N 3.17Å; H230-E232 VanDerWaalsContact C-N 3.3Å; H230-E232 PolarHBondContact O-N 2.99Å; H230-L233 PolarHBondContact O-N 3Å; H230-E234 WeakPolarHBondContact O-CB 3.36Å; H230-E234 PolarHBondContact O-N 3.11Å; H230-C437 VanDerWaalsContact CE1-CB 3.41Å; H230-C437 WeakPolarHBondContact CE1-CB 3.45Å; H230-C437 PolarHBondContact CE1-SG 3.4Å; H230-C437 VanDerWaalsContact CG-SG 3.51Å; H230-C437 WeakPolarHBondContact ND1-CB 3.48Å; H230-C437 PolarHBondContact ND1-SG 3.27Å; H230-F439 PolarHBondContact CE1-O 3.29Å; H230-F439 PolarHBondContact NE2-O 2.87Å; H230-L446 HydrophobicContact CB-CD2 4.27Å
231	V	96.4	Very high	95.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-41	-179	-179.4	0	0	0	0	111.4	Q227 L228 H235 W278 L446 L449	Q227-V231 WeakPolarHBondContact O-CG2 3.48Å; Q227-V231 PolarHBondContact O-N 3.4Å; Q227-V231 VanDerWaalsContact O-N 3.15Å; L228-V231 PolarHBondContact O-N 2.86Å; L228-V231 VanDerWaalsContact O-N 3.15Å; V231-H235 PolarHBondContact O-N 2.88Å; V231-H235 PolarHBondContact O-ND1 3.11Å; V231-W278 HydrophobicContact CB-CH2 4.14Å; V231-W278 HydrophobicContact CB-CZ2 3.84Å; V231-W278 HydrophobicContact CG1-CD2 3.73Å; V231-W278 HydrophobicContact CG1-CE3 3.88Å; V231-W278 HydrophobicContact CG1-CG 4.47Å; V231-W278 HydrophobicContact CG1-CH2 3.65Å; V231-W278 HydrophobicContact CG1-CZ2 3.48Å; V231-W278 VanDerWaalsContact CG1-CZ2 3.48Å; V231-W278 HydrophobicContact CG1-CZ3 3.84Å; V231-W278 HydrophobicContact CG2-CH2 4.28Å; V231-W278 HydrophobicContact CG2-CZ2 4.42Å; V231-L446 HydrophobicContact CG2-CD2 3.6Å; V231-L449 HydrophobicContact CG2-CD1 4.3Å
232	E	97.4	Very high	94.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-49.7	178.7	-61.1	-83.8	175.7	0	0	111	L228 T229 H230 E234 H235 L236 Y275 W278 N320 S321 I388	L228-E232 WeakPolarHBondContact O-CG 3.23Å; L228-E232 PolarHBondContact O-N 3.44Å; T229-E232 PolarHBondContact O-N 2.9Å; H230-E232 VanDerWaalsContact C-N 3.3Å; H230-E232 PolarHBondContact O-N 2.99Å; E232-E234 VanDerWaalsContact C-N 3.32Å; E232-E234 PolarHBondContact O-N 2.85Å; E232-H235 PolarHBondContact O-N 3.25Å; E232-L236 WeakPolarHBondContact O-CB 3.3Å; E232-L236 VanDerWaalsContact O-CG 3.28Å; E232-L236 WeakPolarHBondContact O-CG 3.45Å; E232-L236 PolarHBondContact O-N 3.34Å; E232-Y275 WeakPolarHBondContact OE2-CE2 3.21Å; E232-Y275 VanDerWaalsContact OE2-CZ 3.24Å; E232-Y275 PolarHBondContact OE2-OH 3.17Å; E232-W278 VanDerWaalsContact CD-NE1 3.29Å; E232-W278 PolarHBondContact OE1-NE1 3.44Å; E232-N320 PolarHBondContact OE1-ND2 2.89Å; E232-N320 PolarHBondContact OE2-ND2 3Å; E232-S321 VanDerWaalsContact CD-OG 3.28Å; E232-S321 VanDerWaalsContact CG-OG 3.31Å; E232-S321 WeakPolarHBondContact CG-OG 3.48Å; E232-S321 PolarHBondContact OE1-N 2.81Å; E232-S321 PolarHBondContact OE1-OG 2.66Å; E232-I388 HydrophobicContact CB-CD1 3.65Å; E232-I388 HydrophobicContact CB-CG2 4.11Å; E232-I388 HydrophobicContact CG-CD1 4.47Å
233	L	96	Very high	94.4	Very high	10 Å²	10	18.3 Å²	18.3	5%	0.052	10%	0.097	C	C	.	.	H	α-helix	trans	-63.4	-36.9	178.5	-71.2	172.7	0	0	0	112.3	T229 H230 L236 S237 I388 C437	T229-L233 HydrophobicContact CG2-CD1 3.92Å; T229-L233 HydrophobicContact CG2-CG 4.35Å; T229-L233 WeakPolarHBondContact O-CB 3.36Å; T229-L233 WeakPolarHBondContact O-CG 3.46Å; T229-L233 PolarHBondContact O-N 3.17Å; H230-L233 PolarHBondContact O-N 3Å; L233-L236 PolarHBondContact O-N 3.43Å; L233-S237 WeakPolarHBondContact O-CB 3.08Å; L233-S237 PolarHBondContact O-N 3.07Å; L233-I388 HydrophobicContact CD2-CD1 4.04Å; L233-I388 HydrophobicContact CD2-CG1 4.18Å; L233-I388 HydrophobicContact CG-CD1 3.97Å; L233-C437 HydrophobicContact CD1-CB 3.67Å
234	E	92.2	Very high	93.9	Very high	103 Å²	103	16.3 Å²	16.3	48%	0.481	9%	0.085	S	C	.	.	H	α-helix	trans	-58.7	-52.3	172.7	-174.7	-173.1	173.6	0	0	110.5	H230 E232 L236 S237 H238	H230-E234 WeakPolarHBondContact O-CB 3.36Å; H230-E234 PolarHBondContact O-N 3.11Å; E232-E234 VanDerWaalsContact C-N 3.32Å; E232-E234 PolarHBondContact O-N 2.85Å; E234-L236 PolarHBondContact O-N 2.86Å; E234-S237 PolarHBondContact O-N 2.88Å; E234-S237 PolarHBondContact O-OG 2.9Å; E234-H238 PolarHBondContact O-CE1 3.34Å; E234-H238 PolarHBondContact O-ND1 3.09Å
235	H	92.1	Very high	93.1	Very high	27 Å²	27	16.5 Å²	16.5	13%	0.125	9%	0.087	C	C	.	.	H	α-helix	trans	-61.8	-43.8	178.8	-76	71.7	0	0	0	112.1	V231 E232 S237 H238 Y275	V231-H235 PolarHBondContact O-N 2.88Å; V231-H235 PolarHBondContact O-ND1 3.11Å; E232-H235 PolarHBondContact O-N 3.25Å; H235-S237 VanDerWaalsContact C-N 3.3Å; H235-S237 PolarHBondContact O-N 2.8Å; H235-H238 PolarHBondContact O-N 3.31Å; H235-Y275 HydrophobicContact CB-CD2 3.45Å; H235-Y275 VanDerWaalsContact CB-CD2 3.45Å; H235-Y275 HydrophobicContact CB-CE2 3.93Å; H235-Y275 HydrophobicContact CB-CG 4.29Å
236	L	93.6	Very high	92.2	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-60.7	-39	178.8	-72	-172.2	0	0	0	112.4	E232 L233 E234 H238 I239 Y275 I388 F429 K433	E232-L236 WeakPolarHBondContact O-CB 3.3Å; E232-L236 VanDerWaalsContact O-CG 3.28Å; E232-L236 WeakPolarHBondContact O-CG 3.45Å; E232-L236 PolarHBondContact O-N 3.34Å; L233-L236 PolarHBondContact O-N 3.43Å; E234-L236 PolarHBondContact O-N 2.86Å; L236-H238 PolarHBondContact O-N 3.37Å; L236-H238 VanDerWaalsContact O-N 3.13Å; L236-I239 HydrophobicContact CD2-CD1 4.04Å; L236-I239 PolarHBondContact O-N 3.21Å; L236-Y275 HydrophobicContact CD2-CD1 3.96Å; L236-Y275 HydrophobicContact CD2-CE1 3.29Å; L236-Y275 HydrophobicContact CD2-CE2 4.16Å; L236-Y275 VanDerWaalsContact CD2-CZ 3.41Å; L236-Y275 WeakPolarHBondContact CD2-OH 3.22Å; L236-Y275 HydrophobicContact CG-CE1 4.28Å; L236-Y275 HydrophobicContact CG-CE2 4.39Å; L236-I388 HydrophobicContact CD1-CB 4.48Å; L236-I388 HydrophobicContact CD1-CG1 4.27Å; L236-I388 HydrophobicContact CD1-CG2 4.02Å; L236-F429 HydrophobicContact CD2-CE2 3.6Å; L236-F429 HydrophobicContact CD2-CZ 3.71Å; L236-K433 HydrophobicContact CB-CB 4.07Å
237	S	90.6	Very high	91	Very high	59 Å²	59	18.6 Å²	18.6	41%	0.413	10%	0.104	S	C	.	.	H	α-helix	trans	-56.7	-32.8	-177.6	76	0	0	0	0	112.7	L233 E234 H235 K433	L233-S237 WeakPolarHBondContact O-CB 3.08Å; L233-S237 PolarHBondContact O-N 3.07Å; E234-S237 PolarHBondContact O-N 2.88Å; E234-S237 PolarHBondContact O-OG 2.9Å; H235-S237 VanDerWaalsContact C-N 3.3Å; H235-S237 PolarHBondContact O-N 2.8Å; S237-K433 PolarHBondContact O-NZ 3.18Å
238	H	88.6	Confident	89.5	Confident	45 Å²	45	19.1 Å²	19.1	21%	0.208	11%	0.106	C	C	.	.	H	α-helix	trans	-76.2	-21.9	-179.5	-62.8	95	0	0	0	114	E234 H235 L236 G240 N271	E234-H238 PolarHBondContact O-CE1 3.34Å; E234-H238 PolarHBondContact O-ND1 3.09Å; H235-H238 PolarHBondContact O-N 3.31Å; L236-H238 PolarHBondContact O-N 3.37Å; L236-H238 VanDerWaalsContact O-N 3.13Å; H238-G240 PolarHBondContact O-N 3.35Å; H238-N271 HydrophobicContact CB-CB 4.37Å; H238-N271 PolarHBondContact O-ND2 2.59Å; H238-N271 VanDerWaalsContact O-ND2 3.12Å
239	I	90.4	Very high	88	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.			trans	-74.7	115.6	-173.7	-62.1	171.3	0	0	0	110.7	L236 E243 F244 N271 L272 Y275 F391 F429 K433	L236-I239 HydrophobicContact CD2-CD1 4.04Å; L236-I239 PolarHBondContact O-N 3.21Å; I239-E243 WeakPolarHBondContact CA-OE1 3.44Å; I239-F244 HydrophobicContact CG2-CD2 4.47Å; I239-F244 HydrophobicContact CG2-CE2 3.63Å; I239-F244 HydrophobicContact CG2-CZ 3.96Å; I239-N271 HydrophobicContact CG1-CB 3.9Å; I239-L272 HydrophobicContact CD1-CD2 4.23Å; I239-L272 HydrophobicContact CG1-CD2 4.43Å; I239-L272 HydrophobicContact CG2-CD2 3.62Å; I239-Y275 HydrophobicContact CD1-CD1 3.94Å; I239-Y275 HydrophobicContact CD1-CG 4.26Å; I239-F391 HydrophobicContact CD1-CE2 4.17Å; I239-F391 HydrophobicContact CD1-CZ 3.86Å; I239-F429 HydrophobicContact CB-CE1 4.28Å; I239-F429 HydrophobicContact CB-CZ 4.27Å; I239-F429 HydrophobicContact CD1-CZ 4.21Å; I239-F429 HydrophobicContact CG2-CE1 4.04Å; I239-F429 HydrophobicContact CG2-CZ 4.25Å; I239-K433 PolarHBondContact O-NZ 3.46Å
240	G	90.2	Very high	85.9	Confident	8 Å²	8	28.7 Å²	28.7	8%	0.082	16%	0.156	C	C	.	.			trans	-78.7	148	176	0	0	0	0	0	112.9	H238 E242 E243	H238-G240 PolarHBondContact O-N 3.35Å; G240-E242 WeakPolarHBondContact CA-OE2 3.42Å; G240-E242 PolarHBondContact O-N 3.04Å; G240-E243 PolarHBondContact N-OE1 3.4Å; G240-E243 WeakPolarHBondContact O-CB 3.36Å; G240-E243 PolarHBondContact O-N 2.69Å; G240-E243 VanDerWaalsContact O-N 3.09Å
241	P	91.9	Very high	83.6	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.019	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-31.2	174.7	25.3	-33.2	0	0	0	112.2	F77 L81 T133 F134 E243 F244 V426 M430	F77-P241 HydrophobicContact CE2-CB 4.33Å; F77-P241 HydrophobicContact CZ-CB 4.39Å; L81-P241 HydrophobicContact CD1-CB 4.11Å; L81-P241 WeakPolarHBondContact CD1-O 3.49Å; T133-P241 HydrophobicContact CG2-CG 4.39Å; F134-P241 HydrophobicContact CD1-CG 3.74Å; F134-P241 HydrophobicContact CE1-CB 4Å; F134-P241 HydrophobicContact CE1-CG 3.49Å; F134-P241 VanDerWaalsContact CE1-CG 3.49Å; F134-P241 HydrophobicContact CZ-CG 4.34Å; P241-E243 VanDerWaalsContact C-N 3.25Å; P241-E243 PolarHBondContact O-N 2.98Å; P241-F244 PolarHBondContact O-N 3.45Å; P241-V426 HydrophobicContact CB-CG1 3.73Å; P241-M430 HydrophobicContact CB-CE 4.4Å; P241-M430 HydrophobicContact CB-CG 4.1Å; P241-M430 HydrophobicContact CB-SD 3.98Å; P241-M430 HydrophobicContact CG-CE 4.01Å; P241-M430 HydrophobicContact CG-SD 4.19Å
242	E	88.1	Confident	80.8	Confident	9 Å²	9	41 Å²	41	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-28.7	175.3	68.2	-83.2	-161.9	0	0	113.4	F134 S136 G240 F244 V245 Q246	F134-E242 HydrophobicContact CD1-CB 4.3Å; S136-E242 WeakPolarHBondContact CB-OE1 3.4Å; S136-E242 PolarHBondContact OG-OE1 2.84Å; G240-E242 WeakPolarHBondContact CA-OE2 3.42Å; G240-E242 PolarHBondContact O-N 3.04Å; E242-F244 VanDerWaalsContact C-N 3.26Å; E242-F244 PolarHBondContact O-N 2.93Å; E242-V245 PolarHBondContact O-N 3.36Å; E242-Q246 WeakPolarHBondContact O-CB 3.44Å; E242-Q246 WeakPolarHBondContact O-CG 3.41Å; E242-Q246 PolarHBondContact O-N 3.15Å
243	E	88.2	Confident	78.2	Confident	8 Å²	8	47 Å²	47	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-33.2	-179	-63.1	-171.6	-117.8	0	0	111.2	I239 G240 P241 Q246 A247 N271 L272	I239-E243 WeakPolarHBondContact CA-OE1 3.44Å; G240-E243 PolarHBondContact N-OE1 3.4Å; G240-E243 WeakPolarHBondContact O-CB 3.36Å; G240-E243 PolarHBondContact O-N 2.69Å; G240-E243 VanDerWaalsContact O-N 3.09Å; P241-E243 VanDerWaalsContact C-N 3.25Å; P241-E243 PolarHBondContact O-N 2.98Å; E243-Q246 PolarHBondContact O-N 3.08Å; E243-A247 VanDerWaalsContact O-CB 3.23Å; E243-A247 WeakPolarHBondContact O-CB 3.38Å; E243-A247 PolarHBondContact O-N 2.81Å; E243-N271 WeakPolarHBondContact OE1-CB 3.23Å; E243-N271 PolarHBondContact OE1-ND2 3.44Å; E243-N271 WeakPolarHBondContact OE2-CB 3.47Å; E243-N271 PolarHBondContact OE2-N 2.68Å; E243-L272 HydrophobicContact CB-CD1 3.79Å; E243-L272 HydrophobicContact CB-CD2 4.47Å; E243-L272 HydrophobicContact CB-CG 3.92Å; E243-L272 PolarHBondContact OE2-N 3.01Å
244	F	87.3	Confident	75.7	Confident	1 Å²	1	54 Å²	54	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-41.4	175.9	-66.6	-87	0	0	0	111.4	I239 P241 E242 F248 F391 I395 I398 V426 F429	I239-F244 HydrophobicContact CG2-CD2 4.47Å; I239-F244 HydrophobicContact CG2-CE2 3.63Å; I239-F244 HydrophobicContact CG2-CZ 3.96Å; P241-F244 PolarHBondContact O-N 3.45Å; E242-F244 VanDerWaalsContact C-N 3.26Å; E242-F244 PolarHBondContact O-N 2.93Å; F244-F248 WeakPolarHBondContact O-CD2 3.46Å; F244-F248 WeakPolarHBondContact O-CE2 3.43Å; F244-F391 HydrophobicContact CE1-CE2 4.22Å; F244-F391 HydrophobicContact CE1-CZ 4.28Å; F244-F391 HydrophobicContact CZ-CE2 4.16Å; F244-F391 HydrophobicContact CZ-CZ 4.36Å; F244-I395 HydrophobicContact CD1-CD1 3.59Å; F244-I395 HydrophobicContact CE1-CD1 3.42Å; F244-I395 VanDerWaalsContact CE1-CD1 3.42Å; F244-I398 HydrophobicContact CD1-CD1 3.53Å; F244-I398 HydrophobicContact CE1-CD1 3.83Å; F244-I398 HydrophobicContact CG-CD1 4.4Å; F244-V426 HydrophobicContact CB-CG2 3.99Å; F244-V426 HydrophobicContact CD2-CG1 4.05Å; F244-V426 HydrophobicContact CD2-CG2 4.44Å; F244-V426 HydrophobicContact CG-CG2 4.15Å; F244-F429 AromaticContact CE2-CD1 3.61Å; F244-F429 HydrophobicContact CE2-CD1 3.61Å; F244-F429 AromaticContact CE2-CE1 3.56Å; F244-F429 HydrophobicContact CE2-CE1 3.56Å; F244-F429 HydrophobicContact CE2-CG 4.47Å; F244-F429 HydrophobicContact CE2-CZ 4.37Å; F244-F429 AromaticContact CZ-CD1 3.53Å; F244-F429 HydrophobicContact CZ-CD1 3.53Å; F244-F429 HydrophobicContact CZ-CD2 4.4Å; F244-F429 AromaticContact CZ-CE1 3.47Å; F244-F429 HydrophobicContact CZ-CE1 3.47Å; F244-F429 VanDerWaalsContact CZ-CE1 3.47Å; F244-F429 HydrophobicContact CZ-CE2 4.34Å; F244-F429 HydrophobicContact CZ-CG 4.01Å; F244-F429 AromaticContact CZ-CZ 3.89Å; F244-F429 HydrophobicContact CZ-CZ 3.89Å
245	V	82.5	Confident	73.3	Confident	5 Å²	5	54 Å²	54	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-71.4	-43.5	177	179.4	0	0	0	0	110.2	L81 L85 E242 A247 F248 V249 L422	L81-V245 HydrophobicContact CD1-CG2 3.49Å; L81-V245 VanDerWaalsContact CD1-CG2 3.49Å; L81-V245 HydrophobicContact CD2-CG2 4.45Å; L81-V245 HydrophobicContact CG-CG2 3.67Å; L85-V245 HydrophobicContact CD1-CG1 4.12Å; L85-V245 HydrophobicContact CD2-CG1 3.51Å; L85-V245 HydrophobicContact CG-CG1 3.67Å; E242-V245 PolarHBondContact O-N 3.36Å; V245-A247 VanDerWaalsContact C-N 3.31Å; V245-A247 PolarHBondContact O-N 2.9Å; V245-F248 PolarHBondContact O-N 3.23Å; V245-F248 VanDerWaalsContact O-N 3.13Å; V245-V249 WeakPolarHBondContact O-CG2 3.47Å; V245-V249 PolarHBondContact O-N 2.96Å; V245-L422 HydrophobicContact CG2-CD2 4.26Å
246	Q	79.5	Confident	71	Confident	47 Å²	47	56.8 Å²	56.8	22%	0.22	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-32	-178.6	-71.4	174.6	15.1	0	0	113.2	E242 E243 F248 V249 K268	E242-Q246 WeakPolarHBondContact O-CB 3.44Å; E242-Q246 WeakPolarHBondContact O-CG 3.41Å; E242-Q246 PolarHBondContact O-N 3.15Å; E243-Q246 PolarHBondContact O-N 3.08Å; Q246-F248 PolarHBondContact O-N 3.22Å; Q246-V249 PolarHBondContact O-N 3.41Å; Q246-K268 VanDerWaalsContact OE1-CB 3.29Å; Q246-K268 PolarHBondContact OE1-O 3.15Å
247	A	72.6	Confident	68.6	Low	42 Å²	42	61.7 Å²	61.7	35%	0.347	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.4	175.2	0	0	0	0	0	113	E243 V245 T269 L272	E243-A247 VanDerWaalsContact O-CB 3.23Å; E243-A247 WeakPolarHBondContact O-CB 3.38Å; E243-A247 PolarHBondContact O-N 2.81Å; V245-A247 VanDerWaalsContact C-N 3.31Å; V245-A247 PolarHBondContact O-N 2.9Å; A247-T269 HydrophobicContact CB-CG2 4.17Å; A247-L272 HydrophobicContact CB-CD1 3.94Å
248	F	67.6	Low	66.2	Low	12 Å²	12	67.9 Å²	67.9	5%	0.053	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	11.9	-174	-43.8	-52.2	0	0	0	113.8	F244 V245 Q246 Q250 I395 I398 Y399	F244-F248 WeakPolarHBondContact O-CD2 3.46Å; F244-F248 WeakPolarHBondContact O-CE2 3.43Å; V245-F248 PolarHBondContact O-N 3.23Å; V245-F248 VanDerWaalsContact O-N 3.13Å; Q246-F248 PolarHBondContact O-N 3.22Å; F248-Q250 VanDerWaalsContact C-N 3.28Å; F248-Q250 PolarHBondContact O-N 3.28Å; F248-I395 HydrophobicContact CE1-CG2 4.31Å; F248-I395 HydrophobicContact CZ-CG2 4.03Å; F248-I398 HydrophobicContact CD2-CG2 4.13Å; F248-I398 HydrophobicContact CE2-CB 4.07Å; F248-I398 HydrophobicContact CE2-CG2 3.42Å; F248-I398 VanDerWaalsContact CE2-CG2 3.42Å; F248-I398 HydrophobicContact CZ-CB 4.45Å; F248-I398 HydrophobicContact CZ-CG2 4.26Å; F248-Y399 AromaticContact CD1-CD2 3.53Å; F248-Y399 HydrophobicContact CD1-CD2 3.53Å; F248-Y399 HydrophobicContact CD1-CE2 4.43Å; F248-Y399 HydrophobicContact CD1-CG 4.35Å; F248-Y399 AromaticContact CE1-CD2 3.79Å; F248-Y399 HydrophobicContact CE1-CD2 3.79Å; F248-Y399 HydrophobicContact CE1-CG 4.24Å; F248-Y399 HydrophobicContact CG-CD2 4.32Å
249	V	66.3	Low	63.9	Low	76 Å²	76	74.4 Å²	74.4	46%	0.461	41%	0.411	S	S	.	.			trans	-62.5	98	169.1	177.7	0	0	0	0	107.1	L85 V245 Q246 K251	L85-V249 HydrophobicContact CD2-CG2 3.75Å; V245-V249 WeakPolarHBondContact O-CG2 3.47Å; V245-V249 PolarHBondContact O-N 2.96Å; Q246-V249 PolarHBondContact O-N 3.41Å; V249-K251 PolarHBondContact O-N 2.89Å
250	Q	54.4	Low	61.5	Low	127 Å²	127	77.2 Å²	77.2	59%	0.593	43%	0.43	S	S	*	.			trans	-61.3	134.1	173.2	-70.9	-165.3	-13.8	0	0	109	F248 D252 E403	F248-Q250 VanDerWaalsContact C-N 3.28Å; F248-Q250 PolarHBondContact O-N 3.28Å; Q250-D252 PolarHBondContact O-N 3.01Å; Q250-D252 VanDerWaalsContact O-N 3.14Å; Q250-E403 PolarHBondContact NE2-OE1 3.19Å; Q250-E403 PolarHBondContact NE2-OE2 3.24Å
251	K	49	Very low	58.9	Low	177 Å²	177	79.2 Å²	79.2	77%	0.77	44%	0.442	S	S	*	.			trans	-63.9	106.6	165.5	-70.3	173.3	174.9	176	0	107.2	V249 P253	V249-K251 PolarHBondContact O-N 2.89Å; K251-P253 WeakPolarHBondContact O-CD 3.48Å
252	D	39	Very low	56.2	Low	100 Å²	100	86.2 Å²	86.2	54%	0.535	47%	0.473	S	S	.	.			trans	-68.9	114.1	161.6	-160.8	-25.3	0	0	0	107.1	Q250 L254 D255	Q250-D252 PolarHBondContact O-N 3.01Å; Q250-D252 VanDerWaalsContact O-N 3.14Å; D252-L254 PolarHBondContact O-N 2.97Å; D252-L254 WeakPolarHBondContact OD1-CB 3.28Å; D252-L254 PolarHBondContact OD1-N 3.37Å; D252-L254 VanDerWaalsContact OD1-N 3.16Å; D252-D255 HydrophobicContact CB-CB 4.24Å; D252-D255 PolarHBondContact O-N 3Å
253	P	41.4	Very low	53.7	Low	126 Å²	126	89.3 Å²	89.3	82%	0.818	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.3	179.4	-14.9	30.8	0	0	0	112.5	K251	K251-P253 WeakPolarHBondContact O-CD 3.48Å
254	L	44.3	Very low	51.5	Low	159 Å²	159	93.6 Å²	93.6	83%	0.832	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-13	-175.1	-67.9	158.7	0	0	0	113.4	D252 G256	D252-L254 PolarHBondContact O-N 2.97Å; D252-L254 WeakPolarHBondContact OD1-CB 3.28Å; D252-L254 PolarHBondContact OD1-N 3.37Å; D252-L254 VanDerWaalsContact OD1-N 3.16Å; L254-G256 PolarHBondContact O-N 3.08Å
255	D	42.4	Very low	49.4	Very low	103 Å²	103	97.6 Å²	97.6	55%	0.551	53%	0.534	S	S	*	.			trans	-87.4	96.6	178.5	-148.6	-12.6	0	0	0	109.1	D252 T257	D252-D255 HydrophobicContact CB-CB 4.24Å; D252-D255 PolarHBondContact O-N 3Å; D255-T257 PolarHBondContact O-N 3.39Å
256	G	42.3	Very low	47.7	Very low	85 Å²	85	103.1 Å²	103.1	88%	0.876	56%	0.558	S	S	*	*			trans	-66.4	20.7	-177.9	0	0	0	0	0	115.1	L254	L254-G256 PolarHBondContact O-N 3.08Å
257	T	43.1	Very low	46.4	Very low	104 Å²	104	108.9 Å²	108.9	64%	0.638	58%	0.582	S	S	*	*	S	Bend	trans	-85	136.7	174.2	49.7	0	0	0	0	110.1	D255 Q259	D255-T257 PolarHBondContact O-N 3.39Å; T257-Q259 PolarHBondContact O-N 3.13Å
258	Q	41.5	Very low	45.7	Very low	188 Å²	188	111.5 Å²	111.5	88%	0.879	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-47.8	130.6	-165	-67.1	169.1	24.2	0	0	112.8	P260	Q258-P260 WeakPolarHBondContact O-CD 3.48Å; Q258-P260 VanDerWaalsContact O-N 3.16Å
259	Q	40.7	Very low	45.6	Very low	182 Å²	182	111.7 Å²	111.7	85%	0.85	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-48.8	121.2	171.1	-71.1	178.4	9	0	0	109.4	T257 S261	T257-Q259 PolarHBondContact O-N 3.13Å; Q259-S261 PolarHBondContact O-N 3.25Å
260	P	40.2	Very low	46.2	Very low	59 Å²	59	109.5 Å²	109.5	38%	0.383	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-58.3	131.1	162.9	23.3	-29.1	0	0	0	107.2	Q258 E264	Q258-P260 WeakPolarHBondContact O-CD 3.48Å; Q258-P260 VanDerWaalsContact O-N 3.16Å; P260-E264 VanDerWaalsContact CA-OE2 3.32Å; P260-E264 WeakPolarHBondContact CA-OE2 3.38Å; P260-E264 HydrophobicContact CB-CB 4.2Å; P260-E264 WeakPolarHBondContact CB-OE2 3.21Å
261	S	35.1	Very low	47.8	Very low	50 Å²	50	104.1 Å²	104.1	35%	0.35	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-54.2	148.7	-177.1	64.3	0	0	0	0	110.5	Q259 S263 E264 Q265	Q259-S261 PolarHBondContact O-N 3.25Å; S261-S263 WeakPolarHBondContact CB-OG 3.37Å; S261-S263 PolarHBondContact O-N 3.11Å; S261-S263 PolarHBondContact OG-OG 3.34Å; S261-E264 WeakPolarHBondContact O-CB 3.42Å; S261-E264 PolarHBondContact O-N 2.86Å; S261-E264 WeakPolarHBondContact OG-CG 3.46Å; S261-E264 PolarHBondContact OG-N 3.07Å; S261-Q265 PolarHBondContact O-N 3.39Å
262	F	35.3	Very low	49.6	Very low	150 Å²	150	96.4 Å²	96.4	66%	0.658	52%	0.518	S	S	*	.	H	α-helix	trans	-51.2	-25.7	175.4	-173.9	-104.2	0	0	0	113	K266	F262-K266 PolarHBondContact O-N 3.29Å
263	S	35.1	Very low	51.7	Low	74 Å²	74	94 Å²	94	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-71.5	-32	171.3	34.3	0	0	0	0	115.3	S261	S261-S263 WeakPolarHBondContact CB-OG 3.37Å; S261-S263 PolarHBondContact O-N 3.11Å; S261-S263 PolarHBondContact OG-OG 3.34Å
264	E	41.8	Very low	53.9	Low	98 Å²	98	88.1 Å²	88.1	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-75.5	-33.9	175.9	-77.3	175.5	175.9	0	0	111.9	P260 S261 K267 K268	P260-E264 VanDerWaalsContact CA-OE2 3.32Å; P260-E264 WeakPolarHBondContact CA-OE2 3.38Å; P260-E264 HydrophobicContact CB-CB 4.2Å; P260-E264 WeakPolarHBondContact CB-OE2 3.21Å; S261-E264 WeakPolarHBondContact O-CB 3.42Å; S261-E264 PolarHBondContact O-N 2.86Å; S261-E264 WeakPolarHBondContact OG-CG 3.46Å; S261-E264 PolarHBondContact OG-N 3.07Å; E264-K267 PolarHBondContact O-N 3.23Å; E264-K268 WeakPolarHBondContact O-CG 3.39Å; E264-K268 PolarHBondContact O-N 3.45Å
265	Q	42.7	Very low	56.2	Low	86 Å²	86	80.6 Å²	80.6	40%	0.402	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-45.2	175.8	-157.1	102.2	11	0	0	111.5	S261 K267 K268	S261-Q265 PolarHBondContact O-N 3.39Å; Q265-K267 PolarHBondContact O-N 2.98Å; Q265-K268 PolarHBondContact O-N 3.06Å; Q265-K268 VanDerWaalsContact O-N 3.08Å
266	K	46.6	Very low	58.5	Low	120 Å²	120	78.6 Å²	78.6	52%	0.522	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-27.4	176.7	-94.4	-172.1	173.1	-175.7	0	114.1	F262 S270	F262-K266 PolarHBondContact O-N 3.29Å; K266-S270 WeakPolarHBondContact O-CB 3.49Å
267	K	52.6	Low	60.7	Low	168 Å²	168	79 Å²	79	73%	0.73	39%	0.393	S	S	*	.	H	α-helix	trans	-74.1	-28.9	175.4	-75.6	-178.5	177.6	-177	0	112.3	E264 Q265	E264-K267 PolarHBondContact O-N 3.23Å; Q265-K267 PolarHBondContact O-N 2.98Å
268	K	58.7	Low	63.2	Low	98 Å²	98	74.4 Å²	74.4	43%	0.426	36%	0.364	S	S	.	.	H	α-helix	trans	-81.6	-22	-170.3	-76.3	178	-174.4	-179.4	0	115.1	Q246 E264 Q265	Q246-K268 VanDerWaalsContact OE1-CB 3.29Å; Q246-K268 PolarHBondContact OE1-O 3.15Å; E264-K268 WeakPolarHBondContact O-CG 3.39Å; E264-K268 PolarHBondContact O-N 3.45Å; Q265-K268 PolarHBondContact O-N 3.06Å; Q265-K268 VanDerWaalsContact O-N 3.08Å
269	T	66	Low	65.8	Low	15 Å²	15	66.4 Å²	66.4	9%	0.092	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	22.6	179.5	54.3	0	0	0	0	112.8	A247 N271 L272 E273	A247-T269 HydrophobicContact CB-CG2 4.17Å; T269-N271 VanDerWaalsContact C-N 3.27Å; T269-N271 PolarHBondContact O-N 3.39Å; T269-L272 HydrophobicContact CG2-CD1 4.25Å; T269-L272 PolarHBondContact O-N 3.47Å; T269-E273 WeakPolarHBondContact O-CG 3.38Å; T269-E273 PolarHBondContact O-N 3.22Å; T269-E273 PolarHBondContact OG1-OE1 2.76Å
270	S	78.1	Confident	68.4	Low	30 Å²	30	61 Å²	61	21%	0.21	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-31.7	-169.8	67.4	0	0	0	0	113.4	K266 A274	K266-S270 WeakPolarHBondContact O-CB 3.49Å; S270-A274 VanDerWaalsContact O-CB 3.29Å; S270-A274 WeakPolarHBondContact O-CB 3.31Å; S270-A274 PolarHBondContact O-N 3.13Å
271	N	87.2	Confident	71	Confident	14 Å²	14	59.5 Å²	59.5	8%	0.075	29%	0.29	C	S	.	.	H	α-helix	trans	-78	-41.5	178.8	-57	-51	0	0	0	111.2	H238 I239 E243 T269 E273 A274 Y275	H238-N271 HydrophobicContact CB-CB 4.37Å; H238-N271 PolarHBondContact O-ND2 2.59Å; H238-N271 VanDerWaalsContact O-ND2 3.12Å; I239-N271 HydrophobicContact CG1-CB 3.9Å; E243-N271 WeakPolarHBondContact OE1-CB 3.23Å; E243-N271 PolarHBondContact OE1-ND2 3.44Å; E243-N271 WeakPolarHBondContact OE2-CB 3.47Å; E243-N271 PolarHBondContact OE2-N 2.68Å; T269-N271 VanDerWaalsContact C-N 3.27Å; T269-N271 PolarHBondContact O-N 3.39Å; N271-E273 VanDerWaalsContact C-N 3.32Å; N271-E273 PolarHBondContact O-N 3.04Å; N271-A274 WeakPolarHBondContact O-CB 3.44Å; N271-A274 PolarHBondContact O-N 3.17Å; N271-A274 VanDerWaalsContact O-N 3.17Å; N271-Y275 WeakPolarHBondContact O-CB 3.31Å; N271-Y275 PolarHBondContact O-N 3.48Å
272	L	87.7	Confident	74	Confident	15 Å²	15	57.2 Å²	57.2	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-55.1	-48.7	171.4	-63.4	-178.9	0	0	0	111.1	I239 E243 A247 T269 A274 Y275 V276 F391 I395	I239-L272 HydrophobicContact CD1-CD2 4.23Å; I239-L272 HydrophobicContact CG1-CD2 4.43Å; I239-L272 HydrophobicContact CG2-CD2 3.62Å; E243-L272 HydrophobicContact CB-CD1 3.79Å; E243-L272 HydrophobicContact CB-CD2 4.47Å; E243-L272 HydrophobicContact CB-CG 3.92Å; E243-L272 PolarHBondContact OE2-N 3.01Å; A247-L272 HydrophobicContact CB-CD1 3.94Å; T269-L272 HydrophobicContact CG2-CD1 4.25Å; T269-L272 PolarHBondContact O-N 3.47Å; L272-A274 VanDerWaalsContact C-N 3.35Å; L272-A274 PolarHBondContact O-N 3.39Å; L272-Y275 PolarHBondContact O-N 3.49Å; L272-V276 WeakPolarHBondContact O-CG2 3.49Å; L272-V276 PolarHBondContact O-N 3.24Å; L272-F391 HydrophobicContact CD2-CE1 3.95Å; L272-F391 HydrophobicContact CD2-CZ 3.47Å; L272-F391 VanDerWaalsContact CD2-CZ 3.47Å; L272-I395 HydrophobicContact CD2-CD1 4.24Å
273	E	83.6	Confident	76.9	Confident	49 Å²	49	50.3 Å²	50.3	23%	0.229	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-38.2	177	-71.2	179.1	-167.4	0	0	112.6	M10 T269 N271 Y275 V276 R277	M10-E273 HydrophobicContact CE-CG 4.44Å; M10-E273 WeakPolarHBondContact CE-OE1 3.21Å; T269-E273 WeakPolarHBondContact O-CG 3.38Å; T269-E273 PolarHBondContact O-N 3.22Å; T269-E273 PolarHBondContact OG1-OE1 2.76Å; N271-E273 VanDerWaalsContact C-N 3.32Å; N271-E273 PolarHBondContact O-N 3.04Å; E273-Y275 VanDerWaalsContact C-N 3.32Å; E273-V276 PolarHBondContact O-N 3.24Å; E273-R277 WeakPolarHBondContact O-CB 3.43Å; E273-R277 WeakPolarHBondContact O-CG 3.35Å; E273-R277 PolarHBondContact O-N 3.25Å; E273-R277 PolarHBondContact O-NE 3Å
274	A	87	Confident	79.8	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-41.3	176.3	0	0	0	0	0	111.7	I186 S270 N271 L272 R277 W278	I186-A274 HydrophobicContact CD1-CB 4.46Å; I186-A274 HydrophobicContact CG2-CB 3.64Å; S270-A274 VanDerWaalsContact O-CB 3.29Å; S270-A274 WeakPolarHBondContact O-CB 3.31Å; S270-A274 PolarHBondContact O-N 3.13Å; N271-A274 WeakPolarHBondContact O-CB 3.44Å; N271-A274 PolarHBondContact O-N 3.17Å; N271-A274 VanDerWaalsContact O-N 3.17Å; L272-A274 VanDerWaalsContact C-N 3.35Å; L272-A274 PolarHBondContact O-N 3.39Å; A274-R277 VanDerWaalsContact CA-CZ 3.44Å; A274-R277 WeakPolarHBondContact O-CB 3.34Å; A274-R277 PolarHBondContact O-N 3.42Å; A274-W278 PolarHBondContact O-N 3.35Å
275	Y	92.7	Very high	82.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-69.9	-37.7	179.4	-167.5	-138.5	0	0	0	112.5	E232 H235 L236 I239 N271 L272 E273 R277 W278 F279 N320 I388 F391	E232-Y275 WeakPolarHBondContact OE2-CE2 3.21Å; E232-Y275 VanDerWaalsContact OE2-CZ 3.24Å; E232-Y275 PolarHBondContact OE2-OH 3.17Å; H235-Y275 HydrophobicContact CB-CD2 3.45Å; H235-Y275 VanDerWaalsContact CB-CD2 3.45Å; H235-Y275 HydrophobicContact CB-CE2 3.93Å; H235-Y275 HydrophobicContact CB-CG 4.29Å; L236-Y275 HydrophobicContact CD2-CD1 3.96Å; L236-Y275 HydrophobicContact CD2-CE1 3.29Å; L236-Y275 HydrophobicContact CD2-CE2 4.16Å; L236-Y275 VanDerWaalsContact CD2-CZ 3.41Å; L236-Y275 WeakPolarHBondContact CD2-OH 3.22Å; L236-Y275 HydrophobicContact CG-CE1 4.28Å; L236-Y275 HydrophobicContact CG-CE2 4.39Å; I239-Y275 HydrophobicContact CD1-CD1 3.94Å; I239-Y275 HydrophobicContact CD1-CG 4.26Å; N271-Y275 WeakPolarHBondContact O-CB 3.31Å; N271-Y275 PolarHBondContact O-N 3.48Å; L272-Y275 PolarHBondContact O-N 3.49Å; E273-Y275 VanDerWaalsContact C-N 3.32Å; Y275-R277 VanDerWaalsContact C-N 3.33Å; Y275-R277 PolarHBondContact O-N 2.95Å; Y275-W278 WeakPolarHBondContact O-CB 3.36Å; Y275-W278 PolarHBondContact O-N 3.29Å; Y275-F279 PolarHBondContact O-N 3.26Å; Y275-N320 PolarHBondContact OH-ND2 3.25Å; Y275-I388 WeakPolarHBondContact OH-CG2 3.29Å; Y275-F391 HydrophobicContact CD1-CB 4.01Å; Y275-F391 AromaticContact CD1-CD1 3.42Å; Y275-F391 HydrophobicContact CD1-CD1 3.42Å; Y275-F391 VanDerWaalsContact CD1-CD1 3.42Å; Y275-F391 AromaticContact CD1-CD2 3.79Å; Y275-F391 HydrophobicContact CD1-CD2 3.79Å; Y275-F391 AromaticContact CD1-CE1 3.68Å; Y275-F391 HydrophobicContact CD1-CE1 3.68Å; Y275-F391 HydrophobicContact CD1-CE2 4.04Å; Y275-F391 AromaticContact CD1-CG 3.45Å; Y275-F391 HydrophobicContact CD1-CG 3.45Å; Y275-F391 VanDerWaalsContact CD1-CG 3.45Å; Y275-F391 AromaticContact CD1-CZ 3.97Å; Y275-F391 HydrophobicContact CD1-CZ 3.97Å; Y275-F391 HydrophobicContact CE1-CB 3.51Å; Y275-F391 AromaticContact CE1-CD1 3.83Å; Y275-F391 HydrophobicContact CE1-CD1 3.83Å; Y275-F391 AromaticContact CE1-CD2 3.51Å; Y275-F391 HydrophobicContact CE1-CD2 3.51Å; Y275-F391 HydrophobicContact CE1-CE1 4.38Å; Y275-F391 HydrophobicContact CE1-CE2 4.1Å; Y275-F391 AromaticContact CE1-CG 3.33Å; Y275-F391 HydrophobicContact CE1-CG 3.33Å; Y275-F391 HydrophobicContact CE1-CZ 4.49Å
276	V	89.9	Confident	85.1	Confident	61 Å²	61	41.1 Å²	41.1	37%	0.37	19%	0.19	S	C	.	.	H	α-helix	trans	-63.1	-39.6	169.7	173.4	0	0	0	0	111.4	L272 E273 W278 F279 N280	L272-V276 WeakPolarHBondContact O-CG2 3.49Å; L272-V276 PolarHBondContact O-N 3.24Å; E273-V276 PolarHBondContact O-N 3.24Å; V276-W278 VanDerWaalsContact C-N 3.35Å; V276-F279 PolarHBondContact O-N 3.49Å; V276-N280 PolarHBondContact O-N 3.12Å; V276-N280 VanDerWaalsContact O-N 3.09Å; V276-N280 PolarHBondContact O-ND2 3.24Å
277	R	89.7	Confident	87.5	Confident	94 Å²	94	35.4 Å²	35.4	36%	0.355	17%	0.166	S	C	.	.	H	α-helix	trans	-62.7	-40.8	174.3	-80.4	-178.6	-87.9	117.1	-4.2	111.9	E273 A274 Y275 N280 R281	E273-R277 WeakPolarHBondContact O-CB 3.43Å; E273-R277 WeakPolarHBondContact O-CG 3.35Å; E273-R277 PolarHBondContact O-N 3.25Å; E273-R277 PolarHBondContact O-NE 3Å; A274-R277 VanDerWaalsContact CA-CZ 3.44Å; A274-R277 WeakPolarHBondContact O-CB 3.34Å; A274-R277 PolarHBondContact O-N 3.42Å; Y275-R277 VanDerWaalsContact C-N 3.33Å; Y275-R277 PolarHBondContact O-N 2.95Å; R277-N280 PolarHBondContact O-N 2.86Å; R277-R281 WeakPolarHBondContact O-CB 3.45Å; R277-R281 PolarHBondContact O-N 3.05Å
278	W	94.8	Very high	89.5	Confident	7 Å²	7	27.4 Å²	27.4	3%	0.027	13%	0.131	C	C	.	.	H	α-helix	trans	-60	-50.2	174	166.5	-110.3	0	0	0	111.8	L228 V231 E232 A274 Y275 V276 N280 R281 L282 L449	L228-W278 HydrophobicContact CD2-CH2 4.15Å; L228-W278 HydrophobicContact CD2-CZ2 3.83Å; V231-W278 HydrophobicContact CB-CH2 4.14Å; V231-W278 HydrophobicContact CB-CZ2 3.84Å; V231-W278 HydrophobicContact CG1-CD2 3.73Å; V231-W278 HydrophobicContact CG1-CE3 3.88Å; V231-W278 HydrophobicContact CG1-CG 4.47Å; V231-W278 HydrophobicContact CG1-CH2 3.65Å; V231-W278 HydrophobicContact CG1-CZ2 3.48Å; V231-W278 VanDerWaalsContact CG1-CZ2 3.48Å; V231-W278 HydrophobicContact CG1-CZ3 3.84Å; V231-W278 HydrophobicContact CG2-CH2 4.28Å; V231-W278 HydrophobicContact CG2-CZ2 4.42Å; E232-W278 VanDerWaalsContact CD-NE1 3.29Å; E232-W278 PolarHBondContact OE1-NE1 3.44Å; A274-W278 PolarHBondContact O-N 3.35Å; Y275-W278 WeakPolarHBondContact O-CB 3.36Å; Y275-W278 PolarHBondContact O-N 3.29Å; V276-W278 VanDerWaalsContact C-N 3.35Å; W278-N280 VanDerWaalsContact C-N 3.32Å; W278-N280 PolarHBondContact O-N 3.25Å; W278-R281 WeakPolarHBondContact O-CB 3.46Å; W278-R281 PolarHBondContact O-N 3.31Å; W278-R281 VanDerWaalsContact O-N 3.11Å; W278-L282 HydrophobicContact CZ2-CD2 4.3Å; W278-L282 PolarHBondContact O-N 3.42Å; W278-L449 HydrophobicContact CH2-CB 4.2Å; W278-L449 HydrophobicContact CH2-CD2 4.48Å
279	F	96.6	Very high	91.3	Very high	20 Å²	20	22.9 Å²	22.9	9%	0.088	11%	0.111	C	C	.	.	H	α-helix	trans	-52.4	-50.8	176.6	177.8	-88.1	0	0	0	111.5	Y275 V276 R281 L282 C283 M323 A324 F390	Y275-F279 PolarHBondContact O-N 3.26Å; V276-F279 PolarHBondContact O-N 3.49Å; F279-R281 PolarHBondContact O-N 3.09Å; F279-L282 PolarHBondContact O-N 3.25Å; F279-C283 VanDerWaalsContact CE1-SG 3.59Å; F279-C283 PolarHBondContact O-N 3.33Å; F279-C283 VanDerWaalsContact O-N 3.07Å; F279-C283 PolarHBondContact O-SG 3.28Å; F279-M323 HydrophobicContact CE2-CB 4.07Å; F279-M323 HydrophobicContact CE2-CG 4.15Å; F279-M323 HydrophobicContact CZ-CB 4.46Å; F279-M323 HydrophobicContact CZ-CG 4.09Å; F279-A324 HydrophobicContact CD2-CB 3.75Å; F279-A324 HydrophobicContact CE2-CB 3.64Å; F279-A324 HydrophobicContact CG-CB 4.36Å; F279-A324 HydrophobicContact CZ-CB 4.16Å; F279-F390 HydrophobicContact CE2-CD2 4.35Å; F279-F390 HydrophobicContact CE2-CE2 4.01Å; F279-F390 HydrophobicContact CZ-CE2 4.09Å
280	N	94.3	Very high	92.8	Very high	69 Å²	69	22.2 Å²	22.2	37%	0.369	11%	0.107	S	C	.	.	H	α-helix	trans	-63.1	-43.8	178.5	-73.2	-50.3	0	0	0	112	V276 R277 W278 L282 C283 Y284	V276-N280 PolarHBondContact O-N 3.12Å; V276-N280 VanDerWaalsContact O-N 3.09Å; V276-N280 PolarHBondContact O-ND2 3.24Å; R277-N280 PolarHBondContact O-N 2.86Å; W278-N280 VanDerWaalsContact C-N 3.32Å; W278-N280 PolarHBondContact O-N 3.25Å; N280-L282 VanDerWaalsContact C-N 3.27Å; N280-L282 PolarHBondContact O-N 3.42Å; N280-C283 WeakPolarHBondContact O-CB 3.35Å; N280-C283 PolarHBondContact O-N 3.43Å; N280-Y284 VanDerWaalsContact O-CD2 3.3Å; N280-Y284 WeakPolarHBondContact O-CD2 3.44Å; N280-Y284 PolarHBondContact O-N 3.14Å
281	R	95.3	Very high	93.6	Very high	27 Å²	27	20.9 Å²	20.9	10%	0.102	10%	0.098	C	C	.	.	H	α-helix	trans	-55.1	-45.5	175.9	174.1	176.6	176.4	72.3	13.3	111	R277 W278 F279 Y284 L285 L449 H450 A452 I454	R277-R281 WeakPolarHBondContact O-CB 3.45Å; R277-R281 PolarHBondContact O-N 3.05Å; W278-R281 WeakPolarHBondContact O-CB 3.46Å; W278-R281 PolarHBondContact O-N 3.31Å; W278-R281 VanDerWaalsContact O-N 3.11Å; F279-R281 PolarHBondContact O-N 3.09Å; R281-Y284 PolarHBondContact O-N 3.12Å; R281-L285 VanDerWaalsContact O-CB 3.3Å; R281-L285 WeakPolarHBondContact O-CB 3.44Å; R281-L285 PolarHBondContact O-N 3.42Å; R281-L449 VanDerWaalsContact CZ-O 3.29Å; R281-L449 PolarHBondContact NE-O 3.32Å; R281-L449 PolarHBondContact NH2-O 3.39Å; R281-H450 PolarHBondContact NE-O 3.21Å; R281-H450 PolarHBondContact NH2-O 2.75Å; R281-H450 VanDerWaalsContact NH2-O 3.09Å; R281-A452 PolarHBondContact NH1-O 3.34Å; R281-A452 PolarHBondContact NH2-O 3.47Å; R281-I454 HydrophobicContact CG-CD1 4.43Å
282	L	97.9	Very high	93.7	Very high	2 Å²	2	23 Å²	23	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-44.1	178.7	-178.6	56.3	0	0	0	111.7	L228 W278 F279 N280 Y284 L285 V286 A324	L228-L282 HydrophobicContact CD1-CD2 4.5Å; L228-L282 HydrophobicContact CD2-CD1 3.76Å; L228-L282 HydrophobicContact CD2-CD2 3.96Å; W278-L282 HydrophobicContact CZ2-CD2 4.3Å; W278-L282 PolarHBondContact O-N 3.42Å; F279-L282 PolarHBondContact O-N 3.25Å; N280-L282 VanDerWaalsContact C-N 3.27Å; N280-L282 PolarHBondContact O-N 3.42Å; L282-Y284 PolarHBondContact O-N 3.44Å; L282-L285 PolarHBondContact O-N 2.81Å; L282-V286 HydrophobicContact CD1-CG2 4.25Å; L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.4Å; L282-V286 PolarHBondContact O-N 2.87Å; L282-A324 HydrophobicContact CB-CB 4.09Å; L282-A324 HydrophobicContact CD2-CB 3.71Å; L282-A324 HydrophobicContact CG-CB 3.87Å
283	C	97.3	Very high	93.8	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.027	11%	0.112	C	C	.	.	H	α-helix	trans	-53.8	-51.1	173.7	-62.9	0	0	0	0	111.9	F279 N280 V286 A287 A324 G328 M331	F279-C283 VanDerWaalsContact CE1-SG 3.59Å; F279-C283 PolarHBondContact O-N 3.33Å; F279-C283 VanDerWaalsContact O-N 3.07Å; F279-C283 PolarHBondContact O-SG 3.28Å; N280-C283 WeakPolarHBondContact O-CB 3.35Å; N280-C283 PolarHBondContact O-N 3.43Å; C283-V286 PolarHBondContact O-N 3.21Å; C283-A287 PolarHBondContact O-N 3.33Å; C283-A287 VanDerWaalsContact O-N 3.11Å; C283-A324 VanDerWaalsContact SG-CA 3.54Å; C283-A324 PolarHBondContact SG-O 3.47Å; C283-G328 WeakPolarHBondContact O-CA 3.42Å; C283-M331 HydrophobicContact CB-CE 4.41Å
284	Y	95.8	Very high	94	Very high	64 Å²	64	25.3 Å²	25.3	25%	0.251	14%	0.136	S	C	.	.	H	α-helix	trans	-70.4	-33.3	-178.5	-84	-90.8	0	0	0	112.6	N280 R281 L282 A287 T288 M331 F455 E457 L460	N280-Y284 VanDerWaalsContact O-CD2 3.3Å; N280-Y284 WeakPolarHBondContact O-CD2 3.44Å; N280-Y284 PolarHBondContact O-N 3.14Å; R281-Y284 PolarHBondContact O-N 3.12Å; L282-Y284 PolarHBondContact O-N 3.44Å; Y284-A287 PolarHBondContact O-N 2.8Å; Y284-T288 VanDerWaalsContact O-CB 3.26Å; Y284-T288 WeakPolarHBondContact O-CB 3.37Å; Y284-T288 PolarHBondContact O-N 3.48Å; Y284-T288 PolarHBondContact O-OG1 3.21Å; Y284-M331 HydrophobicContact CD1-CE 4.13Å; Y284-M331 HydrophobicContact CD2-CE 3.73Å; Y284-M331 HydrophobicContact CE1-CE 3.87Å; Y284-M331 HydrophobicContact CE2-CE 3.46Å; Y284-M331 VanDerWaalsContact CE2-CE 3.46Å; Y284-M331 HydrophobicContact CG-CE 4.06Å; Y284-F455 WeakPolarHBondContact CD1-O 3.4Å; Y284-E457 HydrophobicContact CE1-CB 4.48Å; Y284-L460 HydrophobicContact CD1-CD1 3.63Å; Y284-L460 HydrophobicContact CE1-CD1 3.83Å
285	L	96.4	Very high	94.3	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-49.2	173.9	179.3	62.2	0	0	0	110.6	M214 R281 L282 A287 T288 E289 L449 A452 I454	M214-L285 HydrophobicContact CE-CD2 4.24Å; R281-L285 VanDerWaalsContact O-CB 3.3Å; R281-L285 WeakPolarHBondContact O-CB 3.44Å; R281-L285 PolarHBondContact O-N 3.42Å; L282-L285 PolarHBondContact O-N 2.81Å; L285-A287 VanDerWaalsContact C-N 3.34Å; L285-A287 PolarHBondContact O-N 3.45Å; L285-T288 WeakPolarHBondContact O-CB 3.35Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 VanDerWaalsContact O-N 3.11Å; L285-E289 HydrophobicContact CD1-CG 4.24Å; L285-E289 HydrophobicContact CG-CG 4.47Å; L285-E289 WeakPolarHBondContact O-CG 3.45Å; L285-E289 PolarHBondContact O-N 3.13Å; L285-L449 HydrophobicContact CD2-CD2 3.99Å; L285-A452 HydrophobicContact CD1-CB 3.82Å; L285-I454 HydrophobicContact CB-CG2 3.9Å; L285-I454 HydrophobicContact CD1-CG2 4.09Å
286	V	98.3	Very high	94.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57	-48.3	176.6	172.1	0	0	0	0	110.8	L282 C283 T288 E289 I290 F306 I325 M329	L282-V286 HydrophobicContact CD1-CG2 4.25Å; L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.4Å; L282-V286 PolarHBondContact O-N 2.87Å; C283-V286 PolarHBondContact O-N 3.21Å; V286-T288 VanDerWaalsContact C-N 3.29Å; V286-T288 PolarHBondContact O-N 3.47Å; V286-E289 PolarHBondContact O-N 3.46Å; V286-I290 HydrophobicContact CG1-CD1 3.85Å; V286-I290 WeakPolarHBondContact O-CD1 3.22Å; V286-I290 VanDerWaalsContact O-CG1 3.31Å; V286-I290 WeakPolarHBondContact O-CG1 3.06Å; V286-I290 PolarHBondContact O-N 3.41Å; V286-I290 VanDerWaalsContact O-N 3.1Å; V286-F306 HydrophobicContact CG1-CD1 4.39Å; V286-F306 HydrophobicContact CG1-CD2 4.18Å; V286-F306 HydrophobicContact CG1-CG 4.11Å; V286-F306 HydrophobicContact CG2-CD1 3.87Å; V286-F306 HydrophobicContact CG2-CE1 3.71Å; V286-F306 HydrophobicContact CG2-CG 4.41Å; V286-F306 HydrophobicContact CG2-CZ 4.11Å; V286-I325 HydrophobicContact CG1-CG2 4.46Å; V286-I325 HydrophobicContact CG2-CB 4.46Å; V286-I325 HydrophobicContact CG2-CG1 4.01Å; V286-M329 HydrophobicContact CG1-CG 4.06Å
287	A	97.7	Very high	94.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-37.1	177.9	0	0	0	0	0	112.5	C283 Y284 L285 I290 C291 M331 V334 L460	C283-A287 PolarHBondContact O-N 3.33Å; C283-A287 VanDerWaalsContact O-N 3.11Å; Y284-A287 PolarHBondContact O-N 2.8Å; L285-A287 VanDerWaalsContact C-N 3.34Å; L285-A287 PolarHBondContact O-N 3.45Å; A287-I290 PolarHBondContact O-N 2.87Å; A287-C291 WeakPolarHBondContact O-CB 3.3Å; A287-C291 PolarHBondContact O-N 3.38Å; A287-C291 PolarHBondContact O-SG 3.41Å; A287-C291 VanDerWaalsContact O-SG 3.42Å; A287-M331 HydrophobicContact CB-SD 3.69Å; A287-V334 HydrophobicContact CB-CG2 3.8Å; A287-L460 HydrophobicContact CB-CD1 3.89Å; A287-L460 HydrophobicContact CB-CD2 3.73Å
288	T	95.4	Very high	94.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-50.6	177.2	-60.8	0	0	0	0	111	Y284 L285 V286 I290 C291 M292 F455	Y284-T288 VanDerWaalsContact O-CB 3.26Å; Y284-T288 WeakPolarHBondContact O-CB 3.37Å; Y284-T288 PolarHBondContact O-N 3.48Å; Y284-T288 PolarHBondContact O-OG1 3.21Å; L285-T288 WeakPolarHBondContact O-CB 3.35Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 VanDerWaalsContact O-N 3.11Å; V286-T288 VanDerWaalsContact C-N 3.29Å; V286-T288 PolarHBondContact O-N 3.47Å; T288-I290 PolarHBondContact O-N 3.39Å; T288-C291 PolarHBondContact O-N 3.49Å; T288-C291 VanDerWaalsContact O-N 3.16Å; T288-M292 HydrophobicContact CG2-CE 3.91Å; T288-M292 VanDerWaalsContact O-CB 3.23Å; T288-M292 WeakPolarHBondContact O-CB 3.42Å; T288-M292 PolarHBondContact O-N 3.24Å; T288-F455 HydrophobicContact CG2-CB 4.38Å; T288-F455 HydrophobicContact CG2-CD1 3.75Å; T288-F455 HydrophobicContact CG2-CD2 4.11Å; T288-F455 HydrophobicContact CG2-CE1 3.98Å; T288-F455 HydrophobicContact CG2-CE2 4.29Å; T288-F455 HydrophobicContact CG2-CG 3.82Å; T288-F455 HydrophobicContact CG2-CZ 4.23Å; T288-F455 PolarHBondContact OG1-N 3.45Å
289	E	95.8	Very high	95.1	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.019	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-34.8	178.1	-69.5	-64.6	140	0	0	112.1	M214 L285 V286 P293 V302 F306 Y448	M214-E289 HydrophobicContact CB-CG 4.14Å; M214-E289 WeakPolarHBondContact CB-OE2 3.39Å; M214-E289 PolarHBondContact N-OE2 2.78Å; L285-E289 HydrophobicContact CD1-CG 4.24Å; L285-E289 HydrophobicContact CG-CG 4.47Å; L285-E289 WeakPolarHBondContact O-CG 3.45Å; L285-E289 PolarHBondContact O-N 3.13Å; V286-E289 PolarHBondContact O-N 3.46Å; E289-P293 WeakPolarHBondContact O-CD 3.39Å; E289-V302 HydrophobicContact CB-CG1 4.04Å; E289-F306 HydrophobicContact CB-CE2 3.73Å; E289-F306 HydrophobicContact CB-CZ 4.23Å; E289-F306 HydrophobicContact CG-CE2 4.18Å; E289-F306 HydrophobicContact CG-CZ 4.18Å; E289-Y448 PolarHBondContact OE1-OH 3.07Å
290	I	97.1	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-75.1	-39.4	177.4	-65.7	163.7	0	0	0	111.8	V286 A287 T288 R299 V302 I303 M329 V334 L337	V286-I290 HydrophobicContact CG1-CD1 3.85Å; V286-I290 WeakPolarHBondContact O-CD1 3.22Å; V286-I290 VanDerWaalsContact O-CG1 3.31Å; V286-I290 WeakPolarHBondContact O-CG1 3.06Å; V286-I290 PolarHBondContact O-N 3.41Å; V286-I290 VanDerWaalsContact O-N 3.1Å; A287-I290 PolarHBondContact O-N 2.87Å; T288-I290 PolarHBondContact O-N 3.39Å; I290-R299 WeakPolarHBondContact O-CD 3.15Å; I290-R299 VanDerWaalsContact O-CG 3.23Å; I290-R299 WeakPolarHBondContact O-CG 3.48Å; I290-V302 HydrophobicContact CG1-CG1 3.86Å; I290-I303 HydrophobicContact CB-CG1 4.47Å; I290-I303 HydrophobicContact CD1-CG1 3.98Å; I290-I303 HydrophobicContact CG1-CG1 3.92Å; I290-I303 HydrophobicContact CG2-CD1 3.94Å; I290-I303 HydrophobicContact CG2-CG1 3.7Å; I290-M329 HydrophobicContact CD1-CG 3.82Å; I290-V334 HydrophobicContact CB-CG1 4.47Å; I290-V334 HydrophobicContact CD1-CG1 4Å; I290-V334 HydrophobicContact CG2-CG1 3.85Å; I290-V334 HydrophobicContact CG2-CG2 4.47Å; I290-L337 HydrophobicContact CG2-CD1 4.46Å
291	C	94.3	Very high	95.3	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.02	20%	0.204	C	C	.	.	H	α-helix	trans	-82.4	-17.2	-177.6	-74.1	0	0	0	0	113.8	A287 T288 F455 L460 A463	A287-C291 WeakPolarHBondContact O-CB 3.3Å; A287-C291 PolarHBondContact O-N 3.38Å; A287-C291 PolarHBondContact O-SG 3.41Å; A287-C291 VanDerWaalsContact O-SG 3.42Å; T288-C291 PolarHBondContact O-N 3.49Å; T288-C291 VanDerWaalsContact O-N 3.16Å; C291-F455 HydrophobicContact CB-CE2 4.43Å; C291-L460 HydrophobicContact CB-CD2 4.33Å; C291-A463 HydrophobicContact CB-CB 4.03Å
292	M	89.8	Confident	95.4	Very high	59 Å²	59	39.6 Å²	39.6	29%	0.291	20%	0.201	S	C	.	.	S	Bend	trans	-69.9	-42.7	-176.5	-173.1	-170.2	-54.6	0	0	113.8	T288 A294	T288-M292 HydrophobicContact CG2-CE 3.91Å; T288-M292 VanDerWaalsContact O-CB 3.23Å; T288-M292 WeakPolarHBondContact O-CB 3.42Å; T288-M292 PolarHBondContact O-N 3.24Å; M292-A294 PolarHBondContact O-N 3.33Å
293	P	90.8	Very high	95.5	Very high	23 Å²	23	39.5 Å²	39.5	15%	0.149	20%	0.201	C	C	.	.			trans	-69.4	124.1	-178.3	-19.7	31.1	0	0	0	112.9	E289 K295 Q298 R299 V302	E289-P293 WeakPolarHBondContact O-CD 3.39Å; P293-K295 VanDerWaalsContact C-N 3.29Å; P293-K295 PolarHBondContact O-N 3.34Å; P293-Q298 HydrophobicContact CB-CB 3.85Å; P293-R299 HydrophobicContact CB-CG 3.83Å; P293-R299 HydrophobicContact CG-CG 4.22Å; P293-R299 WeakPolarHBondContact O-CD 3.42Å; P293-R299 WeakPolarHBondContact O-CG 3.45Å; P293-R299 PolarHBondContact O-NH1 3.15Å; P293-V302 HydrophobicContact CG-CG2 4.22Å
294	A	88.3	Confident	95.5	Very high	89 Å²	89	42 Å²	42	74%	0.736	21%	0.212	S	C	*	.	S	Bend	trans	-64.3	-33	176.9	0	0	0	0	0	112.8	M292 R299	M292-A294 PolarHBondContact O-N 3.33Å; A294-R299 PolarHBondContact O-NH1 2.55Å
295	K	91.6	Very high	95.7	Very high	143 Å²	143	39.7 Å²	39.7	62%	0.622	20%	0.203	S	C	*	.	S	Bend	trans	-87.4	124.4	-176.9	-63.2	-179	-178.9	175.4	0	111.2	P293 K297 Q298 R299	P293-K295 VanDerWaalsContact C-N 3.29Å; P293-K295 PolarHBondContact O-N 3.34Å; K295-K297 VanDerWaalsContact C-N 3.28Å; K295-K297 PolarHBondContact O-N 3.26Å; K295-K297 VanDerWaalsContact O-N 3.14Å; K295-Q298 HydrophobicContact CB-CB 4.42Å; K295-Q298 HydrophobicContact CB-CG 4.24Å; K295-Q298 WeakPolarHBondContact O-CB 3.4Å; K295-Q298 PolarHBondContact O-N 2.92Å; K295-R299 PolarHBondContact O-N 3.33Å; K295-R299 VanDerWaalsContact O-N 3.15Å
296	K	95.3	Very high	95.8	Very high	82 Å²	82	39.7 Å²	39.7	36%	0.357	20%	0.203	S	C	.	.	H	α-helix	trans	-47.9	-43.1	176.1	-172	176.7	76.3	172.4	0	114.7	Q298 R299 A300 K339	K296-Q298 VanDerWaalsContact C-N 3.34Å; K296-Q298 PolarHBondContact O-N 3.49Å; K296-R299 PolarHBondContact O-N 3.26Å; K296-A300 PolarHBondContact O-N 3.38Å; K296-K339 HydrophobicContact CD-CB 3.92Å; K296-K339 WeakPolarHBondContact CD-O 3.45Å
297	K	96.1	Very high	95.8	Very high	174 Å²	174	39.9 Å²	39.9	76%	0.757	20%	0.204	S	C	*	.	H	α-helix	trans	-63.8	-39.2	179.8	-174.4	179.2	177.2	-177.1	0	111.8	K295 A300 T301	K295-K297 VanDerWaalsContact C-N 3.28Å; K295-K297 PolarHBondContact O-N 3.26Å; K295-K297 VanDerWaalsContact O-N 3.14Å; K297-A300 PolarHBondContact O-N 2.86Å; K297-T301 PolarHBondContact O-N 3.33Å; K297-T301 PolarHBondContact O-OG1 2.99Å
298	Q	95.3	Very high	95.8	Very high	99 Å²	99	41.7 Å²	41.7	46%	0.463	21%	0.214	S	C	.	.	H	α-helix	trans	-68.7	-42.9	178.1	-70.3	172.8	-30	0	0	110.8	P293 K295 K296 A300 T301 V302	P293-Q298 HydrophobicContact CB-CB 3.85Å; K295-Q298 HydrophobicContact CB-CB 4.42Å; K295-Q298 HydrophobicContact CB-CG 4.24Å; K295-Q298 WeakPolarHBondContact O-CB 3.4Å; K295-Q298 PolarHBondContact O-N 2.92Å; K296-Q298 VanDerWaalsContact C-N 3.34Å; K296-Q298 PolarHBondContact O-N 3.49Å; Q298-A300 VanDerWaalsContact C-N 3.31Å; Q298-A300 PolarHBondContact O-N 3.11Å; Q298-T301 WeakPolarHBondContact O-CB 2.98Å; Q298-T301 PolarHBondContact O-N 3.4Å; Q298-T301 VanDerWaalsContact O-N 3.1Å; Q298-V302 WeakPolarHBondContact O-CG2 3.5Å; Q298-V302 PolarHBondContact O-N 3Å
299	R	97.1	Very high	96	Very high	5 Å²	5	41.7 Å²	41.7	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-44	173.9	-62.9	-165.6	-65.8	-92.6	10.6	112.4	I290 P293 A294 K295 K296 T301 V302 I303 T340 S467 E468	I290-R299 WeakPolarHBondContact O-CD 3.15Å; I290-R299 VanDerWaalsContact O-CG 3.23Å; I290-R299 WeakPolarHBondContact O-CG 3.48Å; P293-R299 HydrophobicContact CB-CG 3.83Å; P293-R299 HydrophobicContact CG-CG 4.22Å; P293-R299 WeakPolarHBondContact O-CD 3.42Å; P293-R299 WeakPolarHBondContact O-CG 3.45Å; P293-R299 PolarHBondContact O-NH1 3.15Å; A294-R299 PolarHBondContact O-NH1 2.55Å; K295-R299 PolarHBondContact O-N 3.33Å; K295-R299 VanDerWaalsContact O-N 3.15Å; K296-R299 PolarHBondContact O-N 3.26Å; R299-T301 VanDerWaalsContact C-N 3.31Å; R299-T301 PolarHBondContact O-N 3.09Å; R299-V302 PolarHBondContact O-N 3.06Å; R299-I303 WeakPolarHBondContact O-CG1 2.8Å; R299-I303 PolarHBondContact O-N 2.94Å; R299-T340 HydrophobicContact CB-CG2 3.53Å; R299-T340 PolarHBondContact NE-OG1 2.71Å; R299-T340 PolarHBondContact NH2-OG1 3.01Å; R299-S467 PolarHBondContact NH1-OG 2.94Å; R299-S467 PolarHBondContact NH2-O 3.03Å; R299-E468 IonicContact NH2-OE1 3.53Å
300	A	98.2	Very high	96.2	Very high	5 Å²	5	41.5 Å²	41.5	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-59.6	-41.5	176	0	0	0	0	0	111.8	K296 K297 Q298 I303 E304 T340 K343	K296-A300 PolarHBondContact O-N 3.38Å; K297-A300 PolarHBondContact O-N 2.86Å; Q298-A300 VanDerWaalsContact C-N 3.31Å; Q298-A300 PolarHBondContact O-N 3.11Å; A300-I303 PolarHBondContact O-N 3.38Å; A300-E304 WeakPolarHBondContact O-CG 3.45Å; A300-E304 PolarHBondContact O-N 2.66Å; A300-T340 HydrophobicContact CB-CG2 4.31Å; A300-K343 HydrophobicContact CB-CB 3.96Å
301	T	97.8	Very high	96.2	Very high	67 Å²	67	45.1 Å²	45.1	41%	0.411	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-42.2	174.1	-59.4	0	0	0	0	112.6	L215 K297 Q298 R299 E304 F305	L215-T301 HydrophobicContact CD1-CG2 4.14Å; K297-T301 PolarHBondContact O-N 3.33Å; K297-T301 PolarHBondContact O-OG1 2.99Å; Q298-T301 WeakPolarHBondContact O-CB 2.98Å; Q298-T301 PolarHBondContact O-N 3.4Å; Q298-T301 VanDerWaalsContact O-N 3.1Å; R299-T301 VanDerWaalsContact C-N 3.31Å; R299-T301 PolarHBondContact O-N 3.09Å; T301-E304 PolarHBondContact O-N 2.79Å; T301-F305 WeakPolarHBondContact O-CB 3.38Å; T301-F305 PolarHBondContact O-N 3.26Å
302	V	98.1	Very high	96.5	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-41.8	176.4	177.7	0	0	0	0	111.2	L215 E289 I290 P293 Q298 R299 F305 F306	L215-V302 HydrophobicContact CD1-CG2 3.7Å; L215-V302 HydrophobicContact CG-CG2 4.45Å; E289-V302 HydrophobicContact CB-CG1 4.04Å; I290-V302 HydrophobicContact CG1-CG1 3.86Å; P293-V302 HydrophobicContact CG-CG2 4.22Å; Q298-V302 WeakPolarHBondContact O-CG2 3.5Å; Q298-V302 PolarHBondContact O-N 3Å; R299-V302 PolarHBondContact O-N 3.06Å; V302-F305 WeakPolarHBondContact O-CB 3.05Å; V302-F305 PolarHBondContact O-N 3.35Å; V302-F306 HydrophobicContact CG1-CD2 3.76Å; V302-F306 HydrophobicContact CG1-CE2 3.73Å; V302-F306 WeakPolarHBondContact O-CD2 3.19Å; V302-F306 PolarHBondContact O-N 2.79Å
303	I	98.6	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-48.8	175.2	-65.7	169.6	0	0	0	110.6	I290 R299 A300 F305 F306 I307 M329 T340 W341 T344	I290-I303 HydrophobicContact CB-CG1 4.47Å; I290-I303 HydrophobicContact CD1-CG1 3.98Å; I290-I303 HydrophobicContact CG1-CG1 3.92Å; I290-I303 HydrophobicContact CG2-CD1 3.94Å; I290-I303 HydrophobicContact CG2-CG1 3.7Å; R299-I303 WeakPolarHBondContact O-CG1 2.8Å; R299-I303 PolarHBondContact O-N 2.94Å; A300-I303 PolarHBondContact O-N 3.38Å; I303-F305 VanDerWaalsContact C-N 3.29Å; I303-F305 PolarHBondContact O-N 3.26Å; I303-F306 PolarHBondContact O-N 2.83Å; I303-I307 HydrophobicContact CG2-CD1 3.81Å; I303-I307 HydrophobicContact CG2-CG1 4.39Å; I303-I307 VanDerWaalsContact O-CG1 3.29Å; I303-I307 WeakPolarHBondContact O-CG1 3.26Å; I303-I307 PolarHBondContact O-N 3.46Å; I303-M329 HydrophobicContact CG2-SD 4.3Å; I303-T340 HydrophobicContact CD1-CG2 3.76Å; I303-W341 HydrophobicContact CD1-CD2 4.34Å; I303-W341 HydrophobicContact CD1-CZ2 4.37Å; I303-W341 HydrophobicContact CG2-CE3 4.25Å; I303-W341 HydrophobicContact CG2-CH2 3.8Å; I303-W341 HydrophobicContact CG2-CZ3 3.62Å; I303-T344 HydrophobicContact CB-CG2 4.27Å; I303-T344 HydrophobicContact CG2-CG2 3.57Å
304	E	98.4	Very high	97.3	Very high	56 Å²	56	43.9 Å²	43.9	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-60.7	-39.2	179	-70.3	-176.2	158.2	0	0	112.2	A300 T301 I307 D308 T344 K345	A300-E304 WeakPolarHBondContact O-CG 3.45Å; A300-E304 PolarHBondContact O-N 2.66Å; T301-E304 PolarHBondContact O-N 2.79Å; E304-I307 PolarHBondContact O-N 3.43Å; E304-D308 PolarHBondContact O-N 3.07Å; E304-D308 VanDerWaalsContact O-N 3.11Å; E304-T344 HydrophobicContact CG-CG2 3.8Å; E304-K345 PolarHBondContact OE1-N 3.29Å
305	F	98.7	Very high	97.7	Very high	15 Å²	15	43.6 Å²	43.6	7%	0.066	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-51.9	173.8	174.1	-102	0	0	0	111.8	M214 L215 C218 P221 L224 T301 V302 I303 I307 D308 V309	M214-F305 HydrophobicContact CG-CE1 4.02Å; L215-F305 HydrophobicContact CD2-CB 3.96Å; L215-F305 HydrophobicContact CD2-CD1 3.76Å; L215-F305 HydrophobicContact CD2-CD2 3.64Å; L215-F305 HydrophobicContact CD2-CE1 4.09Å; L215-F305 HydrophobicContact CD2-CE2 3.99Å; L215-F305 HydrophobicContact CD2-CG 3.51Å; L215-F305 HydrophobicContact CD2-CZ 4.2Å; C218-F305 WeakPolarHBondContact O-CZ 3.22Å; P221-F305 HydrophobicContact CB-CD2 4.16Å; P221-F305 HydrophobicContact CB-CE2 4.04Å; L224-F305 HydrophobicContact CB-CZ 4.19Å; L224-F305 HydrophobicContact CD2-CE1 3.44Å; L224-F305 VanDerWaalsContact CD2-CE1 3.44Å; L224-F305 HydrophobicContact CD2-CZ 3.66Å; T301-F305 WeakPolarHBondContact O-CB 3.38Å; T301-F305 PolarHBondContact O-N 3.26Å; V302-F305 WeakPolarHBondContact O-CB 3.05Å; V302-F305 PolarHBondContact O-N 3.35Å; I303-F305 VanDerWaalsContact C-N 3.29Å; I303-F305 PolarHBondContact O-N 3.26Å; F305-I307 VanDerWaalsContact C-N 3.3Å; F305-I307 PolarHBondContact O-N 2.78Å; F305-D308 PolarHBondContact O-N 2.97Å; F305-V309 HydrophobicContact CD1-CG2 4.13Å; F305-V309 HydrophobicContact CE1-CG2 3.85Å; F305-V309 HydrophobicContact CE2-CG2 4.32Å; F305-V309 HydrophobicContact CG-CG2 4.5Å; F305-V309 HydrophobicContact CZ-CG2 3.95Å; F305-V309 VanDerWaalsContact O-CG2 3.3Å; F305-V309 WeakPolarHBondContact O-CG2 3.21Å; F305-V309 PolarHBondContact O-N 2.98Å
306	F	98.8	Very high	98	Very high	2 Å²	2	37 Å²	37	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-66.4	-28.9	179.1	-81.8	-65.7	0	0	0	113.7	M214 L224 V286 E289 V302 I303 D308 V309 A310 I325	M214-F306 HydrophobicContact CG-CZ 4.48Å; L224-F306 HydrophobicContact CD2-CE1 4.12Å; V286-F306 HydrophobicContact CG1-CD1 4.39Å; V286-F306 HydrophobicContact CG1-CD2 4.18Å; V286-F306 HydrophobicContact CG1-CG 4.11Å; V286-F306 HydrophobicContact CG2-CD1 3.87Å; V286-F306 HydrophobicContact CG2-CE1 3.71Å; V286-F306 HydrophobicContact CG2-CG 4.41Å; V286-F306 HydrophobicContact CG2-CZ 4.11Å; E289-F306 HydrophobicContact CB-CE2 3.73Å; E289-F306 HydrophobicContact CB-CZ 4.23Å; E289-F306 HydrophobicContact CG-CE2 4.18Å; E289-F306 HydrophobicContact CG-CZ 4.18Å; V302-F306 HydrophobicContact CG1-CD2 3.76Å; V302-F306 HydrophobicContact CG1-CE2 3.73Å; V302-F306 WeakPolarHBondContact O-CD2 3.19Å; V302-F306 PolarHBondContact O-N 2.79Å; I303-F306 PolarHBondContact O-N 2.83Å; F306-D308 VanDerWaalsContact C-N 3.33Å; F306-V309 PolarHBondContact O-N 3.46Å; F306-A310 VanDerWaalsContact O-CB 3.28Å; F306-A310 WeakPolarHBondContact O-CB 3.26Å; F306-A310 PolarHBondContact O-N 2.58Å; F306-I325 HydrophobicContact CB-CG2 4.05Å; F306-I325 HydrophobicContact CD1-CG2 4.39Å
307	I	98.8	Very high	98.2	Very high	3 Å²	3	33 Å²	33	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-44	170.2	-70.3	165.7	0	0	0	110.5	I303 E304 F305 A310 R311 M329 T344 K348 F349 L352	I303-I307 HydrophobicContact CG2-CD1 3.81Å; I303-I307 HydrophobicContact CG2-CG1 4.39Å; I303-I307 VanDerWaalsContact O-CG1 3.29Å; I303-I307 WeakPolarHBondContact O-CG1 3.26Å; I303-I307 PolarHBondContact O-N 3.46Å; E304-I307 PolarHBondContact O-N 3.43Å; F305-I307 VanDerWaalsContact C-N 3.3Å; F305-I307 PolarHBondContact O-N 2.78Å; I307-A310 PolarHBondContact O-N 3.41Å; I307-R311 WeakPolarHBondContact O-CB 3.35Å; I307-R311 PolarHBondContact O-N 3.38Å; I307-M329 HydrophobicContact CG1-CE 4.26Å; I307-M329 HydrophobicContact CG1-SD 4.07Å; I307-T344 HydrophobicContact CD1-CG2 3.91Å; I307-K348 HydrophobicContact CG2-CB 3.58Å; I307-K348 HydrophobicContact CG2-CD 4.23Å; I307-F349 HydrophobicContact CD1-CB 3.77Å; I307-F349 HydrophobicContact CD1-CG 4.43Å; I307-F349 HydrophobicContact CG1-CB 3.96Å; I307-F349 HydrophobicContact CG1-CD2 4.18Å; I307-F349 HydrophobicContact CG1-CG 4.39Å; I307-L352 HydrophobicContact CG2-CD1 4.41Å
308	D	98.8	Very high	98.3	Very high	38 Å²	38	24.8 Å²	24.8	20%	0.203	12%	0.121	C	C	.	.	H	α-helix	trans	-70.7	-34.6	178.5	-77.1	-33.3	0	0	0	112.2	P221 E304 F305 F306 R311 E312 K348	P221-D308 HydrophobicContact CB-CB 3.81Å; P221-D308 HydrophobicContact CG-CB 3.89Å; E304-D308 PolarHBondContact O-N 3.07Å; E304-D308 VanDerWaalsContact O-N 3.11Å; F305-D308 PolarHBondContact O-N 2.97Å; F306-D308 VanDerWaalsContact C-N 3.33Å; D308-R311 PolarHBondContact O-N 3.03Å; D308-R311 IonicContact OD1-CZ 2.74Å; D308-R311 IonicContact OD1-NE 3.18Å; D308-R311 IonicContact OD1-NH2 3.27Å; D308-E312 PolarHBondContact O-N 3.27Å; D308-K348 IonicContact OD1-NZ 3.45Å; D308-K348 PolarHBondContact OD1-NZ 3.5Å; D308-K348 IonicContact OD2-NZ 3.93Å
309	V	98.9	Very high	98.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.3	-47.9	171.2	178.6	0	0	0	0	110.8	P221 L224 A225 L228 F305 F306 R311 E312 C313 I325	P221-V309 HydrophobicContact CB-CB 4.49Å; P221-V309 HydrophobicContact CB-CG2 3.64Å; L224-V309 HydrophobicContact CB-CG1 4.48Å; L224-V309 HydrophobicContact CB-CG2 4.22Å; L224-V309 HydrophobicContact CD2-CG1 4.29Å; L224-V309 HydrophobicContact CD2-CG2 3.91Å; L224-V309 HydrophobicContact CG-CG1 4.23Å; L224-V309 HydrophobicContact CG-CG2 4.38Å; A225-V309 HydrophobicContact CB-CG1 4.21Å; L228-V309 HydrophobicContact CD1-CG1 3.83Å; F305-V309 HydrophobicContact CD1-CG2 4.13Å; F305-V309 HydrophobicContact CE1-CG2 3.85Å; F305-V309 HydrophobicContact CE2-CG2 4.32Å; F305-V309 HydrophobicContact CG-CG2 4.5Å; F305-V309 HydrophobicContact CZ-CG2 3.95Å; F305-V309 VanDerWaalsContact O-CG2 3.3Å; F305-V309 WeakPolarHBondContact O-CG2 3.21Å; F305-V309 PolarHBondContact O-N 2.98Å; F306-V309 PolarHBondContact O-N 3.46Å; V309-R311 VanDerWaalsContact C-N 3.32Å; V309-R311 PolarHBondContact O-N 3.36Å; V309-E312 PolarHBondContact O-N 3Å; V309-E312 VanDerWaalsContact O-N 3.13Å; V309-C313 PolarHBondContact O-N 3.21Å; V309-C313 PolarHBondContact O-SG 3.05Å; V309-I325 HydrophobicContact CB-CD1 4.36Å; V309-I325 HydrophobicContact CG1-CD1 3.72Å
310	A	98.9	Very high	98.6	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-42.9	178.6	0	0	0	0	0	111.5	F306 I307 E312 C313 F314 L322 I325 L352	F306-A310 VanDerWaalsContact O-CB 3.28Å; F306-A310 WeakPolarHBondContact O-CB 3.26Å; F306-A310 PolarHBondContact O-N 2.58Å; I307-A310 PolarHBondContact O-N 3.41Å; A310-E312 VanDerWaalsContact C-N 3.31Å; A310-E312 PolarHBondContact O-N 3.34Å; A310-C313 WeakPolarHBondContact O-CB 3.02Å; A310-C313 PolarHBondContact O-N 3.16Å; A310-F314 PolarHBondContact O-N 2.81Å; A310-L322 HydrophobicContact CB-CD1 3.85Å; A310-L322 WeakPolarHBondContact O-CD1 3.48Å; A310-I325 HydrophobicContact CB-CB 4.24Å; A310-I325 HydrophobicContact CB-CD1 4.29Å; A310-I325 HydrophobicContact CB-CG2 3.82Å; A310-L352 HydrophobicContact CB-CD1 3.85Å
311	R	98.8	Very high	98.6	Very high	77 Å²	77	19.7 Å²	19.7	29%	0.291	10%	0.097	S	C	.	.	H	α-helix	trans	-59.4	-42.3	174	-174.9	-174.8	64	162.4	2.2	112	Y222 I307 D308 V309 F314 N315 L352	Y222-R311 PolarHBondContact OH-NH2 3.29Å; I307-R311 WeakPolarHBondContact O-CB 3.35Å; I307-R311 PolarHBondContact O-N 3.38Å; D308-R311 PolarHBondContact O-N 3.03Å; D308-R311 IonicContact OD1-CZ 2.74Å; D308-R311 IonicContact OD1-NE 3.18Å; D308-R311 IonicContact OD1-NH2 3.27Å; V309-R311 VanDerWaalsContact C-N 3.32Å; V309-R311 PolarHBondContact O-N 3.36Å; R311-F314 WeakPolarHBondContact O-CB 3.31Å; R311-F314 PolarHBondContact O-N 3.04Å; R311-N315 PolarHBondContact O-N 3.34Å; R311-N315 VanDerWaalsContact O-N 3.08Å; R311-N315 PolarHBondContact O-ND2 2.88Å; R311-L352 HydrophobicContact CB-CD1 4.21Å; R311-L352 HydrophobicContact CB-CD2 4.36Å
312	E	98.8	Very high	98.6	Very high	5 Å²	5	16.5 Å²	16.5	2%	0.023	8%	0.078	C	C	.	.	H	α-helix	trans	-70.3	-34	177.4	-172.1	59.8	-166.4	0	0	112.3	Y222 A225 D308 V309 A310 F314 N315 I316 R383	Y222-E312 HydrophobicContact CD1-CB 4.34Å; Y222-E312 VanDerWaalsContact CD1-CD 3.42Å; Y222-E312 HydrophobicContact CD1-CG 3.71Å; Y222-E312 WeakPolarHBondContact CD1-OE2 3.43Å; Y222-E312 HydrophobicContact CE1-CG 4.29Å; Y222-E312 VanDerWaalsContact CE1-OE2 3.28Å; Y222-E312 WeakPolarHBondContact CE1-OE2 3.36Å; Y222-E312 HydrophobicContact CG-CG 4.44Å; A225-E312 HydrophobicContact CB-CB 3.72Å; A225-E312 HydrophobicContact CB-CG 3.72Å; D308-E312 PolarHBondContact O-N 3.27Å; V309-E312 PolarHBondContact O-N 3Å; V309-E312 VanDerWaalsContact O-N 3.13Å; A310-E312 VanDerWaalsContact C-N 3.31Å; A310-E312 PolarHBondContact O-N 3.34Å; E312-F314 VanDerWaalsContact C-N 3.3Å; E312-F314 PolarHBondContact O-N 2.97Å; E312-N315 PolarHBondContact O-N 3.4Å; E312-N315 VanDerWaalsContact O-N 3.14Å; E312-N315 PolarHBondContact OE2-ND2 3.41Å; E312-I316 HydrophobicContact CG-CD1 3.92Å; E312-I316 HydrophobicContact CG-CG1 4.31Å; E312-I316 WeakPolarHBondContact O-CG1 3.14Å; E312-I316 PolarHBondContact O-N 2.92Å; E312-R383 IonicContact OE1-NH2 3.56Å; E312-R383 PolarHBondContact OE1-NH2 2.99Å; E312-R383 VanDerWaalsContact OE1-NH2 3.12Å
313	C	98.9	Very high	98.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.4	-44.2	170	-64.7	0	0	0	0	111	V309 A310 N315 I316 G317 N318 L322	V309-C313 PolarHBondContact O-N 3.21Å; V309-C313 PolarHBondContact O-SG 3.05Å; A310-C313 WeakPolarHBondContact O-CB 3.02Å; A310-C313 PolarHBondContact O-N 3.16Å; C313-N315 PolarHBondContact O-N 3.33Å; C313-I316 PolarHBondContact O-N 2.93Å; C313-G317 PolarHBondContact O-N 2.89Å; C313-G317 VanDerWaalsContact O-N 3.15Å; C313-N318 HydrophobicContact CB-CB 4.17Å; C313-N318 WeakPolarHBondContact CB-O 3.29Å; C313-N318 WeakPolarHBondContact O-CA 3.37Å; C313-N318 PolarHBondContact O-N 2.87Å; C313-L322 HydrophobicContact CB-CB 4.05Å
314	F	98.7	Very high	98.7	Very high	53 Å²	53	17.6 Å²	17.6	23%	0.232	8%	0.083	C	C	.	.	H	α-helix	trans	-58.3	-46.7	173.4	-175.8	-89.5	0	0	0	112.2	A310 R311 E312 I316 G317 F319 L322 L352 Q355 A368	A310-F314 PolarHBondContact O-N 2.81Å; R311-F314 WeakPolarHBondContact O-CB 3.31Å; R311-F314 PolarHBondContact O-N 3.04Å; E312-F314 VanDerWaalsContact C-N 3.3Å; E312-F314 PolarHBondContact O-N 2.97Å; F314-I316 VanDerWaalsContact C-N 3.35Å; F314-I316 PolarHBondContact O-N 3.17Å; F314-G317 PolarHBondContact O-N 3.27Å; F314-G317 VanDerWaalsContact O-N 3.14Å; F314-F319 HydrophobicContact CD2-CD1 4.34Å; F314-F319 AromaticContact CD2-CE1 3.92Å; F314-F319 HydrophobicContact CD2-CE1 3.92Å; F314-F319 AromaticContact CE2-CE1 3.98Å; F314-F319 HydrophobicContact CE2-CE1 3.98Å; F314-L322 HydrophobicContact CB-CD2 3.94Å; F314-L322 HydrophobicContact CD2-CD2 3.69Å; F314-L322 HydrophobicContact CG-CD2 4.31Å; F314-L352 HydrophobicContact CB-CD2 4.36Å; F314-Q355 HydrophobicContact CE2-CB 4.03Å; F314-Q355 HydrophobicContact CE2-CG 3.98Å; F314-Q355 HydrophobicContact CZ-CG 4.31Å; F314-A368 HydrophobicContact CE2-CB 3.94Å; F314-A368 HydrophobicContact CZ-CB 4.06Å
315	N	98	Very high	98.7	Very high	84 Å²	84	15 Å²	15	45%	0.449	7%	0.07	S	C	.	.	H	α-helix	trans	-62.4	-40.2	-179.9	-66.4	-23.9	0	0	0	112.7	R311 E312 C313 G317	R311-N315 PolarHBondContact O-N 3.34Å; R311-N315 VanDerWaalsContact O-N 3.08Å; R311-N315 PolarHBondContact O-ND2 2.88Å; E312-N315 PolarHBondContact O-N 3.4Å; E312-N315 VanDerWaalsContact O-N 3.14Å; E312-N315 PolarHBondContact OE2-ND2 3.41Å; C313-N315 PolarHBondContact O-N 3.33Å; N315-G317 PolarHBondContact O-N 3.33Å
316	I	98.3	Very high	98.7	Very high	3 Å²	3	14.6 Å²	14.6	2%	0.015	7%	0.069	C	C	.	.	H	α-helix	trans	-68.4	-25.5	177.9	-68.9	169.7	0	0	0	111.3	A225 Q226 T229 E312 C313 F314 N318 I386 F439	A225-I316 HydrophobicContact CB-CD1 4.12Å; Q226-I316 HydrophobicContact CG-CD1 4.34Å; T229-I316 HydrophobicContact CG2-CG2 4.13Å; E312-I316 HydrophobicContact CG-CD1 3.92Å; E312-I316 HydrophobicContact CG-CG1 4.31Å; E312-I316 WeakPolarHBondContact O-CG1 3.14Å; E312-I316 PolarHBondContact O-N 2.92Å; C313-I316 PolarHBondContact O-N 2.93Å; F314-I316 VanDerWaalsContact C-N 3.35Å; F314-I316 PolarHBondContact O-N 3.17Å; I316-N318 HydrophobicContact CG2-CB 4.42Å; I316-I386 HydrophobicContact CG2-CB 4.32Å; I316-I386 HydrophobicContact CG2-CD1 3.98Å; I316-I386 HydrophobicContact CG2-CG2 3.88Å; I316-F439 HydrophobicContact CD1-CE2 4.08Å; I316-F439 HydrophobicContact CD1-CZ 3.99Å; I316-F439 HydrophobicContact CG1-CZ 4.1Å; I316-F439 HydrophobicContact CG2-CE2 4.1Å; I316-F439 HydrophobicContact CG2-CZ 4.22Å
317	G	98.2	Very high	98.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	17.6	-167.9	0	0	0	0	0	113	C313 F314 N315 F319 I388	C313-G317 PolarHBondContact O-N 2.89Å; C313-G317 VanDerWaalsContact O-N 3.15Å; F314-G317 PolarHBondContact O-N 3.27Å; F314-G317 VanDerWaalsContact O-N 3.14Å; N315-G317 PolarHBondContact O-N 3.33Å; G317-F319 WeakPolarHBondContact O-CD2 3.46Å; G317-F319 PolarHBondContact O-N 2.88Å; G317-I388 PolarHBondContact O-N 2.96Å
318	N	98.8	Very high	98.7	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	B	Isolated β-bridge	trans	-89	78	173.5	-174.7	-2.7	0	0	0	111.8	T229 C313 I316 S321 L322 I388	T229-N318 PolarHBondContact OG1-ND2 3.23Å; C313-N318 HydrophobicContact CB-CB 4.17Å; C313-N318 WeakPolarHBondContact CB-O 3.29Å; C313-N318 WeakPolarHBondContact O-CA 3.37Å; C313-N318 PolarHBondContact O-N 2.87Å; I316-N318 HydrophobicContact CG2-CB 4.42Å; N318-S321 VanDerWaalsContact ND2-CB 3.34Å; N318-S321 WeakPolarHBondContact ND2-CB 3.15Å; N318-S321 PolarHBondContact ND2-OG 3.25Å; N318-S321 WeakPolarHBondContact OD1-CB 3.43Å; N318-S321 PolarHBondContact OD1-N 2.92Å; N318-S321 PolarHBondContact OD1-OG 3.07Å; N318-L322 WeakPolarHBondContact O-CB 3.47Å; N318-L322 PolarHBondContact O-N 3.42Å; N318-I388 HydrophobicContact CB-CD1 4.26Å
319	F	98.8	Very high	98.7	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.009	7%	0.069	C	C	.	.	H	α-helix	trans	-76.2	-24.7	-177.4	-57.1	-76.2	0	0	0	113	F314 G317 L322 M323 Y365 A368 L369 A372 I388	F314-F319 HydrophobicContact CD2-CD1 4.34Å; F314-F319 AromaticContact CD2-CE1 3.92Å; F314-F319 HydrophobicContact CD2-CE1 3.92Å; F314-F319 AromaticContact CE2-CE1 3.98Å; F314-F319 HydrophobicContact CE2-CE1 3.98Å; G317-F319 WeakPolarHBondContact O-CD2 3.46Å; G317-F319 PolarHBondContact O-N 2.88Å; F319-L322 HydrophobicContact CD1-CD2 4.21Å; F319-M323 WeakPolarHBondContact O-CB 3.49Å; F319-M323 PolarHBondContact O-N 3.49Å; F319-Y365 HydrophobicContact CB-CD2 4.28Å; F319-Y365 HydrophobicContact CB-CE2 3.69Å; F319-Y365 HydrophobicContact CD1-CD2 4.22Å; F319-Y365 HydrophobicContact CD1-CE2 4.26Å; F319-Y365 HydrophobicContact CD2-CE2 4.33Å; F319-Y365 HydrophobicContact CG-CD2 4.27Å; F319-Y365 AromaticContact CG-CE2 3.85Å; F319-Y365 HydrophobicContact CG-CE2 3.85Å; F319-A368 HydrophobicContact CE1-CB 3.9Å; F319-A368 HydrophobicContact CZ-CB 4.14Å; F319-L369 HydrophobicContact CD2-CD1 4.04Å; F319-L369 HydrophobicContact CE2-CD1 4.05Å; F319-A372 HydrophobicContact CE2-CB 3.78Å; F319-A372 HydrophobicContact CZ-CB 4.02Å; F319-I388 WeakPolarHBondContact CB-O 3.35Å; F319-I388 WeakPolarHBondContact CD2-O 3.47Å; F319-I388 PolarHBondContact N-O 3.46Å
320	N	98.8	Very high	98.6	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-67.8	-52.1	178.2	-161.9	60.2	0	0	0	111.7	E232 Y275 L322 M323 A324 I388 P389 F391	E232-N320 PolarHBondContact OE1-ND2 2.89Å; E232-N320 PolarHBondContact OE2-ND2 3Å; Y275-N320 PolarHBondContact OH-ND2 3.25Å; N320-L322 VanDerWaalsContact C-N 3.34Å; N320-L322 PolarHBondContact O-N 3.15Å; N320-M323 PolarHBondContact O-N 3.33Å; N320-A324 PolarHBondContact O-N 3.14Å; N320-I388 HydrophobicContact CB-CG2 3.83Å; N320-P389 WeakPolarHBondContact CB-O 3.42Å; N320-F391 PolarHBondContact OD1-N 3.35Å
321	S	98.8	Very high	98.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.1	-39	175.8	-65.1	0	0	0	0	112.1	E232 N318 M323 A324 I325	E232-S321 VanDerWaalsContact CD-OG 3.28Å; E232-S321 VanDerWaalsContact CG-OG 3.31Å; E232-S321 WeakPolarHBondContact CG-OG 3.48Å; E232-S321 PolarHBondContact OE1-N 2.81Å; E232-S321 PolarHBondContact OE1-OG 2.66Å; N318-S321 VanDerWaalsContact ND2-CB 3.34Å; N318-S321 WeakPolarHBondContact ND2-CB 3.15Å; N318-S321 PolarHBondContact ND2-OG 3.25Å; N318-S321 WeakPolarHBondContact OD1-CB 3.43Å; N318-S321 PolarHBondContact OD1-N 2.92Å; N318-S321 PolarHBondContact OD1-OG 3.07Å; S321-M323 VanDerWaalsContact C-N 3.34Å; S321-M323 PolarHBondContact O-N 3.4Å; S321-A324 PolarHBondContact O-N 2.91Å; S321-I325 WeakPolarHBondContact O-CB 3.43Å; S321-I325 WeakPolarHBondContact O-CD1 3.42Å; S321-I325 VanDerWaalsContact O-CG1 3.26Å; S321-I325 WeakPolarHBondContact O-CG1 3.35Å; S321-I325 PolarHBondContact O-N 3.15Å
322	L	98.9	Very high	98.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-53.2	-52.2	172.6	165.2	63.1	0	0	0	111.1	A310 C313 F314 N318 F319 N320 A324 I325 I326 L352 M356	A310-L322 HydrophobicContact CB-CD1 3.85Å; A310-L322 WeakPolarHBondContact O-CD1 3.48Å; C313-L322 HydrophobicContact CB-CB 4.05Å; F314-L322 HydrophobicContact CB-CD2 3.94Å; F314-L322 HydrophobicContact CD2-CD2 3.69Å; F314-L322 HydrophobicContact CG-CD2 4.31Å; N318-L322 WeakPolarHBondContact O-CB 3.47Å; N318-L322 PolarHBondContact O-N 3.42Å; F319-L322 HydrophobicContact CD1-CD2 4.21Å; N320-L322 VanDerWaalsContact C-N 3.34Å; N320-L322 PolarHBondContact O-N 3.15Å; L322-A324 VanDerWaalsContact C-N 3.33Å; L322-A324 PolarHBondContact O-N 2.78Å; L322-I325 PolarHBondContact O-N 3.14Å; L322-I326 HydrophobicContact CD1-CD1 3.64Å; L322-I326 HydrophobicContact CD1-CG1 4.21Å; L322-I326 HydrophobicContact CG-CD1 4.08Å; L322-I326 WeakPolarHBondContact O-CG1 3.36Å; L322-I326 PolarHBondContact O-N 3.42Å; L322-L352 HydrophobicContact CD1-CB 4.38Å; L322-L352 HydrophobicContact CD1-CD2 4.09Å; L322-M356 HydrophobicContact CD2-CG 3.82Å; L322-M356 HydrophobicContact CD2-SD 3.63Å; L322-M356 HydrophobicContact CG-CG 4Å; L322-M356 HydrophobicContact CG-SD 4.24Å
323	M	98.8	Very high	98.3	Very high	31 Å²	31	19.2 Å²	19.2	15%	0.153	10%	0.104	C	C	.	.	H	α-helix	trans	-64.1	-38.9	-179.8	-171.5	55.7	-176.6	0	0	111.8	F279 F319 N320 S321 I326 S327 M356 F390	F279-M323 HydrophobicContact CE2-CB 4.07Å; F279-M323 HydrophobicContact CE2-CG 4.15Å; F279-M323 HydrophobicContact CZ-CB 4.46Å; F279-M323 HydrophobicContact CZ-CG 4.09Å; F319-M323 WeakPolarHBondContact O-CB 3.49Å; F319-M323 PolarHBondContact O-N 3.49Å; N320-M323 PolarHBondContact O-N 3.33Å; S321-M323 VanDerWaalsContact C-N 3.34Å; S321-M323 PolarHBondContact O-N 3.4Å; M323-I326 PolarHBondContact O-N 2.86Å; M323-S327 VanDerWaalsContact O-CB 3.23Å; M323-S327 WeakPolarHBondContact O-CB 3.48Å; M323-S327 PolarHBondContact O-N 2.91Å; M323-S327 PolarHBondContact O-OG 3.36Å; M323-M356 HydrophobicContact CB-CE 3.89Å; M323-M356 HydrophobicContact CG-CE 4.19Å; M323-M356 HydrophobicContact SD-CB 3.98Å; M323-M356 HydrophobicContact SD-CE 3.95Å; M323-M356 HydrophobicContact SD-CG 4.47Å; M323-F390 HydrophobicContact CB-CD2 3.94Å; M323-F390 HydrophobicContact CB-CE2 4.26Å; M323-F390 HydrophobicContact CB-CG 4.32Å; M323-F390 HydrophobicContact CE-CE1 4.31Å; M323-F390 HydrophobicContact CE-CZ 4.19Å; M323-F390 HydrophobicContact CG-CD1 4.33Å; M323-F390 HydrophobicContact CG-CD2 3.73Å; M323-F390 HydrophobicContact CG-CE1 4.21Å; M323-F390 HydrophobicContact CG-CE2 3.59Å; M323-F390 HydrophobicContact CG-CG 4.12Å; M323-F390 HydrophobicContact CG-CZ 3.84Å
324	A	98.8	Very high	98.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-43.5	177.2	0	0	0	0	0	112	F279 L282 C283 N320 S321 L322 S327 G328	F279-A324 HydrophobicContact CD2-CB 3.75Å; F279-A324 HydrophobicContact CE2-CB 3.64Å; F279-A324 HydrophobicContact CG-CB 4.36Å; F279-A324 HydrophobicContact CZ-CB 4.16Å; L282-A324 HydrophobicContact CB-CB 4.09Å; L282-A324 HydrophobicContact CD2-CB 3.71Å; L282-A324 HydrophobicContact CG-CB 3.87Å; C283-A324 VanDerWaalsContact SG-CA 3.54Å; C283-A324 PolarHBondContact SG-O 3.47Å; N320-A324 PolarHBondContact O-N 3.14Å; S321-A324 PolarHBondContact O-N 2.91Å; L322-A324 VanDerWaalsContact C-N 3.33Å; L322-A324 PolarHBondContact O-N 2.78Å; A324-S327 PolarHBondContact O-N 3.44Å; A324-G328 PolarHBondContact O-N 2.95Å
325	I	98.9	Very high	98.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.9	-46.3	178.2	-67.5	162.7	0	0	0	110.9	L228 V286 F306 V309 A310 S321 L322 S327 G328 M329	L228-I325 HydrophobicContact CD1-CD1 4.03Å; V286-I325 HydrophobicContact CG1-CG2 4.46Å; V286-I325 HydrophobicContact CG2-CB 4.46Å; V286-I325 HydrophobicContact CG2-CG1 4.01Å; F306-I325 HydrophobicContact CB-CG2 4.05Å; F306-I325 HydrophobicContact CD1-CG2 4.39Å; V309-I325 HydrophobicContact CB-CD1 4.36Å; V309-I325 HydrophobicContact CG1-CD1 3.72Å; A310-I325 HydrophobicContact CB-CB 4.24Å; A310-I325 HydrophobicContact CB-CD1 4.29Å; A310-I325 HydrophobicContact CB-CG2 3.82Å; S321-I325 WeakPolarHBondContact O-CB 3.43Å; S321-I325 WeakPolarHBondContact O-CD1 3.42Å; S321-I325 VanDerWaalsContact O-CG1 3.26Å; S321-I325 WeakPolarHBondContact O-CG1 3.35Å; S321-I325 PolarHBondContact O-N 3.15Å; L322-I325 PolarHBondContact O-N 3.14Å; I325-S327 VanDerWaalsContact C-N 3.32Å; I325-S327 PolarHBondContact O-N 3.25Å; I325-G328 PolarHBondContact O-N 3.39Å; I325-M329 HydrophobicContact CG2-CE 3.42Å; I325-M329 VanDerWaalsContact CG2-CE 3.42Å; I325-M329 PolarHBondContact O-N 3.16Å
326	I	98.8	Very high	98.2	Very high	7 Å²	7	14.8 Å²	14.8	4%	0.036	9%	0.085	C	C	.	.	H	α-helix	trans	-58.3	-46.7	174.1	-69.5	168.4	0	0	0	110.4	L322 M323 G328 M329 N330 F349 L352 E353 M356	L322-I326 HydrophobicContact CD1-CD1 3.64Å; L322-I326 HydrophobicContact CD1-CG1 4.21Å; L322-I326 HydrophobicContact CG-CD1 4.08Å; L322-I326 WeakPolarHBondContact O-CG1 3.36Å; L322-I326 PolarHBondContact O-N 3.42Å; M323-I326 PolarHBondContact O-N 2.86Å; I326-G328 VanDerWaalsContact C-N 3.35Å; I326-G328 PolarHBondContact O-N 3.28Å; I326-M329 PolarHBondContact O-N 3.18Å; I326-N330 WeakPolarHBondContact O-CB 3.34Å; I326-N330 PolarHBondContact O-N 3.12Å; I326-F349 HydrophobicContact CG1-CE2 4.36Å; I326-F349 HydrophobicContact CG2-CE2 4.47Å; I326-L352 HydrophobicContact CD1-CB 4.11Å; I326-E353 HydrophobicContact CG2-CG 4.07Å; I326-M356 HydrophobicContact CD1-CB 4.06Å; I326-M356 HydrophobicContact CD1-CG 3.72Å
327	S	98.5	Very high	98.1	Very high	34 Å²	34	14.7 Å²	14.7	24%	0.238	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-42.9	-179.7	-61.4	0	0	0	0	111.8	M323 A324 I325 M329 N330 M331	M323-S327 VanDerWaalsContact O-CB 3.23Å; M323-S327 WeakPolarHBondContact O-CB 3.48Å; M323-S327 PolarHBondContact O-N 2.91Å; M323-S327 PolarHBondContact O-OG 3.36Å; A324-S327 PolarHBondContact O-N 3.44Å; I325-S327 VanDerWaalsContact C-N 3.32Å; I325-S327 PolarHBondContact O-N 3.25Å; S327-M329 PolarHBondContact O-N 2.93Å; S327-N330 PolarHBondContact O-N 3.41Å; S327-M331 WeakPolarHBondContact O-CG 3.42Å; S327-M331 PolarHBondContact O-N 3.46Å; S327-M331 VanDerWaalsContact O-N 3.1Å
328	G	98.4	Very high	98.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.1	-41.2	174.5	0	0	0	0	0	113.1	C283 A324 I325 I326 N330 M331	C283-G328 WeakPolarHBondContact O-CA 3.42Å; A324-G328 PolarHBondContact O-N 2.95Å; I325-G328 PolarHBondContact O-N 3.39Å; I326-G328 VanDerWaalsContact C-N 3.35Å; I326-G328 PolarHBondContact O-N 3.28Å; G328-N330 VanDerWaalsContact C-N 3.33Å; G328-M331 WeakPolarHBondContact O-CB 3.46Å; G328-M331 PolarHBondContact O-N 2.96Å
329	M	98.5	Very high	98	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-29.3	175.8	-72.7	-170.8	-82.6	0	0	113.4	V286 I290 I303 I307 I325 I326 S327 V334 W341 F349	V286-M329 HydrophobicContact CG1-CG 4.06Å; I290-M329 HydrophobicContact CD1-CG 3.82Å; I303-M329 HydrophobicContact CG2-SD 4.3Å; I307-M329 HydrophobicContact CG1-CE 4.26Å; I307-M329 HydrophobicContact CG1-SD 4.07Å; I325-M329 HydrophobicContact CG2-CE 3.42Å; I325-M329 VanDerWaalsContact CG2-CE 3.42Å; I325-M329 PolarHBondContact O-N 3.16Å; I326-M329 PolarHBondContact O-N 3.18Å; S327-M329 PolarHBondContact O-N 2.93Å; M329-V334 WeakPolarHBondContact O-CB 3.42Å; M329-V334 WeakPolarHBondContact O-CG1 3.33Å; M329-W341 HydrophobicContact CB-CH2 4.33Å; M329-W341 HydrophobicContact CB-CZ2 4.5Å; M329-W341 HydrophobicContact SD-CH2 4.35Å; M329-F349 HydrophobicContact CB-CE2 3.96Å; M329-F349 HydrophobicContact CB-CZ 3.97Å; M329-F349 HydrophobicContact CE-CD2 3.66Å; M329-F349 HydrophobicContact CE-CE2 3.44Å; M329-F349 VanDerWaalsContact CE-CE2 3.44Å; M329-F349 HydrophobicContact SD-CD2 4.04Å; M329-F349 HydrophobicContact SD-CE2 3.87Å
330	N	98.1	Very high	98	Very high	68 Å²	68	25.9 Å²	25.9	36%	0.364	13%	0.133	S	C	.	.	H	α-helix	trans	-85.2	-9.9	179.1	-79.5	-19.1	0	0	0	114.4	I326 S327 G328 T332 E353	I326-N330 WeakPolarHBondContact O-CB 3.34Å; I326-N330 PolarHBondContact O-N 3.12Å; S327-N330 PolarHBondContact O-N 3.41Å; G328-N330 VanDerWaalsContact C-N 3.33Å; N330-T332 PolarHBondContact O-N 2.89Å; N330-E353 PolarHBondContact ND2-OE1 3.2Å; N330-E353 PolarHBondContact OD1-OE1 3.27Å
331	M	97.5	Very high	97.9	Very high	43 Å²	43	27.4 Å²	27.4	21%	0.212	14%	0.139	C	C	.	.	S	Bend	trans	-53.3	136.2	169.8	-70.4	-175.7	147.8	0	0	110.8	C283 Y284 A287 S327 G328 P333 V334 S335 L460	C283-M331 HydrophobicContact CB-CE 4.41Å; Y284-M331 HydrophobicContact CD1-CE 4.13Å; Y284-M331 HydrophobicContact CD2-CE 3.73Å; Y284-M331 HydrophobicContact CE1-CE 3.87Å; Y284-M331 HydrophobicContact CE2-CE 3.46Å; Y284-M331 VanDerWaalsContact CE2-CE 3.46Å; Y284-M331 HydrophobicContact CG-CE 4.06Å; A287-M331 HydrophobicContact CB-SD 3.69Å; S327-M331 WeakPolarHBondContact O-CG 3.42Å; S327-M331 PolarHBondContact O-N 3.46Å; S327-M331 VanDerWaalsContact O-N 3.1Å; G328-M331 WeakPolarHBondContact O-CB 3.46Å; G328-M331 PolarHBondContact O-N 2.96Å; M331-P333 VanDerWaalsContact C-CD 3.43Å; M331-P333 VanDerWaalsContact C-N 3.34Å; M331-V334 PolarHBondContact O-N 2.66Å; M331-S335 PolarHBondContact O-N 3.4Å; M331-S335 PolarHBondContact O-OG 3.31Å; M331-L460 HydrophobicContact SD-CD1 4.04Å
332	T	96.9	Very high	97.9	Very high	72 Å²	72	31.7 Å²	31.7	44%	0.442	17%	0.169	S	C	.	.	H	α-helix	trans	-51.8	-41.8	-175.9	-50.3	0	0	0	0	114.3	N330 V334 S335 R336 Y461	N330-T332 PolarHBondContact O-N 2.89Å; T332-V334 PolarHBondContact O-N 3Å; T332-S335 WeakPolarHBondContact CA-OG 3.43Å; T332-S335 PolarHBondContact O-N 2.87Å; T332-R336 WeakPolarHBondContact O-CB 3.41Å; T332-R336 WeakPolarHBondContact O-CG 3.4Å; T332-R336 PolarHBondContact O-N 3.16Å; T332-R336 VanDerWaalsContact O-N 3.09Å; T332-Y461 VanDerWaalsContact CB-OH 3.27Å; T332-Y461 WeakPolarHBondContact CB-OH 3.46Å; T332-Y461 HydrophobicContact CG2-CE1 3.97Å
333	P	96	Very high	97.7	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.032	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-28.5	175.5	-27.4	37.7	0	0	0	114.5	M331 L337 L460 Y461 S464	M331-P333 VanDerWaalsContact C-CD 3.43Å; M331-P333 VanDerWaalsContact C-N 3.34Å; P333-L337 WeakPolarHBondContact O-CG 3.26Å; P333-L460 HydrophobicContact CB-CB 3.81Å; P333-L460 HydrophobicContact CG-CB 3.75Å; P333-Y461 HydrophobicContact CG-CD1 3.96Å; P333-Y461 HydrophobicContact CG-CD2 3.62Å; P333-Y461 HydrophobicContact CG-CE1 3.97Å; P333-Y461 HydrophobicContact CG-CE2 3.58Å; P333-Y461 HydrophobicContact CG-CG 3.8Å; P333-S464 WeakPolarHBondContact O-CB 3.48Å; P333-S464 PolarHBondContact O-OG 3.5Å
334	V	98.2	Very high	97.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-90.1	-49.9	178.2	-179.7	0	0	0	0	110.7	A287 I290 M329 M331 T332 R336 L337 W341	A287-V334 HydrophobicContact CB-CG2 3.8Å; I290-V334 HydrophobicContact CB-CG1 4.47Å; I290-V334 HydrophobicContact CD1-CG1 4Å; I290-V334 HydrophobicContact CG2-CG1 3.85Å; I290-V334 HydrophobicContact CG2-CG2 4.47Å; M329-V334 WeakPolarHBondContact O-CB 3.42Å; M329-V334 WeakPolarHBondContact O-CG1 3.33Å; M331-V334 PolarHBondContact O-N 2.66Å; T332-V334 PolarHBondContact O-N 3Å; V334-R336 PolarHBondContact O-N 2.71Å; V334-R336 VanDerWaalsContact O-N 3.17Å; V334-L337 WeakPolarHBondContact O-CB 3.47Å; V334-L337 PolarHBondContact O-N 2.7Å; V334-W341 HydrophobicContact CG1-CZ2 3.98Å; V334-W341 PolarHBondContact O-NE1 3.06Å
335	S	97.4	Very high	97.5	Very high	34 Å²	34	45 Å²	45	24%	0.238	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-19.1	-175	63.5	0	0	0	0	113.9	M331 T332 K338	M331-S335 PolarHBondContact O-N 3.4Å; M331-S335 PolarHBondContact O-OG 3.31Å; T332-S335 WeakPolarHBondContact CA-OG 3.43Å; T332-S335 PolarHBondContact O-N 2.87Å; S335-K338 PolarHBondContact O-NZ 2.86Å
336	R	96.9	Very high	97.2	Very high	11 Å²	11	47 Å²	47	4%	0.042	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.4	172.9	74.4	174.7	-72.1	-76.5	-5	115.2	T332 V334 K338 S464 Y465 E468 S469 E475	T332-R336 WeakPolarHBondContact O-CB 3.41Å; T332-R336 WeakPolarHBondContact O-CG 3.4Å; T332-R336 PolarHBondContact O-N 3.16Å; T332-R336 VanDerWaalsContact O-N 3.09Å; V334-R336 PolarHBondContact O-N 2.71Å; V334-R336 VanDerWaalsContact O-N 3.17Å; R336-K338 PolarHBondContact O-N 3.26Å; R336-S464 VanDerWaalsContact CD-OG 3.25Å; R336-S464 WeakPolarHBondContact CD-OG 3.25Å; R336-S464 VanDerWaalsContact CG-OG 3.29Å; R336-S464 WeakPolarHBondContact CG-OG 3.49Å; R336-S464 PolarHBondContact NH1-O 3.24Å; R336-S464 VanDerWaalsContact NH1-O 3.14Å; R336-S464 PolarHBondContact NH1-OG 3.29Å; R336-Y465 VanDerWaalsContact CZ-CD1 3.42Å; R336-E468 PolarHBondContact NH1-O 3.39Å; R336-E468 PolarHBondContact NH2-O 3.27Å; R336-S469 PolarHBondContact NH2-O 3.38Å; R336-S469 VanDerWaalsContact NH2-O 3.08Å; R336-E475 IonicContact CZ-OE1 3.66Å; R336-E475 IonicContact CZ-OE2 3.39Å; R336-E475 IonicContact NE-OE1 3.12Å; R336-E475 PolarHBondContact NE-OE1 3.11Å; R336-E475 IonicContact NE-OE2 3.37Å; R336-E475 PolarHBondContact NE-OE2 2.86Å; R336-E475 IonicContact NH2-OE1 3.83Å; R336-E475 IonicContact NH2-OE2 2.7Å; R336-E475 PolarHBondContact NH2-OE2 3.46Å
337	L	97.3	Very high	97.2	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.			trans	-75.1	59.5	-176	-61.3	175.7	0	0	0	112.1	I290 P333 V334 K339 T340 W341 S464 E468	I290-L337 HydrophobicContact CG2-CD1 4.46Å; P333-L337 WeakPolarHBondContact O-CG 3.26Å; V334-L337 WeakPolarHBondContact O-CB 3.47Å; V334-L337 PolarHBondContact O-N 2.7Å; L337-K339 PolarHBondContact O-N 3.41Å; L337-T340 WeakPolarHBondContact O-CA 3.28Å; L337-T340 WeakPolarHBondContact O-CB 3.5Å; L337-T340 PolarHBondContact O-N 2.82Å; L337-W341 PolarHBondContact O-N 3.41Å; L337-S464 WeakPolarHBondContact CD2-OG 3.48Å; L337-E468 VanDerWaalsContact C-OE2 3.28Å; L337-E468 HydrophobicContact CD2-CB 3.9Å; L337-E468 HydrophobicContact CD2-CG 3.87Å
338	K	97.1	Very high	97	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.517	27%	0.27	S	S	.	.	H	α-helix	trans	-57.6	-36.4	-169	-59.7	-50.1	-175.7	-168.1	0	112.4	S335 R336 T340 W341 S342 E468	S335-K338 PolarHBondContact O-NZ 2.86Å; R336-K338 PolarHBondContact O-N 3.26Å; K338-T340 VanDerWaalsContact C-N 3.32Å; K338-T340 PolarHBondContact O-N 3.48Å; K338-W341 PolarHBondContact O-N 3.36Å; K338-S342 PolarHBondContact O-N 2.99Å; K338-E468 PolarHBondContact N-OE2 3.32Å
339	K	96.9	Very high	97	Very high	118 Å²	118	52.6 Å²	52.6	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-68.7	-34.9	178	-58.3	172.6	-177.2	168.6	0	111	K296 L337 S342 E468	K296-K339 HydrophobicContact CD-CB 3.92Å; K296-K339 WeakPolarHBondContact CD-O 3.45Å; L337-K339 PolarHBondContact O-N 3.41Å; K339-S342 PolarHBondContact O-OG 3.28Å; K339-E468 VanDerWaalsContact CB-OE2 3.27Å; K339-E468 WeakPolarHBondContact CB-OE2 3.27Å; K339-E468 WeakPolarHBondContact CG-OE2 3.4Å; K339-E468 PolarHBondContact N-OE2 3.03Å
340	T	97.9	Very high	97	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-50.5	173.4	-56.2	0	0	0	0	110.5	R299 A300 I303 L337 K338 S342 K343 E468	R299-T340 HydrophobicContact CB-CG2 3.53Å; R299-T340 PolarHBondContact NE-OG1 2.71Å; R299-T340 PolarHBondContact NH2-OG1 3.01Å; A300-T340 HydrophobicContact CB-CG2 4.31Å; I303-T340 HydrophobicContact CD1-CG2 3.76Å; L337-T340 WeakPolarHBondContact O-CA 3.28Å; L337-T340 WeakPolarHBondContact O-CB 3.5Å; L337-T340 PolarHBondContact O-N 2.82Å; K338-T340 VanDerWaalsContact C-N 3.32Å; K338-T340 PolarHBondContact O-N 3.48Å; T340-S342 VanDerWaalsContact C-N 3.3Å; T340-S342 PolarHBondContact O-N 3.01Å; T340-K343 WeakPolarHBondContact O-CB 3.16Å; T340-K343 PolarHBondContact O-N 3.11Å; T340-E468 WeakPolarHBondContact CB-OE1 3.46Å; T340-E468 PolarHBondContact N-OE1 2.96Å; T340-E468 PolarHBondContact OG1-OE1 3.46Å
341	W	98	Very high	97	Very high	34 Å²	34	60.1 Å²	60.1	13%	0.129	31%	0.305	C	S	.	.	H	α-helix	trans	-58.7	-36.3	179.8	-76.1	106.9	0	0	0	113.6	I303 M329 V334 L337 K338 K343 T344 T346 F349	I303-W341 HydrophobicContact CD1-CD2 4.34Å; I303-W341 HydrophobicContact CD1-CZ2 4.37Å; I303-W341 HydrophobicContact CG2-CE3 4.25Å; I303-W341 HydrophobicContact CG2-CH2 3.8Å; I303-W341 HydrophobicContact CG2-CZ3 3.62Å; M329-W341 HydrophobicContact CB-CH2 4.33Å; M329-W341 HydrophobicContact CB-CZ2 4.5Å; M329-W341 HydrophobicContact SD-CH2 4.35Å; V334-W341 HydrophobicContact CG1-CZ2 3.98Å; V334-W341 PolarHBondContact O-NE1 3.06Å; L337-W341 PolarHBondContact O-N 3.41Å; K338-W341 PolarHBondContact O-N 3.36Å; W341-K343 PolarHBondContact O-N 3.2Å; W341-T344 HydrophobicContact CE3-CG2 4.36Å; W341-T344 HydrophobicContact CZ3-CG2 4.42Å; W341-T344 WeakPolarHBondContact O-CB 3.44Å; W341-T344 PolarHBondContact O-N 3.07Å; W341-T346 HydrophobicContact CE3-CG2 3.75Å; W341-T346 HydrophobicContact CZ3-CG2 4.16Å; W341-F349 HydrophobicContact CH2-CD1 4.27Å; W341-F349 HydrophobicContact CH2-CE1 4.11Å; W341-F349 HydrophobicContact CH2-CZ 4.44Å; W341-F349 HydrophobicContact CZ3-CD1 4.19Å; W341-F349 HydrophobicContact CZ3-CE1 4.45Å
342	S	97.3	Very high	97	Very high	90 Å²	90	58.5 Å²	58.5	63%	0.629	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-10.9	173.3	69.8	0	0	0	0	115	K338 K339 T340	K338-S342 PolarHBondContact O-N 2.99Å; K339-S342 PolarHBondContact O-OG 3.28Å; T340-S342 VanDerWaalsContact C-N 3.3Å; T340-S342 PolarHBondContact O-N 3.01Å
343	K	96.5	Very high	97.1	Very high	134 Å²	134	57.4 Å²	57.4	58%	0.583	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-4.4	175	-67.6	-63.8	-176.8	-175.1	0	113.5	A300 T340 W341	A300-K343 HydrophobicContact CB-CB 3.96Å; T340-K343 WeakPolarHBondContact O-CB 3.16Å; T340-K343 PolarHBondContact O-N 3.11Å; W341-K343 PolarHBondContact O-N 3.2Å
344	T	96.9	Very high	97.1	Very high	12 Å²	12	62.4 Å²	62.4	7%	0.074	31%	0.31	C	S	.	.	S	Bend	trans	-98.3	142.6	-178.1	-61	0	0	0	0	110.2	I303 E304 I307 W341 T346	I303-T344 HydrophobicContact CB-CG2 4.27Å; I303-T344 HydrophobicContact CG2-CG2 3.57Å; E304-T344 HydrophobicContact CG-CG2 3.8Å; I307-T344 HydrophobicContact CD1-CG2 3.91Å; W341-T344 HydrophobicContact CE3-CG2 4.36Å; W341-T344 HydrophobicContact CZ3-CG2 4.42Å; W341-T344 WeakPolarHBondContact O-CB 3.44Å; W341-T344 PolarHBondContact O-N 3.07Å; T344-T346 HydrophobicContact CG2-CG2 4.23Å; T344-T346 PolarHBondContact O-N 3.24Å; T344-T346 VanDerWaalsContact O-N 3.13Å
345	K	94.4	Very high	97.1	Very high	165 Å²	165	64.9 Å²	64.9	72%	0.717	32%	0.322	S	S	*	.			trans	-76.6	91.3	167.7	-65.4	173.8	-175.9	173.1	0	111.3	E304 A347	E304-K345 PolarHBondContact OE1-N 3.29Å; K345-A347 PolarHBondContact O-N 3.03Å
346	T	94.3	Very high	97.2	Very high	40 Å²	40	63.6 Å²	63.6	25%	0.245	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-12	-171.8	53.8	0	0	0	0	115.7	W341 T344 K348 F349 F350	W341-T346 HydrophobicContact CE3-CG2 3.75Å; W341-T346 HydrophobicContact CZ3-CG2 4.16Å; T344-T346 HydrophobicContact CG2-CG2 4.23Å; T344-T346 PolarHBondContact O-N 3.24Å; T344-T346 VanDerWaalsContact O-N 3.13Å; T346-K348 VanDerWaalsContact C-N 3.31Å; T346-K348 PolarHBondContact O-N 3.42Å; T346-F349 WeakPolarHBondContact O-CA 3.3Å; T346-F349 WeakPolarHBondContact O-CB 3.35Å; T346-F349 PolarHBondContact O-N 3.43Å; T346-F350 WeakPolarHBondContact O-CD2 3.33Å; T346-F350 PolarHBondContact O-N 2.88Å; T346-F350 WeakPolarHBondContact OG1-CE2 3.05Å
347	A	97.1	Very high	97.1	Very high	70 Å²	70	65.7 Å²	65.7	58%	0.579	32%	0.324	S	S	*	.	H	α-helix	trans	-55.6	-43	-176	0	0	0	0	0	113.3	K345 F349 I351	K345-A347 PolarHBondContact O-N 3.03Å; A347-F349 VanDerWaalsContact C-N 3.33Å; A347-F349 PolarHBondContact O-N 2.89Å; A347-I351 WeakPolarHBondContact O-CG1 3.4Å; A347-I351 PolarHBondContact O-N 3.05Å
348	K	96	Very high	97	Very high	83 Å²	83	68.7 Å²	68.7	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.9	-69.6	179.8	-178.9	176.1	0	112.1	I307 D308 T346 I351 L352	I307-K348 HydrophobicContact CG2-CB 3.58Å; I307-K348 HydrophobicContact CG2-CD 4.23Å; D308-K348 IonicContact OD1-NZ 3.45Å; D308-K348 PolarHBondContact OD1-NZ 3.5Å; D308-K348 IonicContact OD2-NZ 3.93Å; T346-K348 VanDerWaalsContact C-N 3.31Å; T346-K348 PolarHBondContact O-N 3.42Å; K348-I351 PolarHBondContact O-N 3.43Å; K348-L352 WeakPolarHBondContact O-CG 3.26Å; K348-L352 PolarHBondContact O-N 3.25Å
349	F	97.8	Very high	97	Very high	6 Å²	6	68 Å²	68	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-48.2	179.3	-179.7	-115.6	0	0	0	111.3	I307 I326 M329 W341 T346 A347 I351 L352 E353	I307-F349 HydrophobicContact CD1-CB 3.77Å; I307-F349 HydrophobicContact CD1-CG 4.43Å; I307-F349 HydrophobicContact CG1-CB 3.96Å; I307-F349 HydrophobicContact CG1-CD2 4.18Å; I307-F349 HydrophobicContact CG1-CG 4.39Å; I326-F349 HydrophobicContact CG1-CE2 4.36Å; I326-F349 HydrophobicContact CG2-CE2 4.47Å; M329-F349 HydrophobicContact CB-CE2 3.96Å; M329-F349 HydrophobicContact CB-CZ 3.97Å; M329-F349 HydrophobicContact CE-CD2 3.66Å; M329-F349 HydrophobicContact CE-CE2 3.44Å; M329-F349 VanDerWaalsContact CE-CE2 3.44Å; M329-F349 HydrophobicContact SD-CD2 4.04Å; M329-F349 HydrophobicContact SD-CE2 3.87Å; W341-F349 HydrophobicContact CH2-CD1 4.27Å; W341-F349 HydrophobicContact CH2-CE1 4.11Å; W341-F349 HydrophobicContact CH2-CZ 4.44Å; W341-F349 HydrophobicContact CZ3-CD1 4.19Å; W341-F349 HydrophobicContact CZ3-CE1 4.45Å; T346-F349 WeakPolarHBondContact O-CA 3.3Å; T346-F349 WeakPolarHBondContact O-CB 3.35Å; T346-F349 PolarHBondContact O-N 3.43Å; A347-F349 VanDerWaalsContact C-N 3.33Å; A347-F349 PolarHBondContact O-N 2.89Å; F349-I351 VanDerWaalsContact C-N 3.26Å; F349-I351 PolarHBondContact O-N 3.4Å; F349-L352 WeakPolarHBondContact O-CB 3.42Å; F349-L352 PolarHBondContact O-N 3.36Å; F349-E353 HydrophobicContact CD1-CG 4.26Å; F349-E353 WeakPolarHBondContact CD1-OE2 3.23Å; F349-E353 HydrophobicContact CD2-CG 4.42Å; F349-E353 HydrophobicContact CE1-CG 3.85Å; F349-E353 WeakPolarHBondContact CE1-OE2 3.37Å; F349-E353 HydrophobicContact CE2-CG 4Å; F349-E353 VanDerWaalsContact CZ-CD 3.49Å; F349-E353 HydrophobicContact CZ-CG 3.71Å; F349-E353 PolarHBondContact O-N 3Å
350	F	97.9	Very high	96.9	Very high	120 Å²	120	65.2 Å²	65.2	53%	0.526	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-33.7	178.2	-65.8	-48.9	0	0	0	113.3	T346 E353 H354	T346-F350 WeakPolarHBondContact O-CD2 3.33Å; T346-F350 PolarHBondContact O-N 2.88Å; T346-F350 WeakPolarHBondContact OG1-CE2 3.05Å; F350-E353 VanDerWaalsContact CD1-OE2 3.29Å; F350-E353 WeakPolarHBondContact CD1-OE2 3.33Å; F350-H354 WeakPolarHBondContact O-CB 3.4Å; F350-H354 PolarHBondContact O-N 3.11Å
351	I	98.2	Very high	96.7	Very high	107 Å²	107	69.2 Å²	69.2	55%	0.549	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-45.7	173.2	-66.7	165.6	0	0	0	110.3	A347 K348 F349 H354 Q355	A347-I351 WeakPolarHBondContact O-CG1 3.4Å; A347-I351 PolarHBondContact O-N 3.05Å; K348-I351 PolarHBondContact O-N 3.43Å; F349-I351 VanDerWaalsContact C-N 3.26Å; F349-I351 PolarHBondContact O-N 3.4Å; I351-H354 PolarHBondContact O-N 3.34Å; I351-Q355 WeakPolarHBondContact O-CG 3.32Å; I351-Q355 PolarHBondContact O-N 2.95Å
352	L	98.3	Very high	96.7	Very high	9 Å²	9	68.9 Å²	68.9	5%	0.047	38%	0.375	C	S	.	.	H	α-helix	trans	-66	-40.2	179	-65.5	169.8	0	0	0	112	I307 A310 R311 F314 L322 I326 K348 F349 H354 Q355 M356	I307-L352 HydrophobicContact CG2-CD1 4.41Å; A310-L352 HydrophobicContact CB-CD1 3.85Å; R311-L352 HydrophobicContact CB-CD1 4.21Å; R311-L352 HydrophobicContact CB-CD2 4.36Å; F314-L352 HydrophobicContact CB-CD2 4.36Å; L322-L352 HydrophobicContact CD1-CB 4.38Å; L322-L352 HydrophobicContact CD1-CD2 4.09Å; I326-L352 HydrophobicContact CD1-CB 4.11Å; K348-L352 WeakPolarHBondContact O-CG 3.26Å; K348-L352 PolarHBondContact O-N 3.25Å; F349-L352 WeakPolarHBondContact O-CB 3.42Å; F349-L352 PolarHBondContact O-N 3.36Å; L352-H354 VanDerWaalsContact C-N 3.33Å; L352-H354 PolarHBondContact O-N 2.91Å; L352-Q355 PolarHBondContact O-N 3.46Å; L352-M356 PolarHBondContact O-N 3.25Å
353	E	97.8	Very high	96.8	Very high	48 Å²	48	71.5 Å²	71.5	22%	0.224	37%	0.372	C	S	.	.	H	α-helix	trans	-59.1	-45.6	172.3	-72.1	-168.9	107.3	0	0	111.3	I326 N330 F349 F350 Q355 M356 D357	I326-E353 HydrophobicContact CG2-CG 4.07Å; N330-E353 PolarHBondContact ND2-OE1 3.2Å; N330-E353 PolarHBondContact OD1-OE1 3.27Å; F349-E353 HydrophobicContact CD1-CG 4.26Å; F349-E353 WeakPolarHBondContact CD1-OE2 3.23Å; F349-E353 HydrophobicContact CD2-CG 4.42Å; F349-E353 HydrophobicContact CE1-CG 3.85Å; F349-E353 WeakPolarHBondContact CE1-OE2 3.37Å; F349-E353 HydrophobicContact CE2-CG 4Å; F349-E353 VanDerWaalsContact CZ-CD 3.49Å; F349-E353 HydrophobicContact CZ-CG 3.71Å; F349-E353 PolarHBondContact O-N 3Å; F350-E353 VanDerWaalsContact CD1-OE2 3.29Å; F350-E353 WeakPolarHBondContact CD1-OE2 3.33Å; E353-Q355 VanDerWaalsContact C-N 3.28Å; E353-Q355 PolarHBondContact O-N 2.69Å; E353-M356 CarbonylContact O-C 3.58Å; E353-M356 PolarHBondContact O-N 2.77Å; E353-D357 PolarHBondContact O-N 3.48Å
354	H	97.9	Very high	96.9	Very high	110 Å²	110	67 Å²	67	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-35.4	177.5	-175.9	64.1	0	0	0	112.9	F350 I351 L352 M356 D357 N364	F350-H354 WeakPolarHBondContact O-CB 3.4Å; F350-H354 PolarHBondContact O-N 3.11Å; I351-H354 PolarHBondContact O-N 3.34Å; L352-H354 VanDerWaalsContact C-N 3.33Å; L352-H354 PolarHBondContact O-N 2.91Å; H354-M356 VanDerWaalsContact C-N 3.28Å; H354-M356 PolarHBondContact O-N 3.25Å; H354-D357 WeakPolarHBondContact O-CB 3.27Å; H354-D357 PolarHBondContact O-N 3.47Å; H354-N364 PolarHBondContact CE1-ND2 3.26Å; H354-N364 VanDerWaalsContact CE1-ND2 3.3Å; H354-N364 PolarHBondContact NE2-ND2 3.03Å; H354-N364 VanDerWaalsContact NE2-ND2 3.11Å; H354-N364 PolarHBondContact O-ND2 2.87Å
355	Q	97.9	Very high	96.9	Very high	53 Å²	53	66.6 Å²	66.6	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-31.3	175.2	-69.2	-58.6	-36.4	0	0	112.6	F314 I351 L352 E353 Y365	F314-Q355 HydrophobicContact CE2-CB 4.03Å; F314-Q355 HydrophobicContact CE2-CG 3.98Å; F314-Q355 HydrophobicContact CZ-CG 4.31Å; I351-Q355 WeakPolarHBondContact O-CG 3.32Å; I351-Q355 PolarHBondContact O-N 2.95Å; L352-Q355 PolarHBondContact O-N 3.46Å; E353-Q355 VanDerWaalsContact C-N 3.28Å; E353-Q355 PolarHBondContact O-N 2.69Å; Q355-Y365 WeakPolarHBondContact O-CA 3.42Å; Q355-Y365 WeakPolarHBondContact O-CB 3.26Å; Q355-Y365 PolarHBondContact O-N 3.35Å
356	M	97.8	Very high	97.1	Very high	6 Å²	6	61.3 Å²	61.3	3%	0.03	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	11.2	-178.4	-60.6	-56.7	-58.7	0	0	113.4	L322 M323 I326 L352 E353 H354 F362 Y365 F390	L322-M356 HydrophobicContact CD2-CG 3.82Å; L322-M356 HydrophobicContact CD2-SD 3.63Å; L322-M356 HydrophobicContact CG-CG 4Å; L322-M356 HydrophobicContact CG-SD 4.24Å; M323-M356 HydrophobicContact CB-CE 3.89Å; M323-M356 HydrophobicContact CG-CE 4.19Å; M323-M356 HydrophobicContact SD-CB 3.98Å; M323-M356 HydrophobicContact SD-CE 3.95Å; M323-M356 HydrophobicContact SD-CG 4.47Å; I326-M356 HydrophobicContact CD1-CB 4.06Å; I326-M356 HydrophobicContact CD1-CG 3.72Å; L352-M356 PolarHBondContact O-N 3.25Å; E353-M356 CarbonylContact O-C 3.58Å; E353-M356 PolarHBondContact O-N 2.77Å; H354-M356 VanDerWaalsContact C-N 3.28Å; H354-M356 PolarHBondContact O-N 3.25Å; M356-F362 WeakPolarHBondContact O-CE1 3.3Å; M356-Y365 HydrophobicContact CE-CD2 3.67Å; M356-Y365 HydrophobicContact CE-CE2 4.29Å; M356-Y365 HydrophobicContact CE-CG 4.16Å; M356-Y365 HydrophobicContact SD-CD2 3.82Å; M356-Y365 HydrophobicContact SD-CG 4.38Å; M356-F390 HydrophobicContact CE-CB 4.23Å; M356-F390 HydrophobicContact CE-CG 4.49Å
357	D	95.8	Very high	97.3	Very high	55 Å²	55	62.2 Å²	62.2	29%	0.294	33%	0.333	S	S	.	.			trans	-65.7	136.8	-175.3	-173.6	-89.6	0	0	0	111.7	E353 H354 T359 F362	E353-D357 PolarHBondContact O-N 3.48Å; H354-D357 WeakPolarHBondContact O-CB 3.27Å; H354-D357 PolarHBondContact O-N 3.47Å; D357-T359 VanDerWaalsContact C-N 3.27Å; D357-T359 PolarHBondContact O-N 3.26Å; D357-T359 WeakPolarHBondContact OD1-CA 3.47Å; D357-T359 WeakPolarHBondContact OD1-CB 3.47Å; D357-T359 PolarHBondContact OD1-N 2.91Å; D357-T359 PolarHBondContact OD1-OG1 3.2Å; D357-F362 WeakPolarHBondContact O-CA 3.34Å
358	P	95.5	Very high	97.3	Very high	63 Å²	63	59.8 Å²	59.8	41%	0.409	31%	0.313	S	S	.	.			trans	-73.8	-10.9	-177.2	29.5	-36.1	0	0	0	114.6	N361 F362	P358-N361 PolarHBondContact O-N 3.21Å; P358-F362 HydrophobicContact CB-CD1 4.41Å; P358-F362 HydrophobicContact CB-CD2 4.35Å; P358-F362 HydrophobicContact CB-CE1 3.96Å; P358-F362 HydrophobicContact CB-CE2 3.88Å; P358-F362 HydrophobicContact CB-CZ 3.67Å; P358-F362 PolarHBondContact O-N 3.32Å
359	T	96.1	Very high	97.5	Very high	105 Å²	105	57.1 Å²	57.1	64%	0.644	30%	0.302	S	S	*	.	H	α-helix	trans	-57.1	141	-178.7	-56.8	0	0	0	0	111.3	D357 N361 F362 Y363	D357-T359 VanDerWaalsContact C-N 3.27Å; D357-T359 PolarHBondContact O-N 3.26Å; D357-T359 WeakPolarHBondContact OD1-CA 3.47Å; D357-T359 WeakPolarHBondContact OD1-CB 3.47Å; D357-T359 PolarHBondContact OD1-N 2.91Å; D357-T359 PolarHBondContact OD1-OG1 3.2Å; T359-N361 VanDerWaalsContact C-N 3.26Å; T359-N361 PolarHBondContact O-N 3.33Å; T359-F362 PolarHBondContact O-N 2.93Å; T359-Y363 PolarHBondContact O-N 3.03Å
360	G	95.4	Very high	97.4	Very high	60 Å²	60	63.6 Å²	63.6	62%	0.619	33%	0.327	S	S	*	.	H	α-helix	trans	61.9	34.2	-176.8	0	0	0	0	0	113	Y363	G360-Y363 PolarHBondContact O-N 2.94Å
361	N	94.8	Very high	97.4	Very high	84 Å²	84	59.4 Å²	59.4	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	55.1	51.7	-174.3	-174.5	28.4	0	0	0	112.1	P358 T359 R366	P358-N361 PolarHBondContact O-N 3.21Å; T359-N361 VanDerWaalsContact C-N 3.26Å; T359-N361 PolarHBondContact O-N 3.33Å; N361-R366 PolarHBondContact ND2-NH2 3.29Å; N361-R366 WeakPolarHBondContact O-CD 3.48Å; N361-R366 PolarHBondContact O-NE 2.99Å; N361-R366 PolarHBondContact OD1-NH2 3.16Å
362	F	97.8	Very high	97.4	Very high	27 Å²	27	54.3 Å²	54.3	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	61.4	43.7	-178	-63.4	-95.1	0	0	0	113.7	M356 D357 P358 T359 N364 Y365 R366 F390 L393	M356-F362 WeakPolarHBondContact O-CE1 3.3Å; D357-F362 WeakPolarHBondContact O-CA 3.34Å; P358-F362 HydrophobicContact CB-CD1 4.41Å; P358-F362 HydrophobicContact CB-CD2 4.35Å; P358-F362 HydrophobicContact CB-CE1 3.96Å; P358-F362 HydrophobicContact CB-CE2 3.88Å; P358-F362 HydrophobicContact CB-CZ 3.67Å; P358-F362 PolarHBondContact O-N 3.32Å; T359-F362 PolarHBondContact O-N 2.93Å; F362-N364 VanDerWaalsContact C-N 3.35Å; F362-N364 PolarHBondContact O-N 3.23Å; F362-Y365 HydrophobicContact CB-CD1 3.97Å; F362-Y365 PolarHBondContact O-N 2.88Å; F362-R366 WeakPolarHBondContact O-CB 3.49Å; F362-R366 VanDerWaalsContact O-CG 3.31Å; F362-R366 WeakPolarHBondContact O-CG 3.37Å; F362-R366 PolarHBondContact O-N 3.5Å; F362-F390 HydrophobicContact CE1-CE1 4.18Å; F362-F390 HydrophobicContact CZ-CE1 4.2Å; F362-L393 HydrophobicContact CB-CD2 3.63Å; F362-L393 HydrophobicContact CD1-CD2 4.23Å; F362-L393 HydrophobicContact CD2-CD1 3.88Å; F362-L393 HydrophobicContact CD2-CD2 3.53Å; F362-L393 HydrophobicContact CD2-CG 4.35Å; F362-L393 HydrophobicContact CE2-CD1 4.07Å; F362-L393 HydrophobicContact CE2-CD2 4.21Å; F362-L393 HydrophobicContact CG-CD2 3.54Å
363	Y	98.1	Very high	97.3	Very high	144 Å²	144	54.2 Å²	54.2	57%	0.565	29%	0.292	S	S	*	.	H	α-helix	trans	-53.4	-47.3	-174.6	174.3	-95	0	0	0	113.4	T359 G360 R366 T367	T359-Y363 PolarHBondContact O-N 3.03Å; G360-Y363 PolarHBondContact O-N 2.94Å; Y363-R366 PolarHBondContact O-N 2.93Å; Y363-T367 PolarHBondContact O-N 2.89Å; Y363-T367 PolarHBondContact O-OG1 3.36Å
364	N	98.2	Very high	97.2	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.214	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-51.3	-179	-72.4	-22.3	0	0	0	111.4	H354 F362 R366 T367 A368	H354-N364 PolarHBondContact CE1-ND2 3.26Å; H354-N364 VanDerWaalsContact CE1-ND2 3.3Å; H354-N364 PolarHBondContact NE2-ND2 3.03Å; H354-N364 VanDerWaalsContact NE2-ND2 3.11Å; H354-N364 PolarHBondContact O-ND2 2.87Å; F362-N364 VanDerWaalsContact C-N 3.35Å; F362-N364 PolarHBondContact O-N 3.23Å; N364-R366 VanDerWaalsContact C-N 3.32Å; N364-R366 PolarHBondContact O-N 3.44Å; N364-T367 WeakPolarHBondContact O-CB 3.33Å; N364-T367 PolarHBondContact O-N 3.34Å; N364-T367 VanDerWaalsContact O-N 3.11Å; N364-A368 PolarHBondContact O-N 3.42Å
365	Y	98.6	Very high	97.1	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-56.3	-46	176.1	156.5	-98.1	0	0	0	111.5	F319 Q355 M356 F362 T367 A368 L369 F390 L393	F319-Y365 HydrophobicContact CB-CD2 4.28Å; F319-Y365 HydrophobicContact CB-CE2 3.69Å; F319-Y365 HydrophobicContact CD1-CD2 4.22Å; F319-Y365 HydrophobicContact CD1-CE2 4.26Å; F319-Y365 HydrophobicContact CD2-CE2 4.33Å; F319-Y365 HydrophobicContact CG-CD2 4.27Å; F319-Y365 AromaticContact CG-CE2 3.85Å; F319-Y365 HydrophobicContact CG-CE2 3.85Å; Q355-Y365 WeakPolarHBondContact O-CA 3.42Å; Q355-Y365 WeakPolarHBondContact O-CB 3.26Å; Q355-Y365 PolarHBondContact O-N 3.35Å; M356-Y365 HydrophobicContact CE-CD2 3.67Å; M356-Y365 HydrophobicContact CE-CE2 4.29Å; M356-Y365 HydrophobicContact CE-CG 4.16Å; M356-Y365 HydrophobicContact SD-CD2 3.82Å; M356-Y365 HydrophobicContact SD-CG 4.38Å; F362-Y365 HydrophobicContact CB-CD1 3.97Å; F362-Y365 PolarHBondContact O-N 2.88Å; Y365-T367 VanDerWaalsContact C-N 3.26Å; Y365-T367 PolarHBondContact O-N 2.68Å; Y365-A368 CarbonylContact O-C 3.49Å; Y365-A368 PolarHBondContact O-N 3.07Å; Y365-A368 VanDerWaalsContact O-N 3.13Å; Y365-L369 HydrophobicContact CE1-CD2 4.24Å; Y365-L369 HydrophobicContact CE2-CB 4.34Å; Y365-L369 WeakPolarHBondContact O-CB 3.38Å; Y365-L369 PolarHBondContact O-N 2.92Å; Y365-F390 HydrophobicContact CE1-CB 4.45Å; Y365-F390 HydrophobicContact CE2-CB 3.8Å; Y365-F390 PolarHBondContact OH-N 2.97Å; Y365-L393 HydrophobicContact CD1-CD2 3.71Å; Y365-L393 HydrophobicContact CE1-CD2 3.6Å
366	R	98.1	Very high	97	Very high	53 Å²	53	55.2 Å²	55.2	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-35.5	179.4	-71.9	-179.1	-175	-80.1	0.3	111.9	N361 F362 Y363 N364 R370 D397	N361-R366 PolarHBondContact ND2-NH2 3.29Å; N361-R366 WeakPolarHBondContact O-CD 3.48Å; N361-R366 PolarHBondContact O-NE 2.99Å; N361-R366 PolarHBondContact OD1-NH2 3.16Å; F362-R366 WeakPolarHBondContact O-CB 3.49Å; F362-R366 VanDerWaalsContact O-CG 3.31Å; F362-R366 WeakPolarHBondContact O-CG 3.37Å; F362-R366 PolarHBondContact O-N 3.5Å; Y363-R366 PolarHBondContact O-N 2.93Å; N364-R366 VanDerWaalsContact C-N 3.32Å; N364-R366 PolarHBondContact O-N 3.44Å; R366-R370 WeakPolarHBondContact O-CG 3.47Å; R366-R370 PolarHBondContact O-N 3.21Å; R366-D397 IonicContact CZ-OD1 3.53Å; R366-D397 IonicContact CZ-OD2 3.75Å; R366-D397 VanDerWaalsContact CZ-OD2 3.23Å; R366-D397 IonicContact NH1-OD1 2.83Å; R366-D397 IonicContact NH1-OD2 2.84Å; R366-D397 PolarHBondContact NH1-OD2 3.5Å; R366-D397 IonicContact NH2-OD1 3.75Å; R366-D397 PolarHBondContact NH2-OD1 3.25Å; R366-D397 IonicContact NH2-OD2 3.39Å; R366-D397 PolarHBondContact NH2-OD2 2.99Å
367	T	98.2	Very high	96.8	Very high	60 Å²	60	61.9 Å²	61.9	37%	0.368	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-45	173.7	-58.4	0	0	0	0	111.2	Y363 N364 Y365 R370 G371	Y363-T367 PolarHBondContact O-N 2.89Å; Y363-T367 PolarHBondContact O-OG1 3.36Å; N364-T367 WeakPolarHBondContact O-CB 3.33Å; N364-T367 PolarHBondContact O-N 3.34Å; N364-T367 VanDerWaalsContact O-N 3.11Å; Y365-T367 VanDerWaalsContact C-N 3.26Å; Y365-T367 PolarHBondContact O-N 2.68Å; T367-R370 PolarHBondContact O-N 2.87Å; T367-R370 PolarHBondContact OG1-NH2 3.42Å; T367-G371 PolarHBondContact O-N 3.13Å
368	A	98.3	Very high	96.7	Very high	18 Å²	18	63.3 Å²	63.3	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-41.1	175.4	0	0	0	0	0	112.5	F314 F319 N364 Y365 G371 A372	F314-A368 HydrophobicContact CE2-CB 3.94Å; F314-A368 HydrophobicContact CZ-CB 4.06Å; F319-A368 HydrophobicContact CE1-CB 3.9Å; F319-A368 HydrophobicContact CZ-CB 4.14Å; N364-A368 PolarHBondContact O-N 3.42Å; Y365-A368 CarbonylContact O-C 3.49Å; Y365-A368 PolarHBondContact O-N 3.07Å; Y365-A368 VanDerWaalsContact O-N 3.13Å; A368-G371 PolarHBondContact O-N 3.46Å; A368-A372 PolarHBondContact O-N 3.29Å
369	L	98.3	Very high	96.5	Very high	27 Å²	27	61 Å²	61	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-46.8	176.4	-178.2	69.2	0	0	0	111.3	F319 Y365 G371 A372 A373 V387 P389 W432	F319-L369 HydrophobicContact CD2-CD1 4.04Å; F319-L369 HydrophobicContact CE2-CD1 4.05Å; Y365-L369 HydrophobicContact CE1-CD2 4.24Å; Y365-L369 HydrophobicContact CE2-CB 4.34Å; Y365-L369 WeakPolarHBondContact O-CB 3.38Å; Y365-L369 PolarHBondContact O-N 2.92Å; L369-G371 VanDerWaalsContact C-N 3.29Å; L369-G371 PolarHBondContact O-N 3.19Å; L369-A372 PolarHBondContact O-N 3.05Å; L369-A372 VanDerWaalsContact O-N 3.14Å; L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 3.46Å; L369-V387 HydrophobicContact CD1-CG1 3.76Å; L369-P389 HydrophobicContact CD1-CB 4.08Å; L369-W432 HydrophobicContact CD1-CH2 4.28Å; L369-W432 HydrophobicContact CD2-CH2 4.38Å; L369-W432 HydrophobicContact CG-CH2 4.46Å
370	R	97.4	Very high	96.2	Very high	143 Å²	143	63.3 Å²	63.3	54%	0.54	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-42.2	174.2	-76.8	-172.3	-63.4	-93.7	0.4	111.7	R366 T367 A373 H374	R366-R370 WeakPolarHBondContact O-CG 3.47Å; R366-R370 PolarHBondContact O-N 3.21Å; T367-R370 PolarHBondContact O-N 2.87Å; T367-R370 PolarHBondContact OG1-NH2 3.42Å; R370-A373 PolarHBondContact O-N 3Å; R370-H374 WeakPolarHBondContact O-CB 3.41Å; R370-H374 PolarHBondContact O-N 3Å
371	G	97.6	Very high	96	Very high	32 Å²	32	62.7 Å²	62.7	33%	0.33	32%	0.317	S	S	.	.	H	α-helix	trans	-58.5	-46.8	173.7	0	0	0	0	0	112	T367 A368 L369 H374 R375	T367-G371 PolarHBondContact O-N 3.13Å; A368-G371 PolarHBondContact O-N 3.46Å; L369-G371 VanDerWaalsContact C-N 3.29Å; L369-G371 PolarHBondContact O-N 3.19Å; G371-H374 PolarHBondContact O-N 3.46Å; G371-R375 WeakPolarHBondContact O-CG 3.3Å; G371-R375 PolarHBondContact O-N 3.08Å
372	A	97.4	Very high	95.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-42.6	177.3	0	0	0	0	0	112.8	F319 A368 L369 H374 R375 S376 V387	F319-A372 HydrophobicContact CE2-CB 3.78Å; F319-A372 HydrophobicContact CZ-CB 4.02Å; A368-A372 PolarHBondContact O-N 3.29Å; L369-A372 PolarHBondContact O-N 3.05Å; L369-A372 VanDerWaalsContact O-N 3.14Å; A372-H374 VanDerWaalsContact C-N 3.34Å; A372-H374 PolarHBondContact O-N 3.47Å; A372-R375 PolarHBondContact O-N 3.43Å; A372-S376 PolarHBondContact O-N 3Å; A372-V387 HydrophobicContact CB-CG1 4.45Å; A372-V387 HydrophobicContact CB-CG2 4.22Å
373	A	96.2	Very high	95.4	Very high	7 Å²	7	66.6 Å²	66.6	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-43.5	175.3	0	0	0	0	0	111.6	L369 R370 S376 Q377 W432	L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 3.46Å; R370-A373 PolarHBondContact O-N 3Å; A373-S376 WeakPolarHBondContact O-CB 3.28Å; A373-S376 PolarHBondContact O-N 3.42Å; A373-Q377 WeakPolarHBondContact O-CG 3.26Å; A373-Q377 PolarHBondContact O-N 3.4Å; A373-Q377 VanDerWaalsContact O-N 3.12Å; A373-W432 HydrophobicContact CB-CZ2 3.97Å
374	H	96	Very high	95.2	Very high	116 Å²	116	63.7 Å²	63.7	54%	0.537	32%	0.321	S	S	.	.	H	α-helix	trans	-64.9	-42.1	176.1	-175.5	64.6	0	0	0	112.7	R370 G371 A372 S376 Q377 T378	R370-H374 WeakPolarHBondContact O-CB 3.41Å; R370-H374 PolarHBondContact O-N 3Å; G371-H374 PolarHBondContact O-N 3.46Å; A372-H374 VanDerWaalsContact C-N 3.34Å; A372-H374 PolarHBondContact O-N 3.47Å; H374-S376 VanDerWaalsContact C-N 3.29Å; H374-S376 PolarHBondContact O-N 3.14Å; H374-Q377 PolarHBondContact O-N 2.85Å; H374-T378 PolarHBondContact O-N 3.24Å; H374-T378 PolarHBondContact O-OG1 2.97Å
375	R	96.1	Very high	95	Very high	97 Å²	97	66.6 Å²	66.6	37%	0.366	33%	0.329	S	S	.	.	H	α-helix	trans	-58.2	-42.3	172.6	-69.7	-171.8	-31.1	-113.3	2.5	111.5	G371 A372 Q377 T378 A379	G371-R375 WeakPolarHBondContact O-CG 3.3Å; G371-R375 PolarHBondContact O-N 3.08Å; A372-R375 PolarHBondContact O-N 3.43Å; R375-Q377 VanDerWaalsContact C-N 3.32Å; R375-Q377 PolarHBondContact O-N 2.78Å; R375-T378 CarbonylContact O-C 3.59Å; R375-T378 PolarHBondContact O-N 2.9Å; R375-T378 PolarHBondContact O-OG1 3.38Å; R375-A379 WeakPolarHBondContact O-CA 3.5Å; R375-A379 WeakPolarHBondContact O-CB 3.38Å; R375-A379 PolarHBondContact O-N 3.25Å
376	S	95.9	Very high	95	Very high	19 Å²	19	66.4 Å²	66.4	13%	0.133	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-37.8	178.8	177.9	0	0	0	0	112.8	A372 A373 H374 T378 A379 E384 R385	A372-S376 PolarHBondContact O-N 3Å; A373-S376 WeakPolarHBondContact O-CB 3.28Å; A373-S376 PolarHBondContact O-N 3.42Å; H374-S376 VanDerWaalsContact C-N 3.29Å; H374-S376 PolarHBondContact O-N 3.14Å; S376-T378 VanDerWaalsContact C-N 3.31Å; S376-A379 WeakPolarHBondContact O-CB 3.49Å; S376-E384 WeakPolarHBondContact CA-O 3.38Å; S376-E384 PolarHBondContact N-O 2.97Å; S376-R385 WeakPolarHBondContact OG-CA 3.5Å; S376-R385 PolarHBondContact OG-O 3.4Å; S376-R385 VanDerWaalsContact OG-O 3.13Å
377	Q	92.7	Very high	95	Very high	146 Å²	146	63.9 Å²	63.9	68%	0.682	32%	0.319	S	S	*	.	H	α-helix	trans	-69.1	-31	179.5	-70.5	168.4	6.7	0	0	112.6	A373 H374 R375	A373-Q377 WeakPolarHBondContact O-CG 3.26Å; A373-Q377 PolarHBondContact O-N 3.4Å; A373-Q377 VanDerWaalsContact O-N 3.12Å; H374-Q377 PolarHBondContact O-N 2.85Å; R375-Q377 VanDerWaalsContact C-N 3.32Å; R375-Q377 PolarHBondContact O-N 2.78Å
378	T	93.9	Very high	95	Very high	85 Å²	85	61 Å²	61	52%	0.521	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	10.9	-177.7	54	0	0	0	0	113	H374 R375 S376	H374-T378 PolarHBondContact O-N 3.24Å; H374-T378 PolarHBondContact O-OG1 2.97Å; R375-T378 CarbonylContact O-C 3.59Å; R375-T378 PolarHBondContact O-N 2.9Å; R375-T378 PolarHBondContact O-OG1 3.38Å; S376-T378 VanDerWaalsContact C-N 3.31Å
379	A	91.6	Very high	95	Very high	13 Å²	13	60.2 Å²	60.2	11%	0.107	30%	0.295	C	S	.	.			trans	-66.5	133.3	-171.5	0	0	0	0	0	113.1	R375 S376 E384 R385	R375-A379 WeakPolarHBondContact O-CA 3.5Å; R375-A379 WeakPolarHBondContact O-CB 3.38Å; R375-A379 PolarHBondContact O-N 3.25Å; S376-A379 WeakPolarHBondContact O-CB 3.49Å; A379-E384 HydrophobicContact CB-CB 3.58Å; A379-R385 HydrophobicContact CB-CG 3.51Å
380	N	90.1	Very high	95	Very high	154 Å²	154	59.8 Å²	59.8	82%	0.824	29%	0.292	S	S	*	.	S	Bend	trans	-98.4	-6.4	172.9	-63	-63.6	0	0	0	112.1	E384	N380-E384 PolarHBondContact N-OE2 3.04Å
381	S	91	Very high	94.9	Very high	48 Å²	48	53.1 Å²	53.1	34%	0.336	27%	0.267	S	S	.	.	S	Bend	trans	-137	156	178.2	68.4	0	0	0	0	112	R383 E384	S381-R383 PolarHBondContact O-N 3.16Å; S381-E384 PolarHBondContact N-OE2 3.02Å; S381-E384 PolarHBondContact O-N 3.36Å; S381-E384 VanDerWaalsContact OG-CD 3.31Å; S381-E384 WeakPolarHBondContact OG-CG 3.38Å; S381-E384 PolarHBondContact OG-N 3.45Å; S381-E384 PolarHBondContact OG-OE2 3.43Å
382	N	87.9	Confident	94.6	Very high	72 Å²	72	53.8 Å²	53.8	39%	0.385	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62.3	-29.2	176	-76.5	-15.3	0	0	0	112.8	E384 R385 P438	N382-E384 VanDerWaalsContact C-N 3.33Å; N382-E384 PolarHBondContact O-N 3.31Å; N382-R385 WeakPolarHBondContact O-CB 3.39Å; N382-R385 PolarHBondContact O-N 3.47Å; N382-R385 PolarHBondContact OD1-NH1 3.44Å; N382-P438 HydrophobicContact CB-CB 3.96Å; N382-P438 HydrophobicContact CB-CG 4.47Å
383	R	91.9	Very high	94.4	Very high	120 Å²	120	54 Å²	54	45%	0.453	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62	-40.7	176.3	-176.4	179.8	178.7	178.4	2.4	112.4	E312 S381 R385 I386 P438 F439	E312-R383 IonicContact OE1-NH2 3.56Å; E312-R383 PolarHBondContact OE1-NH2 2.99Å; E312-R383 VanDerWaalsContact OE1-NH2 3.12Å; S381-R383 PolarHBondContact O-N 3.16Å; R383-R385 PolarHBondContact O-N 3.09Å; R383-I386 WeakPolarHBondContact O-CG1 3.42Å; R383-I386 PolarHBondContact O-N 2.67Å; R383-P438 HydrophobicContact CB-CG 4.05Å; R383-F439 HydrophobicContact CG-CE1 4.11Å; R383-F439 HydrophobicContact CG-CZ 4.02Å
384	E	93	Very high	94.3	Very high	83 Å²	83	54.4 Å²	54.4	39%	0.388	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-73.4	-15.1	-178.9	-68.3	164	140.9	0	0	112.9	S376 A379 N380 S381 N382 I386	S376-E384 WeakPolarHBondContact CA-O 3.38Å; S376-E384 PolarHBondContact N-O 2.97Å; A379-E384 HydrophobicContact CB-CB 3.58Å; N380-E384 PolarHBondContact N-OE2 3.04Å; S381-E384 PolarHBondContact N-OE2 3.02Å; S381-E384 PolarHBondContact O-N 3.36Å; S381-E384 VanDerWaalsContact OG-CD 3.31Å; S381-E384 WeakPolarHBondContact OG-CG 3.38Å; S381-E384 PolarHBondContact OG-N 3.45Å; S381-E384 PolarHBondContact OG-OE2 3.43Å; N382-E384 VanDerWaalsContact C-N 3.33Å; N382-E384 PolarHBondContact O-N 3.31Å; E384-I386 VanDerWaalsContact C-N 3.33Å
385	R	95.5	Very high	94.1	Very high	101 Å²	101	49.5 Å²	49.5	38%	0.381	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-78.9	-14.4	176.7	-64.7	-178.6	176.7	133.8	2.7	113.8	S376 A379 N382 R383 V387 V435	S376-R385 WeakPolarHBondContact OG-CA 3.5Å; S376-R385 PolarHBondContact OG-O 3.4Å; S376-R385 VanDerWaalsContact OG-O 3.13Å; A379-R385 HydrophobicContact CB-CG 3.51Å; N382-R385 WeakPolarHBondContact O-CB 3.39Å; N382-R385 PolarHBondContact O-N 3.47Å; N382-R385 PolarHBondContact OD1-NH1 3.44Å; R383-R385 PolarHBondContact O-N 3.09Å; R385-V387 PolarHBondContact O-N 2.96Å; R385-V435 HydrophobicContact CB-CG1 4.11Å; R385-V435 HydrophobicContact CB-CG2 3.76Å; R385-V435 WeakPolarHBondContact O-CG2 3.29Å
386	I	97.8	Very high	93.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.			trans	-69.4	121	-174.7	-57.6	171.2	0	0	0	110	T229 I316 R383 E384 I388 V435 P438 F439	T229-I386 HydrophobicContact CG2-CD1 4.1Å; T229-I386 HydrophobicContact CG2-CG2 4.06Å; I316-I386 HydrophobicContact CG2-CB 4.32Å; I316-I386 HydrophobicContact CG2-CD1 3.98Å; I316-I386 HydrophobicContact CG2-CG2 3.88Å; R383-I386 WeakPolarHBondContact O-CG1 3.42Å; R383-I386 PolarHBondContact O-N 2.67Å; E384-I386 VanDerWaalsContact C-N 3.33Å; I386-I388 HydrophobicContact CG2-CD1 4.1Å; I386-I388 HydrophobicContact CG2-CG1 4.01Å; I386-V435 HydrophobicContact CG1-CG1 3.95Å; I386-P438 HydrophobicContact CD1-CG 3.91Å; I386-F439 HydrophobicContact CD1-CE2 3.66Å; I386-F439 HydrophobicContact CD1-CZ 3.95Å
387	V	98.2	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.			trans	-138.2	112	170.8	-175.5	0	0	0	0	107.8	L369 A372 R385 W432	L369-V387 HydrophobicContact CD1-CG1 3.76Å; A372-V387 HydrophobicContact CB-CG1 4.45Å; A372-V387 HydrophobicContact CB-CG2 4.22Å; R385-V387 PolarHBondContact O-N 2.96Å; V387-W432 HydrophobicContact CB-CB 4.25Å; V387-W432 HydrophobicContact CB-CD2 3.95Å; V387-W432 HydrophobicContact CB-CG 3.75Å; V387-W432 HydrophobicContact CG1-CD2 3.71Å; V387-W432 HydrophobicContact CG1-CE3 4.1Å; V387-W432 HydrophobicContact CG1-CG 4.09Å; V387-W432 HydrophobicContact CG1-CH2 4.4Å; V387-W432 HydrophobicContact CG1-CZ2 3.99Å; V387-W432 HydrophobicContact CG1-CZ3 4.44Å; V387-W432 WeakPolarHBondContact O-CB 3.47Å
388	I	98.5	Very high	93.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-121.4	99.9	178.2	-53.8	178.2	0	0	0	106.3	T229 E232 L233 L236 Y275 G317 N318 F319 N320 I386	T229-I388 HydrophobicContact CG2-CD1 4.03Å; E232-I388 HydrophobicContact CB-CD1 3.65Å; E232-I388 HydrophobicContact CB-CG2 4.11Å; E232-I388 HydrophobicContact CG-CD1 4.47Å; L233-I388 HydrophobicContact CD2-CD1 4.04Å; L233-I388 HydrophobicContact CD2-CG1 4.18Å; L233-I388 HydrophobicContact CG-CD1 3.97Å; L236-I388 HydrophobicContact CD1-CB 4.48Å; L236-I388 HydrophobicContact CD1-CG1 4.27Å; L236-I388 HydrophobicContact CD1-CG2 4.02Å; Y275-I388 WeakPolarHBondContact OH-CG2 3.29Å; G317-I388 PolarHBondContact O-N 2.96Å; N318-I388 HydrophobicContact CB-CD1 4.26Å; F319-I388 WeakPolarHBondContact CB-O 3.35Å; F319-I388 WeakPolarHBondContact CD2-O 3.47Å; F319-I388 PolarHBondContact N-O 3.46Å; N320-I388 HydrophobicContact CB-CG2 3.83Å; I386-I388 HydrophobicContact CG2-CD1 4.1Å; I386-I388 HydrophobicContact CG2-CG1 4.01Å
389	P	97.9	Very high	93.2	Very high	1 Å²	1	43 Å²	43	1%	0.006	21%	0.209	C	C	.	.			trans	-69.1	157.9	-174.4	29.4	-35.1	0	0	0	111	N320 L369 F391 L394 F429 W432	N320-P389 WeakPolarHBondContact CB-O 3.42Å; L369-P389 HydrophobicContact CD1-CB 4.08Å; P389-F391 PolarHBondContact O-N 3.5Å; P389-L394 HydrophobicContact CG-CD2 3.91Å; P389-F429 HydrophobicContact CG-CD2 4.45Å; P389-W432 HydrophobicContact CB-CZ3 4.13Å; P389-W432 HydrophobicContact CG-CE3 4.03Å; P389-W432 HydrophobicContact CG-CZ3 3.93Å
390	F	97.9	Very high	93	Very high	18 Å²	18	48.1 Å²	48.1	8%	0.079	23%	0.228	C	C	.	.			trans	-63.5	101.8	163.9	173.2	-145	0	0	0	108.9	F279 M323 M356 F362 Y365 S392 L393 L394	F279-F390 HydrophobicContact CE2-CD2 4.35Å; F279-F390 HydrophobicContact CE2-CE2 4.01Å; F279-F390 HydrophobicContact CZ-CE2 4.09Å; M323-F390 HydrophobicContact CB-CD2 3.94Å; M323-F390 HydrophobicContact CB-CE2 4.26Å; M323-F390 HydrophobicContact CB-CG 4.32Å; M323-F390 HydrophobicContact CE-CE1 4.31Å; M323-F390 HydrophobicContact CE-CZ 4.19Å; M323-F390 HydrophobicContact CG-CD1 4.33Å; M323-F390 HydrophobicContact CG-CD2 3.73Å; M323-F390 HydrophobicContact CG-CE1 4.21Å; M323-F390 HydrophobicContact CG-CE2 3.59Å; M323-F390 HydrophobicContact CG-CG 4.12Å; M323-F390 HydrophobicContact CG-CZ 3.84Å; M356-F390 HydrophobicContact CE-CB 4.23Å; M356-F390 HydrophobicContact CE-CG 4.49Å; F362-F390 HydrophobicContact CE1-CE1 4.18Å; F362-F390 HydrophobicContact CZ-CE1 4.2Å; Y365-F390 HydrophobicContact CE1-CB 4.45Å; Y365-F390 HydrophobicContact CE2-CB 3.8Å; Y365-F390 PolarHBondContact OH-N 2.97Å; F390-S392 VanDerWaalsContact C-N 3.35Å; F390-S392 PolarHBondContact O-N 2.9Å; F390-L393 HydrophobicContact CD1-CB 3.56Å; F390-L393 HydrophobicContact CD1-CD2 4.4Å; F390-L393 HydrophobicContact CE1-CB 3.92Å; F390-L393 HydrophobicContact CG-CB 4.28Å; F390-L393 PolarHBondContact O-N 3.17Å; F390-L393 VanDerWaalsContact O-N 3.16Å; F390-L394 PolarHBondContact O-N 3.37Å
391	F	95.3	Very high	92.9	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.018	20%	0.198	C	C	.	.	H	α-helix	trans	-66.4	-36.9	-161.2	-169.7	-111.4	0	0	0	113.4	I239 F244 L272 Y275 N320 P389 L393 L394 I395 F429	I239-F391 HydrophobicContact CD1-CE2 4.17Å; I239-F391 HydrophobicContact CD1-CZ 3.86Å; F244-F391 HydrophobicContact CE1-CE2 4.22Å; F244-F391 HydrophobicContact CE1-CZ 4.28Å; F244-F391 HydrophobicContact CZ-CE2 4.16Å; F244-F391 HydrophobicContact CZ-CZ 4.36Å; L272-F391 HydrophobicContact CD2-CE1 3.95Å; L272-F391 HydrophobicContact CD2-CZ 3.47Å; L272-F391 VanDerWaalsContact CD2-CZ 3.47Å; Y275-F391 HydrophobicContact CD1-CB 4.01Å; Y275-F391 AromaticContact CD1-CD1 3.42Å; Y275-F391 HydrophobicContact CD1-CD1 3.42Å; Y275-F391 VanDerWaalsContact CD1-CD1 3.42Å; Y275-F391 AromaticContact CD1-CD2 3.79Å; Y275-F391 HydrophobicContact CD1-CD2 3.79Å; Y275-F391 AromaticContact CD1-CE1 3.68Å; Y275-F391 HydrophobicContact CD1-CE1 3.68Å; Y275-F391 HydrophobicContact CD1-CE2 4.04Å; Y275-F391 AromaticContact CD1-CG 3.45Å; Y275-F391 HydrophobicContact CD1-CG 3.45Å; Y275-F391 VanDerWaalsContact CD1-CG 3.45Å; Y275-F391 AromaticContact CD1-CZ 3.97Å; Y275-F391 HydrophobicContact CD1-CZ 3.97Å; Y275-F391 HydrophobicContact CE1-CB 3.51Å; Y275-F391 AromaticContact CE1-CD1 3.83Å; Y275-F391 HydrophobicContact CE1-CD1 3.83Å; Y275-F391 AromaticContact CE1-CD2 3.51Å; Y275-F391 HydrophobicContact CE1-CD2 3.51Å; Y275-F391 HydrophobicContact CE1-CE1 4.38Å; Y275-F391 HydrophobicContact CE1-CE2 4.1Å; Y275-F391 AromaticContact CE1-CG 3.33Å; Y275-F391 HydrophobicContact CE1-CG 3.33Å; Y275-F391 HydrophobicContact CE1-CZ 4.49Å; N320-F391 PolarHBondContact OD1-N 3.35Å; P389-F391 PolarHBondContact O-N 3.5Å; F391-L393 VanDerWaalsContact C-N 3.26Å; F391-L393 PolarHBondContact O-N 3.07Å; F391-L394 HydrophobicContact CD2-CD2 4.24Å; F391-L394 HydrophobicContact CE2-CD2 4.36Å; F391-L394 WeakPolarHBondContact O-CB 3.41Å; F391-L394 PolarHBondContact O-N 3.08Å; F391-I395 HydrophobicContact CD1-CG1 3.89Å; F391-I395 HydrophobicContact CE1-CD1 3.91Å; F391-I395 HydrophobicContact CE1-CG1 3.54Å; F391-I395 HydrophobicContact CE2-CD1 4.3Å; F391-I395 HydrophobicContact CE2-CG1 4.28Å; F391-I395 HydrophobicContact CG-CG1 4.41Å; F391-I395 HydrophobicContact CZ-CD1 3.69Å; F391-I395 HydrophobicContact CZ-CG1 3.76Å; F391-I395 WeakPolarHBondContact O-CG1 3.38Å; F391-I395 PolarHBondContact O-N 3.15Å; F391-F429 HydrophobicContact CD2-CE2 4.28Å; F391-F429 AromaticContact CE2-CE2 3.87Å; F391-F429 HydrophobicContact CE2-CE2 3.87Å; F391-F429 HydrophobicContact CE2-CZ 4.12Å
392	S	91.4	Very high	92.7	Very high	46 Å²	46	41 Å²	41	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-35.5	179.5	-61.9	0	0	0	0	111.9	F390 K396	F390-S392 VanDerWaalsContact C-N 3.35Å; F390-S392 PolarHBondContact O-N 2.9Å; S392-K396 VanDerWaalsContact O-CB 3.27Å; S392-K396 WeakPolarHBondContact O-CB 3.4Å; S392-K396 PolarHBondContact O-N 3.34Å
393	L	94.4	Very high	92.5	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-74	-39.1	176.1	-175.4	59.5	0	0	0	111.9	F362 Y365 F390 F391 I395 K396 D397	F362-L393 HydrophobicContact CB-CD2 3.63Å; F362-L393 HydrophobicContact CD1-CD2 4.23Å; F362-L393 HydrophobicContact CD2-CD1 3.88Å; F362-L393 HydrophobicContact CD2-CD2 3.53Å; F362-L393 HydrophobicContact CD2-CG 4.35Å; F362-L393 HydrophobicContact CE2-CD1 4.07Å; F362-L393 HydrophobicContact CE2-CD2 4.21Å; F362-L393 HydrophobicContact CG-CD2 3.54Å; Y365-L393 HydrophobicContact CD1-CD2 3.71Å; Y365-L393 HydrophobicContact CE1-CD2 3.6Å; F390-L393 HydrophobicContact CD1-CB 3.56Å; F390-L393 HydrophobicContact CD1-CD2 4.4Å; F390-L393 HydrophobicContact CE1-CB 3.92Å; F390-L393 HydrophobicContact CG-CB 4.28Å; F390-L393 PolarHBondContact O-N 3.17Å; F390-L393 VanDerWaalsContact O-N 3.16Å; F391-L393 VanDerWaalsContact C-N 3.26Å; F391-L393 PolarHBondContact O-N 3.07Å; L393-I395 PolarHBondContact O-N 3.34Å; L393-K396 HydrophobicContact CD1-CD 4.21Å; L393-K396 WeakPolarHBondContact O-CB 3.47Å; L393-K396 PolarHBondContact O-N 3.01Å; L393-D397 VanDerWaalsContact O-CG 3.26Å; L393-D397 PolarHBondContact O-N 3.48Å
394	L	93.9	Very high	92.2	Very high	17 Å²	17	38 Å²	38	9%	0.089	19%	0.192	C	C	.	.	H	α-helix	trans	-57.4	-49.8	173.2	176.9	67.1	0	0	0	111.1	P389 F390 F391 K396 D397 I398 F429	P389-L394 HydrophobicContact CG-CD2 3.91Å; F390-L394 PolarHBondContact O-N 3.37Å; F391-L394 HydrophobicContact CD2-CD2 4.24Å; F391-L394 HydrophobicContact CE2-CD2 4.36Å; F391-L394 WeakPolarHBondContact O-CB 3.41Å; F391-L394 PolarHBondContact O-N 3.08Å; L394-K396 VanDerWaalsContact C-N 3.31Å; L394-K396 PolarHBondContact O-N 3.48Å; L394-D397 PolarHBondContact O-N 3.1Å; L394-I398 HydrophobicContact CD1-CD1 4.05Å; L394-I398 HydrophobicContact CD1-CG1 4.44Å; L394-I398 HydrophobicContact CG-CD1 3.99Å; L394-I398 VanDerWaalsContact O-CG1 3.29Å; L394-I398 WeakPolarHBondContact O-CG1 3.43Å; L394-I398 PolarHBondContact O-N 3Å; L394-F429 HydrophobicContact CD2-CB 4.24Å; L394-F429 HydrophobicContact CD2-CD2 3.61Å; L394-F429 HydrophobicContact CD2-CE2 4.3Å; L394-F429 HydrophobicContact CD2-CG 4.16Å
395	I	90.8	Very high	91.9	Very high	13 Å²	13	36.8 Å²	36.8	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-41.5	177.3	-68.3	-65.4	0	0	0	111.3	F11 F244 F248 L272 F391 L393 D397 I398 Y399	F11-I395 HydrophobicContact CE1-CG2 3.78Å; F11-I395 HydrophobicContact CZ-CG2 3.95Å; F244-I395 HydrophobicContact CD1-CD1 3.59Å; F244-I395 HydrophobicContact CE1-CD1 3.42Å; F244-I395 VanDerWaalsContact CE1-CD1 3.42Å; F248-I395 HydrophobicContact CE1-CG2 4.31Å; F248-I395 HydrophobicContact CZ-CG2 4.03Å; L272-I395 HydrophobicContact CD2-CD1 4.24Å; F391-I395 HydrophobicContact CD1-CG1 3.89Å; F391-I395 HydrophobicContact CE1-CD1 3.91Å; F391-I395 HydrophobicContact CE1-CG1 3.54Å; F391-I395 HydrophobicContact CE2-CD1 4.3Å; F391-I395 HydrophobicContact CE2-CG1 4.28Å; F391-I395 HydrophobicContact CG-CG1 4.41Å; F391-I395 HydrophobicContact CZ-CD1 3.69Å; F391-I395 HydrophobicContact CZ-CG1 3.76Å; F391-I395 WeakPolarHBondContact O-CG1 3.38Å; F391-I395 PolarHBondContact O-N 3.15Å; L393-I395 PolarHBondContact O-N 3.34Å; I395-D397 PolarHBondContact O-N 3.33Å; I395-I398 PolarHBondContact O-N 2.97Å; I395-Y399 WeakPolarHBondContact O-CB 3.44Å; I395-Y399 PolarHBondContact O-N 3.42Å
396	K	89.9	Confident	91.6	Very high	95 Å²	95	35 Å²	35	41%	0.413	20%	0.199	S	C	.	.	H	α-helix	trans	-60.9	-43.1	176.1	-177.1	-177	174.7	-170.6	0	111.8	S392 L393 L394 Y399 F400	S392-K396 VanDerWaalsContact O-CB 3.27Å; S392-K396 WeakPolarHBondContact O-CB 3.4Å; S392-K396 PolarHBondContact O-N 3.34Å; L393-K396 HydrophobicContact CD1-CD 4.21Å; L393-K396 WeakPolarHBondContact O-CB 3.47Å; L393-K396 PolarHBondContact O-N 3.01Å; L394-K396 VanDerWaalsContact C-N 3.31Å; L394-K396 PolarHBondContact O-N 3.48Å; K396-Y399 WeakPolarHBondContact O-CB 3.26Å; K396-Y399 PolarHBondContact O-N 2.85Å; K396-F400 HydrophobicContact CD-CE2 4.14Å; K396-F400 VanDerWaalsContact CE-CE2 3.46Å; K396-F400 HydrophobicContact CG-CD2 3.72Å; K396-F400 HydrophobicContact CG-CE2 3.52Å; K396-F400 WeakPolarHBondContact O-CD2 3.41Å; K396-F400 PolarHBondContact O-N 3.1Å
397	D	91.6	Very high	91.2	Very high	32 Å²	32	37.7 Å²	37.7	17%	0.171	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-45.9	178.6	-69.9	-19.7	0	0	0	111.5	R366 L393 L394 I395 Y399 F400 L401	R366-D397 IonicContact CZ-OD1 3.53Å; R366-D397 IonicContact CZ-OD2 3.75Å; R366-D397 VanDerWaalsContact CZ-OD2 3.23Å; R366-D397 IonicContact NH1-OD1 2.83Å; R366-D397 IonicContact NH1-OD2 2.84Å; R366-D397 PolarHBondContact NH1-OD2 3.5Å; R366-D397 IonicContact NH2-OD1 3.75Å; R366-D397 PolarHBondContact NH2-OD1 3.25Å; R366-D397 IonicContact NH2-OD2 3.39Å; R366-D397 PolarHBondContact NH2-OD2 2.99Å; L393-D397 VanDerWaalsContact O-CG 3.26Å; L393-D397 PolarHBondContact O-N 3.48Å; L394-D397 PolarHBondContact O-N 3.1Å; I395-D397 PolarHBondContact O-N 3.33Å; D397-Y399 VanDerWaalsContact C-N 3.31Å; D397-Y399 PolarHBondContact O-N 3.25Å; D397-F400 PolarHBondContact O-N 3.15Å; D397-L401 WeakPolarHBondContact O-CB 3.33Å; D397-L401 PolarHBondContact O-N 3.38Å
398	I	90.3	Very high	90.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-40.2	177.1	-62.9	171.4	0	0	0	110.6	F244 F248 L394 I395 N402 L422 Q425 V426	F244-I398 HydrophobicContact CD1-CD1 3.53Å; F244-I398 HydrophobicContact CE1-CD1 3.83Å; F244-I398 HydrophobicContact CG-CD1 4.4Å; F248-I398 HydrophobicContact CD2-CG2 4.13Å; F248-I398 HydrophobicContact CE2-CB 4.07Å; F248-I398 HydrophobicContact CE2-CG2 3.42Å; F248-I398 VanDerWaalsContact CE2-CG2 3.42Å; F248-I398 HydrophobicContact CZ-CB 4.45Å; F248-I398 HydrophobicContact CZ-CG2 4.26Å; L394-I398 HydrophobicContact CD1-CD1 4.05Å; L394-I398 HydrophobicContact CD1-CG1 4.44Å; L394-I398 HydrophobicContact CG-CD1 3.99Å; L394-I398 VanDerWaalsContact O-CG1 3.29Å; L394-I398 WeakPolarHBondContact O-CG1 3.43Å; L394-I398 PolarHBondContact O-N 3Å; I395-I398 PolarHBondContact O-N 2.97Å; I398-N402 WeakPolarHBondContact O-CB 3.28Å; I398-N402 PolarHBondContact O-N 3.32Å; I398-L422 HydrophobicContact CG2-CD1 3.5Å; I398-L422 VanDerWaalsContact CG2-CD1 3.5Å; I398-Q425 HydrophobicContact CG1-CB 4.27Å; I398-V426 HydrophobicContact CD1-CG2 4.34Å
399	Y	87.7	Confident	90.7	Very high	84 Å²	84	45.5 Å²	45.5	33%	0.329	25%	0.247	S	C	.	.	H	α-helix	trans	-59.3	-53.9	174	175.3	-96.3	0	0	0	111.5	F248 I395 K396 D397 L401 N402 E403	F248-Y399 AromaticContact CD1-CD2 3.53Å; F248-Y399 HydrophobicContact CD1-CD2 3.53Å; F248-Y399 HydrophobicContact CD1-CE2 4.43Å; F248-Y399 HydrophobicContact CD1-CG 4.35Å; F248-Y399 AromaticContact CE1-CD2 3.79Å; F248-Y399 HydrophobicContact CE1-CD2 3.79Å; F248-Y399 HydrophobicContact CE1-CG 4.24Å; F248-Y399 HydrophobicContact CG-CD2 4.32Å; I395-Y399 WeakPolarHBondContact O-CB 3.44Å; I395-Y399 PolarHBondContact O-N 3.42Å; K396-Y399 WeakPolarHBondContact O-CB 3.26Å; K396-Y399 PolarHBondContact O-N 2.85Å; D397-Y399 VanDerWaalsContact C-N 3.31Å; D397-Y399 PolarHBondContact O-N 3.25Å; Y399-L401 VanDerWaalsContact C-N 3.3Å; Y399-L401 PolarHBondContact O-N 2.97Å; Y399-N402 WeakPolarHBondContact O-CB 3.35Å; Y399-N402 PolarHBondContact O-N 3.48Å; Y399-E403 HydrophobicContact CD1-CG 4.04Å; Y399-E403 HydrophobicContact CD2-CG 4.15Å; Y399-E403 HydrophobicContact CE1-CG 3.61Å; Y399-E403 HydrophobicContact CE2-CG 3.76Å; Y399-E403 HydrophobicContact CG-CG 4.3Å; Y399-E403 VanDerWaalsContact CZ-CG 3.46Å; Y399-E403 WeakPolarHBondContact O-CG 3.33Å; Y399-E403 PolarHBondContact O-N 3.4Å
400	F	88.5	Confident	90.5	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.522	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-33.6	-178.2	-80	-63.1	0	0	0	113.1	K396 D397 N402 E403 G404	K396-F400 HydrophobicContact CD-CE2 4.14Å; K396-F400 VanDerWaalsContact CE-CE2 3.46Å; K396-F400 HydrophobicContact CG-CD2 3.72Å; K396-F400 HydrophobicContact CG-CE2 3.52Å; K396-F400 WeakPolarHBondContact O-CD2 3.41Å; K396-F400 PolarHBondContact O-N 3.1Å; D397-F400 PolarHBondContact O-N 3.15Å; F400-N402 VanDerWaalsContact C-N 3.33Å; F400-E403 PolarHBondContact O-N 2.98Å; F400-G404 PolarHBondContact O-N 3.41Å
401	L	88.2	Confident	90.2	Very high	36 Å²	36	56 Å²	56	19%	0.188	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-41.9	171.5	178.2	66.9	0	0	0	111.5	D397 Y399 E421 L422	D397-L401 WeakPolarHBondContact O-CB 3.33Å; D397-L401 PolarHBondContact O-N 3.38Å; Y399-L401 VanDerWaalsContact C-N 3.3Å; Y399-L401 PolarHBondContact O-N 2.97Å; L401-E421 HydrophobicContact CD1-CB 4.23Å; L401-E421 HydrophobicContact CD1-CG 3.62Å; L401-E421 HydrophobicContact CD2-CB 4.24Å; L401-E421 HydrophobicContact CD2-CG 3.76Å; L401-E421 HydrophobicContact CG-CG 4.34Å; L401-L422 HydrophobicContact CD2-CB 4.17Å; L401-L422 HydrophobicContact CD2-CD1 4.1Å
402	N	85.4	Confident	90	Very high	16 Å²	16	57.7 Å²	57.7	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-67.6	-43.5	177	-177	62.1	0	0	0	112.2	I398 Y399 F400 K418	I398-N402 WeakPolarHBondContact O-CB 3.28Å; I398-N402 PolarHBondContact O-N 3.32Å; Y399-N402 WeakPolarHBondContact O-CB 3.35Å; Y399-N402 PolarHBondContact O-N 3.48Å; F400-N402 VanDerWaalsContact C-N 3.33Å; N402-K418 VanDerWaalsContact O-CE 3.3Å; N402-K418 WeakPolarHBondContact O-CE 3.23Å; N402-K418 PolarHBondContact O-NZ 2.96Å; N402-K418 WeakPolarHBondContact OD1-CE 3.17Å; N402-K418 PolarHBondContact OD1-NZ 3.1Å
403	E	84.6	Confident	90.2	Very high	66 Å²	66	58.5 Å²	58.5	31%	0.308	33%	0.329	S	S	.	.	H	α-helix	trans	-72.6	-32.9	-178.7	-67.6	-63.2	116.9	0	0	113.1	Q250 Y399 F400 C405	Q250-E403 PolarHBondContact NE2-OE1 3.19Å; Q250-E403 PolarHBondContact NE2-OE2 3.24Å; Y399-E403 HydrophobicContact CD1-CG 4.04Å; Y399-E403 HydrophobicContact CD2-CG 4.15Å; Y399-E403 HydrophobicContact CE1-CG 3.61Å; Y399-E403 HydrophobicContact CE2-CG 3.76Å; Y399-E403 HydrophobicContact CG-CG 4.3Å; Y399-E403 VanDerWaalsContact CZ-CG 3.46Å; Y399-E403 WeakPolarHBondContact O-CG 3.33Å; Y399-E403 PolarHBondContact O-N 3.4Å; F400-E403 PolarHBondContact O-N 2.98Å; E403-C405 PolarHBondContact O-N 2.97Å
404	G	85.3	Confident	90.2	Very high	63 Å²	63	58.5 Å²	58.5	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.1	-174.8	0	0	0	0	0	114.7	F400	F400-G404 PolarHBondContact O-N 3.41Å
405	C	86.6	Confident	90.2	Very high	59 Å²	59	58.6 Å²	58.6	40%	0.399	33%	0.329	S	S	.	.	S	Bend	trans	-138.9	135.8	-174.8	-73.2	0	0	0	0	111.9	E403 K418	E403-C405 PolarHBondContact O-N 2.97Å; C405-K418 HydrophobicContact CB-CB 4.17Å; C405-K418 HydrophobicContact CB-CD 3.65Å; C405-K418 HydrophobicContact CB-CG 3.78Å; C405-K418 WeakPolarHBondContact O-CD 3.42Å; C405-K418 WeakPolarHBondContact O-CE 3.37Å; C405-K418 PolarHBondContact O-NZ 3.32Å
406	A	88.9	Confident	90.4	Very high	62 Å²	62	58.3 Å²	58.3	51%	0.512	33%	0.328	S	S	.	.			trans	-67.3	141.5	176.9	0	0	0	0	0	112	R408 N415	A406-R408 VanDerWaalsContact C-N 3.28Å; A406-R408 WeakPolarHBondContact CB-O 3.31Å; A406-R408 PolarHBondContact O-N 3.05Å; A406-N415 VanDerWaalsContact O-CB 3.26Å; A406-N415 WeakPolarHBondContact O-CB 3.18Å; A406-N415 PolarHBondContact O-ND2 3.21Å; A406-N415 VanDerWaalsContact O-ND2 3.11Å
407	N	89.8	Confident	90.6	Very high	57 Å²	57	59.9 Å²	59.9	31%	0.305	34%	0.336	S	S	.	.	S	Bend	trans	-67.1	-29.5	175.5	-74	-17.4	0	0	0	112.7	F86 N415 K418 F419	F86-N407 HydrophobicContact CE1-CB 3.9Å; F86-N407 HydrophobicContact CZ-CB 3.89Å; N407-N415 PolarHBondContact O-N 2.81Å; N407-K418 PolarHBondContact OD1-NZ 3.18Å; N407-F419 HydrophobicContact CB-CZ 4.23Å; N407-F419 WeakPolarHBondContact OD1-CZ 3.48Å
408	R	92.8	Very high	90.6	Very high	106 Å²	106	58.9 Å²	58.9	40%	0.4	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-125.2	143.9	175.3	-66.8	-176.4	-178.7	-84.8	-0.5	110.6	F86 A406 G412 H413	F86-R408 HydrophobicContact CE1-CG 4.14Å; A406-R408 VanDerWaalsContact C-N 3.28Å; A406-R408 WeakPolarHBondContact CB-O 3.31Å; A406-R408 PolarHBondContact O-N 3.05Å; R408-G412 PolarHBondContact NH1-O 3.42Å; R408-H413 CarbonylContact C-O 3.56Å; R408-H413 WeakPolarHBondContact CA-O 3.23Å; R408-H413 WeakPolarHBondContact CB-O 3.47Å
409	L	93	Very high	90.8	Very high	58 Å²	58	59 Å²	59	30%	0.304	33%	0.331	S	S	.	.			trans	-79.8	164.8	170.3	-61.1	-176	0	0	0	110.5	S53 N411 G412 H413 N415	S53-L409 VanDerWaalsContact CB-CD1 3.41Å; S53-L409 WeakPolarHBondContact OG-CD1 3.32Å; L409-N411 WeakPolarHBondContact CB-OD1 3.43Å; L409-N411 PolarHBondContact O-N 3.34Å; L409-G412 PolarHBondContact O-N 3.46Å; L409-H413 PolarHBondContact N-O 2.92Å; L409-N415 HydrophobicContact CD2-CB 4.05Å; L409-N415 HydrophobicContact CG-CB 4.2Å
410	P	93.4	Very high	91.1	Very high	144 Å²	144	58.2 Å²	58.2	94%	0.935	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.3	-179.4	-27.9	36.3	0	0	0	115.2	G412	P410-G412 PolarHBondContact O-N 3.32Å
411	N	92.6	Very high	91.3	Very high	97 Å²	97	55.7 Å²	55.7	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	4.5	174.8	66.2	-2.2	0	0	0	113.7	L409 H413	L409-N411 WeakPolarHBondContact CB-OD1 3.43Å; L409-N411 PolarHBondContact O-N 3.34Å; N411-H413 VanDerWaalsContact C-N 3.26Å; N411-H413 PolarHBondContact ND2-ND1 3.03Å; N411-H413 PolarHBondContact O-N 2.87Å; N411-H413 WeakPolarHBondContact OD1-CB 3.45Å; N411-H413 PolarHBondContact OD1-N 2.86Å
412	G	91.6	Very high	91.5	Very high	38 Å²	38	54.1 Å²	54.1	39%	0.392	32%	0.316	S	S	.	.	S	Bend	trans	82.1	-6.6	-178.1	0	0	0	0	0	114.9	R408 L409 P410	R408-G412 PolarHBondContact NH1-O 3.42Å; L409-G412 PolarHBondContact O-N 3.46Å; P410-G412 PolarHBondContact O-N 3.32Å
413	H	95.2	Very high	92	Very high	64 Å²	64	53.6 Å²	53.6	30%	0.296	31%	0.314	S	S	.	.			trans	-64.7	148.3	176.6	-70.3	-168.2	0	0	0	111.2	A54 R408 L409 N411	A54-H413 CarbonylContact O-C 3.45Å; A54-H413 WeakPolarHBondContact O-CA 3.45Å; A54-H413 WeakPolarHBondContact O-CB 3.44Å; R408-H413 CarbonylContact C-O 3.56Å; R408-H413 WeakPolarHBondContact CA-O 3.23Å; R408-H413 WeakPolarHBondContact CB-O 3.47Å; L409-H413 PolarHBondContact N-O 2.92Å; N411-H413 VanDerWaalsContact C-N 3.26Å; N411-H413 PolarHBondContact ND2-ND1 3.03Å; N411-H413 PolarHBondContact O-N 2.87Å; N411-H413 WeakPolarHBondContact OD1-CB 3.45Å; N411-H413 PolarHBondContact OD1-N 2.86Å
414	V	94.3	Very high	92.4	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.012	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	129.7	167.3	176.6	0	0	0	0	108.3	S53 A54 L56 L59 F86 F416 F419	S53-V414 WeakPolarHBondContact CA-O 3.16Å; S53-V414 VanDerWaalsContact CB-O 3.26Å; S53-V414 WeakPolarHBondContact CB-O 3.46Å; A54-V414 PolarHBondContact N-O 3.49Å; A54-V414 PolarHBondContact O-N 3.11Å; L56-V414 HydrophobicContact CB-CG2 4.37Å; L59-V414 HydrophobicContact CD1-CB 3.63Å; L59-V414 HydrophobicContact CD1-CG1 3.79Å; L59-V414 HydrophobicContact CD1-CG2 4Å; F86-V414 HydrophobicContact CD2-CG1 4.43Å; F86-V414 HydrophobicContact CD2-CG2 4.41Å; F86-V414 HydrophobicContact CE1-CG2 4.37Å; F86-V414 HydrophobicContact CE2-CG1 3.66Å; F86-V414 HydrophobicContact CE2-CG2 4.27Å; F86-V414 HydrophobicContact CZ-CG1 3.78Å; F86-V414 HydrophobicContact CZ-CG2 4.24Å; V414-F416 PolarHBondContact O-N 2.7Å; V414-F419 HydrophobicContact CG1-CD2 3.86Å; V414-F419 HydrophobicContact CG1-CE2 3.62Å
415	N	94.1	Very high	92.8	Very high	20 Å²	20	54.8 Å²	54.8	11%	0.107	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	85.4	174.9	-176.7	-3.5	0	0	0	109.6	A406 N407 L409 K418 F419	A406-N415 VanDerWaalsContact O-CB 3.26Å; A406-N415 WeakPolarHBondContact O-CB 3.18Å; A406-N415 PolarHBondContact O-ND2 3.21Å; A406-N415 VanDerWaalsContact O-ND2 3.11Å; N407-N415 PolarHBondContact O-N 2.81Å; L409-N415 HydrophobicContact CD2-CB 4.05Å; L409-N415 HydrophobicContact CG-CB 4.2Å; N415-K418 HydrophobicContact CB-CB 4.39Å; N415-K418 PolarHBondContact OD1-N 3.38Å; N415-F419 WeakPolarHBondContact O-CD2 3.29Å; N415-F419 WeakPolarHBondContact O-CE2 3.42Å
416	F	95.2	Very high	93.2	Very high	7 Å²	7	52 Å²	52	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-72.3	-30.6	-172.9	-158	-102.5	0	0	0	112.3	I51 T52 L59 Y75 T78 F79 V414 K418 F419 V420	I51-F416 HydrophobicContact CB-CD1 4.33Å; I51-F416 HydrophobicContact CG2-CB 4.31Å; I51-F416 HydrophobicContact CG2-CD1 4.32Å; I51-F416 HydrophobicContact CG2-CG 4.39Å; I51-F416 VanDerWaalsContact O-CD1 3.31Å; I51-F416 WeakPolarHBondContact O-CD1 3.38Å; T52-F416 WeakPolarHBondContact O-CA 3.45Å; T52-F416 PolarHBondContact O-N 3.17Å; L59-F416 HydrophobicContact CD1-CD2 3.92Å; L59-F416 HydrophobicContact CD1-CE2 4.46Å; L59-F416 HydrophobicContact CD2-CD2 3.85Å; L59-F416 HydrophobicContact CD2-CE2 4.14Å; L59-F416 HydrophobicContact CD2-CG 4.3Å; Y75-F416 AromaticContact CD2-CE1 3.59Å; Y75-F416 HydrophobicContact CD2-CE1 3.59Å; Y75-F416 HydrophobicContact CD2-CE2 4.42Å; Y75-F416 AromaticContact CD2-CZ 3.4Å; Y75-F416 HydrophobicContact CD2-CZ 3.4Å; Y75-F416 VanDerWaalsContact CD2-CZ 3.4Å; Y75-F416 AromaticContact CE2-CE1 3.69Å; Y75-F416 HydrophobicContact CE2-CE1 3.69Å; Y75-F416 AromaticContact CE2-CE2 3.9Å; Y75-F416 HydrophobicContact CE2-CE2 3.9Å; Y75-F416 AromaticContact CE2-CZ 3.3Å; Y75-F416 HydrophobicContact CE2-CZ 3.3Å; Y75-F416 HydrophobicContact CG-CZ 4.34Å; T78-F416 HydrophobicContact CG2-CE1 3.95Å; T78-F416 HydrophobicContact CG2-CE2 3.98Å; T78-F416 HydrophobicContact CG2-CZ 3.56Å; F79-F416 HydrophobicContact CB-CE2 4.01Å; F79-F416 HydrophobicContact CB-CZ 4.23Å; F79-F416 HydrophobicContact CD2-CE2 4.1Å; V414-F416 PolarHBondContact O-N 2.7Å; F416-K418 VanDerWaalsContact C-N 3.34Å; F416-K418 PolarHBondContact O-N 3.37Å; F416-F419 CarbonylContact O-C 3.41Å; F416-F419 PolarHBondContact O-N 2.96Å; F416-V420 HydrophobicContact CD1-CG2 3.76Å; F416-V420 HydrophobicContact CE1-CG2 3.79Å; F416-V420 WeakPolarHBondContact O-CG2 3.38Å; F416-V420 PolarHBondContact O-N 2.86Å
417	E	93.4	Very high	93.4	Very high	128 Å²	128	50 Å²	50	60%	0.598	26%	0.264	S	S	*	.	H	α-helix	trans	-56.7	-44.9	174.9	-176.7	172.8	-152.9	0	0	112.1	T52 F419 V420 E421	T52-E417 PolarHBondContact O-N 2.93Å; E417-F419 VanDerWaalsContact C-N 3.28Å; E417-F419 PolarHBondContact O-N 3.38Å; E417-V420 PolarHBondContact O-N 2.71Å; E417-E421 PolarHBondContact O-N 3.24Å
418	K	92.6	Very high	93.6	Very high	11 Å²	11	50.3 Å²	50.3	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-53.8	-47	171.5	175.8	-168.9	177	177.2	0	111.5	N402 C405 N407 N415 F416 E421 L422	N402-K418 VanDerWaalsContact O-CE 3.3Å; N402-K418 WeakPolarHBondContact O-CE 3.23Å; N402-K418 PolarHBondContact O-NZ 2.96Å; N402-K418 WeakPolarHBondContact OD1-CE 3.17Å; N402-K418 PolarHBondContact OD1-NZ 3.1Å; C405-K418 HydrophobicContact CB-CB 4.17Å; C405-K418 HydrophobicContact CB-CD 3.65Å; C405-K418 HydrophobicContact CB-CG 3.78Å; C405-K418 WeakPolarHBondContact O-CD 3.42Å; C405-K418 WeakPolarHBondContact O-CE 3.37Å; C405-K418 PolarHBondContact O-NZ 3.32Å; N407-K418 PolarHBondContact OD1-NZ 3.18Å; N415-K418 HydrophobicContact CB-CB 4.39Å; N415-K418 PolarHBondContact OD1-N 3.38Å; F416-K418 VanDerWaalsContact C-N 3.34Å; F416-K418 PolarHBondContact O-N 3.37Å; K418-E421 PolarHBondContact O-N 3.35Å; K418-L422 PolarHBondContact O-N 3.33Å
419	F	93.4	Very high	93.7	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-73.3	-29.4	-175.4	-63.7	-55.6	0	0	0	113	T78 L85 F86 N407 V414 N415 F416 E417 E421 L422 A423	T78-F419 HydrophobicContact CG2-CB 3.92Å; T78-F419 WeakPolarHBondContact CG2-O 3.37Å; L85-F419 HydrophobicContact CD1-CE1 3.47Å; L85-F419 VanDerWaalsContact CD1-CE1 3.47Å; L85-F419 HydrophobicContact CD1-CZ 3.85Å; F86-F419 HydrophobicContact CE2-CD2 4.36Å; F86-F419 AromaticContact CE2-CE2 3.5Å; F86-F419 HydrophobicContact CE2-CE2 3.5Å; F86-F419 VanDerWaalsContact CE2-CE2 3.5Å; F86-F419 AromaticContact CE2-CZ 3.65Å; F86-F419 HydrophobicContact CE2-CZ 3.65Å; F86-F419 AromaticContact CZ-CE2 3.46Å; F86-F419 HydrophobicContact CZ-CE2 3.46Å; F86-F419 VanDerWaalsContact CZ-CE2 3.46Å; F86-F419 AromaticContact CZ-CZ 3.49Å; F86-F419 HydrophobicContact CZ-CZ 3.49Å; F86-F419 VanDerWaalsContact CZ-CZ 3.49Å; N407-F419 HydrophobicContact CB-CZ 4.23Å; N407-F419 WeakPolarHBondContact OD1-CZ 3.48Å; V414-F419 HydrophobicContact CG1-CD2 3.86Å; V414-F419 HydrophobicContact CG1-CE2 3.62Å; N415-F419 WeakPolarHBondContact O-CD2 3.29Å; N415-F419 WeakPolarHBondContact O-CE2 3.42Å; F416-F419 CarbonylContact O-C 3.41Å; F416-F419 PolarHBondContact O-N 2.96Å; E417-F419 VanDerWaalsContact C-N 3.28Å; E417-F419 PolarHBondContact O-N 3.38Å; F419-E421 VanDerWaalsContact C-N 3.34Å; F419-L422 HydrophobicContact CD1-CD2 4.17Å; F419-L422 PolarHBondContact O-N 3.11Å; F419-A423 WeakPolarHBondContact O-CB 3.4Å; F419-A423 PolarHBondContact O-N 3.13Å
420	V	94.8	Very high	93.7	Very high	68 Å²	68	43.5 Å²	43.5	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-60.3	-45.8	170.5	170.1	0	0	0	0	110.2	T78 F416 E417 A423 R424	T78-V420 HydrophobicContact CG2-CG2 4.07Å; F416-V420 HydrophobicContact CD1-CG2 3.76Å; F416-V420 HydrophobicContact CE1-CG2 3.79Å; F416-V420 WeakPolarHBondContact O-CG2 3.38Å; F416-V420 PolarHBondContact O-N 2.86Å; E417-V420 PolarHBondContact O-N 2.71Å; V420-A423 PolarHBondContact O-N 2.97Å; V420-R424 WeakPolarHBondContact O-CB 3.31Å; V420-R424 PolarHBondContact O-N 2.95Å
421	E	93.2	Very high	93.7	Very high	66 Å²	66	40.7 Å²	40.7	31%	0.308	22%	0.215	S	C	.	.	H	α-helix	trans	-67.4	-37.9	178.3	-175.6	51.6	-151.9	0	0	111.9	L401 E417 K418 F419 R424 Q425	L401-E421 HydrophobicContact CD1-CB 4.23Å; L401-E421 HydrophobicContact CD1-CG 3.62Å; L401-E421 HydrophobicContact CD2-CB 4.24Å; L401-E421 HydrophobicContact CD2-CG 3.76Å; L401-E421 HydrophobicContact CG-CG 4.34Å; E417-E421 PolarHBondContact O-N 3.24Å; K418-E421 PolarHBondContact O-N 3.35Å; F419-E421 VanDerWaalsContact C-N 3.34Å; E421-R424 WeakPolarHBondContact O-CB 3.48Å; E421-R424 PolarHBondContact O-N 2.68Å; E421-R424 IonicContact OE1-CZ 3.81Å; E421-R424 IonicContact OE1-NE 3.28Å; E421-R424 PolarHBondContact OE1-NE 2.81Å; E421-R424 IonicContact OE1-NH2 3.39Å; E421-R424 PolarHBondContact OE1-NH2 2.97Å; E421-R424 IonicContact OE2-CZ 2.68Å; E421-R424 IonicContact OE2-NE 3.66Å; E421-R424 PolarHBondContact OE2-NE 3.11Å; E421-R424 IonicContact OE2-NH2 2.71Å; E421-Q425 PolarHBondContact O-N 3.48Å
422	L	92.7	Very high	93.8	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-48	174.4	-172.3	72.6	0	0	0	111.3	V245 I398 L401 K418 F419 R424 Q425 V426	V245-L422 HydrophobicContact CG2-CD2 4.26Å; I398-L422 HydrophobicContact CG2-CD1 3.5Å; I398-L422 VanDerWaalsContact CG2-CD1 3.5Å; L401-L422 HydrophobicContact CD2-CB 4.17Å; L401-L422 HydrophobicContact CD2-CD1 4.1Å; K418-L422 PolarHBondContact O-N 3.33Å; F419-L422 HydrophobicContact CD1-CD2 4.17Å; F419-L422 PolarHBondContact O-N 3.11Å; L422-R424 VanDerWaalsContact C-N 3.27Å; L422-R424 PolarHBondContact O-N 3.03Å; L422-Q425 PolarHBondContact O-N 3.37Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.43Å
423	A	94.2	Very high	93.8	Very high	4 Å²	4	36 Å²	36	3%	0.033	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-33.5	178.4	0	0	0	0	0	111.8	F77 T78 L81 F419 V420 G427	F77-A423 HydrophobicContact CD1-CB 3.92Å; F77-A423 HydrophobicContact CE1-CB 3.92Å; F77-A423 WeakPolarHBondContact CE1-O 3.4Å; T78-A423 HydrophobicContact CG2-CB 3.95Å; T78-A423 VanDerWaalsContact OG1-CB 3.23Å; T78-A423 WeakPolarHBondContact OG1-CB 3.45Å; L81-A423 HydrophobicContact CD2-CB 4.17Å; F419-A423 WeakPolarHBondContact O-CB 3.4Å; F419-A423 PolarHBondContact O-N 3.13Å; V420-A423 PolarHBondContact O-N 2.97Å; A423-G427 WeakPolarHBondContact O-CA 3.4Å; A423-G427 PolarHBondContact O-N 3.28Å
424	R	93.9	Very high	93.6	Very high	125 Å²	125	39.9 Å²	39.9	47%	0.472	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-48.5	174.1	-167.2	-170.1	66.5	69	1.7	111.2	V420 E421 L422 E428	V420-R424 WeakPolarHBondContact O-CB 3.31Å; V420-R424 PolarHBondContact O-N 2.95Å; E421-R424 WeakPolarHBondContact O-CB 3.48Å; E421-R424 PolarHBondContact O-N 2.68Å; E421-R424 IonicContact OE1-CZ 3.81Å; E421-R424 IonicContact OE1-NE 3.28Å; E421-R424 PolarHBondContact OE1-NE 2.81Å; E421-R424 IonicContact OE1-NH2 3.39Å; E421-R424 PolarHBondContact OE1-NH2 2.97Å; E421-R424 IonicContact OE2-CZ 2.68Å; E421-R424 IonicContact OE2-NE 3.66Å; E421-R424 PolarHBondContact OE2-NE 3.11Å; E421-R424 IonicContact OE2-NH2 2.71Å; L422-R424 VanDerWaalsContact C-N 3.27Å; L422-R424 PolarHBondContact O-N 3.03Å; R424-E428 WeakPolarHBondContact O-CB 3.39Å; R424-E428 PolarHBondContact O-N 2.95Å
425	Q	93.3	Very high	93.5	Very high	30 Å²	30	40.7 Å²	40.7	14%	0.14	20%	0.203	C	C	.	.	H	α-helix	trans	-68.5	-44.4	-180	-63.4	-159.1	18.7	0	0	112.7	I398 E421 L422 E428 F429	I398-Q425 HydrophobicContact CG1-CB 4.27Å; E421-Q425 PolarHBondContact O-N 3.48Å; L422-Q425 PolarHBondContact O-N 3.37Å; Q425-E428 PolarHBondContact O-N 3.46Å; Q425-F429 PolarHBondContact O-N 3.48Å
426	V	94.2	Very high	93.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177.6	178.8	0	0	0	0	110.6	F77 L81 P241 F244 I398 L422 E428 F429 M430	F77-V426 HydrophobicContact CZ-CB 4.46Å; F77-V426 HydrophobicContact CZ-CG1 4.06Å; L81-V426 HydrophobicContact CD2-CB 4.04Å; L81-V426 HydrophobicContact CD2-CG1 4.18Å; L81-V426 HydrophobicContact CD2-CG2 4.21Å; P241-V426 HydrophobicContact CB-CG1 3.73Å; F244-V426 HydrophobicContact CB-CG2 3.99Å; F244-V426 HydrophobicContact CD2-CG1 4.05Å; F244-V426 HydrophobicContact CD2-CG2 4.44Å; F244-V426 HydrophobicContact CG-CG2 4.15Å; I398-V426 HydrophobicContact CD1-CG2 4.34Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.43Å; V426-E428 VanDerWaalsContact C-N 3.34Å; V426-E428 PolarHBondContact O-N 3Å; V426-F429 WeakPolarHBondContact O-CB 3.34Å; V426-F429 PolarHBondContact O-N 2.97Å; V426-M430 HydrophobicContact CG1-CG 4.19Å; V426-M430 WeakPolarHBondContact O-CB 3.41Å; V426-M430 WeakPolarHBondContact O-CG 3.29Å; V426-M430 PolarHBondContact O-N 2.95Å
427	G	94.4	Very high	93.3	Very high	21 Å²	21	48.3 Å²	48.3	22%	0.216	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-37.5	179	0	0	0	0	0	113.2	A423 M430 T431	A423-G427 WeakPolarHBondContact O-CA 3.4Å; A423-G427 PolarHBondContact O-N 3.28Å; G427-M430 PolarHBondContact O-N 3.25Å; G427-T431 PolarHBondContact O-N 3.38Å; G427-T431 PolarHBondContact O-OG1 3.25Å
428	E	93.3	Very high	93.4	Very high	63 Å²	63	44.9 Å²	44.9	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-48.5	173.9	-166.7	176.9	-158.4	0	0	110.9	R424 Q425 V426 M430 T431 W432	R424-E428 WeakPolarHBondContact O-CB 3.39Å; R424-E428 PolarHBondContact O-N 2.95Å; Q425-E428 PolarHBondContact O-N 3.46Å; V426-E428 VanDerWaalsContact C-N 3.34Å; V426-E428 PolarHBondContact O-N 3Å; E428-M430 VanDerWaalsContact C-N 3.33Å; E428-M430 PolarHBondContact O-N 3.36Å; E428-T431 WeakPolarHBondContact O-CB 3.47Å; E428-T431 PolarHBondContact O-N 3.46Å; E428-T431 VanDerWaalsContact O-N 3.11Å; E428-W432 HydrophobicContact CG-CD2 4.36Å; E428-W432 HydrophobicContact CG-CH2 3.74Å; E428-W432 HydrophobicContact CG-CZ2 3.32Å; E428-W432 HydrophobicContact CG-CZ3 4.43Å; E428-W432 PolarHBondContact O-N 2.92Å; E428-W432 VanDerWaalsContact OE1-CZ2 3.26Å; E428-W432 WeakPolarHBondContact OE1-CZ2 3.48Å
429	F	94.8	Very high	93.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-42.9	173.5	171.3	-94.2	0	0	0	112.8	L236 I239 F244 P389 F391 L394 Q425 V426 T431 W432 K433	L236-F429 HydrophobicContact CD2-CE2 3.6Å; L236-F429 HydrophobicContact CD2-CZ 3.71Å; I239-F429 HydrophobicContact CB-CE1 4.28Å; I239-F429 HydrophobicContact CB-CZ 4.27Å; I239-F429 HydrophobicContact CD1-CZ 4.21Å; I239-F429 HydrophobicContact CG2-CE1 4.04Å; I239-F429 HydrophobicContact CG2-CZ 4.25Å; F244-F429 AromaticContact CE2-CD1 3.61Å; F244-F429 HydrophobicContact CE2-CD1 3.61Å; F244-F429 AromaticContact CE2-CE1 3.56Å; F244-F429 HydrophobicContact CE2-CE1 3.56Å; F244-F429 HydrophobicContact CE2-CG 4.47Å; F244-F429 HydrophobicContact CE2-CZ 4.37Å; F244-F429 AromaticContact CZ-CD1 3.53Å; F244-F429 HydrophobicContact CZ-CD1 3.53Å; F244-F429 HydrophobicContact CZ-CD2 4.4Å; F244-F429 AromaticContact CZ-CE1 3.47Å; F244-F429 HydrophobicContact CZ-CE1 3.47Å; F244-F429 VanDerWaalsContact CZ-CE1 3.47Å; F244-F429 HydrophobicContact CZ-CE2 4.34Å; F244-F429 HydrophobicContact CZ-CG 4.01Å; F244-F429 AromaticContact CZ-CZ 3.89Å; F244-F429 HydrophobicContact CZ-CZ 3.89Å; P389-F429 HydrophobicContact CG-CD2 4.45Å; F391-F429 HydrophobicContact CD2-CE2 4.28Å; F391-F429 AromaticContact CE2-CE2 3.87Å; F391-F429 HydrophobicContact CE2-CE2 3.87Å; F391-F429 HydrophobicContact CE2-CZ 4.12Å; L394-F429 HydrophobicContact CD2-CB 4.24Å; L394-F429 HydrophobicContact CD2-CD2 3.61Å; L394-F429 HydrophobicContact CD2-CE2 4.3Å; L394-F429 HydrophobicContact CD2-CG 4.16Å; Q425-F429 PolarHBondContact O-N 3.48Å; V426-F429 WeakPolarHBondContact O-CB 3.34Å; V426-F429 PolarHBondContact O-N 2.97Å; F429-T431 PolarHBondContact O-N 3.46Å; F429-W432 PolarHBondContact O-N 2.91Å; F429-W432 VanDerWaalsContact O-N 3.13Å; F429-K433 HydrophobicContact CE1-CD 4.02Å; F429-K433 PolarHBondContact O-N 3.31Å; F429-K433 VanDerWaalsContact O-N 3.08Å
430	M	93.8	Very high	93.6	Very high	20 Å²	20	53.6 Å²	53.6	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-26.6	178.6	-72.8	-58.2	-66.2	0	0	112.7	P241 V426 G427 E428 K433 Q434	P241-M430 HydrophobicContact CB-CE 4.4Å; P241-M430 HydrophobicContact CB-CG 4.1Å; P241-M430 HydrophobicContact CB-SD 3.98Å; P241-M430 HydrophobicContact CG-CE 4.01Å; P241-M430 HydrophobicContact CG-SD 4.19Å; V426-M430 HydrophobicContact CG1-CG 4.19Å; V426-M430 WeakPolarHBondContact O-CB 3.41Å; V426-M430 WeakPolarHBondContact O-CG 3.29Å; V426-M430 PolarHBondContact O-N 2.95Å; G427-M430 PolarHBondContact O-N 3.25Å; E428-M430 VanDerWaalsContact C-N 3.33Å; E428-M430 PolarHBondContact O-N 3.36Å; M430-K433 HydrophobicContact CE-CD 4.17Å; M430-K433 VanDerWaalsContact CE-CE 3.43Å; M430-K433 WeakPolarHBondContact O-CG 3.27Å; M430-K433 HydrophobicContact SD-CD 3.76Å; M430-Q434 WeakPolarHBondContact O-CG 3.28Å; M430-Q434 PolarHBondContact O-NE2 2.6Å
431	T	92.9	Very high	93.7	Very high	85 Å²	85	55.9 Å²	55.9	52%	0.521	28%	0.277	S	S	.	.	H	α-helix	trans	-73.6	-46.6	173	-56.2	0	0	0	0	110.6	G427 E428 F429 K433 Q434	G427-T431 PolarHBondContact O-N 3.38Å; G427-T431 PolarHBondContact O-OG1 3.25Å; E428-T431 WeakPolarHBondContact O-CB 3.47Å; E428-T431 PolarHBondContact O-N 3.46Å; E428-T431 VanDerWaalsContact O-N 3.11Å; F429-T431 PolarHBondContact O-N 3.46Å; T431-K433 VanDerWaalsContact C-N 3.34Å; T431-K433 PolarHBondContact O-N 3.28Å; T431-Q434 PolarHBondContact O-N 2.98Å
432	W	94.1	Very high	93.8	Very high	13 Å²	13	55.7 Å²	55.7	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-36.6	-177.7	-60.8	-27.1	0	0	0	113.7	L369 A373 V387 P389 E428 F429 Q434 V435	L369-W432 HydrophobicContact CD1-CH2 4.28Å; L369-W432 HydrophobicContact CD2-CH2 4.38Å; L369-W432 HydrophobicContact CG-CH2 4.46Å; A373-W432 HydrophobicContact CB-CZ2 3.97Å; V387-W432 HydrophobicContact CB-CB 4.25Å; V387-W432 HydrophobicContact CB-CD2 3.95Å; V387-W432 HydrophobicContact CB-CG 3.75Å; V387-W432 HydrophobicContact CG1-CD2 3.71Å; V387-W432 HydrophobicContact CG1-CE3 4.1Å; V387-W432 HydrophobicContact CG1-CG 4.09Å; V387-W432 HydrophobicContact CG1-CH2 4.4Å; V387-W432 HydrophobicContact CG1-CZ2 3.99Å; V387-W432 HydrophobicContact CG1-CZ3 4.44Å; V387-W432 WeakPolarHBondContact O-CB 3.47Å; P389-W432 HydrophobicContact CB-CZ3 4.13Å; P389-W432 HydrophobicContact CG-CE3 4.03Å; P389-W432 HydrophobicContact CG-CZ3 3.93Å; E428-W432 HydrophobicContact CG-CD2 4.36Å; E428-W432 HydrophobicContact CG-CH2 3.74Å; E428-W432 HydrophobicContact CG-CZ2 3.32Å; E428-W432 HydrophobicContact CG-CZ3 4.43Å; E428-W432 PolarHBondContact O-N 2.92Å; E428-W432 VanDerWaalsContact OE1-CZ2 3.26Å; E428-W432 WeakPolarHBondContact OE1-CZ2 3.48Å; F429-W432 PolarHBondContact O-N 2.91Å; F429-W432 VanDerWaalsContact O-N 3.13Å; W432-Q434 PolarHBondContact O-N 2.98Å; W432-V435 WeakPolarHBondContact O-CG2 3.48Å
433	K	92.4	Very high	93.9	Very high	24 Å²	24	65.2 Å²	65.2	10%	0.104	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.9	-179.4	74	168.9	-140.2	157.3	0	114.9	L236 S237 I239 F429 M430 T431 V435	L236-K433 HydrophobicContact CB-CB 4.07Å; S237-K433 PolarHBondContact O-NZ 3.18Å; I239-K433 PolarHBondContact O-NZ 3.46Å; F429-K433 HydrophobicContact CE1-CD 4.02Å; F429-K433 PolarHBondContact O-N 3.31Å; F429-K433 VanDerWaalsContact O-N 3.08Å; M430-K433 HydrophobicContact CE-CD 4.17Å; M430-K433 VanDerWaalsContact CE-CE 3.43Å; M430-K433 WeakPolarHBondContact O-CG 3.27Å; M430-K433 HydrophobicContact SD-CD 3.76Å; T431-K433 VanDerWaalsContact C-N 3.34Å; T431-K433 PolarHBondContact O-N 3.28Å; K433-V435 PolarHBondContact O-N 2.98Å
434	Q	90.1	Very high	93.9	Very high	145 Å²	145	67.9 Å²	67.9	68%	0.678	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.4	-179.6	-71.5	175	16.1	0	0	113	M430 T431 W432 E436	M430-Q434 WeakPolarHBondContact O-CG 3.28Å; M430-Q434 PolarHBondContact O-NE2 2.6Å; T431-Q434 PolarHBondContact O-N 2.98Å; W432-Q434 PolarHBondContact O-N 2.98Å; Q434-E436 PolarHBondContact O-N 3.14Å
435	V	92.4	Very high	94	Very high	20 Å²	20	62 Å²	62	12%	0.121	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-73.1	120	-178.5	179.8	0	0	0	0	110	R385 I386 W432 K433	R385-V435 HydrophobicContact CB-CG1 4.11Å; R385-V435 HydrophobicContact CB-CG2 3.76Å; R385-V435 WeakPolarHBondContact O-CG2 3.29Å; I386-V435 HydrophobicContact CG1-CG1 3.95Å; W432-V435 WeakPolarHBondContact O-CG2 3.48Å; K433-V435 PolarHBondContact O-N 2.98Å
436	E	91.7	Very high	94	Very high	156 Å²	156	61.9 Å²	61.9	73%	0.729	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-69.3	132.4	166.8	-68.4	-179.7	177.1	0	0	109.7	Q434 P438	Q434-E436 PolarHBondContact O-N 3.14Å; E436-P438 WeakPolarHBondContact O-CD 3.01Å
437	C	93.8	Very high	93.8	Very high	31 Å²	31	67.8 Å²	67.8	21%	0.209	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-66	120.9	-179.3	-168.2	0	0	0	0	110.1	H230 L233 F439	H230-C437 VanDerWaalsContact CE1-CB 3.41Å; H230-C437 WeakPolarHBondContact CE1-CB 3.45Å; H230-C437 PolarHBondContact CE1-SG 3.4Å; H230-C437 VanDerWaalsContact CG-SG 3.51Å; H230-C437 WeakPolarHBondContact ND1-CB 3.48Å; H230-C437 PolarHBondContact ND1-SG 3.27Å; L233-C437 HydrophobicContact CD1-CB 3.67Å; C437-F439 VanDerWaalsContact C-N 3.29Å; C437-F439 PolarHBondContact O-N 2.87Å; C437-F439 VanDerWaalsContact SG-CD2 3.57Å
438	P	94.7	Very high	93.7	Very high	56 Å²	56	67.6 Å²	67.6	36%	0.364	33%	0.334	S	S	.	.			trans	-86.1	0.3	-173.7	35.3	-36.4	0	0	0	113.6	N382 R383 I386 E436	N382-P438 HydrophobicContact CB-CB 3.96Å; N382-P438 HydrophobicContact CB-CG 4.47Å; R383-P438 HydrophobicContact CB-CG 4.05Å; I386-P438 HydrophobicContact CD1-CG 3.91Å; E436-P438 WeakPolarHBondContact O-CD 3.01Å
439	F	96	Very high	93.7	Very high	22 Å²	22	64.7 Å²	64.7	10%	0.096	32%	0.32	C	S	.	.	S	Bend	trans	-90.2	152.9	-177.8	-52.1	-58.3	0	0	0	110.6	Q226 T229 H230 I316 R383 I386 C437	Q226-F439 HydrophobicContact CB-CB 3.78Å; Q226-F439 HydrophobicContact CB-CD1 4.25Å; Q226-F439 HydrophobicContact CB-CD2 3.75Å; Q226-F439 HydrophobicContact CB-CE2 4.4Å; Q226-F439 HydrophobicContact CB-CG 3.66Å; Q226-F439 HydrophobicContact CG-CB 4.06Å; Q226-F439 HydrophobicContact CG-CD1 3.59Å; Q226-F439 HydrophobicContact CG-CD2 3.78Å; Q226-F439 HydrophobicContact CG-CE1 3.91Å; Q226-F439 HydrophobicContact CG-CE2 4.09Å; Q226-F439 HydrophobicContact CG-CG 3.53Å; Q226-F439 HydrophobicContact CG-CZ 4.15Å; T229-F439 HydrophobicContact CG2-CD2 4.31Å; T229-F439 HydrophobicContact CG2-CE2 3.97Å; H230-F439 PolarHBondContact CE1-O 3.29Å; H230-F439 PolarHBondContact NE2-O 2.87Å; I316-F439 HydrophobicContact CD1-CE2 4.08Å; I316-F439 HydrophobicContact CD1-CZ 3.99Å; I316-F439 HydrophobicContact CG1-CZ 4.1Å; I316-F439 HydrophobicContact CG2-CE2 4.1Å; I316-F439 HydrophobicContact CG2-CZ 4.22Å; R383-F439 HydrophobicContact CG-CE1 4.11Å; R383-F439 HydrophobicContact CG-CZ 4.02Å; I386-F439 HydrophobicContact CD1-CE2 3.66Å; I386-F439 HydrophobicContact CD1-CZ 3.95Å; C437-F439 VanDerWaalsContact C-N 3.29Å; C437-F439 PolarHBondContact O-N 2.87Å; C437-F439 VanDerWaalsContact SG-CD2 3.57Å
440	E	95.4	Very high	93.3	Very high	172 Å²	172	66.5 Å²	66.5	80%	0.804	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-69.8	139.7	174.5	-169.2	174.1	179.9	0	0	110.4	Q227	Q227-E440 PolarHBondContact NE2-O 2.85Å
441	E	95.4	Very high	93	Very high	117 Å²	117	68.2 Å²	68.2	55%	0.547	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-80.7	126.8	177.7	-72.7	-178.1	-174.3	0	0	111.3	L446	E441-L446 HydrophobicContact CB-CD1 4.28Å; E441-L446 HydrophobicContact CG-CD1 4.41Å
442	D	96.6	Very high	92.7	Very high	61 Å²	61	64.3 Å²	64.3	33%	0.326	32%	0.316	S	S	.	.			trans	-105.1	102.5	167.4	-172.2	-40.2	0	0	0	109.9	Q227 A444 I445 L446	Q227-D442 HydrophobicContact CG-CB 4.29Å; D442-A444 PolarHBondContact O-N 2.86Å; D442-A444 WeakPolarHBondContact OD1-CA 3.47Å; D442-A444 WeakPolarHBondContact OD1-CB 3.31Å; D442-A444 PolarHBondContact OD1-N 2.92Å; D442-I445 HydrophobicContact CB-CB 4.2Å; D442-I445 HydrophobicContact CB-CD1 3.83Å; D442-I445 HydrophobicContact CB-CG1 4.05Å; D442-I445 PolarHBondContact O-N 3.44Å; D442-I445 PolarHBondContact OD1-N 3.49Å; D442-I445 VanDerWaalsContact OD1-N 3.17Å; D442-L446 WeakPolarHBondContact O-CG 3.46Å; D442-L446 PolarHBondContact O-N 3.2Å
443	R	94.2	Very high	92.3	Very high	204 Å²	204	64.3 Å²	64.3	77%	0.77	32%	0.318	S	S	*	.	H	α-helix	trans	-61.1	-29.6	-177.8	-65.2	-174.9	178.1	-173.9	-0.6	113.6	H447	R443-H447 WeakPolarHBondContact O-CB 3.25Å; R443-H447 PolarHBondContact O-N 3.06Å
444	A	93.9	Very high	92.1	Very high	60 Å²	60	64.5 Å²	64.5	50%	0.496	32%	0.32	S	S	.	.	H	α-helix	trans	-72.3	-41.9	-179.9	0	0	0	0	0	110.8	D442 Y448	D442-A444 PolarHBondContact O-N 2.86Å; D442-A444 WeakPolarHBondContact OD1-CA 3.47Å; D442-A444 WeakPolarHBondContact OD1-CB 3.31Å; D442-A444 PolarHBondContact OD1-N 2.92Å; A444-Y448 PolarHBondContact O-N 3.48Å; A444-Y448 VanDerWaalsContact O-N 3.07Å
445	I	95.8	Very high	92	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-67.1	-48.1	176.2	-59.6	175.3	0	0	0	110.3	I217 C218 T223 L224 Q227 D442 H447 Y448 L449	I217-I445 HydrophobicContact CG2-CG1 4.13Å; C218-I445 HydrophobicContact CB-CD1 3.61Å; C218-I445 HydrophobicContact CB-CG1 3.91Å; T223-I445 HydrophobicContact CG2-CD1 3.64Å; L224-I445 HydrophobicContact CD1-CG2 3.73Å; Q227-I445 HydrophobicContact CB-CB 4.47Å; Q227-I445 HydrophobicContact CB-CG2 3.79Å; Q227-I445 HydrophobicContact CG-CB 3.96Å; Q227-I445 HydrophobicContact CG-CD1 4.04Å; Q227-I445 HydrophobicContact CG-CG2 3.72Å; D442-I445 HydrophobicContact CB-CB 4.2Å; D442-I445 HydrophobicContact CB-CD1 3.83Å; D442-I445 HydrophobicContact CB-CG1 4.05Å; D442-I445 PolarHBondContact O-N 3.44Å; D442-I445 PolarHBondContact OD1-N 3.49Å; D442-I445 VanDerWaalsContact OD1-N 3.17Å; I445-H447 VanDerWaalsContact C-N 3.33Å; I445-H447 PolarHBondContact O-N 2.96Å; I445-Y448 WeakPolarHBondContact O-CB 3.29Å; I445-Y448 PolarHBondContact O-N 3.17Å; I445-Y448 VanDerWaalsContact O-N 3.11Å; I445-L449 HydrophobicContact CG2-CD1 4.08Å; I445-L449 HydrophobicContact CG2-CG 4.35Å; I445-L449 WeakPolarHBondContact O-CG 3.17Å; I445-L449 PolarHBondContact O-N 2.89Å
446	L	93.6	Very high	91.8	Very high	27 Å²	27	59.5 Å²	59.5	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-46.4	177.7	-68.4	172.2	0	0	0	111.2	Q227 H230 V231 E441 D442 Y448 L449 H450	Q227-L446 HydrophobicContact CB-CD2 4.18Å; H230-L446 HydrophobicContact CB-CD2 4.27Å; V231-L446 HydrophobicContact CG2-CD2 3.6Å; E441-L446 HydrophobicContact CB-CD1 4.28Å; E441-L446 HydrophobicContact CG-CD1 4.41Å; D442-L446 WeakPolarHBondContact O-CG 3.46Å; D442-L446 PolarHBondContact O-N 3.2Å; L446-Y448 VanDerWaalsContact C-N 3.3Å; L446-Y448 PolarHBondContact O-N 2.9Å; L446-L449 PolarHBondContact O-N 3.19Å; L446-H450 PolarHBondContact O-CD2 3.42Å; L446-H450 PolarHBondContact O-N 3.14Å; L446-H450 VanDerWaalsContact O-N 3.11Å
447	H	90.5	Very high	91.6	Very high	124 Å²	124	56.5 Å²	56.5	57%	0.574	29%	0.285	S	S	*	.	H	α-helix	trans	-57.7	-43.5	175.8	-177.9	73.2	0	0	0	112	R443 I445 H450 T451	R443-H447 WeakPolarHBondContact O-CB 3.25Å; R443-H447 PolarHBondContact O-N 3.06Å; I445-H447 VanDerWaalsContact C-N 3.33Å; I445-H447 PolarHBondContact O-N 2.96Å; H447-H450 PolarHBondContact O-N 3.06Å; H447-T451 WeakPolarHBondContact O-CB 3.27Å; H447-T451 WeakPolarHBondContact O-CG2 3.49Å; H447-T451 PolarHBondContact O-N 3.34Å; H447-T451 PolarHBondContact O-OG1 3.06Å
448	Y	91.8	Very high	91.4	Very high	18 Å²	18	58.4 Å²	58.4	7%	0.071	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-47.9	176.7	-171.2	-101.9	0	0	0	112.1	K212 M214 I217 E289 A444 I445 L446 H450 T451 A452	K212-Y448 WeakPolarHBondContact O-CE2 3.29Å; K212-Y448 PolarHBondContact O-OH 2.94Å; M214-Y448 HydrophobicContact CB-CE1 4.04Å; M214-Y448 HydrophobicContact CE-CD1 3.58Å; M214-Y448 HydrophobicContact CE-CE1 3.67Å; M214-Y448 HydrophobicContact SD-CD1 3.89Å; M214-Y448 HydrophobicContact SD-CE1 4.06Å; I217-Y448 HydrophobicContact CD1-CD1 4.07Å; I217-Y448 HydrophobicContact CD1-CD2 3.04Å; I217-Y448 HydrophobicContact CD1-CE1 4.43Å; I217-Y448 HydrophobicContact CD1-CE2 3.47Å; I217-Y448 VanDerWaalsContact CD1-CE2 3.47Å; I217-Y448 HydrophobicContact CD1-CG 3.36Å; E289-Y448 PolarHBondContact OE1-OH 3.07Å; A444-Y448 PolarHBondContact O-N 3.48Å; A444-Y448 VanDerWaalsContact O-N 3.07Å; I445-Y448 WeakPolarHBondContact O-CB 3.29Å; I445-Y448 PolarHBondContact O-N 3.17Å; I445-Y448 VanDerWaalsContact O-N 3.11Å; L446-Y448 VanDerWaalsContact C-N 3.3Å; L446-Y448 PolarHBondContact O-N 2.9Å; Y448-H450 PolarHBondContact O-N 3.45Å; Y448-T451 PolarHBondContact O-N 2.96Å; Y448-A452 HydrophobicContact CD1-CB 3.98Å; Y448-A452 HydrophobicContact CD2-CB 3.95Å; Y448-A452 HydrophobicContact CE1-CB 3.73Å; Y448-A452 HydrophobicContact CE2-CB 3.73Å; Y448-A452 HydrophobicContact CG-CB 4.1Å; Y448-A452 WeakPolarHBondContact O-CB 3.46Å; Y448-A452 PolarHBondContact O-N 2.87Å
449	L	93.5	Very high	91	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-53.4	-39.9	178.1	-74.8	172.5	0	0	0	112.1	M214 L224 Q227 L228 V231 W278 R281 L285 I445 L446	M214-L449 HydrophobicContact CE-CD2 3.87Å; L224-L449 HydrophobicContact CD1-CD1 4.27Å; L224-L449 HydrophobicContact CD1-CD2 4.13Å; L224-L449 HydrophobicContact CD1-CG 4.46Å; Q227-L449 HydrophobicContact CB-CD1 4.18Å; L228-L449 HydrophobicContact CD2-CD1 3.98Å; L228-L449 HydrophobicContact CD2-CD2 3.76Å; V231-L449 HydrophobicContact CG2-CD1 4.3Å; W278-L449 HydrophobicContact CH2-CB 4.2Å; W278-L449 HydrophobicContact CH2-CD2 4.48Å; R281-L449 VanDerWaalsContact CZ-O 3.29Å; R281-L449 PolarHBondContact NE-O 3.32Å; R281-L449 PolarHBondContact NH2-O 3.39Å; L285-L449 HydrophobicContact CD2-CD2 3.99Å; I445-L449 HydrophobicContact CG2-CD1 4.08Å; I445-L449 HydrophobicContact CG2-CG 4.35Å; I445-L449 WeakPolarHBondContact O-CG 3.17Å; I445-L449 PolarHBondContact O-N 2.89Å; L446-L449 PolarHBondContact O-N 3.19Å
450	H	87.6	Confident	90.8	Very high	39 Å²	39	55.7 Å²	55.7	18%	0.181	28%	0.28	C	S	.	.	H	α-helix	trans	-81.8	-30.2	179.8	-71.9	-65.3	0	0	0	115.2	R281 L446 H447 Y448	R281-H450 PolarHBondContact NE-O 3.21Å; R281-H450 PolarHBondContact NH2-O 2.75Å; R281-H450 VanDerWaalsContact NH2-O 3.09Å; L446-H450 PolarHBondContact O-CD2 3.42Å; L446-H450 PolarHBondContact O-N 3.14Å; L446-H450 VanDerWaalsContact O-N 3.11Å; H447-H450 PolarHBondContact O-N 3.06Å; Y448-H450 PolarHBondContact O-N 3.45Å
451	T	86	Confident	90.7	Very high	55 Å²	55	48.2 Å²	48.2	34%	0.337	25%	0.245	S	C	.	.	H	α-helix	trans	-116	-14.1	-167.8	65.6	0	0	0	0	114.8	H447 Y448	H447-T451 WeakPolarHBondContact O-CB 3.27Å; H447-T451 WeakPolarHBondContact O-CG2 3.49Å; H447-T451 PolarHBondContact O-N 3.34Å; H447-T451 PolarHBondContact O-OG1 3.06Å; Y448-T451 PolarHBondContact O-N 2.96Å
452	A	87.6	Confident	90.5	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	22%	0.224	C	C	.	.	S	Bend	trans	-53	134.3	177.4	0	0	0	0	0	110.3	R281 L285 Y448	R281-A452 PolarHBondContact NH1-O 3.34Å; R281-A452 PolarHBondContact NH2-O 3.47Å; L285-A452 HydrophobicContact CD1-CB 3.82Å; Y448-A452 HydrophobicContact CD1-CB 3.98Å; Y448-A452 HydrophobicContact CD2-CB 3.95Å; Y448-A452 HydrophobicContact CE1-CB 3.73Å; Y448-A452 HydrophobicContact CE2-CB 3.73Å; Y448-A452 HydrophobicContact CG-CB 4.1Å; Y448-A452 WeakPolarHBondContact O-CB 3.46Å; Y448-A452 PolarHBondContact O-N 2.87Å
453	P	85.3	Confident	90.3	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.084	21%	0.21	C	C	.	.			trans	-65.9	140.7	174.3	27.8	-32.8	0	0	0	110.2	I196 L200 Q211	I196-P453 HydrophobicContact CG2-CB 3.51Å; L200-P453 HydrophobicContact CD2-CB 3.83Å; Q211-P453 VanDerWaalsContact CD-CG 3.48Å
454	I	87.6	Confident	90.3	Very high	28 Å²	28	31.1 Å²	31.1	14%	0.144	17%	0.173	C	C	.	.			trans	-116	139.9	174.5	60.2	176.1	0	0	0	108.8	L200 R281 L285	L200-I454 WeakPolarHBondContact CD2-O 3.3Å; R281-I454 HydrophobicContact CG-CD1 4.43Å; L285-I454 HydrophobicContact CB-CG2 3.9Å; L285-I454 HydrophobicContact CD1-CG2 4.09Å
455	F	87.8	Confident	90.3	Very high	25 Å²	25	28.7 Å²	28.7	11%	0.11	15%	0.151	C	C	.	.			trans	-66	140.7	173.1	-70.2	-6.3	0	0	0	109.6	L200 Y284 T288 C291 L460 A463	L200-F455 HydrophobicContact CD1-CE1 4.28Å; L200-F455 HydrophobicContact CD2-CD1 3.35Å; L200-F455 HydrophobicContact CD2-CE1 3.78Å; L200-F455 HydrophobicContact CG-CD1 3.93Å; L200-F455 HydrophobicContact CG-CE1 4.06Å; Y284-F455 WeakPolarHBondContact CD1-O 3.4Å; T288-F455 HydrophobicContact CG2-CB 4.38Å; T288-F455 HydrophobicContact CG2-CD1 3.75Å; T288-F455 HydrophobicContact CG2-CD2 4.11Å; T288-F455 HydrophobicContact CG2-CE1 3.98Å; T288-F455 HydrophobicContact CG2-CE2 4.29Å; T288-F455 HydrophobicContact CG2-CG 3.82Å; T288-F455 HydrophobicContact CG2-CZ 4.23Å; T288-F455 PolarHBondContact OG1-N 3.45Å; C291-F455 HydrophobicContact CB-CE2 4.43Å; F455-L460 HydrophobicContact CB-CD2 3.8Å; F455-L460 HydrophobicContact CB-CG 3.68Å; F455-L460 HydrophobicContact CD2-CD2 3.92Å; F455-L460 HydrophobicContact CD2-CG 4.48Å; F455-L460 HydrophobicContact CG-CD2 4.31Å; F455-A463 HydrophobicContact CD2-CB 3.98Å; F455-A463 HydrophobicContact CE2-CB 3.59Å
456	S	88.7	Confident	90.1	Very high	36 Å²	36	34.3 Å²	34.3	25%	0.252	18%	0.177	S	C	.	.			trans	-63.8	167.1	161.9	65.3	0	0	0	0	110	D458 G459 L460	S456-D458 VanDerWaalsContact C-N 3.33Å; S456-D458 PolarHBondContact O-N 3.24Å; S456-G459 WeakPolarHBondContact O-CA 3.46Å; S456-G459 PolarHBondContact O-N 3.32Å; S456-G459 PolarHBondContact OG-N 3.05Å; S456-L460 PolarHBondContact O-N 2.96Å
457	E	87.7	Confident	90.1	Very high	92 Å²	92	34.4 Å²	34.4	43%	0.43	18%	0.18	S	C	.	.	H	α-helix	trans	-52.8	-51.8	175.7	-170.4	-173.8	165.3	0	0	111.3	Y284 G459 L460 Y461 R478	Y284-E457 HydrophobicContact CE1-CB 4.48Å; E457-G459 VanDerWaalsContact C-N 3.3Å; E457-G459 PolarHBondContact O-N 3.31Å; E457-L460 WeakPolarHBondContact O-CB 3.49Å; E457-L460 PolarHBondContact O-N 3.24Å; E457-L460 VanDerWaalsContact O-N 3.15Å; E457-Y461 HydrophobicContact CG-CD2 4.07Å; E457-Y461 HydrophobicContact CG-CE2 3.83Å; E457-Y461 VanDerWaalsContact O-CD2 3.28Å; E457-Y461 WeakPolarHBondContact O-CD2 3.36Å; E457-Y461 PolarHBondContact O-N 3.21Å; E457-Y461 VanDerWaalsContact O-N 3.08Å; E457-R478 IonicContact OE1-NH2 3.9Å; E457-R478 PolarHBondContact OE1-NH2 2.94Å
458	D	89.1	Confident	90.3	Very high	72 Å²	72	29 Å²	29	39%	0.385	16%	0.155	S	C	.	.	H	α-helix	trans	-58.5	-40.3	176.5	-75.4	-7.2	0	0	0	112.6	S456 L460 Y461 L462 L482	S456-D458 VanDerWaalsContact C-N 3.33Å; S456-D458 PolarHBondContact O-N 3.24Å; D458-L460 PolarHBondContact O-N 3.41Å; D458-Y461 PolarHBondContact O-N 3.3Å; D458-L462 WeakPolarHBondContact O-CG 3.38Å; D458-L462 PolarHBondContact O-N 2.89Å; D458-L482 HydrophobicContact CB-CD2 3.71Å; D458-L482 VanDerWaalsContact OD1-CD2 3.27Å; D458-L482 WeakPolarHBondContact OD1-CD2 3.38Å
459	G	88	Confident	90.4	Very high	18 Å²	18	32.2 Å²	32.2	19%	0.186	18%	0.181	C	C	.	.	H	α-helix	trans	-61.2	-41.8	176.1	0	0	0	0	0	112.7	S456 E457 L462 A463	S456-G459 WeakPolarHBondContact O-CA 3.46Å; S456-G459 PolarHBondContact O-N 3.32Å; S456-G459 PolarHBondContact OG-N 3.05Å; E457-G459 VanDerWaalsContact C-N 3.3Å; E457-G459 PolarHBondContact O-N 3.31Å; G459-L462 PolarHBondContact O-N 3.2Å; G459-A463 WeakPolarHBondContact O-CB 3.48Å; G459-A463 PolarHBondContact O-N 3.36Å
460	L	91.5	Very high	90.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-47.3	175	-73.2	170.7	0	0	0	111.3	Y284 A287 C291 M331 P333 F455 S456 E457 D458 L462 A463 S464	Y284-L460 HydrophobicContact CD1-CD1 3.63Å; Y284-L460 HydrophobicContact CE1-CD1 3.83Å; A287-L460 HydrophobicContact CB-CD1 3.89Å; A287-L460 HydrophobicContact CB-CD2 3.73Å; C291-L460 HydrophobicContact CB-CD2 4.33Å; M331-L460 HydrophobicContact SD-CD1 4.04Å; P333-L460 HydrophobicContact CB-CB 3.81Å; P333-L460 HydrophobicContact CG-CB 3.75Å; F455-L460 HydrophobicContact CB-CD2 3.8Å; F455-L460 HydrophobicContact CB-CG 3.68Å; F455-L460 HydrophobicContact CD2-CD2 3.92Å; F455-L460 HydrophobicContact CD2-CG 4.48Å; F455-L460 HydrophobicContact CG-CD2 4.31Å; S456-L460 PolarHBondContact O-N 2.96Å; E457-L460 WeakPolarHBondContact O-CB 3.49Å; E457-L460 PolarHBondContact O-N 3.24Å; E457-L460 VanDerWaalsContact O-N 3.15Å; D458-L460 PolarHBondContact O-N 3.41Å; L460-L462 PolarHBondContact O-N 3.39Å; L460-A463 PolarHBondContact O-N 3.48Å; L460-S464 VanDerWaalsContact O-CB 3.29Å; L460-S464 WeakPolarHBondContact O-CB 3.38Å; L460-S464 PolarHBondContact O-N 3.17Å
461	Y	93.3	Very high	90.6	Very high	15 Å²	15	36.8 Å²	36.8	6%	0.059	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-44.5	178	-84	-82.1	0	0	0	111.8	T332 P333 E457 D458 S464 Y465 R478 L482	T332-Y461 VanDerWaalsContact CB-OH 3.27Å; T332-Y461 WeakPolarHBondContact CB-OH 3.46Å; T332-Y461 HydrophobicContact CG2-CE1 3.97Å; P333-Y461 HydrophobicContact CG-CD1 3.96Å; P333-Y461 HydrophobicContact CG-CD2 3.62Å; P333-Y461 HydrophobicContact CG-CE1 3.97Å; P333-Y461 HydrophobicContact CG-CE2 3.58Å; P333-Y461 HydrophobicContact CG-CG 3.8Å; E457-Y461 HydrophobicContact CG-CD2 4.07Å; E457-Y461 HydrophobicContact CG-CE2 3.83Å; E457-Y461 VanDerWaalsContact O-CD2 3.28Å; E457-Y461 WeakPolarHBondContact O-CD2 3.36Å; E457-Y461 PolarHBondContact O-N 3.21Å; E457-Y461 VanDerWaalsContact O-N 3.08Å; D458-Y461 PolarHBondContact O-N 3.3Å; Y461-S464 WeakPolarHBondContact O-CB 3.34Å; Y461-S464 PolarHBondContact O-N 3.5Å; Y461-Y465 HydrophobicContact CD1-CE2 4.06Å; Y461-Y465 WeakPolarHBondContact O-CD2 3.15Å; Y461-Y465 PolarHBondContact O-N 3.27Å; Y461-R478 VanDerWaalsContact CD2-NH2 3.27Å; Y461-R478 VanDerWaalsContact CE1-CZ 3.48Å; Y461-R478 PolarHBondContact OH-NH1 3.49Å; Y461-L482 HydrophobicContact CG-CD1 4.46Å
462	L	91	Very high	91	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.099	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-49.8	176.6	-76.3	169.3	0	0	0	111.9	D458 G459 L460 S464 Y465 E466 L482 R483 V486	D458-L462 WeakPolarHBondContact O-CG 3.38Å; D458-L462 PolarHBondContact O-N 2.89Å; G459-L462 PolarHBondContact O-N 3.2Å; L460-L462 PolarHBondContact O-N 3.39Å; L462-S464 VanDerWaalsContact C-N 3.27Å; L462-S464 PolarHBondContact O-N 3.29Å; L462-Y465 PolarHBondContact O-N 3.06Å; L462-E466 WeakPolarHBondContact O-CB 3.39Å; L462-E466 VanDerWaalsContact O-CG 3.29Å; L462-E466 WeakPolarHBondContact O-CG 3.42Å; L462-E466 PolarHBondContact O-N 3.01Å; L462-L482 HydrophobicContact CD1-CB 4.42Å; L462-L482 HydrophobicContact CD2-CB 3.68Å; L462-L482 HydrophobicContact CD2-CD1 4.49Å; L462-L482 HydrophobicContact CG-CB 3.99Å; L462-L482 HydrophobicContact CG-CD1 4.31Å; L462-R483 HydrophobicContact CD2-CG 4.15Å; L462-V486 HydrophobicContact CD1-CG2 3.65Å
463	A	91	Very high	91.3	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-36.5	177.6	0	0	0	0	0	112.5	C291 F455 G459 L460 S467	C291-A463 HydrophobicContact CB-CB 4.03Å; F455-A463 HydrophobicContact CD2-CB 3.98Å; F455-A463 HydrophobicContact CE2-CB 3.59Å; G459-A463 WeakPolarHBondContact O-CB 3.48Å; G459-A463 PolarHBondContact O-N 3.36Å; L460-A463 PolarHBondContact O-N 3.48Å; A463-S467 VanDerWaalsContact O-CB 3.31Å; A463-S467 WeakPolarHBondContact O-CB 3.46Å; A463-S467 PolarHBondContact O-N 3.11Å; A463-S467 PolarHBondContact O-OG 2.97Å
464	S	95.3	Very high	91.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-47.5	174.5	-177.9	0	0	0	0	112.3	P333 R336 L337 L460 Y461 L462 E466 S467 E468	P333-S464 WeakPolarHBondContact O-CB 3.48Å; P333-S464 PolarHBondContact O-OG 3.5Å; R336-S464 VanDerWaalsContact CD-OG 3.25Å; R336-S464 WeakPolarHBondContact CD-OG 3.25Å; R336-S464 VanDerWaalsContact CG-OG 3.29Å; R336-S464 WeakPolarHBondContact CG-OG 3.49Å; R336-S464 PolarHBondContact NH1-O 3.24Å; R336-S464 VanDerWaalsContact NH1-O 3.14Å; R336-S464 PolarHBondContact NH1-OG 3.29Å; L337-S464 WeakPolarHBondContact CD2-OG 3.48Å; L460-S464 VanDerWaalsContact O-CB 3.29Å; L460-S464 WeakPolarHBondContact O-CB 3.38Å; L460-S464 PolarHBondContact O-N 3.17Å; Y461-S464 WeakPolarHBondContact O-CB 3.34Å; Y461-S464 PolarHBondContact O-N 3.5Å; L462-S464 VanDerWaalsContact C-N 3.27Å; L462-S464 PolarHBondContact O-N 3.29Å; S464-E466 VanDerWaalsContact C-N 3.33Å; S464-E466 PolarHBondContact O-N 2.96Å; S464-S467 WeakPolarHBondContact O-CB 3.39Å; S464-S467 PolarHBondContact O-N 3.3Å; S464-E468 PolarHBondContact O-N 3.04Å
465	Y	94.3	Very high	91.9	Very high	10 Å²	10	47.4 Å²	47.4	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-32.5	178.5	-66.7	-47.1	0	0	0	113.3	R336 Y461 L462 E468 S469 P470 E475 W479 L482	R336-Y465 VanDerWaalsContact CZ-CD1 3.42Å; Y461-Y465 HydrophobicContact CD1-CE2 4.06Å; Y461-Y465 WeakPolarHBondContact O-CD2 3.15Å; Y461-Y465 PolarHBondContact O-N 3.27Å; L462-Y465 PolarHBondContact O-N 3.06Å; Y465-E468 WeakPolarHBondContact CA-O 3.43Å; Y465-E468 CarbonylContact O-C 3.34Å; Y465-S469 WeakPolarHBondContact O-CA 3.21Å; Y465-S469 PolarHBondContact O-N 3.47Å; Y465-P470 HydrophobicContact CD1-CB 4.44Å; Y465-P470 HydrophobicContact CD1-CG 3.75Å; Y465-P470 HydrophobicContact CE1-CG 4.24Å; Y465-P470 HydrophobicContact CG-CG 4.19Å; Y465-E475 HydrophobicContact CE1-CB 3.76Å; Y465-E475 HydrophobicContact CE1-CG 3.95Å; Y465-W479 HydrophobicContact CD2-CB 3.73Å; Y465-W479 AromaticContact CD2-CD1 3.67Å; Y465-W479 HydrophobicContact CD2-CG 4.05Å; Y465-W479 HydrophobicContact CE2-CB 3.98Å; Y465-W479 HydrophobicContact CG-CB 4.12Å; Y465-W479 AromaticContact CG-CD1 3.84Å; Y465-W479 HydrophobicContact CG-CG 4.21Å; Y465-L482 HydrophobicContact CE2-CD1 4.18Å
466	E	91.3	Very high	92.2	Very high	120 Å²	120	50.6 Å²	50.6	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-67.3	-38.6	171.5	-73.2	166.8	-160.4	0	0	111.7	K204 L462 S464	K204-E466 IonicContact NZ-OE1 3.75Å; K204-E466 PolarHBondContact NZ-OE1 3.48Å; K204-E466 IonicContact NZ-OE2 3.57Å; K204-E466 PolarHBondContact NZ-OE2 2.88Å; L462-E466 WeakPolarHBondContact O-CB 3.39Å; L462-E466 VanDerWaalsContact O-CG 3.29Å; L462-E466 WeakPolarHBondContact O-CG 3.42Å; L462-E466 PolarHBondContact O-N 3.01Å; S464-E466 VanDerWaalsContact C-N 3.33Å; S464-E466 PolarHBondContact O-N 2.96Å
467	S	93.2	Very high	92.4	Very high	29 Å²	29	52.5 Å²	52.5	20%	0.203	28%	0.279	C	S	.	.	H	α-helix	trans	-71.3	-41.9	178.3	-73.5	0	0	0	0	113.1	R299 A463 S464	R299-S467 PolarHBondContact NH1-OG 2.94Å; R299-S467 PolarHBondContact NH2-O 3.03Å; A463-S467 VanDerWaalsContact O-CB 3.31Å; A463-S467 WeakPolarHBondContact O-CB 3.46Å; A463-S467 PolarHBondContact O-N 3.11Å; A463-S467 PolarHBondContact O-OG 2.97Å; S464-S467 WeakPolarHBondContact O-CB 3.39Å; S464-S467 PolarHBondContact O-N 3.3Å
468	E	94.6	Very high	92.7	Very high	9 Å²	9	52.2 Å²	52.2	4%	0.042	27%	0.274	C	S	.	.	S	Bend	trans	-144.3	115.8	177.3	-64	-174.4	-151.3	0	0	109.6	R299 R336 L337 K338 K339 T340 S464 Y465	R299-E468 IonicContact NH2-OE1 3.53Å; R336-E468 PolarHBondContact NH1-O 3.39Å; R336-E468 PolarHBondContact NH2-O 3.27Å; L337-E468 VanDerWaalsContact C-OE2 3.28Å; L337-E468 HydrophobicContact CD2-CB 3.9Å; L337-E468 HydrophobicContact CD2-CG 3.87Å; K338-E468 PolarHBondContact N-OE2 3.32Å; K339-E468 VanDerWaalsContact CB-OE2 3.27Å; K339-E468 WeakPolarHBondContact CB-OE2 3.27Å; K339-E468 WeakPolarHBondContact CG-OE2 3.4Å; K339-E468 PolarHBondContact N-OE2 3.03Å; T340-E468 WeakPolarHBondContact CB-OE1 3.46Å; T340-E468 PolarHBondContact N-OE1 2.96Å; T340-E468 PolarHBondContact OG1-OE1 3.46Å; S464-E468 PolarHBondContact O-N 3.04Å; Y465-E468 WeakPolarHBondContact CA-O 3.43Å; Y465-E468 CarbonylContact O-C 3.34Å
469	S	94	Very high	92.8	Very high	87 Å²	87	52.4 Å²	52.4	61%	0.608	27%	0.269	S	S	*	.			trans	-55.9	153.7	-173	-51.6	0	0	0	0	113.7	R336 Y465 E471	R336-S469 PolarHBondContact NH2-O 3.38Å; R336-S469 VanDerWaalsContact NH2-O 3.08Å; Y465-S469 WeakPolarHBondContact O-CA 3.21Å; Y465-S469 PolarHBondContact O-N 3.47Å; S469-E471 PolarHBondContact O-N 2.87Å
470	P	94.6	Very high	93	Very high	24 Å²	24	57.3 Å²	57.3	16%	0.156	29%	0.285	C	S	.	.			trans	-51.3	131	174.9	-30.6	37	0	0	0	113.7	Y465 E475 K476 W479	Y465-P470 HydrophobicContact CD1-CB 4.44Å; Y465-P470 HydrophobicContact CD1-CG 3.75Å; Y465-P470 HydrophobicContact CE1-CG 4.24Å; Y465-P470 HydrophobicContact CG-CG 4.19Å; P470-E475 VanDerWaalsContact CA-OE2 3.31Å; P470-E475 WeakPolarHBondContact CA-OE2 3.42Å; P470-E475 HydrophobicContact CB-CB 3.74Å; P470-K476 HydrophobicContact CB-CB 4.39Å; P470-K476 HydrophobicContact CB-CG 3.65Å; P470-K476 HydrophobicContact CG-CG 4.47Å; P470-W479 HydrophobicContact CG-CB 3.9Å; P470-W479 HydrophobicContact CG-CD2 4.3Å; P470-W479 HydrophobicContact CG-CE3 4.45Å; P470-W479 HydrophobicContact CG-CG 4.08Å
471	E	91.8	Very high	92.9	Very high	111 Å²	111	59.6 Å²	59.6	52%	0.519	31%	0.305	S	S	.	.			trans	-93.6	-28.4	-176.5	-63.2	-169.3	157.4	0	0	113.1	S469 E475	S469-E471 PolarHBondContact O-N 2.87Å; E471-E475 PolarHBondContact N-OE2 2.84Å
472	N	92.6	Very high	92.7	Very high	77 Å²	77	59.3 Å²	59.3	41%	0.412	30%	0.304	S	S	.	.	S	Bend	trans	-130.1	172.1	-176.8	65.7	51.2	0	0	0	112.2	V474 E475 K476	N472-V474 VanDerWaalsContact C-N 3.35Å; N472-V474 PolarHBondContact O-N 2.95Å; N472-V474 WeakPolarHBondContact OD1-CB 3.45Å; N472-V474 PolarHBondContact OD1-N 3.07Å; N472-V474 VanDerWaalsContact OD1-N 3.13Å; N472-E475 PolarHBondContact O-N 3.48Å; N472-E475 WeakPolarHBondContact OD1-CG 3.34Å; N472-E475 PolarHBondContact OD1-N 3.39Å; N472-K476 WeakPolarHBondContact O-CG 3.29Å; N472-K476 PolarHBondContact O-N 2.94Å
473	Q	94.2	Very high	92.3	Very high	105 Å²	105	64.3 Å²	64.3	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-39.1	-176.5	-172.5	56.2	39.6	0	0	112.6	E475 K476 D477	Q473-E475 PolarHBondContact O-N 2.79Å; Q473-K476 WeakPolarHBondContact O-CB 3.44Å; Q473-K476 PolarHBondContact O-N 2.83Å; Q473-D477 PolarHBondContact NE2-OD1 2.77Å; Q473-D477 PolarHBondContact NE2-OD2 3.08Å; Q473-D477 VanDerWaalsContact O-CG 3.31Å; Q473-D477 PolarHBondContact O-N 3.29Å
474	V	93.1	Very high	91.8	Very high	115 Å²	115	67.6 Å²	67.6	70%	0.697	34%	0.344	S	S	*	.	H	α-helix	trans	-60.3	-46	178	179.6	0	0	0	0	111.1	N472 D477 R478	N472-V474 VanDerWaalsContact C-N 3.35Å; N472-V474 PolarHBondContact O-N 2.95Å; N472-V474 WeakPolarHBondContact OD1-CB 3.45Å; N472-V474 PolarHBondContact OD1-N 3.07Å; N472-V474 VanDerWaalsContact OD1-N 3.13Å; V474-D477 PolarHBondContact O-N 2.93Å; V474-R478 PolarHBondContact O-N 3.09Å
475	E	93.9	Very high	91	Very high	25 Å²	25	71.8 Å²	71.8	12%	0.117	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-39.4	175.9	-71.2	-167.5	160.2	0	0	112.2	R336 Y465 P470 E471 N472 Q473 D477 R478 W479	R336-E475 IonicContact CZ-OE1 3.66Å; R336-E475 IonicContact CZ-OE2 3.39Å; R336-E475 IonicContact NE-OE1 3.12Å; R336-E475 PolarHBondContact NE-OE1 3.11Å; R336-E475 IonicContact NE-OE2 3.37Å; R336-E475 PolarHBondContact NE-OE2 2.86Å; R336-E475 IonicContact NH2-OE1 3.83Å; R336-E475 IonicContact NH2-OE2 2.7Å; R336-E475 PolarHBondContact NH2-OE2 3.46Å; Y465-E475 HydrophobicContact CE1-CB 3.76Å; Y465-E475 HydrophobicContact CE1-CG 3.95Å; P470-E475 VanDerWaalsContact CA-OE2 3.31Å; P470-E475 WeakPolarHBondContact CA-OE2 3.42Å; P470-E475 HydrophobicContact CB-CB 3.74Å; E471-E475 PolarHBondContact N-OE2 2.84Å; N472-E475 PolarHBondContact O-N 3.48Å; N472-E475 WeakPolarHBondContact OD1-CG 3.34Å; N472-E475 PolarHBondContact OD1-N 3.39Å; Q473-E475 PolarHBondContact O-N 2.79Å; E475-D477 VanDerWaalsContact C-N 3.31Å; E475-D477 PolarHBondContact O-N 2.58Å; E475-R478 PolarHBondContact O-N 2.86Å; E475-W479 VanDerWaalsContact O-CB 3.25Å; E475-W479 WeakPolarHBondContact O-CB 2.94Å; E475-W479 PolarHBondContact O-N 2.79Å
476	K	93.6	Very high	89.8	Confident	93 Å²	93	73.6 Å²	73.6	40%	0.404	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-42.5	176.6	-73.9	174.1	-175.2	175.6	0	111.2	P470 N472 Q473 K480	P470-K476 HydrophobicContact CB-CB 4.39Å; P470-K476 HydrophobicContact CB-CG 3.65Å; P470-K476 HydrophobicContact CG-CG 4.47Å; N472-K476 WeakPolarHBondContact O-CG 3.29Å; N472-K476 PolarHBondContact O-N 2.94Å; Q473-K476 WeakPolarHBondContact O-CB 3.44Å; Q473-K476 PolarHBondContact O-N 2.83Å; K476-K480 VanDerWaalsContact O-CG 3.28Å; K476-K480 WeakPolarHBondContact O-CG 3.44Å; K476-K480 PolarHBondContact O-N 2.95Å
477	D	93.4	Very high	88.3	Confident	75 Å²	75	73.1 Å²	73.1	40%	0.401	38%	0.379	S	S	.	.	H	α-helix	trans	-71.4	-42.3	-179.2	-66.1	-27.5	0	0	0	111.4	Q473 V474 E475 W479 K480 A481	Q473-D477 PolarHBondContact NE2-OD1 2.77Å; Q473-D477 PolarHBondContact NE2-OD2 3.08Å; Q473-D477 VanDerWaalsContact O-CG 3.31Å; Q473-D477 PolarHBondContact O-N 3.29Å; V474-D477 PolarHBondContact O-N 2.93Å; E475-D477 VanDerWaalsContact C-N 3.31Å; E475-D477 PolarHBondContact O-N 2.58Å; D477-W479 PolarHBondContact O-N 3.43Å; D477-K480 PolarHBondContact O-N 3.18Å; D477-K480 IonicContact OD1-NZ 3.88Å; D477-A481 WeakPolarHBondContact O-CB 3.45Å; D477-A481 PolarHBondContact O-N 2.91Å
478	R	92.9	Very high	86.7	Confident	86 Å²	86	75.6 Å²	75.6	33%	0.325	40%	0.402	S	S	.	.	H	α-helix	trans	-59.9	-45.7	172.4	-172.3	174.3	-173.7	162.3	3	111.7	E457 Y461 V474 E475 K480 A481 L482	E457-R478 IonicContact OE1-NH2 3.9Å; E457-R478 PolarHBondContact OE1-NH2 2.94Å; Y461-R478 VanDerWaalsContact CD2-NH2 3.27Å; Y461-R478 VanDerWaalsContact CE1-CZ 3.48Å; Y461-R478 PolarHBondContact OH-NH1 3.49Å; V474-R478 PolarHBondContact O-N 3.09Å; E475-R478 PolarHBondContact O-N 2.86Å; R478-K480 PolarHBondContact O-N 3Å; R478-A481 PolarHBondContact O-N 3Å; R478-L482 HydrophobicContact CG-CD1 3.98Å; R478-L482 HydrophobicContact CG-CG 4.34Å; R478-L482 WeakPolarHBondContact O-CB 3.37Å; R478-L482 VanDerWaalsContact O-CG 3.28Å; R478-L482 WeakPolarHBondContact O-CG 3.38Å; R478-L482 PolarHBondContact O-N 2.57Å
479	W	91.8	Very high	84.8	Confident	77 Å²	77	83 Å²	83	29%	0.292	43%	0.434	S	S	.	.	H	α-helix	trans	-60.7	-43	178	175.8	66.1	0	0	0	112.4	Y465 P470 E475 D477 L482 R483	Y465-W479 HydrophobicContact CD2-CB 3.73Å; Y465-W479 AromaticContact CD2-CD1 3.67Å; Y465-W479 HydrophobicContact CD2-CG 4.05Å; Y465-W479 HydrophobicContact CE2-CB 3.98Å; Y465-W479 HydrophobicContact CG-CB 4.12Å; Y465-W479 AromaticContact CG-CD1 3.84Å; Y465-W479 HydrophobicContact CG-CG 4.21Å; P470-W479 HydrophobicContact CG-CB 3.9Å; P470-W479 HydrophobicContact CG-CD2 4.3Å; P470-W479 HydrophobicContact CG-CE3 4.45Å; P470-W479 HydrophobicContact CG-CG 4.08Å; E475-W479 VanDerWaalsContact O-CB 3.25Å; E475-W479 WeakPolarHBondContact O-CB 2.94Å; E475-W479 PolarHBondContact O-N 2.79Å; D477-W479 PolarHBondContact O-N 3.43Å; W479-L482 PolarHBondContact O-N 2.83Å; W479-R483 PolarHBondContact O-N 3.13Å
480	K	91.3	Very high	82.5	Confident	120 Å²	120	85.7 Å²	85.7	52%	0.522	45%	0.447	S	S	.	.	H	α-helix	trans	-61.2	-46.1	174.6	-74.1	171	-175.4	173	0	111.8	K476 D477 R478 R483 S484	K476-K480 VanDerWaalsContact O-CG 3.28Å; K476-K480 WeakPolarHBondContact O-CG 3.44Å; K476-K480 PolarHBondContact O-N 2.95Å; D477-K480 PolarHBondContact O-N 3.18Å; D477-K480 IonicContact OD1-NZ 3.88Å; R478-K480 PolarHBondContact O-N 3Å; K480-R483 PolarHBondContact O-N 3.04Å; K480-S484 WeakPolarHBondContact O-CB 3.28Å; K480-S484 PolarHBondContact O-N 3.47Å
481	A	90.5	Very high	81.9	Confident	51 Å²	51	88.8 Å²	88.8	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-60.4	-46.9	178.1	0	0	0	0	0	111.6	D477 R478 R483 S484 N485	D477-A481 WeakPolarHBondContact O-CB 3.45Å; D477-A481 PolarHBondContact O-N 2.91Å; R478-A481 PolarHBondContact O-N 3Å; A481-R483 PolarHBondContact O-N 3.27Å; A481-S484 PolarHBondContact O-N 3.38Å; A481-N485 PolarHBondContact O-N 2.96Å
482	L	87.9	Confident	81.3	Confident	9 Å²	9	87.6 Å²	87.6	5%	0.047	46%	0.458	C	S	.	.	H	α-helix	trans	-61.2	-45.1	177.6	-70.6	171.3	0	0	0	112	D458 Y461 L462 Y465 R478 W479 S484 N485 V486	D458-L482 HydrophobicContact CB-CD2 3.71Å; D458-L482 VanDerWaalsContact OD1-CD2 3.27Å; D458-L482 WeakPolarHBondContact OD1-CD2 3.38Å; Y461-L482 HydrophobicContact CG-CD1 4.46Å; L462-L482 HydrophobicContact CD1-CB 4.42Å; L462-L482 HydrophobicContact CD2-CB 3.68Å; L462-L482 HydrophobicContact CD2-CD1 4.49Å; L462-L482 HydrophobicContact CG-CB 3.99Å; L462-L482 HydrophobicContact CG-CD1 4.31Å; Y465-L482 HydrophobicContact CE2-CD1 4.18Å; R478-L482 HydrophobicContact CG-CD1 3.98Å; R478-L482 HydrophobicContact CG-CG 4.34Å; R478-L482 WeakPolarHBondContact O-CB 3.37Å; R478-L482 VanDerWaalsContact O-CG 3.28Å; R478-L482 WeakPolarHBondContact O-CG 3.38Å; R478-L482 PolarHBondContact O-N 2.57Å; W479-L482 PolarHBondContact O-N 2.83Å; L482-S484 VanDerWaalsContact C-N 3.34Å; L482-S484 PolarHBondContact O-N 2.93Å; L482-N485 PolarHBondContact O-N 3.48Å; L482-V486 WeakPolarHBondContact O-CG2 3.46Å; L482-V486 PolarHBondContact O-N 3.45Å; L482-V486 VanDerWaalsContact O-N 3.09Å
483	R	83.3	Confident	80.7	Confident	123 Å²	123	88.2 Å²	88.2	46%	0.464	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-40.5	176.1	-79.6	-163.6	70.3	-172.4	2	112.4	L462 W479 K480 A481 N485 V486 L487	L462-R483 HydrophobicContact CD2-CG 4.15Å; W479-R483 PolarHBondContact O-N 3.13Å; K480-R483 PolarHBondContact O-N 3.04Å; A481-R483 PolarHBondContact O-N 3.27Å; R483-N485 VanDerWaalsContact C-N 3.31Å; R483-N485 PolarHBondContact O-N 2.89Å; R483-V486 PolarHBondContact O-N 3.17Å; R483-L487 WeakPolarHBondContact O-CB 3.35Å; R483-L487 VanDerWaalsContact O-CG 3.29Å; R483-L487 WeakPolarHBondContact O-CG 3.43Å; R483-L487 PolarHBondContact O-N 3.04Å
484	S	81.1	Confident	79.9	Confident	73 Å²	73	87.2 Å²	87.2	51%	0.51	46%	0.459	S	S	.	.	H	α-helix	trans	-62	-40.8	176.8	-167.2	0	0	0	0	111.6	K480 A481 L482 L487 A488	K480-S484 WeakPolarHBondContact O-CB 3.28Å; K480-S484 PolarHBondContact O-N 3.47Å; A481-S484 PolarHBondContact O-N 3.38Å; L482-S484 VanDerWaalsContact C-N 3.34Å; L482-S484 PolarHBondContact O-N 2.93Å; S484-L487 PolarHBondContact O-N 3.45Å; S484-A488 WeakPolarHBondContact O-CB 3.49Å; S484-A488 PolarHBondContact O-N 2.87Å
485	N	77	Confident	79.1	Confident	88 Å²	88	85.5 Å²	85.5	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-68.3	-35.8	179.2	-73.2	-15.6	0	0	0	113.1	A481 L482 R483 K489	A481-N485 PolarHBondContact O-N 2.96Å; L482-N485 PolarHBondContact O-N 3.48Å; R483-N485 VanDerWaalsContact C-N 3.31Å; R483-N485 PolarHBondContact O-N 2.89Å; N485-K489 WeakPolarHBondContact O-CG 3.31Å; N485-K489 PolarHBondContact O-N 3.41Å
486	V	68.9	Low	78.1	Confident	49 Å²	49	89.5 Å²	89.5	30%	0.297	47%	0.466	S	S	.	.	H	α-helix	trans	-69.1	-43.6	174.8	173.7	0	0	0	0	110.8	L462 L482 R483 A488 K489 T490	L462-V486 HydrophobicContact CD1-CG2 3.65Å; L482-V486 WeakPolarHBondContact O-CG2 3.46Å; L482-V486 PolarHBondContact O-N 3.45Å; L482-V486 VanDerWaalsContact O-N 3.09Å; R483-V486 PolarHBondContact O-N 3.17Å; V486-A488 VanDerWaalsContact C-N 3.26Å; V486-A488 PolarHBondContact O-N 3.13Å; V486-K489 PolarHBondContact O-N 2.85Å; V486-K489 VanDerWaalsContact O-N 3.16Å; V486-T490 PolarHBondContact O-N 2.95Å; V486-T490 PolarHBondContact O-OG1 3.47Å
487	L	60.1	Low	77	Confident	109 Å²	109	89.3 Å²	89.3	57%	0.571	47%	0.471	S	S	*	.	H	α-helix	trans	-65.5	-27.2	177	-70.9	167.8	0	0	0	113.1	R483 S484 K489 T490	R483-L487 WeakPolarHBondContact O-CB 3.35Å; R483-L487 VanDerWaalsContact O-CG 3.29Å; R483-L487 WeakPolarHBondContact O-CG 3.43Å; R483-L487 PolarHBondContact O-N 3.04Å; S484-L487 PolarHBondContact O-N 3.45Å; L487-K489 VanDerWaalsContact C-N 3.34Å; L487-T490 PolarHBondContact O-OG1 3.39Å
488	A	59.6	Low	75.7	Confident	81 Å²	81	90.4 Å²	90.4	67%	0.669	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-13.8	175.8	0	0	0	0	0	113.9	S484 V486	S484-A488 WeakPolarHBondContact O-CB 3.49Å; S484-A488 PolarHBondContact O-N 2.87Å; V486-A488 VanDerWaalsContact C-N 3.26Å; V486-A488 PolarHBondContact O-N 3.13Å
489	K	54.9	Low	74.3	Confident	165 Å²	165	90.8 Å²	90.8	72%	0.717	49%	0.489	S	S	*	.			trans	-102.9	-5	178.9	-71.6	-179.1	-179.9	-177	0	113.4	N485 V486 L487	N485-K489 WeakPolarHBondContact O-CG 3.31Å; N485-K489 PolarHBondContact O-N 3.41Å; V486-K489 PolarHBondContact O-N 2.85Å; V486-K489 VanDerWaalsContact O-N 3.16Å; L487-K489 VanDerWaalsContact C-N 3.34Å
490	T	45.4	Very low	72.7	Confident	144 Å²	144	92 Å²	92	88%	0.883	51%	0.507	S	S	*	.			trans	-105.5	0	173.8	31.1	0	0	0	0	109.2	V486 L487	V486-T490 PolarHBondContact O-N 2.95Å; V486-T490 PolarHBondContact O-OG1 3.47Å; L487-T490 PolarHBondContact O-OG1 3.39Å

Retrieved 490 of 490 residues in 1646.3 ms (Link to these results)

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