A0A096NHH4_PAPAN Loading...

Ral guanine nucleotide dissociation stimulator-like 2

Probable guanine nucleotide exchange factor. Putative effector of Ras and/or Rap. Associates with the GTP-bound form of Rap 1A and H-Ras in vitro.

AlphaFold DB , UniProt , Accession A0A096NHH4, Species PAPAN (Papio anubis, Olive baboon), Gene RGL2, Length 777 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.8	Very low	31.4	Very low	223 Å²	223	106.4 Å²	106.4	100%	1.099	52%	0.516	S	S	*	.				0	109.3	0	-75.2	-63.8	-176.6	0	0	108
2	L	27.7	Very low	31.5	Very low	77 Å²	77	108.6 Å²	108.6	40%	0.403	54%	0.541	S	S	.	.			trans	-80.7	147.4	173.5	-69.1	165.7	0	0	0	110.2	L6 L10	L2-L6 HydrophobicContact CB-CB 4.44Å; L2-L6 HydrophobicContact CD2-CD1 4.2Å; L2-L10 HydrophobicContact CD1-CD1 3.62Å
3	P	29.3	Very low	31.2	Very low	62 Å²	62	106.7 Å²	106.7	40%	0.403	54%	0.544	S	S	.	.			trans	-65	153.1	177.2	28.2	-36	0	0	0	112	L6	P3-L6 HydrophobicContact CG-CB 4.3Å; P3-L6 HydrophobicContact CG-CD1 3.95Å; P3-L6 HydrophobicContact CG-CG 4.18Å; P3-L6 PolarHBondContact O-N 3.39Å
4	R	29.1	Very low	30.9	Very low	216 Å²	216	107.5 Å²	107.5	82%	0.815	56%	0.56	S	S	*	*	H	α-helix	trans	-46.1	-51	-177.3	-95.1	-178.7	165.7	178.9	-7.9	115.4	L6 R7	R4-L6 PolarHBondContact O-N 3.39Å; R4-R7 WeakPolarHBondContact O-CB 3.49Å; R4-R7 PolarHBondContact O-N 2.87Å
5	P	31.2	Very low	30.7	Very low	31 Å²	31	108.5 Å²	108.5	20%	0.201	58%	0.576	C	S	.	*	H	α-helix	trans	-65.2	-22.3	-179.5	23.8	-35.2	0	0	0	114.2	R7 L9 N393	P5-R7 VanDerWaalsContact C-N 3.31Å; P5-L9 PolarHBondContact O-N 3.13Å; P5-N393 HydrophobicContact CG-CB 4.06Å
6	L	33.4	Very low	30.6	Very low	21 Å²	21	106.6 Å²	106.6	11%	0.11	59%	0.59	C	S	.	*	H	α-helix	trans	-77.3	-14	170.3	-75.4	-179.6	0	0	0	112.9	L2 P3 R4 L9 L10	L2-L6 HydrophobicContact CB-CB 4.44Å; L2-L6 HydrophobicContact CD2-CD1 4.2Å; P3-L6 HydrophobicContact CG-CB 4.3Å; P3-L6 HydrophobicContact CG-CD1 3.95Å; P3-L6 HydrophobicContact CG-CG 4.18Å; P3-L6 PolarHBondContact O-N 3.39Å; R4-L6 PolarHBondContact O-N 3.39Å; L6-L9 HydrophobicContact CD2-CD1 4.3Å; L6-L10 WeakPolarHBondContact O-CB 3.27Å; L6-L10 VanDerWaalsContact O-CD1 3.26Å; L6-L10 WeakPolarHBondContact O-CD1 3.43Å; L6-L10 WeakPolarHBondContact O-CG 3.5Å; L6-L10 PolarHBondContact O-N 3.09Å
7	R	35.7	Very low	30.3	Very low	134 Å²	134	104.3 Å²	104.3	51%	0.506	60%	0.597	S	S	.	*	H	α-helix	trans	-73.9	-44.9	169	-61.9	-173.5	179.2	-168.2	-5.8	111.1	R4 P5 L9 L10 D11	R4-R7 WeakPolarHBondContact O-CB 3.49Å; R4-R7 PolarHBondContact O-N 2.87Å; P5-R7 VanDerWaalsContact C-N 3.31Å; R7-L9 PolarHBondContact O-N 2.68Å; R7-L10 CarbonylContact O-C 3.46Å; R7-L10 PolarHBondContact O-N 3.16Å; R7-D11 PolarHBondContact O-N 3.09Å
8	L	33.3	Very low	30	Very low	151 Å²	151	105.7 Å²	105.7	79%	0.791	61%	0.607	S	S	*	*	H	α-helix	trans	-59.8	-21.4	175.1	-60.6	173.8	0	0	0	113.4
9	L	33.8	Very low	29.6	Very low	94 Å²	94	106.8 Å²	106.8	49%	0.492	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.4	-3.2	172.3	-83	163.5	0	0	0	114.6	P5 L6 R7	P5-L9 PolarHBondContact O-N 3.13Å; L6-L9 HydrophobicContact CD2-CD1 4.3Å; R7-L9 PolarHBondContact O-N 2.68Å
10	L	35.1	Very low	29.4	Very low	51 Å²	51	109.9 Å²	109.9	27%	0.267	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.9	-8.7	-175.9	-69.4	174.9	0	0	0	114.2	L2 L6 R7 T12 K462	L2-L10 HydrophobicContact CD1-CD1 3.62Å; L6-L10 WeakPolarHBondContact O-CB 3.27Å; L6-L10 VanDerWaalsContact O-CD1 3.26Å; L6-L10 WeakPolarHBondContact O-CD1 3.43Å; L6-L10 WeakPolarHBondContact O-CG 3.5Å; L6-L10 PolarHBondContact O-N 3.09Å; R7-L10 CarbonylContact O-C 3.46Å; R7-L10 PolarHBondContact O-N 3.16Å; L10-T12 VanDerWaalsContact C-N 3.26Å; L10-T12 PolarHBondContact O-N 3.05Å; L10-K462 HydrophobicContact CD2-CB 4.22Å; L10-K462 HydrophobicContact CD2-CD 4.49Å; L10-K462 HydrophobicContact CD2-CG 4.02Å
11	D	28.2	Very low	29.1	Very low	110 Å²	110	109.4 Å²	109.4	59%	0.588	63%	0.632	S	S	*	*			trans	-73.2	81.8	170.9	-73.5	-40.6	0	0	0	109	R7 S13	R7-D11 PolarHBondContact O-N 3.09Å; D11-S13 PolarHBondContact O-N 3.37Å
12	T	32.8	Very low	28.9	Very low	133 Å²	133	104 Å²	104	82%	0.816	62%	0.617	S	S	*	*			trans	-74.3	50.1	179.8	62.8	0	0	0	0	112.8	L10	L10-T12 VanDerWaalsContact C-N 3.26Å; L10-T12 PolarHBondContact O-N 3.05Å
13	S	26.9	Very low	28.6	Very low	84 Å²	84	110.5 Å²	110.5	59%	0.587	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-78.9	130.4	155.3	-72.4	0	0	0	0	107.6	D11	D11-S13 PolarHBondContact O-N 3.37Å
14	P	26.5	Very low	28.4	Very low	118 Å²	118	118.9 Å²	118.9	77%	0.766	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-66.7	134.8	176.4	28.1	-33.2	0	0	0	109.5
15	P	29.2	Very low	28.2	Very low	122 Å²	122	113.8 Å²	113.8	79%	0.792	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-60.3	147.6	162	28.4	-33.6	0	0	0	108.8	G17	P15-G17 VanDerWaalsContact C-N 3.31Å; P15-G17 PolarHBondContact O-N 3.41Å
16	G	28.8	Very low	27.9	Very low	78 Å²	78	123.7 Å²	123.7	80%	0.804	70%	0.696	S	S	*	*			trans	-64.1	83.6	-176.7	0	0	0	0	0	113	V18	G16-V18 PolarHBondContact O-N 2.67Å
17	G	24.7	Very low	27.6	Very low	68 Å²	68	129.7 Å²	129.7	70%	0.701	73%	0.728	S	S	*	*			trans	-68.7	94.2	-179.6	0	0	0	0	0	111.9	P15 V19	P15-G17 VanDerWaalsContact C-N 3.31Å; P15-G17 PolarHBondContact O-N 3.41Å; G17-V19 PolarHBondContact O-N 2.83Å
18	V	25	Very low	27.7	Very low	129 Å²	129	128.8 Å²	128.8	78%	0.782	74%	0.74	S	S	*	*			trans	-59.3	109.8	172	178.1	0	0	0	0	109.2	G16 L20	G16-V18 PolarHBondContact O-N 2.67Å; V18-L20 PolarHBondContact O-N 2.81Å; V18-L20 VanDerWaalsContact O-N 3.15Å
19	V	23	Very low	27.5	Very low	128 Å²	128	129.1 Å²	129.1	78%	0.776	74%	0.743	S	S	*	*			trans	-70.3	109.3	172.5	177.6	0	0	0	0	108.1	G17 S21	G17-V19 PolarHBondContact O-N 2.83Å; V19-S21 VanDerWaalsContact C-N 3.28Å; V19-S21 PolarHBondContact O-N 3.31Å
20	L	24.6	Very low	27.4	Very low	167 Å²	167	133.6 Å²	133.6	87%	0.874	76%	0.761	S	S	*	*			trans	-65.4	87.1	171.4	-77.3	170.3	0	0	0	110.1	V18 S22	V18-L20 PolarHBondContact O-N 2.81Å; V18-L20 VanDerWaalsContact O-N 3.15Å; L20-S22 PolarHBondContact O-N 3.1Å
21	S	24.9	Very low	27.2	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	79%	0.786	S	S	*	*			trans	-62.6	125.1	170.9	60.8	0	0	0	0	109.9	V19 F23	V19-S21 VanDerWaalsContact C-N 3.28Å; V19-S21 PolarHBondContact O-N 3.31Å; S21-F23 PolarHBondContact O-N 2.81Å
22	S	24.3	Very low	27.2	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	80%	0.801	S	S	*	*			trans	-25.5	122.3	175.6	37.1	0	0	0	0	115.8	L20 R24	L20-S22 PolarHBondContact O-N 3.1Å; S22-R24 PolarHBondContact O-N 3.47Å
23	F	21.6	Very low	27.1	Very low	212 Å²	212	131 Å²	131	93%	0.93	80%	0.799	S	S	*	*			trans	-52.2	121.2	163.3	-106.1	-102.5	0	0	0	109.6	S21	S21-F23 PolarHBondContact O-N 2.81Å
24	R	24.5	Very low	27.8	Very low	239 Å²	239	133.5 Å²	133.5	90%	0.902	81%	0.813	S	S	*	*			trans	-112.9	108.4	169.4	-164.3	177.2	-167.2	178.9	4.3	107.7	S22 R26	S22-R24 PolarHBondContact O-N 3.47Å; R24-R26 PolarHBondContact O-N 2.75Å
25	S	23.9	Very low	27.9	Very low	109 Å²	109	132 Å²	132	76%	0.762	82%	0.819	S	S	*	*			trans	-52.8	137.3	178.6	-54.2	0	0	0	0	110.8
26	R	26.1	Very low	27.8	Very low	238 Å²	238	130 Å²	130	90%	0.898	82%	0.82	S	S	*	*			trans	-125.8	108.9	173.3	-172	174.4	-173.2	165.5	1.2	107.1	R24	R24-R26 PolarHBondContact O-N 2.75Å
27	D	27.7	Very low	27.8	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	82%	0.823	S	S	*	*			trans	-63.4	146.9	179.1	-63.9	-66.5	0	0	0	111
28	P	37.2	Very low	28.1	Very low	116 Å²	116	137.5 Å²	137.5	75%	0.753	83%	0.83	S	S	*	*			trans	-90.9	127.8	-179.8	34	-30.6	0	0	0	111.1
29	D	29.9	Very low	28.3	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	83%	0.83	S	S	*	*			trans	-157.6	164.9	146.2	-132.7	-32.5	0	0	0	113.5
30	E	31.4	Very low	28.8	Very low	188 Å²	188	135.2 Å²	135.2	88%	0.879	83%	0.832	S	S	*	*			trans	56.3	123.2	171.1	-59.1	-161.7	131.8	0	0	119.5
31	G	29.6	Very low	28.8	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	82%	0.822	S	S	*	*				149.6	10.3	122.2	0	0	0	0	0	122.9
32	G	29.5	Very low	29	Very low	88 Å²	88	129.2 Å²	129.2	91%	0.907	83%	0.827	S	S	*	*			trans	34.1	133.7	155.4	0	0	0	0	0	123.6
33	G	30.3	Very low	29	Very low	75 Å²	75	132.9 Å²	132.9	77%	0.773	83%	0.832	S	S	*	*			trans	150.6	135.8	157.9	0	0	0	0	0	114.6
34	P	41.5	Very low	29.3	Very low	138 Å²	138	131.2 Å²	131.2	90%	0.896	83%	0.827	S	S	*	*			trans	-118.5	155.3	-163.5	40.6	-30.7	0	0	0	116.4
35	G	27.9	Very low	29.5	Very low	85 Å²	85	128.9 Å²	128.9	88%	0.876	83%	0.826	S	S	*	*			trans	129.9	108.2	154.8	0	0	0	0	0	114.9
36	G	27.8	Very low	29.7	Very low	80 Å²	80	131.8 Å²	131.8	83%	0.825	83%	0.827	S	S	*	*			trans	-179.1	89.6	178.9	0	0	0	0	0	113.2
37	L	29.3	Very low	29.8	Very low	165 Å²	165	129.5 Å²	129.5	86%	0.864	83%	0.827	S	S	*	*			trans	-11.1	133.4	171.5	-77.7	149.9	0	0	0	119.2	V39	L37-V39 PolarHBondContact O-N 3.1Å
38	V	30.3	Very low	30.1	Very low	139 Å²	139	129.9 Å²	129.9	84%	0.842	82%	0.824	S	S	*	*			trans	-60.1	123.1	159.7	175.3	0	0	0	0	110.1
39	V	29.9	Very low	30	Very low	131 Å²	131	133.4 Å²	133.4	79%	0.794	83%	0.831	S	S	*	*			trans	-126.9	116.2	155.3	177.8	0	0	0	0	107	L37 G41	L37-V39 PolarHBondContact O-N 3.1Å; V39-G41 PolarHBondContact O-N 3.02Å
40	G	32.6	Very low	30.5	Very low	78 Å²	78	133.5 Å²	133.5	80%	0.804	83%	0.826	S	S	*	*			trans	-77.2	101.7	173.5	0	0	0	0	0	109.9
41	G	25.5	Very low	31.1	Very low	66 Å²	66	130.6 Å²	130.6	68%	0.68	81%	0.812	S	S	*	*			trans	-110.3	100.3	165.2	0	0	0	0	0	108.8	V39 Q43	V39-G41 PolarHBondContact O-N 3.02Å; G41-Q43 PolarHBondContact O-N 2.89Å; G41-Q43 VanDerWaalsContact O-N 3.15Å
42	G	27.8	Very low	32	Very low	77 Å²	77	136.4 Å²	136.4	79%	0.794	82%	0.819	S	S	*	*			trans	-73.1	98.6	161.9	0	0	0	0	0	107.5	E44	G42-E44 VanDerWaalsContact C-N 3.34Å; G42-E44 PolarHBondContact O-N 2.98Å; G42-E44 VanDerWaalsContact O-N 3.17Å
43	Q	25.1	Very low	33.6	Very low	187 Å²	187	133.6 Å²	133.6	87%	0.874	79%	0.787	S	S	*	*			trans	-72.2	103	157.2	-74.2	-175.3	-93.7	0	0	106	G41 E45	G41-Q43 PolarHBondContact O-N 2.89Å; G41-Q43 VanDerWaalsContact O-N 3.15Å; Q43-E45 PolarHBondContact O-N 2.91Å
44	E	28	Very low	35.6	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	78%	0.778	S	S	*	*			trans	-54.9	120.2	152.3	-64.5	174.5	146.9	0	0	105.4	G42 E46	G42-E44 VanDerWaalsContact C-N 3.34Å; G42-E44 PolarHBondContact O-N 2.98Å; G42-E44 VanDerWaalsContact O-N 3.17Å; E44-E46 PolarHBondContact O-N 3.32Å
45	E	28.1	Very low	37.7	Very low	189 Å²	189	130.9 Å²	130.9	88%	0.883	76%	0.755	S	S	*	*			trans	-69.2	92.2	171.3	-70.5	-177.6	149.4	0	0	106.2	Q43 E47	Q43-E45 PolarHBondContact O-N 2.91Å; E45-E47 PolarHBondContact O-N 3.41Å; E45-E47 VanDerWaalsContact O-N 3.12Å
46	E	28.7	Very low	40.4	Very low	170 Å²	170	128.5 Å²	128.5	79%	0.794	73%	0.725	S	S	*	*			trans	-56.3	117	169.6	-69.1	-173.3	133.2	0	0	107.3	E44 E48	E44-E46 PolarHBondContact O-N 3.32Å; E46-E48 PolarHBondContact O-N 3.24Å
47	E	28.8	Very low	43.4	Very low	191 Å²	191	127.8 Å²	127.8	89%	0.893	70%	0.704	S	S	*	*			trans	-66.1	84.7	168.9	-67.7	-174.8	137.8	0	0	107.4	E45 E49	E45-E47 PolarHBondContact O-N 3.41Å; E45-E47 VanDerWaalsContact O-N 3.12Å; E47-E49 PolarHBondContact O-N 3.27Å
48	E	33.1	Very low	46.3	Very low	154 Å²	154	125 Å²	125	72%	0.72	68%	0.682	S	S	*	*			trans	-53.8	115.3	175.2	-74.6	-166.7	148.6	0	0	108.7	E46 E50	E46-E48 PolarHBondContact O-N 3.24Å; E48-E50 PolarHBondContact O-N 3.27Å
49	E	34.8	Very low	49.3	Very low	191 Å²	191	122 Å²	122	89%	0.893	66%	0.661	S	S	*	*			trans	-60.1	106.6	178.8	-66.4	-173.3	127.7	0	0	109.2	E47 E51	E47-E49 PolarHBondContact O-N 3.27Å; E49-E51 PolarHBondContact O-N 2.91Å
50	E	40.7	Very low	52.3	Low	159 Å²	159	118.8 Å²	118.8	74%	0.743	64%	0.638	S	S	*	*			trans	-56.4	99.6	172.9	-82.5	-161.1	156.7	0	0	109.2	E48 E52	E48-E50 PolarHBondContact O-N 3.27Å; E50-E52 PolarHBondContact O-N 3.12Å; E50-E52 VanDerWaalsContact O-N 3.1Å
51	E	44.4	Very low	55.1	Low	127 Å²	127	122.9 Å²	122.9	59%	0.593	64%	0.636	S	S	*	*			trans	-49.2	115	-177.2	-154.9	-163.8	129.4	0	0	110.5	E49 A53 R75	E49-E51 PolarHBondContact O-N 2.91Å; E51-A53 PolarHBondContact O-N 3.07Å; E51-R75 IonicContact OE1-CZ 3.17Å; E51-R75 IonicContact OE1-NH1 2.83Å; E51-R75 PolarHBondContact OE1-NH1 2.95Å; E51-R75 IonicContact OE1-NH2 3.99Å; E51-R75 PolarHBondContact OE1-NH2 2.81Å; E51-R75 IonicContact OE2-CZ 3.58Å; E51-R75 IonicContact OE2-NH1 2.67Å; E51-R75 PolarHBondContact OE2-NH1 2.91Å; E51-R75 IonicContact OE2-NH2 2.7Å
52	E	49	Very low	58.2	Low	197 Å²	197	124.5 Å²	124.5	92%	0.921	63%	0.626	S	S	*	*			trans	-47.4	94.6	-164.9	-82.3	-159.8	127.9	0	0	113.3	E50	E50-E52 PolarHBondContact O-N 3.12Å; E50-E52 VanDerWaalsContact O-N 3.1Å
53	A	61.2	Low	61	Low	29 Å²	29	126.8 Å²	126.8	24%	0.24	62%	0.62	C	S	.	*			trans	-76.8	141.9	-173.4	0	0	0	0	0	110.6	E51 V55 Q73	E51-A53 PolarHBondContact O-N 3.07Å; A53-V55 PolarHBondContact O-N 2.98Å; A53-Q73 WeakPolarHBondContact CB-O 3.43Å
54	P	73.8	Confident	64.1	Low	91 Å²	91	118.5 Å²	118.5	59%	0.591	59%	0.585	S	S	*	*			trans	-64.6	111.1	-162.6	23.5	-34.2	0	0	0	112.8
55	V	84.3	Confident	67.3	Low	66 Å²	66	110.3 Å²	110.3	40%	0.4	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.8	172.7	-172	0	0	0	0	109.7	A53 V57 T70 R72	A53-V55 PolarHBondContact O-N 2.98Å; V55-V57 HydrophobicContact CG1-CG2 4.06Å; V55-T70 HydrophobicContact CG1-CG2 3.9Å; V55-R72 HydrophobicContact CG1-CG 4.09Å; V55-R72 HydrophobicContact CG2-CG 3.99Å
56	S	85.9	Confident	70.5	Confident	35 Å²	35	101.9 Å²	101.9	25%	0.245	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.9	172.1	-170.2	0	0	0	0	110	S71 R774	S56-S71 PolarHBondContact N-O 2.75Å; S56-S71 PolarHBondContact O-N 2.9Å; S56-R774 PolarHBondContact OG-NH2 2.92Å
57	V	90.7	Very high	73.6	Confident	65 Å²	65	94.4 Å²	94.4	39%	0.394	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.2	179.6	-173.7	0	0	0	0	109.3	V55 T68 V69 T70	V55-V57 HydrophobicContact CG1-CG2 4.06Å; V57-T68 HydrophobicContact CG1-CG2 3.49Å; V57-T68 VanDerWaalsContact CG1-CG2 3.49Å; V57-V69 WeakPolarHBondContact CA-O 3.44Å; V57-T70 HydrophobicContact CG2-CG2 4.16Å
58	W	90.6	Very high	76.6	Confident	107 Å²	107	85.4 Å²	85.4	41%	0.405	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	154.6	169.6	61.4	93.8	0	0	0	110.3	E60 V69	W58-E60 PolarHBondContact NE1-OE1 2.88Å; W58-V69 HydrophobicContact CD2-CB 4.14Å; W58-V69 HydrophobicContact CD2-CG1 4.33Å; W58-V69 HydrophobicContact CG-CB 4.48Å; W58-V69 HydrophobicContact CH2-CG1 3.8Å; W58-V69 HydrophobicContact CZ2-CB 3.95Å; W58-V69 HydrophobicContact CZ2-CG1 3.37Å; W58-V69 HydrophobicContact CZ3-CG1 4.41Å; W58-V69 PolarHBondContact N-O 3.2Å; W58-V69 VanDerWaalsContact N-O 3.08Å; W58-V69 PolarHBondContact O-N 3.25Å
59	D	92.6	Very high	79.3	Confident	75 Å²	75	78.5 Å²	78.5	40%	0.401	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	149.5	172.7	-75.4	-20.2	0	0	0	110.7	V66 F67 T68 R93	D59-V66 HydrophobicContact CB-CG1 4.23Å; D59-F67 CarbonylContact C-O 3.55Å; D59-F67 VanDerWaalsContact CA-O 3.27Å; D59-F67 WeakPolarHBondContact CA-O 3.48Å; D59-T68 WeakPolarHBondContact OD1-CA 3.39Å; D59-T68 WeakPolarHBondContact OD1-CB 3.27Å; D59-T68 VanDerWaalsContact OD1-CG2 3.3Å; D59-T68 WeakPolarHBondContact OD1-CG2 3.4Å; D59-T68 PolarHBondContact OD1-OG1 2.84Å; D59-R93 IonicContact OD1-NH1 3.62Å; D59-R93 IonicContact OD2-CZ 3.57Å; D59-R93 IonicContact OD2-NH1 2.74Å; D59-R93 PolarHBondContact OD2-NH1 3.17Å
60	E	93.1	Very high	81.9	Confident	64 Å²	64	70.4 Å²	70.4	30%	0.299	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.1	177.9	-65.8	176.2	173.8	0	0	108.8	W58 F67 V69 R90	W58-E60 PolarHBondContact NE1-OE1 2.88Å; E60-F67 PolarHBondContact N-O 2.79Å; E60-F67 PolarHBondContact O-N 2.95Å; E60-V69 VanDerWaalsContact CD-CG2 3.4Å; E60-V69 HydrophobicContact CG-CG2 4.2Å; E60-V69 WeakPolarHBondContact OE1-CG2 3.46Å; E60-V69 WeakPolarHBondContact OE2-CG2 3.41Å; E60-R90 IonicContact OE2-CZ 3.35Å; E60-R90 VanDerWaalsContact OE2-CZ 3.32Å; E60-R90 IonicContact OE2-NE 3.55Å; E60-R90 PolarHBondContact OE2-NE 2.89Å; E60-R90 IonicContact OE2-NH2 3.95Å; E60-R90 PolarHBondContact OE2-NH2 2.86Å
61	E	91.3	Very high	84.2	Confident	163 Å²	163	63.8 Å²	63.8	76%	0.762	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.9	176.3	-58.3	-168.5	144	0	0	110	V66	E61-V66 HydrophobicContact CG-CG2 4.31Å
62	E	89.7	Confident	86.1	Confident	100 Å²	100	63.2 Å²	63.2	47%	0.467	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	123.2	178.4	-79	-179.2	153	0	0	109.4	G64 A65 F67 R90	E62-G64 PolarHBondContact O-N 2.95Å; E62-G64 VanDerWaalsContact O-N 3.13Å; E62-A65 PolarHBondContact N-O 3.35Å; E62-A65 WeakPolarHBondContact O-CA 3.13Å; E62-A65 PolarHBondContact O-N 2.8Å; E62-F67 HydrophobicContact CB-CD2 4.39Å; E62-F67 HydrophobicContact CB-CE2 4.11Å; E62-F67 WeakPolarHBondContact OE2-CE2 3.39Å; E62-R90 IonicContact OE1-NH2 2.91Å; E62-R90 PolarHBondContact OE1-NH2 3.01Å; E62-R90 IonicContact OE2-CZ 3.4Å; E62-R90 VanDerWaalsContact OE2-CZ 3.22Å; E62-R90 IonicContact OE2-NH1 2.81Å; E62-R90 PolarHBondContact OE2-NH1 3.02Å; E62-R90 IonicContact OE2-NH2 3.32Å; E62-R90 PolarHBondContact OE2-NH2 2.8Å
63	D	86.9	Confident	87.7	Confident	125 Å²	125	57.5 Å²	57.5	67%	0.668	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	19.2	76.4	171	-175.2	44.6	0	0	0	116.2	R102	D63-R102 VanDerWaalsContact O-CZ 3.28Å; D63-R102 PolarHBondContact O-NH1 2.7Å; D63-R102 PolarHBondContact O-NH2 2.98Å; D63-R102 IonicContact OD2-CZ 2.71Å; D63-R102 IonicContact OD2-NE 2.8Å; D63-R102 IonicContact OD2-NH1 3.07Å; D63-R102 PolarHBondContact OD2-NH1 2.83Å; D63-R102 IonicContact OD2-NH2 2.77Å; D63-R102 PolarHBondContact OD2-NH2 2.99Å
64	G	91.2	Very high	88.3	Confident	14 Å²	14	59.1 Å²	59.1	14%	0.144	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	5.4	177.1	0	0	0	0	0	115.9	E62 G95 T96 A99 Y454	E62-G64 PolarHBondContact O-N 2.95Å; E62-G64 VanDerWaalsContact O-N 3.13Å; G64-G95 CarbonylContact O-C 3.58Å; G64-G95 WeakPolarHBondContact O-CA 3.36Å; G64-T96 PolarHBondContact O-N 3.05Å; G64-A99 WeakPolarHBondContact O-CB 3.05Å; G64-Y454 WeakPolarHBondContact CA-OH 3.4Å
65	A	94.8	Very high	88.3	Confident	4 Å²	4	61.5 Å²	61.5	3%	0.033	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	158.7	177.4	0	0	0	0	0	113.5	E62 F67 L92 A94 A99	E62-A65 PolarHBondContact N-O 3.35Å; E62-A65 WeakPolarHBondContact O-CA 3.13Å; E62-A65 PolarHBondContact O-N 2.8Å; A65-F67 HydrophobicContact CB-CD2 4.43Å; A65-F67 HydrophobicContact CB-CE2 3.78Å; A65-F67 HydrophobicContact CB-CZ 4.28Å; A65-L92 HydrophobicContact CB-CD1 4.36Å; A65-A94 CarbonylContact C-O 3.57Å; A65-A94 WeakPolarHBondContact CA-O 3.49Å; A65-A99 HydrophobicContact CB-CB 3.92Å
66	V	94.8	Very high	87.8	Confident	13 Å²	13	59.9 Å²	59.9	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.7	170.7	-174.6	0	0	0	0	108.2	D59 E61 R93 A94 Y454	D59-V66 HydrophobicContact CB-CG1 4.23Å; E61-V66 HydrophobicContact CG-CG2 4.31Å; V66-R93 HydrophobicContact CG1-CB 4.49Å; V66-R93 WeakPolarHBondContact O-CA 3.5Å; V66-R93 VanDerWaalsContact O-CB 3.28Å; V66-R93 WeakPolarHBondContact O-CB 3.48Å; V66-R93 PolarHBondContact O-N 2.71Å; V66-A94 PolarHBondContact N-O 3.28Å; V66-A94 PolarHBondContact O-N 3.17Å; V66-Y454 HydrophobicContact CG2-CD2 4.03Å; V66-Y454 HydrophobicContact CG2-CE2 4.01Å
67	F	93.3	Very high	87.2	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	147.4	173.9	-64	-93.8	0	0	0	109.6	D59 E60 E62 A65 R90 R91 L92 H103	D59-F67 CarbonylContact C-O 3.55Å; D59-F67 VanDerWaalsContact CA-O 3.27Å; D59-F67 WeakPolarHBondContact CA-O 3.48Å; E60-F67 PolarHBondContact N-O 2.79Å; E60-F67 PolarHBondContact O-N 2.95Å; E62-F67 HydrophobicContact CB-CD2 4.39Å; E62-F67 HydrophobicContact CB-CE2 4.11Å; E62-F67 WeakPolarHBondContact OE2-CE2 3.39Å; A65-F67 HydrophobicContact CB-CD2 4.43Å; A65-F67 HydrophobicContact CB-CE2 3.78Å; A65-F67 HydrophobicContact CB-CZ 4.28Å; F67-R90 HydrophobicContact CB-CG 4.25Å; F67-R90 HydrophobicContact CD1-CG 4.35Å; F67-R91 CarbonylContact C-O 3.6Å; F67-R91 VanDerWaalsContact CA-O 3.26Å; F67-R91 WeakPolarHBondContact CA-O 3.22Å; F67-L92 HydrophobicContact CD1-CB 3.9Å; F67-L92 HydrophobicContact CD1-CG 4.29Å; F67-L92 HydrophobicContact CE1-CB 3.71Å; F67-L92 HydrophobicContact CE1-CD1 3.86Å; F67-L92 HydrophobicContact CE1-CG 3.93Å; F67-L92 HydrophobicContact CZ-CD1 3.9Å; F67-L92 HydrophobicContact CZ-CG 4.3Å; F67-H103 AromaticContact CE1-CE1 3.79Å; F67-H103 AromaticContact CE1-ND1 3.86Å; F67-H103 AromaticContact CE1-NE2 3.94Å
68	T	92.4	Very high	86.6	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.7	166.4	-52.2	0	0	0	0	109.2	V57 D59 R91 R93	V57-T68 HydrophobicContact CG1-CG2 3.49Å; V57-T68 VanDerWaalsContact CG1-CG2 3.49Å; D59-T68 WeakPolarHBondContact OD1-CA 3.39Å; D59-T68 WeakPolarHBondContact OD1-CB 3.27Å; D59-T68 VanDerWaalsContact OD1-CG2 3.3Å; D59-T68 WeakPolarHBondContact OD1-CG2 3.4Å; D59-T68 PolarHBondContact OD1-OG1 2.84Å; T68-R91 VanDerWaalsContact CG2-NH2 3.3Å; T68-R91 PolarHBondContact N-O 3.26Å; T68-R91 PolarHBondContact O-N 3.45Å; T68-R93 WeakPolarHBondContact OG1-CD 3.3Å
69	V	90.4	Very high	85.7	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.055	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136.1	167.8	179.6	0	0	0	0	109.4	V57 W58 E60 S89 R90	V57-V69 WeakPolarHBondContact CA-O 3.44Å; W58-V69 HydrophobicContact CD2-CB 4.14Å; W58-V69 HydrophobicContact CD2-CG1 4.33Å; W58-V69 HydrophobicContact CG-CB 4.48Å; W58-V69 HydrophobicContact CH2-CG1 3.8Å; W58-V69 HydrophobicContact CZ2-CB 3.95Å; W58-V69 HydrophobicContact CZ2-CG1 3.37Å; W58-V69 HydrophobicContact CZ3-CG1 4.41Å; W58-V69 PolarHBondContact N-O 3.2Å; W58-V69 VanDerWaalsContact N-O 3.08Å; W58-V69 PolarHBondContact O-N 3.25Å; E60-V69 VanDerWaalsContact CD-CG2 3.4Å; E60-V69 HydrophobicContact CG-CG2 4.2Å; E60-V69 WeakPolarHBondContact OE1-CG2 3.46Å; E60-V69 WeakPolarHBondContact OE2-CG2 3.41Å; V69-S89 CarbonylContact C-O 3.52Å; V69-S89 WeakPolarHBondContact CA-O 3.23Å; V69-R90 HydrophobicContact CG2-CB 4.08Å; V69-R90 HydrophobicContact CG2-CG 3.83Å
70	T	88.8	Confident	85.2	Confident	21 Å²	21	71 Å²	71	13%	0.129	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	105.5	177.6	-62.7	0	0	0	0	107.8	V55 V57 S88 S89 R91	V55-T70 HydrophobicContact CG1-CG2 3.9Å; V57-T70 HydrophobicContact CG2-CG2 4.16Å; T70-S88 WeakPolarHBondContact O-CA 3.44Å; T70-S89 PolarHBondContact N-O 2.91Å; T70-S89 PolarHBondContact O-N 2.85Å; T70-R91 PolarHBondContact OG1-NH1 3.2Å
71	S	88.4	Confident	84.5	Confident	20 Å²	20	71.3 Å²	71.3	14%	0.14	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.7	178	-170.2	0	0	0	0	109.5	S56	S56-S71 PolarHBondContact N-O 2.75Å; S56-S71 PolarHBondContact O-N 2.9Å
72	R	85.4	Confident	83.9	Confident	115 Å²	115	69 Å²	69	43%	0.434	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.3	170.7	-63.9	-159.8	179.7	-156.2	3.8	109.1	V55 Y74 P86 R87	V55-R72 HydrophobicContact CG1-CG 4.09Å; V55-R72 HydrophobicContact CG2-CG 3.99Å; R72-Y74 HydrophobicContact CB-CD2 4.37Å; R72-Y74 HydrophobicContact CB-CE2 3.66Å; R72-Y74 WeakPolarHBondContact O-CD2 3.42Å; R72-P86 CarbonylContact O-C 3.6Å; R72-P86 WeakPolarHBondContact O-CA 3.23Å; R72-R87 PolarHBondContact N-O 3.21Å; R72-R87 PolarHBondContact O-N 3.08Å
73	Q	81.4	Confident	83.2	Confident	77 Å²	77	68.9 Å²	68.9	36%	0.36	36%	0.362	S	S	.	.			trans	-83.4	139.9	164.4	-166.8	155.9	24.1	0	0	108.6	A53 M83 P86	A53-Q73 WeakPolarHBondContact CB-O 3.43Å; Q73-M83 HydrophobicContact CG-CE 3.73Å; Q73-P86 HydrophobicContact CB-CB 4.13Å; Q73-P86 HydrophobicContact CG-CB 4.46Å
74	Y	74.7	Confident	82.9	Confident	64 Å²	64	65 Å²	65	25%	0.251	34%	0.344	S	S	.	.			trans	-112.5	142	178.6	-71.1	-98.9	0	0	0	108.8	R72 M83 P84 R87	R72-Y74 HydrophobicContact CB-CD2 4.37Å; R72-Y74 HydrophobicContact CB-CE2 3.66Å; R72-Y74 WeakPolarHBondContact O-CD2 3.42Å; Y74-M83 WeakPolarHBondContact O-CE 3.27Å; Y74-P84 WeakPolarHBondContact O-CD 3.44Å; Y74-P84 WeakPolarHBondContact O-CG 3.1Å; Y74-R87 HydrophobicContact CD2-CG 4.17Å; Y74-R87 HydrophobicContact CE2-CB 4Å; Y74-R87 HydrophobicContact CE2-CG 3.92Å
75	R	73.6	Confident	82.3	Confident	141 Å²	141	69.7 Å²	69.7	53%	0.532	37%	0.372	S	S	.	.			trans	-81.1	138	165.1	-67.8	-171.6	-173.3	171.2	17.8	108.7	E51 M83	E51-R75 IonicContact OE1-CZ 3.17Å; E51-R75 IonicContact OE1-NH1 2.83Å; E51-R75 PolarHBondContact OE1-NH1 2.95Å; E51-R75 IonicContact OE1-NH2 3.99Å; E51-R75 PolarHBondContact OE1-NH2 2.81Å; E51-R75 IonicContact OE2-CZ 3.58Å; E51-R75 IonicContact OE2-NH1 2.67Å; E51-R75 PolarHBondContact OE2-NH1 2.91Å; E51-R75 IonicContact OE2-NH2 2.7Å; R75-M83 HydrophobicContact CG-CE 4.31Å
76	P	73.6	Confident	81.6	Confident	32 Å²	32	72.4 Å²	72.4	21%	0.208	39%	0.389	C	S	.	.			trans	-72.8	148.4	167.1	30.7	-30.2	0	0	0	109.7	D78 V81	P76-D78 WeakPolarHBondContact CG-O 3.5Å; P76-D78 PolarHBondContact O-N 2.98Å; P76-V81 HydrophobicContact CB-CB 4.01Å; P76-V81 HydrophobicContact CB-CG1 4.08Å; P76-V81 HydrophobicContact CG-CB 4.1Å; P76-V81 HydrophobicContact CG-CG1 4.35Å; P76-V81 WeakPolarHBondContact CG-O 3.37Å
77	L	72.9	Confident	81	Confident	159 Å²	159	80.1 Å²	80.1	83%	0.832	42%	0.417	S	S	*	.	S	Bend	trans	-64.6	-28.8	176.1	-68.2	103.3	0	0	0	112.6	P79	L77-P79 WeakPolarHBondContact O-CD 3.49Å
78	D	78.1	Confident	80.5	Confident	78 Å²	78	83.8 Å²	83.8	42%	0.417	44%	0.444	S	S	.	.	S	Bend	trans	-93.4	113.8	170.1	178.2	2.4	0	0	0	110.1	P76 L80 V81	P76-D78 WeakPolarHBondContact CG-O 3.5Å; P76-D78 PolarHBondContact O-N 2.98Å; D78-L80 PolarHBondContact O-N 2.81Å; D78-L80 VanDerWaalsContact O-N 3.16Å; D78-L80 VanDerWaalsContact OD1-CB 3.27Å; D78-L80 WeakPolarHBondContact OD1-CB 3.38Å; D78-L80 WeakPolarHBondContact OD1-CG 3.44Å; D78-L80 PolarHBondContact OD1-N 2.99Å; D78-V81 HydrophobicContact CB-CG2 3.82Å; D78-V81 WeakPolarHBondContact O-CB 3.36Å; D78-V81 PolarHBondContact O-N 3.14Å
79	P	73.1	Confident	80.1	Confident	122 Å²	122	86.3 Å²	86.3	79%	0.792	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-6	179.6	30.3	-36.4	0	0	0	114.1	L77	L77-P79 WeakPolarHBondContact O-CD 3.49Å
80	L	81.2	Confident	80	Confident	156 Å²	156	88.6 Å²	88.6	82%	0.817	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-16	170.6	-56.9	175.5	0	0	0	112.6	D78	D78-L80 PolarHBondContact O-N 2.81Å; D78-L80 VanDerWaalsContact O-N 3.16Å; D78-L80 VanDerWaalsContact OD1-CB 3.27Å; D78-L80 WeakPolarHBondContact OD1-CB 3.38Å; D78-L80 WeakPolarHBondContact OD1-CG 3.44Å; D78-L80 PolarHBondContact OD1-N 2.99Å
81	V	78.4	Confident	80.1	Confident	71 Å²	71	91.3 Å²	91.3	43%	0.43	48%	0.477	S	S	.	.	S	Bend	trans	-78.4	131	177.9	173.7	0	0	0	0	110	P76 D78 M83	P76-V81 HydrophobicContact CB-CB 4.01Å; P76-V81 HydrophobicContact CB-CG1 4.08Å; P76-V81 HydrophobicContact CG-CB 4.1Å; P76-V81 HydrophobicContact CG-CG1 4.35Å; P76-V81 WeakPolarHBondContact CG-O 3.37Å; D78-V81 HydrophobicContact CB-CG2 3.82Å; D78-V81 WeakPolarHBondContact O-CB 3.36Å; D78-V81 PolarHBondContact O-N 3.14Å; V81-M83 PolarHBondContact O-N 3.37Å
82	P	78.5	Confident	80.3	Confident	113 Å²	113	90.3 Å²	90.3	73%	0.734	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-56	135.4	173.9	-25.9	34.9	0	0	0	111.9
83	M	76.2	Confident	80.7	Confident	98 Å²	98	89.3 Å²	89.3	48%	0.483	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-47.5	123.3	-178.8	-74.2	-64.8	-63.1	0	0	111.5	Q73 Y74 R75 V81	Q73-M83 HydrophobicContact CG-CE 3.73Å; Y74-M83 WeakPolarHBondContact O-CE 3.27Å; R75-M83 HydrophobicContact CG-CE 4.31Å; V81-M83 PolarHBondContact O-N 3.37Å
84	P	79.4	Confident	81.4	Confident	43 Å²	43	85.6 Å²	85.6	28%	0.279	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-64.3	153.5	-178.4	26.9	-34.6	0	0	0	111.1	Y74	Y74-P84 WeakPolarHBondContact O-CD 3.44Å; Y74-P84 WeakPolarHBondContact O-CG 3.1Å
85	P	79.5	Confident	82.5	Confident	114 Å²	114	82.6 Å²	82.6	74%	0.74	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-58.1	136.1	174.2	25.7	-34	0	0	0	109.8	R87	P85-R87 PolarHBondContact O-N 2.96Å
86	P	80.4	Confident	83.6	Confident	61 Å²	61	77.8 Å²	77.8	40%	0.396	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-65.3	136.4	-176.5	28.2	-35.3	0	0	0	110.6	R72 Q73 S88	R72-P86 CarbonylContact O-C 3.6Å; R72-P86 WeakPolarHBondContact O-CA 3.23Å; Q73-P86 HydrophobicContact CB-CB 4.13Å; Q73-P86 HydrophobicContact CG-CB 4.46Å; P86-S88 PolarHBondContact O-N 3.46Å
87	R	81.5	Confident	84.7	Confident	175 Å²	175	77.7 Å²	77.7	66%	0.66	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	107.9	176.6	-60	-177.2	179.2	156.9	-2.1	108.4	R72 Y74 P85	R72-R87 PolarHBondContact N-O 3.21Å; R72-R87 PolarHBondContact O-N 3.08Å; Y74-R87 HydrophobicContact CD2-CG 4.17Å; Y74-R87 HydrophobicContact CE2-CB 4Å; Y74-R87 HydrophobicContact CE2-CG 3.92Å; P85-R87 PolarHBondContact O-N 2.96Å
88	S	82.2	Confident	85.8	Confident	88 Å²	88	74.7 Å²	74.7	62%	0.615	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.5	173.4	52.9	0	0	0	0	111.1	T70 P86	T70-S88 WeakPolarHBondContact O-CA 3.44Å; P86-S88 PolarHBondContact O-N 3.46Å
89	S	84.6	Confident	86.6	Confident	56 Å²	56	71.1 Å²	71.1	39%	0.392	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.4	161.7	173.4	0	0	0	0	109.1	V69 T70	V69-S89 CarbonylContact C-O 3.52Å; V69-S89 WeakPolarHBondContact CA-O 3.23Å; T70-S89 PolarHBondContact N-O 2.91Å; T70-S89 PolarHBondContact O-N 2.85Å
90	R	88.3	Confident	87.7	Confident	57 Å²	57	65.3 Å²	65.3	22%	0.215	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.5	171.1	-178.1	174.7	-156.4	-103.7	3.9	107.8	E60 E62 F67 V69	E60-R90 IonicContact OE2-CZ 3.35Å; E60-R90 VanDerWaalsContact OE2-CZ 3.32Å; E60-R90 IonicContact OE2-NE 3.55Å; E60-R90 PolarHBondContact OE2-NE 2.89Å; E60-R90 IonicContact OE2-NH2 3.95Å; E60-R90 PolarHBondContact OE2-NH2 2.86Å; E62-R90 IonicContact OE1-NH2 2.91Å; E62-R90 PolarHBondContact OE1-NH2 3.01Å; E62-R90 IonicContact OE2-CZ 3.4Å; E62-R90 VanDerWaalsContact OE2-CZ 3.22Å; E62-R90 IonicContact OE2-NH1 2.81Å; E62-R90 PolarHBondContact OE2-NH1 3.02Å; E62-R90 IonicContact OE2-NH2 3.32Å; E62-R90 PolarHBondContact OE2-NH2 2.8Å; F67-R90 HydrophobicContact CB-CG 4.25Å; F67-R90 HydrophobicContact CD1-CG 4.35Å; V69-R90 HydrophobicContact CG2-CB 4.08Å; V69-R90 HydrophobicContact CG2-CG 3.83Å
91	R	90.4	Very high	88.3	Confident	77 Å²	77	58 Å²	58	29%	0.291	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	143.2	-177.5	65	177.4	-177.8	-82.8	0	111.5	F67 T68 T70 D113	F67-R91 CarbonylContact C-O 3.6Å; F67-R91 VanDerWaalsContact CA-O 3.26Å; F67-R91 WeakPolarHBondContact CA-O 3.22Å; T68-R91 VanDerWaalsContact CG2-NH2 3.3Å; T68-R91 PolarHBondContact N-O 3.26Å; T68-R91 PolarHBondContact O-N 3.45Å; T70-R91 PolarHBondContact OG1-NH1 3.2Å; R91-D113 WeakPolarHBondContact CA-OD2 3.47Å; R91-D113 WeakPolarHBondContact CB-OD2 3.47Å
92	L	93.3	Very high	89	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128.9	170.8	-167.7	152.7	0	0	0	110.2	A65 F67 L100 H103 D113 F116 F457 R461	A65-L92 HydrophobicContact CB-CD1 4.36Å; F67-L92 HydrophobicContact CD1-CB 3.9Å; F67-L92 HydrophobicContact CD1-CG 4.29Å; F67-L92 HydrophobicContact CE1-CB 3.71Å; F67-L92 HydrophobicContact CE1-CD1 3.86Å; F67-L92 HydrophobicContact CE1-CG 3.93Å; F67-L92 HydrophobicContact CZ-CD1 3.9Å; F67-L92 HydrophobicContact CZ-CG 4.3Å; L92-L100 HydrophobicContact CD1-CD2 3.8Å; L92-L100 HydrophobicContact CD2-CD2 3.32Å; L92-L100 HydrophobicContact CG-CD2 4.25Å; L92-H103 HydrophobicContact CD1-CB 3.74Å; L92-H103 VanDerWaalsContact CD1-CD2 3.45Å; L92-H103 WeakPolarHBondContact CD1-CD2 3.49Å; L92-D113 PolarHBondContact N-OD2 2.83Å; L92-F116 HydrophobicContact CB-CD2 4.2Å; L92-F116 HydrophobicContact CB-CE2 4.16Å; L92-F116 HydrophobicContact CD1-CE2 4.19Å; L92-F116 HydrophobicContact CD1-CZ 4.45Å; L92-F116 HydrophobicContact CD2-CE2 4.18Å; L92-F116 HydrophobicContact CG-CE2 4.41Å; L92-F457 HydrophobicContact CD2-CB 3.84Å; L92-F457 HydrophobicContact CD2-CG 4.17Å; L92-R461 PolarHBondContact O-NE 2.88Å; L92-R461 PolarHBondContact O-NH2 2.94Å
93	R	93.9	Very high	89.7	Confident	93 Å²	93	53.6 Å²	53.6	35%	0.351	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-45.1	-177.3	-163.2	-171.7	-177.4	-179.9	-3	112.5	D59 V66 T68 F457 D458	D59-R93 IonicContact OD1-NH1 3.62Å; D59-R93 IonicContact OD2-CZ 3.57Å; D59-R93 IonicContact OD2-NH1 2.74Å; D59-R93 PolarHBondContact OD2-NH1 3.17Å; V66-R93 HydrophobicContact CG1-CB 4.49Å; V66-R93 WeakPolarHBondContact O-CA 3.5Å; V66-R93 VanDerWaalsContact O-CB 3.28Å; V66-R93 WeakPolarHBondContact O-CB 3.48Å; V66-R93 PolarHBondContact O-N 2.71Å; T68-R93 WeakPolarHBondContact OG1-CD 3.3Å; R93-F457 WeakPolarHBondContact O-CA 3.36Å; R93-F457 VanDerWaalsContact O-CB 3.29Å; R93-F457 WeakPolarHBondContact O-CB 3.39Å; R93-F457 PolarHBondContact O-N 3.07Å; R93-D458 WeakPolarHBondContact CG-OD2 3.44Å; R93-D458 IonicContact CZ-OD2 2.72Å; R93-D458 IonicContact NE-OD2 3.2Å; R93-D458 PolarHBondContact NE-OD2 3.15Å; R93-D458 IonicContact NH2-OD2 2.69Å; R93-D458 PolarHBondContact O-N 3.22Å; R93-D458 VanDerWaalsContact O-N 3.16Å
94	A	96.5	Very high	90.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	163.3	175.5	0	0	0	0	0	111.2	A65 V66 L450 I455	A65-A94 CarbonylContact C-O 3.57Å; A65-A94 WeakPolarHBondContact CA-O 3.49Å; V66-A94 PolarHBondContact N-O 3.28Å; V66-A94 PolarHBondContact O-N 3.17Å; A94-L450 HydrophobicContact CB-CD1 3.42Å; A94-L450 VanDerWaalsContact CB-CD1 3.42Å; A94-L450 HydrophobicContact CB-CG 4.1Å; A94-I455 WeakPolarHBondContact CA-O 3.21Å; A94-I455 VanDerWaalsContact CB-O 3.25Å; A94-I455 WeakPolarHBondContact CB-O 3.39Å
95	G	97	Very high	91.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	176.9	170	0	0	0	0	0	114.3	G64 I455	G64-G95 CarbonylContact O-C 3.58Å; G64-G95 WeakPolarHBondContact O-CA 3.36Å; G95-I455 PolarHBondContact N-O 2.97Å; G95-I455 WeakPolarHBondContact O-CB 3.49Å; G95-I455 PolarHBondContact O-N 2.57Å
96	T	97.2	Very high	91.5	Very high	41 Å²	41	44.4 Å²	44.4	25%	0.252	22%	0.215	S	C	.	.			trans	-68.6	162.3	167.3	81	0	0	0	0	110.4	G64 E98 A99 L100 Y454	G64-T96 PolarHBondContact O-N 3.05Å; T96-E98 VanDerWaalsContact C-N 3.26Å; T96-E98 WeakPolarHBondContact CB-OE2 3.41Å; T96-E98 PolarHBondContact O-N 2.9Å; T96-E98 PolarHBondContact OG1-OE2 2.83Å; T96-A99 WeakPolarHBondContact O-CB 3.32Å; T96-A99 PolarHBondContact O-N 2.92Å; T96-A99 PolarHBondContact OG1-N 3Å; T96-L100 WeakPolarHBondContact O-CG 3.36Å; T96-L100 PolarHBondContact O-N 2.83Å; T96-Y454 HydrophobicContact CG2-CD1 4.04Å; T96-Y454 HydrophobicContact CG2-CE1 3.92Å
97	L	96.8	Very high	91.3	Very high	29 Å²	29	44.8 Å²	44.8	15%	0.152	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-37.2	-177.8	-176.1	61.3	0	0	0	112	A99 L100 V101 F120 F127 T128 L136 I455	L97-A99 VanDerWaalsContact C-N 3.33Å; L97-L100 PolarHBondContact O-N 2.77Å; L97-V101 WeakPolarHBondContact O-CG2 3.39Å; L97-V101 PolarHBondContact O-N 3.36Å; L97-F120 HydrophobicContact CD1-CZ 4.39Å; L97-F127 HydrophobicContact CD1-CD2 4.16Å; L97-F127 HydrophobicContact CD1-CE2 3.86Å; L97-T128 HydrophobicContact CD1-CG2 3.97Å; L97-T128 HydrophobicContact CD2-CG2 4.43Å; L97-T128 WeakPolarHBondContact CD2-OG1 3.38Å; L97-L136 HydrophobicContact CB-CD1 4.35Å; L97-L136 HydrophobicContact CD2-CD1 3.47Å; L97-L136 VanDerWaalsContact CD2-CD1 3.47Å; L97-L136 HydrophobicContact CG-CD1 3.54Å; L97-I455 HydrophobicContact CB-CD1 3.96Å; L97-I455 HydrophobicContact CD1-CD1 4.23Å
98	E	95.3	Very high	91	Very high	96 Å²	96	45.1 Å²	45.1	45%	0.449	22%	0.217	S	C	.	.	H	α-helix	trans	-66.8	-35.3	176.1	-48.5	71.1	-152.8	0	0	111.2	T96 V101 R102 L136	T96-E98 VanDerWaalsContact C-N 3.26Å; T96-E98 WeakPolarHBondContact CB-OE2 3.41Å; T96-E98 PolarHBondContact O-N 2.9Å; T96-E98 PolarHBondContact OG1-OE2 2.83Å; E98-V101 PolarHBondContact O-N 2.8Å; E98-R102 WeakPolarHBondContact O-CB 3.31Å; E98-R102 WeakPolarHBondContact O-CG 3.39Å; E98-R102 PolarHBondContact O-N 2.97Å; E98-R102 PolarHBondContact O-NE 3.12Å; E98-L136 HydrophobicContact CG-CD2 4.27Å
99	A	94.9	Very high	90.7	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.033	19%	0.19	C	C	.	.	H	α-helix	trans	-70.3	-38.5	175.1	0	0	0	0	0	111.9	G64 A65 T96 L97 R102 H103	G64-A99 WeakPolarHBondContact O-CB 3.05Å; A65-A99 HydrophobicContact CB-CB 3.92Å; T96-A99 WeakPolarHBondContact O-CB 3.32Å; T96-A99 PolarHBondContact O-N 2.92Å; T96-A99 PolarHBondContact OG1-N 3Å; L97-A99 VanDerWaalsContact C-N 3.33Å; A99-R102 PolarHBondContact O-N 2.58Å; A99-H103 PolarHBondContact O-N 3.36Å
100	L	95.8	Very high	89.9	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-42.3	171.9	-62.1	-179.4	0	0	0	111.7	L92 T96 L97 H103 L104 F116 F120 F127 I455 F457	L92-L100 HydrophobicContact CD1-CD2 3.8Å; L92-L100 HydrophobicContact CD2-CD2 3.32Å; L92-L100 HydrophobicContact CG-CD2 4.25Å; T96-L100 WeakPolarHBondContact O-CG 3.36Å; T96-L100 PolarHBondContact O-N 2.83Å; L97-L100 PolarHBondContact O-N 2.77Å; L100-H103 PolarHBondContact O-N 2.99Å; L100-L104 WeakPolarHBondContact O-CB 3.39Å; L100-L104 PolarHBondContact O-N 3.49Å; L100-F116 HydrophobicContact CB-CZ 4.34Å; L100-F116 HydrophobicContact CD2-CE2 4.08Å; L100-F116 HydrophobicContact CD2-CZ 4.14Å; L100-F120 HydrophobicContact CB-CD2 4.16Å; L100-F120 HydrophobicContact CB-CE2 3.57Å; L100-F120 HydrophobicContact CB-CZ 4.42Å; L100-F120 HydrophobicContact CD1-CD2 4.23Å; L100-F120 HydrophobicContact CD1-CE2 3.79Å; L100-F120 HydrophobicContact CG-CE2 4.29Å; L100-F127 HydrophobicContact CD1-CE2 4Å; L100-F127 HydrophobicContact CD1-CZ 4.32Å; L100-I455 HydrophobicContact CD1-CB 4.07Å; L100-I455 HydrophobicContact CD1-CD1 3.74Å; L100-I455 HydrophobicContact CD1-CG2 4.08Å; L100-F457 HydrophobicContact CD1-CD2 4.48Å; L100-F457 HydrophobicContact CD2-CD2 4.24Å
101	V	94.9	Very high	88.8	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-38.5	176.6	173.3	0	0	0	0	111.8	L97 E98 H103 L104 L105 F120 L133 L136 M137	L97-V101 WeakPolarHBondContact O-CG2 3.39Å; L97-V101 PolarHBondContact O-N 3.36Å; E98-V101 PolarHBondContact O-N 2.8Å; V101-H103 VanDerWaalsContact C-N 3.32Å; V101-H103 PolarHBondContact O-N 3.4Å; V101-L104 PolarHBondContact O-N 2.88Å; V101-L105 HydrophobicContact CG1-CD1 4.05Å; V101-L105 WeakPolarHBondContact O-CB 3.21Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.36Å; V101-L105 VanDerWaalsContact O-N 3.09Å; V101-F120 HydrophobicContact CG2-CZ 4.41Å; V101-L133 HydrophobicContact CG2-CD1 3.66Å; V101-L136 HydrophobicContact CG1-CB 4.27Å; V101-L136 HydrophobicContact CG2-CB 4.11Å; V101-L136 HydrophobicContact CG2-CD1 4.36Å; V101-M137 HydrophobicContact CG1-CG 4.1Å
102	R	92.4	Very high	88	Confident	76 Å²	76	43.1 Å²	43.1	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-58.3	-42.8	170.6	-81.7	-178.5	-77.9	125.7	-11.9	111.9	D63 E98 A99 L105 D106	D63-R102 VanDerWaalsContact O-CZ 3.28Å; D63-R102 PolarHBondContact O-NH1 2.7Å; D63-R102 PolarHBondContact O-NH2 2.98Å; D63-R102 IonicContact OD2-CZ 2.71Å; D63-R102 IonicContact OD2-NE 2.8Å; D63-R102 IonicContact OD2-NH1 3.07Å; D63-R102 PolarHBondContact OD2-NH1 2.83Å; D63-R102 IonicContact OD2-NH2 2.77Å; D63-R102 PolarHBondContact OD2-NH2 2.99Å; E98-R102 WeakPolarHBondContact O-CB 3.31Å; E98-R102 WeakPolarHBondContact O-CG 3.39Å; E98-R102 PolarHBondContact O-N 2.97Å; E98-R102 PolarHBondContact O-NE 3.12Å; A99-R102 PolarHBondContact O-N 2.58Å; R102-L105 PolarHBondContact O-N 3.13Å; R102-D106 PolarHBondContact O-N 3.36Å
103	H	93.2	Very high	87.4	Confident	15 Å²	15	43.7 Å²	43.7	7%	0.069	24%	0.235	C	C	.	.	H	α-helix	trans	-70.8	-37.6	176.5	-170.8	46.1	0	0	0	112.7	F67 L92 A99 L100 V101 L105 D106 T109 F116	F67-H103 AromaticContact CE1-CE1 3.79Å; F67-H103 AromaticContact CE1-ND1 3.86Å; F67-H103 AromaticContact CE1-NE2 3.94Å; L92-H103 HydrophobicContact CD1-CB 3.74Å; L92-H103 VanDerWaalsContact CD1-CD2 3.45Å; L92-H103 WeakPolarHBondContact CD1-CD2 3.49Å; A99-H103 PolarHBondContact O-N 3.36Å; L100-H103 PolarHBondContact O-N 2.99Å; V101-H103 VanDerWaalsContact C-N 3.32Å; V101-H103 PolarHBondContact O-N 3.4Å; H103-L105 PolarHBondContact O-N 3.47Å; H103-D106 PolarHBondContact O-N 2.89Å; H103-T109 PolarHBondContact CE1-OG1 3.47Å; H103-T109 PolarHBondContact ND1-OG1 3.17Å; H103-T109 WeakPolarHBondContact O-CB 3.44Å; H103-T109 PolarHBondContact O-OG1 3.42Å; H103-F116 HydrophobicContact CB-CE1 4.3Å; H103-F116 HydrophobicContact CB-CZ 4.35Å; H103-F116 AromaticContact CD2-CD1 3.72Å; H103-F116 AromaticContact CD2-CD2 3.81Å; H103-F116 AromaticContact CD2-CE1 3.71Å; H103-F116 AromaticContact CD2-CE2 3.82Å; H103-F116 AromaticContact CD2-CG 3.78Å; H103-F116 AromaticContact CD2-CZ 3.77Å
104	L	93.6	Very high	86.8	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-31.9	175.7	-172.9	64.4	0	0	0	112.7	L100 V101 F116 M117 F120 V162	L100-L104 WeakPolarHBondContact O-CB 3.39Å; L100-L104 PolarHBondContact O-N 3.49Å; V101-L104 PolarHBondContact O-N 2.88Å; L104-F116 HydrophobicContact CB-CE1 3.98Å; L104-F116 HydrophobicContact CD1-CD1 4.37Å; L104-F116 HydrophobicContact CD1-CE1 4.12Å; L104-M117 HydrophobicContact CD1-CB 4.11Å; L104-M117 HydrophobicContact CD1-CG 4.03Å; L104-F120 HydrophobicContact CD1-CD1 4.25Å; L104-F120 HydrophobicContact CD2-CD1 3.76Å; L104-F120 HydrophobicContact CD2-CE1 3.64Å; L104-V162 HydrophobicContact CD1-CG1 4.16Å; L104-V162 HydrophobicContact CD1-CG2 4.19Å; L104-V162 HydrophobicContact CD2-CG1 3.9Å; L104-V162 HydrophobicContact CG-CG1 3.99Å; L104-V162 HydrophobicContact CG-CG2 4.13Å
105	L	91.5	Very high	86.4	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	2.8	-177.9	-67.1	179.6	0	0	0	114.3	V101 R102 H103 M137 R140 T155 V158 A159	V101-L105 HydrophobicContact CG1-CD1 4.05Å; V101-L105 WeakPolarHBondContact O-CB 3.21Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.36Å; V101-L105 VanDerWaalsContact O-N 3.09Å; R102-L105 PolarHBondContact O-N 3.13Å; H103-L105 PolarHBondContact O-N 3.47Å; L105-M137 HydrophobicContact CD1-CG 4.45Å; L105-M137 HydrophobicContact CD2-CE 4.01Å; L105-R140 HydrophobicContact CD1-CB 4.1Å; L105-R140 HydrophobicContact CD1-CG 3.89Å; L105-T155 HydrophobicContact CB-CG2 4.04Å; L105-T155 HydrophobicContact CD1-CG2 4.48Å; L105-V158 HydrophobicContact CD2-CG1 4.47Å; L105-A159 HydrophobicContact CD2-CB 3.71Å
106	D	87.9	Confident	86.3	Confident	53 Å²	53	45.8 Å²	45.8	28%	0.283	27%	0.271	S	S	.	.			trans	-82.5	122.9	172.6	-179	4.5	0	0	0	111.3	R102 H103 R108 T109	R102-D106 PolarHBondContact O-N 3.36Å; H103-D106 PolarHBondContact O-N 2.89Å; D106-R108 PolarHBondContact O-N 3.45Å; D106-R108 WeakPolarHBondContact OD1-CG 2.87Å; D106-R108 PolarHBondContact OD1-N 3.13Å; D106-T109 WeakPolarHBondContact O-CB 3.32Å; D106-T109 PolarHBondContact O-N 3.26Å; D106-T109 PolarHBondContact O-OG1 2.81Å
107	T	75.9	Confident	86.1	Confident	68 Å²	68	46.1 Å²	46.1	42%	0.417	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.3	-33.2	166.9	55.9	0	0	0	0	115.8	R154 V158	T107-R154 HydrophobicContact CG2-CB 3.81Å; T107-V158 HydrophobicContact CG2-CG2 3.95Å
108	R	76.3	Confident	86	Confident	183 Å²	183	46.8 Å²	46.8	69%	0.691	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.3	-176.1	-60.1	170.6	-179	-172.5	1.2	112.4	D106 S110 G111 T112	D106-R108 PolarHBondContact O-N 3.45Å; D106-R108 WeakPolarHBondContact OD1-CG 2.87Å; D106-R108 PolarHBondContact OD1-N 3.13Å; R108-S110 VanDerWaalsContact C-N 3.32Å; R108-S110 PolarHBondContact O-N 3.13Å; R108-G111 PolarHBondContact O-N 2.94Å; R108-T112 PolarHBondContact O-N 3.15Å; R108-T112 VanDerWaalsContact O-N 3.13Å; R108-T112 PolarHBondContact O-OG1 3.11Å
109	T	76.1	Confident	86	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-58.8	-41.6	-171.7	-57.9	0	0	0	0	112.5	H103 D106 G111 T112 D113 F116	H103-T109 PolarHBondContact CE1-OG1 3.47Å; H103-T109 PolarHBondContact ND1-OG1 3.17Å; H103-T109 WeakPolarHBondContact O-CB 3.44Å; H103-T109 PolarHBondContact O-OG1 3.42Å; D106-T109 WeakPolarHBondContact O-CB 3.32Å; D106-T109 PolarHBondContact O-N 3.26Å; D106-T109 PolarHBondContact O-OG1 2.81Å; T109-G111 PolarHBondContact O-N 2.88Å; T109-G111 VanDerWaalsContact O-N 3.12Å; T109-T112 PolarHBondContact O-N 3.23Å; T109-D113 CarbonylContact O-C 3.58Å; T109-D113 PolarHBondContact O-N 2.96Å; T109-F116 HydrophobicContact CG2-CB 4.18Å; T109-F116 HydrophobicContact CG2-CD1 3.86Å; T109-F116 HydrophobicContact CG2-CG 4.3Å
110	S	66.4	Low	86	Confident	91 Å²	91	42 Å²	42	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-59.6	-22.8	177.3	-55.3	0	0	0	0	113.9	R108	R108-S110 VanDerWaalsContact C-N 3.32Å; R108-S110 PolarHBondContact O-N 3.13Å
111	G	65.9	Low	86	Confident	73 Å²	73	42.1 Å²	42.1	75%	0.753	26%	0.255	S	S	*	.	H	α-helix	trans	-100.5	-22.8	177	0	0	0	0	0	115	R108 T109	R108-G111 PolarHBondContact O-N 2.94Å; T109-G111 PolarHBondContact O-N 2.88Å; T109-G111 VanDerWaalsContact O-N 3.12Å
112	T	73.6	Confident	86.1	Confident	65 Å²	65	42 Å²	42	40%	0.399	26%	0.255	S	S	.	.	H	α-helix	trans	-103.5	-31	-175.7	57.3	0	0	0	0	114.2	R108 T109	R108-T112 PolarHBondContact O-N 3.15Å; R108-T112 VanDerWaalsContact O-N 3.13Å; R108-T112 PolarHBondContact O-OG1 3.11Å; T109-T112 PolarHBondContact O-N 3.23Å
113	D	80.5	Confident	86.3	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.059	24%	0.241	C	C	.	.			trans	-141.6	60.3	-172	-163.4	-16.7	0	0	0	110.7	R91 L92 T109 T115 F116 R461	R91-D113 WeakPolarHBondContact CA-OD2 3.47Å; R91-D113 WeakPolarHBondContact CB-OD2 3.47Å; L92-D113 PolarHBondContact N-OD2 2.83Å; T109-D113 CarbonylContact O-C 3.58Å; T109-D113 PolarHBondContact O-N 2.96Å; D113-T115 PolarHBondContact O-N 2.79Å; D113-F116 HydrophobicContact CB-CB 4.13Å; D113-F116 VanDerWaalsContact O-CB 3.31Å; D113-F116 WeakPolarHBondContact O-CB 3.38Å; D113-F116 PolarHBondContact O-N 3.36Å; D113-F116 PolarHBondContact OD1-N 2.88Å; D113-R461 IonicContact OD1-CZ 3.44Å; D113-R461 IonicContact OD1-NH1 3.26Å; D113-R461 PolarHBondContact OD1-NH1 2.9Å; D113-R461 IonicContact OD1-NH2 3.66Å; D113-R461 PolarHBondContact OD1-NH2 2.81Å; D113-R461 IonicContact OD2-CZ 2.72Å; D113-R461 IonicContact OD2-NH1 3.77Å; D113-R461 PolarHBondContact OD2-NH1 3.46Å; D113-R461 IonicContact OD2-NH2 2.77Å; D113-R461 PolarHBondContact OD2-NH2 2.84Å
114	G	81.1	Confident	86.4	Confident	63 Å²	63	37.8 Å²	37.8	65%	0.649	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-3.2	-173.3	0	0	0	0	0	116.4
115	T	88.7	Confident	86.4	Confident	74 Å²	74	41.1 Å²	41.1	45%	0.454	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.1	170.8	61.8	0	0	0	0	113.5	D113 A119 R461	D113-T115 PolarHBondContact O-N 2.79Å; T115-A119 VanDerWaalsContact O-CB 3.23Å; T115-A119 WeakPolarHBondContact O-CB 3.37Å; T115-A119 PolarHBondContact O-N 2.76Å; T115-R461 PolarHBondContact OG1-NH1 2.76Å
116	F	94.1	Very high	86.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-53.4	-174.4	178.4	-98.6	0	0	0	112.5	L92 L100 H103 L104 T109 D113 S118 A119 F120 F457	L92-F116 HydrophobicContact CB-CD2 4.2Å; L92-F116 HydrophobicContact CB-CE2 4.16Å; L92-F116 HydrophobicContact CD1-CE2 4.19Å; L92-F116 HydrophobicContact CD1-CZ 4.45Å; L92-F116 HydrophobicContact CD2-CE2 4.18Å; L92-F116 HydrophobicContact CG-CE2 4.41Å; L100-F116 HydrophobicContact CB-CZ 4.34Å; L100-F116 HydrophobicContact CD2-CE2 4.08Å; L100-F116 HydrophobicContact CD2-CZ 4.14Å; H103-F116 HydrophobicContact CB-CE1 4.3Å; H103-F116 HydrophobicContact CB-CZ 4.35Å; H103-F116 AromaticContact CD2-CD1 3.72Å; H103-F116 AromaticContact CD2-CD2 3.81Å; H103-F116 AromaticContact CD2-CE1 3.71Å; H103-F116 AromaticContact CD2-CE2 3.82Å; H103-F116 AromaticContact CD2-CG 3.78Å; H103-F116 AromaticContact CD2-CZ 3.77Å; L104-F116 HydrophobicContact CB-CE1 3.98Å; L104-F116 HydrophobicContact CD1-CD1 4.37Å; L104-F116 HydrophobicContact CD1-CE1 4.12Å; T109-F116 HydrophobicContact CG2-CB 4.18Å; T109-F116 HydrophobicContact CG2-CD1 3.86Å; T109-F116 HydrophobicContact CG2-CG 4.3Å; D113-F116 HydrophobicContact CB-CB 4.13Å; D113-F116 VanDerWaalsContact O-CB 3.31Å; D113-F116 WeakPolarHBondContact O-CB 3.38Å; D113-F116 PolarHBondContact O-N 3.36Å; D113-F116 PolarHBondContact OD1-N 2.88Å; F116-S118 PolarHBondContact O-N 3.05Å; F116-A119 PolarHBondContact O-N 3.21Å; F116-F120 HydrophobicContact CE1-CB 4.41Å; F116-F120 HydrophobicContact CZ-CB 4.38Å; F116-F120 HydrophobicContact CZ-CD2 4.05Å; F116-F120 HydrophobicContact CZ-CG 4.4Å; F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 PolarHBondContact O-N 2.71Å; F116-F457 AromaticContact CD2-CD1 3.89Å; F116-F457 HydrophobicContact CD2-CD1 3.89Å; F116-F457 AromaticContact CD2-CE1 3.32Å; F116-F457 HydrophobicContact CD2-CE1 3.32Å; F116-F457 HydrophobicContact CD2-CE2 4.31Å; F116-F457 AromaticContact CD2-CZ 3.56Å; F116-F457 HydrophobicContact CD2-CZ 3.56Å; F116-F457 AromaticContact CE2-CD1 3.98Å; F116-F457 HydrophobicContact CE2-CD1 3.98Å; F116-F457 HydrophobicContact CE2-CD2 4.16Å; F116-F457 AromaticContact CE2-CE1 3.65Å; F116-F457 HydrophobicContact CE2-CE1 3.65Å; F116-F457 AromaticContact CE2-CE2 3.85Å; F116-F457 HydrophobicContact CE2-CE2 3.85Å; F116-F457 HydrophobicContact CE2-CG 4.23Å; F116-F457 AromaticContact CE2-CZ 3.58Å; F116-F457 HydrophobicContact CE2-CZ 3.58Å; F116-F457 HydrophobicContact CG-CE1 4.34Å; F116-F457 HydrophobicContact CG-CZ 4.44Å; F116-F457 HydrophobicContact CZ-CZ 4.48Å
117	M	93.7	Very high	86.8	Confident	48 Å²	48	42 Å²	42	24%	0.236	26%	0.257	C	S	.	.	H	α-helix	trans	-55.7	-53.9	-178.8	176.7	179.3	61.6	0	0	111.3	L104 A119 F120 L121 V162 T165	L104-M117 HydrophobicContact CD1-CB 4.11Å; L104-M117 HydrophobicContact CD1-CG 4.03Å; M117-A119 PolarHBondContact O-N 3.13Å; M117-F120 PolarHBondContact O-N 2.92Å; M117-L121 HydrophobicContact CG-CD1 3.79Å; M117-L121 HydrophobicContact CG-CG 4.37Å; M117-L121 WeakPolarHBondContact O-CB 3.06Å; M117-L121 VanDerWaalsContact O-CG 3.27Å; M117-L121 WeakPolarHBondContact O-CG 3.44Å; M117-L121 PolarHBondContact O-N 3.09Å; M117-V162 HydrophobicContact SD-CB 4.47Å; M117-V162 HydrophobicContact SD-CG2 3.92Å; M117-T165 HydrophobicContact CE-CG2 3.87Å; M117-T165 HydrophobicContact SD-CG2 4.32Å
118	S	93.4	Very high	87.8	Confident	44 Å²	44	40 Å²	40	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-39.4	-178.1	-51.5	0	0	0	0	112.5	F116 A122 F464	F116-S118 PolarHBondContact O-N 3.05Å; S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 2.96Å; S118-A122 VanDerWaalsContact O-N 3.07Å; S118-F464 WeakPolarHBondContact O-CE2 3.24Å
119	A	95.6	Very high	88.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-41	175.8	0	0	0	0	0	112.6	T115 F116 M117 T123 F457 F464	T115-A119 VanDerWaalsContact O-CB 3.23Å; T115-A119 WeakPolarHBondContact O-CB 3.37Å; T115-A119 PolarHBondContact O-N 2.76Å; F116-A119 PolarHBondContact O-N 3.21Å; M117-A119 PolarHBondContact O-N 3.13Å; A119-T123 WeakPolarHBondContact O-CB 3.32Å; A119-T123 WeakPolarHBondContact O-CG2 3.42Å; A119-T123 PolarHBondContact O-N 3.12Å; A119-T123 PolarHBondContact O-OG1 2.99Å; A119-F457 HydrophobicContact CB-CE1 4.16Å; A119-F457 HydrophobicContact CB-CZ 3.9Å; A119-F464 VanDerWaalsContact CA-CG 3.41Å; A119-F464 HydrophobicContact CB-CB 3.71Å; A119-F464 HydrophobicContact CB-CD1 3.58Å; A119-F464 HydrophobicContact CB-CD2 4.29Å; A119-F464 HydrophobicContact CB-CE1 4.26Å; A119-F464 HydrophobicContact CB-CG 3.59Å
120	F	96.6	Very high	89.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-55	179	-178.9	-89.4	0	0	0	110.2	L97 L100 V101 L104 F116 M117 A122 T123 H124 F127 L133 F457	L97-F120 HydrophobicContact CD1-CZ 4.39Å; L100-F120 HydrophobicContact CB-CD2 4.16Å; L100-F120 HydrophobicContact CB-CE2 3.57Å; L100-F120 HydrophobicContact CB-CZ 4.42Å; L100-F120 HydrophobicContact CD1-CD2 4.23Å; L100-F120 HydrophobicContact CD1-CE2 3.79Å; L100-F120 HydrophobicContact CG-CE2 4.29Å; V101-F120 HydrophobicContact CG2-CZ 4.41Å; L104-F120 HydrophobicContact CD1-CD1 4.25Å; L104-F120 HydrophobicContact CD2-CD1 3.76Å; L104-F120 HydrophobicContact CD2-CE1 3.64Å; F116-F120 HydrophobicContact CE1-CB 4.41Å; F116-F120 HydrophobicContact CZ-CB 4.38Å; F116-F120 HydrophobicContact CZ-CD2 4.05Å; F116-F120 HydrophobicContact CZ-CG 4.4Å; F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 PolarHBondContact O-N 2.71Å; M117-F120 PolarHBondContact O-N 2.92Å; F120-A122 VanDerWaalsContact C-N 3.31Å; F120-A122 PolarHBondContact O-N 2.92Å; F120-T123 PolarHBondContact O-N 3.5Å; F120-T123 VanDerWaalsContact O-N 3.15Å; F120-H124 WeakPolarHBondContact O-CB 3.32Å; F120-H124 PolarHBondContact O-N 3.02Å; F120-F127 HydrophobicContact CD2-CE2 4.44Å; F120-F127 AromaticContact CD2-CZ 3.89Å; F120-F127 HydrophobicContact CD2-CZ 3.89Å; F120-F127 AromaticContact CE2-CE2 3.8Å; F120-F127 HydrophobicContact CE2-CE2 3.8Å; F120-F127 AromaticContact CE2-CZ 3.71Å; F120-F127 HydrophobicContact CE2-CZ 3.71Å; F120-F127 HydrophobicContact CZ-CE2 4.37Å; F120-F127 HydrophobicContact CZ-CZ 4.43Å; F120-L133 HydrophobicContact CD1-CD2 4.47Å; F120-L133 HydrophobicContact CE1-CD1 3.58Å; F120-L133 HydrophobicContact CE1-CD2 3.57Å; F120-L133 HydrophobicContact CE1-CG 4.25Å; F120-L133 HydrophobicContact CZ-CD1 3.8Å; F120-L133 HydrophobicContact CZ-CD2 4.25Å; F120-F457 HydrophobicContact CB-CE2 3.98Å; F120-F457 HydrophobicContact CB-CZ 3.91Å; F120-F457 AromaticContact CD2-CE2 3.92Å; F120-F457 HydrophobicContact CD2-CE2 3.92Å; F120-F457 HydrophobicContact CG-CE2 4.45Å
121	L	95.6	Very high	90.6	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-57.2	-43	179.2	-65.1	176.6	0	0	0	111.7	M117 T123 H124 V162 W166	M117-L121 HydrophobicContact CG-CD1 3.79Å; M117-L121 HydrophobicContact CG-CG 4.37Å; M117-L121 WeakPolarHBondContact O-CB 3.06Å; M117-L121 VanDerWaalsContact O-CG 3.27Å; M117-L121 WeakPolarHBondContact O-CG 3.44Å; M117-L121 PolarHBondContact O-N 3.09Å; L121-T123 VanDerWaalsContact C-N 3.32Å; L121-T123 PolarHBondContact O-N 3.44Å; L121-H124 PolarHBondContact O-ND1 2.82Å; L121-V162 HydrophobicContact CD2-CG1 4.34Å; L121-W166 HydrophobicContact CD1-CB 3.84Å; L121-W166 HydrophobicContact CD1-CG 4.28Å; L121-W166 HydrophobicContact CD2-CB 3.96Å; L121-W166 HydrophobicContact CD2-CD2 3.64Å; L121-W166 HydrophobicContact CD2-CE3 3.91Å; L121-W166 HydrophobicContact CD2-CG 3.66Å; L121-W166 HydrophobicContact CG-CB 4.47Å; L121-W166 HydrophobicContact CG-CG 4.42Å
122	A	95.7	Very high	92	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-73.4	-16	-179.2	0	0	0	0	0	116	S118 F120 H170 F464 L467	S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 2.96Å; S118-A122 VanDerWaalsContact O-N 3.07Å; F120-A122 VanDerWaalsContact C-N 3.31Å; F120-A122 PolarHBondContact O-N 2.92Å; A122-H170 WeakPolarHBondContact CA-CE1 3.1Å; A122-F464 HydrophobicContact CB-CD2 3.72Å; A122-F464 HydrophobicContact CB-CE2 4.1Å; A122-L467 HydrophobicContact CB-CD1 4.43Å; A122-L467 WeakPolarHBondContact O-CD1 3.22Å
123	T	96.9	Very high	93	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-120.1	-5.6	-176.9	63.4	0	0	0	0	114.5	A119 F120 L121 R125 A126 F127 L268 R460 E463 F464	A119-T123 WeakPolarHBondContact O-CB 3.32Å; A119-T123 WeakPolarHBondContact O-CG2 3.42Å; A119-T123 PolarHBondContact O-N 3.12Å; A119-T123 PolarHBondContact O-OG1 2.99Å; F120-T123 PolarHBondContact O-N 3.5Å; F120-T123 VanDerWaalsContact O-N 3.15Å; L121-T123 VanDerWaalsContact C-N 3.32Å; L121-T123 PolarHBondContact O-N 3.44Å; T123-R125 VanDerWaalsContact C-N 3.27Å; T123-R125 PolarHBondContact O-N 2.65Å; T123-R125 VanDerWaalsContact O-N 3.14Å; T123-A126 WeakPolarHBondContact O-CB 3.47Å; T123-A126 PolarHBondContact O-N 2.72Å; T123-F127 WeakPolarHBondContact O-CE1 3.49Å; T123-L268 HydrophobicContact CG2-CD2 4.42Å; T123-R460 HydrophobicContact CG2-CB 4.46Å; T123-E463 HydrophobicContact CG2-CB 4.15Å; T123-F464 HydrophobicContact CG2-CB 4.36Å
124	H	96.1	Very high	93.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-53.7	-39.6	-174.4	81.3	-80.9	0	0	0	113.4	F120 L121 A126 F127 T128 T130 L133 W166 D173	F120-H124 WeakPolarHBondContact O-CB 3.32Å; F120-H124 PolarHBondContact O-N 3.02Å; L121-H124 PolarHBondContact O-ND1 2.82Å; H124-A126 PolarHBondContact O-N 2.9Å; H124-F127 HydrophobicContact CB-CZ 4.23Å; H124-F127 PolarHBondContact O-N 3.27Å; H124-T128 HydrophobicContact CB-CG2 3.91Å; H124-T128 PolarHBondContact O-N 3.26Å; H124-T130 PolarHBondContact NE2-OG1 3.04Å; H124-L133 HydrophobicContact CB-CD2 4.08Å; H124-W166 AromaticContact CE1-CE2 3.99Å; H124-W166 AromaticContact CE1-CZ2 3.55Å; H124-W166 AromaticContact CE1-NE1 3.94Å; H124-W166 AromaticContact NE2-CZ2 3.6Å; H124-D173 IonicContact CE1-OD1 2.7Å; H124-D173 IonicContact CE1-OD2 3.04Å; H124-D173 PolarHBondContact CE1-OD2 3.29Å
125	R	93.6	Very high	94.1	Very high	76 Å²	76	23 Å²	23	29%	0.287	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-61	-5.9	176.9	-72.8	-158.7	179.8	-110.8	-4.4	115.4	T123 T128 T130 D173 E177	T123-R125 VanDerWaalsContact C-N 3.27Å; T123-R125 PolarHBondContact O-N 2.65Å; T123-R125 VanDerWaalsContact O-N 3.14Å; R125-T128 WeakPolarHBondContact CA-O 3.34Å; R125-T130 PolarHBondContact NE-OG1 3.01Å; R125-T130 PolarHBondContact NH2-OG1 2.88Å; R125-D173 IonicContact CZ-OD1 2.69Å; R125-D173 IonicContact NE-OD1 2.65Å; R125-D173 PolarHBondContact NE-OD1 3.32Å; R125-D173 PolarHBondContact NH2-O 3.24Å; R125-D173 VanDerWaalsContact NH2-O 3.12Å; R125-D173 IonicContact NH2-OD1 3.09Å; R125-E177 IonicContact CZ-OE1 2.69Å; R125-E177 IonicContact NH1-OE1 3.38Å; R125-E177 PolarHBondContact NH1-OE1 2.86Å; R125-E177 IonicContact NH2-OE1 3.74Å; R125-E177 PolarHBondContact NH2-OE1 3.44Å
126	A	93	Very high	94.3	Very high	30 Å²	30	21.2 Å²	21.2	25%	0.248	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-92	-10.1	171.1	0	0	0	0	0	114.4	T123 H124 L268	T123-A126 WeakPolarHBondContact O-CB 3.47Å; T123-A126 PolarHBondContact O-N 2.72Å; H124-A126 PolarHBondContact O-N 2.9Å; A126-L268 HydrophobicContact CB-CD1 3.99Å
127	F	94.7	Very high	94.2	Very high	44 Å²	44	21.3 Å²	21.3	19%	0.193	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.2	-7.3	-178.7	61.5	-95.8	0	0	0	115	L97 L100 F120 T123 H124 I455 R460	L97-F127 HydrophobicContact CD1-CD2 4.16Å; L97-F127 HydrophobicContact CD1-CE2 3.86Å; L100-F127 HydrophobicContact CD1-CE2 4Å; L100-F127 HydrophobicContact CD1-CZ 4.32Å; F120-F127 HydrophobicContact CD2-CE2 4.44Å; F120-F127 AromaticContact CD2-CZ 3.89Å; F120-F127 HydrophobicContact CD2-CZ 3.89Å; F120-F127 AromaticContact CE2-CE2 3.8Å; F120-F127 HydrophobicContact CE2-CE2 3.8Å; F120-F127 AromaticContact CE2-CZ 3.71Å; F120-F127 HydrophobicContact CE2-CZ 3.71Å; F120-F127 HydrophobicContact CZ-CE2 4.37Å; F120-F127 HydrophobicContact CZ-CZ 4.43Å; T123-F127 WeakPolarHBondContact O-CE1 3.49Å; H124-F127 HydrophobicContact CB-CZ 4.23Å; H124-F127 PolarHBondContact O-N 3.27Å; F127-I455 HydrophobicContact CB-CG2 4.4Å; F127-I455 HydrophobicContact CD1-CG2 4.33Å; F127-I455 HydrophobicContact CD2-CD1 3.76Å; F127-I455 HydrophobicContact CD2-CG1 4.49Å; F127-I455 HydrophobicContact CD2-CG2 4.1Å; F127-I455 HydrophobicContact CE2-CD1 4.2Å; F127-I455 HydrophobicContact CE2-CG2 4.43Å; F127-I455 HydrophobicContact CG-CG2 4.03Å; F127-R460 HydrophobicContact CD1-CG 4.31Å; F127-R460 HydrophobicContact CE1-CG 3.95Å
128	T	95.6	Very high	94.1	Very high	27 Å²	27	19.1 Å²	19.1	17%	0.166	12%	0.115	C	C	.	.	S	Bend	trans	-154	179.3	173.4	-169.7	0	0	0	0	110	L97 H124 R125 L133	L97-T128 HydrophobicContact CD1-CG2 3.97Å; L97-T128 HydrophobicContact CD2-CG2 4.43Å; L97-T128 WeakPolarHBondContact CD2-OG1 3.38Å; H124-T128 HydrophobicContact CB-CG2 3.91Å; H124-T128 PolarHBondContact O-N 3.26Å; R125-T128 WeakPolarHBondContact CA-O 3.34Å; T128-L133 HydrophobicContact CG2-CB 4.42Å
129	S	93.7	Very high	94	Very high	54 Å²	54	20.3 Å²	20.3	38%	0.378	12%	0.118	S	C	.	.			trans	-110.3	155.3	174.4	70.5	0	0	0	0	111.6	A132 L133	S129-A132 PolarHBondContact O-N 3.09Å; S129-A132 VanDerWaalsContact O-N 3.16Å; S129-A132 WeakPolarHBondContact OG-CB 3.26Å; S129-A132 PolarHBondContact OG-N 2.88Å; S129-L133 PolarHBondContact O-N 3.01Å
130	T	92.7	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-54.3	-45.1	175.5	-59.7	0	0	0	0	112.5	H124 R125 A132 L133 L134 W166 D173	H124-T130 PolarHBondContact NE2-OG1 3.04Å; R125-T130 PolarHBondContact NE-OG1 3.01Å; R125-T130 PolarHBondContact NH2-OG1 2.88Å; T130-A132 PolarHBondContact O-N 3.01Å; T130-L133 PolarHBondContact O-N 2.65Å; T130-L134 HydrophobicContact CG2-CD1 3.94Å; T130-L134 HydrophobicContact CG2-CG 4.48Å; T130-L134 WeakPolarHBondContact O-CG 3.45Å; T130-L134 PolarHBondContact O-N 2.89Å; T130-W166 HydrophobicContact CG2-CH2 3.75Å; T130-W166 HydrophobicContact CG2-CZ2 3.59Å; T130-D173 HydrophobicContact CG2-CB 4.15Å; T130-D173 WeakPolarHBondContact CG2-O 3.22Å
131	P	92.3	Very high	93.3	Very high	26 Å²	26	24 Å²	24	17%	0.169	13%	0.132	C	C	.	.	H	α-helix	trans	-66.5	-34.9	176.3	-22.3	35.6	0	0	0	114	G135 E177	P131-G135 PolarHBondContact O-N 3.48Å; P131-E177 HydrophobicContact CG-CB 4.02Å; P131-E177 HydrophobicContact CG-CG 3.98Å; P131-E177 VanDerWaalsContact CG-O 3.26Å; P131-E177 WeakPolarHBondContact CG-O 3.21Å
132	A	94.1	Very high	93	Very high	40 Å²	40	27.3 Å²	27.3	33%	0.331	15%	0.147	S	C	.	.	H	α-helix	trans	-68.4	-40.4	177	0	0	0	0	0	111.8	S129 T130 G135 L136	S129-A132 PolarHBondContact O-N 3.09Å; S129-A132 VanDerWaalsContact O-N 3.16Å; S129-A132 WeakPolarHBondContact OG-CB 3.26Å; S129-A132 PolarHBondContact OG-N 2.88Å; T130-A132 PolarHBondContact O-N 3.01Å; A132-G135 PolarHBondContact O-N 3.25Å; A132-L136 PolarHBondContact O-N 3.36Å
133	L	94.8	Very high	92.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-47	174.3	172.7	53	0	0	0	111.9	V101 F120 H124 T128 S129 T130 G135 L136 M137 W166	V101-L133 HydrophobicContact CG2-CD1 3.66Å; F120-L133 HydrophobicContact CD1-CD2 4.47Å; F120-L133 HydrophobicContact CE1-CD1 3.58Å; F120-L133 HydrophobicContact CE1-CD2 3.57Å; F120-L133 HydrophobicContact CE1-CG 4.25Å; F120-L133 HydrophobicContact CZ-CD1 3.8Å; F120-L133 HydrophobicContact CZ-CD2 4.25Å; H124-L133 HydrophobicContact CB-CD2 4.08Å; T128-L133 HydrophobicContact CG2-CB 4.42Å; S129-L133 PolarHBondContact O-N 3.01Å; T130-L133 PolarHBondContact O-N 2.65Å; L133-G135 VanDerWaalsContact C-N 3.29Å; L133-G135 PolarHBondContact O-N 3.49Å; L133-L136 PolarHBondContact O-N 2.77Å; L133-M137 HydrophobicContact CD1-CG 4.28Å; L133-M137 HydrophobicContact CD1-SD 4.23Å; L133-M137 HydrophobicContact CG-SD 4.42Å; L133-M137 WeakPolarHBondContact O-CG 3.22Å; L133-M137 PolarHBondContact O-N 3.48Å; L133-W166 HydrophobicContact CB-CH2 4.12Å; L133-W166 HydrophobicContact CD2-CH2 3.39Å; L133-W166 HydrophobicContact CD2-CZ2 3.93Å; L133-W166 HydrophobicContact CD2-CZ3 3.74Å; L133-W166 HydrophobicContact CG-CH2 3.68Å; L133-W166 HydrophobicContact CG-CZ3 3.84Å
134	L	92.1	Very high	92.1	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-38.9	174.8	-70.9	169.3	0	0	0	112	T130 M137 A138 L163 W166 F174 A178 Q181	T130-L134 HydrophobicContact CG2-CD1 3.94Å; T130-L134 HydrophobicContact CG2-CG 4.48Å; T130-L134 WeakPolarHBondContact O-CG 3.45Å; T130-L134 PolarHBondContact O-N 2.89Å; L134-M137 PolarHBondContact O-N 3.16Å; L134-A138 PolarHBondContact O-N 2.99Å; L134-L163 HydrophobicContact CD2-CD2 3.6Å; L134-W166 HydrophobicContact CD2-CE3 4.42Å; L134-W166 HydrophobicContact CD2-CH2 4.22Å; L134-W166 HydrophobicContact CD2-CZ3 3.65Å; L134-W166 HydrophobicContact CG-CH2 4.03Å; L134-W166 HydrophobicContact CG-CZ3 3.97Å; L134-F174 HydrophobicContact CD1-CE1 4.39Å; L134-F174 HydrophobicContact CD2-CE1 4.37Å; L134-A178 HydrophobicContact CD1-CB 3.75Å; L134-Q181 HydrophobicContact CB-CB 3.78Å; L134-Q181 HydrophobicContact CB-CG 4.46Å
135	G	92.6	Very high	91.4	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-57.6	-52.2	173.4	0	0	0	0	0	112.5	P131 A132 L133 M137 A138 D139	P131-G135 PolarHBondContact O-N 3.48Å; A132-G135 PolarHBondContact O-N 3.25Å; L133-G135 VanDerWaalsContact C-N 3.29Å; L133-G135 PolarHBondContact O-N 3.49Å; G135-M137 VanDerWaalsContact C-N 3.29Å; G135-M137 PolarHBondContact O-N 2.83Å; G135-A138 CarbonylContact O-C 3.4Å; G135-A138 WeakPolarHBondContact O-CB 3.41Å; G135-A138 PolarHBondContact O-N 2.84Å; G135-A138 VanDerWaalsContact O-N 3.09Å; G135-D139 PolarHBondContact O-N 3.23Å
136	L	94	Very high	90.8	Very high	36 Å²	36	34.9 Å²	34.9	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-30	179.1	-71.6	173.5	0	0	0	113.6	L97 E98 V101 A132 L133 R140	L97-L136 HydrophobicContact CB-CD1 4.35Å; L97-L136 HydrophobicContact CD2-CD1 3.47Å; L97-L136 VanDerWaalsContact CD2-CD1 3.47Å; L97-L136 HydrophobicContact CG-CD1 3.54Å; E98-L136 HydrophobicContact CG-CD2 4.27Å; V101-L136 HydrophobicContact CG1-CB 4.27Å; V101-L136 HydrophobicContact CG2-CB 4.11Å; V101-L136 HydrophobicContact CG2-CD1 4.36Å; A132-L136 PolarHBondContact O-N 3.36Å; L133-L136 PolarHBondContact O-N 2.77Å; L136-R140 WeakPolarHBondContact O-CB 3.29Å; L136-R140 PolarHBondContact O-N 3.01Å
137	M	92.5	Very high	90	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-42.5	171.7	-68.7	176.3	76.1	0	0	111.2	V101 L105 L133 L134 G135 L141 V162 L163 W166	V101-M137 HydrophobicContact CG1-CG 4.1Å; L105-M137 HydrophobicContact CD1-CG 4.45Å; L105-M137 HydrophobicContact CD2-CE 4.01Å; L133-M137 HydrophobicContact CD1-CG 4.28Å; L133-M137 HydrophobicContact CD1-SD 4.23Å; L133-M137 HydrophobicContact CG-SD 4.42Å; L133-M137 WeakPolarHBondContact O-CG 3.22Å; L133-M137 PolarHBondContact O-N 3.48Å; L134-M137 PolarHBondContact O-N 3.16Å; G135-M137 VanDerWaalsContact C-N 3.29Å; G135-M137 PolarHBondContact O-N 2.83Å; M137-L141 WeakPolarHBondContact O-CG 3.39Å; M137-L141 PolarHBondContact O-N 2.77Å; M137-L141 VanDerWaalsContact O-N 3.16Å; M137-V162 HydrophobicContact CE-CB 4.21Å; M137-V162 HydrophobicContact CE-CG1 3.76Å; M137-L163 HydrophobicContact CE-CD1 4.44Å; M137-L163 HydrophobicContact CE-CD2 4.15Å; M137-L163 HydrophobicContact CE-CG 3.94Å; M137-L163 HydrophobicContact SD-CD2 4.42Å; M137-W166 HydrophobicContact SD-CZ3 4.25Å
138	A	90.1	Very high	89.2	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-45.4	173.8	0	0	0	0	0	112	L134 G135 R140 L141 E142 R184	L134-A138 PolarHBondContact O-N 2.99Å; G135-A138 CarbonylContact O-C 3.4Å; G135-A138 WeakPolarHBondContact O-CB 3.41Å; G135-A138 PolarHBondContact O-N 2.84Å; G135-A138 VanDerWaalsContact O-N 3.09Å; A138-R140 VanDerWaalsContact C-N 3.27Å; A138-R140 PolarHBondContact O-N 2.78Å; A138-L141 PolarHBondContact O-N 2.83Å; A138-L141 VanDerWaalsContact O-N 3.09Å; A138-E142 WeakPolarHBondContact O-CG 3.42Å; A138-E142 PolarHBondContact O-N 2.78Å; A138-R184 HydrophobicContact CB-CG 4.32Å
139	D	91.6	Very high	88.2	Confident	70 Å²	70	43.1 Å²	43.1	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-56	-40.8	176.7	-61.9	-31.1	0	0	0	111.7	G135 A143 R184	G135-D139 PolarHBondContact O-N 3.23Å; D139-A143 VanDerWaalsContact O-CB 3.29Å; D139-A143 WeakPolarHBondContact O-CB 3.28Å; D139-A143 PolarHBondContact O-N 2.67Å; D139-R184 IonicContact OD1-CZ 3.53Å; D139-R184 IonicContact OD1-NH1 3.17Å; D139-R184 PolarHBondContact OD1-NH1 3.43Å; D139-R184 IonicContact OD1-NH2 3.28Å; D139-R184 PolarHBondContact OD1-NH2 3.41Å
140	R	89.4	Confident	87.6	Confident	76 Å²	76	41.5 Å²	41.5	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-71	-34.2	178	179.9	56.4	-175.9	164.4	6.8	112.8	L105 L136 A138 L144	L105-R140 HydrophobicContact CD1-CB 4.1Å; L105-R140 HydrophobicContact CD1-CG 3.89Å; L136-R140 WeakPolarHBondContact O-CB 3.29Å; L136-R140 PolarHBondContact O-N 3.01Å; A138-R140 VanDerWaalsContact C-N 3.27Å; A138-R140 PolarHBondContact O-N 2.78Å; R140-L144 WeakPolarHBondContact O-CG 3.45Å
141	L	88.4	Confident	87.1	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-72.2	-47.1	176.7	-74	170.2	0	0	0	111.5	M137 A138 A143 L144 E145 T155 A159 L185 F188	M137-L141 WeakPolarHBondContact O-CG 3.39Å; M137-L141 PolarHBondContact O-N 2.77Å; M137-L141 VanDerWaalsContact O-N 3.16Å; A138-L141 PolarHBondContact O-N 2.83Å; A138-L141 VanDerWaalsContact O-N 3.09Å; L141-A143 VanDerWaalsContact C-N 3.35Å; L141-A143 PolarHBondContact O-N 2.84Å; L141-L144 PolarHBondContact O-N 3.28Å; L141-L144 VanDerWaalsContact O-N 3.08Å; L141-E145 PolarHBondContact O-N 2.87Å; L141-T155 HydrophobicContact CD2-CG2 4.04Å; L141-A159 HydrophobicContact CD1-CB 4.03Å; L141-A159 HydrophobicContact CD2-CB 4.3Å; L141-L185 HydrophobicContact CD1-CD1 3.73Å; L141-F188 HydrophobicContact CB-CD1 4.35Å; L141-F188 HydrophobicContact CB-CD2 4.47Å; L141-F188 HydrophobicContact CB-CE1 3.87Å; L141-F188 HydrophobicContact CB-CE2 3.98Å; L141-F188 HydrophobicContact CB-CZ 3.67Å; L141-F188 HydrophobicContact CD1-CD1 4.27Å; L141-F188 HydrophobicContact CD1-CE1 4.04Å; L141-F188 HydrophobicContact CD2-CE1 4.22Å; L141-F188 HydrophobicContact CD2-CZ 4.31Å; L141-F188 HydrophobicContact CG-CE1 4.27Å; L141-F188 HydrophobicContact CG-CZ 4.42Å
142	E	89.1	Confident	86.7	Confident	72 Å²	72	44.7 Å²	44.7	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-40.3	176.7	-72	174	-161.2	0	0	111.9	A138 L144 E145 R184 F188	A138-E142 WeakPolarHBondContact O-CG 3.42Å; A138-E142 PolarHBondContact O-N 2.78Å; E142-L144 PolarHBondContact O-N 3.43Å; E142-E145 WeakPolarHBondContact O-CB 3.25Å; E142-E145 PolarHBondContact O-N 2.92Å; E142-E145 VanDerWaalsContact O-N 3.08Å; E142-R184 IonicContact OE1-CZ 3.86Å; E142-R184 IonicContact OE1-NE 2.69Å; E142-R184 PolarHBondContact OE1-NE 3.07Å; E142-R184 IonicContact OE1-NH2 2.8Å; E142-R184 PolarHBondContact OE1-NH2 3.07Å; E142-R184 IonicContact OE2-CZ 3.97Å; E142-R184 IonicContact OE2-NE 2.87Å; E142-R184 IonicContact OE2-NH2 2.92Å; E142-R184 PolarHBondContact OE2-NH2 3.04Å; E142-F188 HydrophobicContact CG-CD2 4.12Å
143	A	88.6	Confident	86.2	Confident	52 Å²	52	46.9 Å²	46.9	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-30	175	0	0	0	0	0	113.2	D139 L141 S146 H147	D139-A143 VanDerWaalsContact O-CB 3.29Å; D139-A143 WeakPolarHBondContact O-CB 3.28Å; D139-A143 PolarHBondContact O-N 2.67Å; L141-A143 VanDerWaalsContact C-N 3.35Å; L141-A143 PolarHBondContact O-N 2.84Å; A143-S146 PolarHBondContact O-OG 3.18Å; A143-H147 PolarHBondContact O-ND1 3.21Å
144	L	86.1	Confident	85.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-84.8	-5	179	-69.8	171.4	0	0	0	113.7	R140 L141 E142 S146 H147 E151 L152 T155	R140-L144 WeakPolarHBondContact O-CG 3.45Å; L141-L144 PolarHBondContact O-N 3.28Å; L141-L144 VanDerWaalsContact O-N 3.08Å; E142-L144 PolarHBondContact O-N 3.43Å; L144-S146 PolarHBondContact O-N 3.37Å; L144-S146 VanDerWaalsContact O-N 3.15Å; L144-H147 HydrophobicContact CD2-CB 3.97Å; L144-H147 WeakPolarHBondContact O-CB 3.36Å; L144-H147 PolarHBondContact O-N 2.85Å; L144-E151 HydrophobicContact CD2-CG 4.48Å; L144-L152 HydrophobicContact CB-CD1 3.67Å; L144-T155 HydrophobicContact CD1-CG2 3.71Å
145	E	81.8	Confident	85.6	Confident	87 Å²	87	53.7 Å²	53.7	41%	0.407	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-59.1	-25.7	170.7	-69.1	-174	-162.1	0	0	112.5	L141 E142 F188	L141-E145 PolarHBondContact O-N 2.87Å; E142-E145 WeakPolarHBondContact O-CB 3.25Å; E142-E145 PolarHBondContact O-N 2.92Å; E142-E145 VanDerWaalsContact O-N 3.08Å; E145-F188 HydrophobicContact CG-CE2 3.89Å; E145-F188 WeakPolarHBondContact OE1-CD2 3.17Å; E145-F188 WeakPolarHBondContact OE1-CE2 3.3Å
146	S	78.9	Confident	85.4	Confident	98 Å²	98	53.5 Å²	53.5	69%	0.685	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-82	-8.7	176.8	64.8	0	0	0	0	114.6	A143 L144	A143-S146 PolarHBondContact O-OG 3.18Å; L144-S146 PolarHBondContact O-N 3.37Å; L144-S146 VanDerWaalsContact O-N 3.15Å
147	H	77.7	Confident	85	Confident	81 Å²	81	57.9 Å²	57.9	38%	0.375	31%	0.305	S	S	.	.	S	Bend	trans	-98	164.2	-172.3	-74.6	53.8	0	0	0	111.3	A143 L144 T149 E151	A143-H147 PolarHBondContact O-ND1 3.21Å; L144-H147 HydrophobicContact CD2-CB 3.97Å; L144-H147 WeakPolarHBondContact O-CB 3.36Å; L144-H147 PolarHBondContact O-N 2.85Å; H147-T149 PolarHBondContact O-N 3.49Å; H147-E151 IonicContact CD2-OE2 3.1Å
148	P	77.8	Confident	84.8	Confident	94 Å²	94	58.6 Å²	58.6	61%	0.61	31%	0.309	S	S	*	.			trans	-54.8	133.4	175.7	21.7	-34.9	0	0	0	111.8	G150 E151	P148-G150 PolarHBondContact O-N 3.4Å; P148-E151 PolarHBondContact O-N 3.41Å
149	T	74.2	Confident	84.8	Confident	100 Å²	100	58.7 Å²	58.7	61%	0.613	31%	0.31	S	S	*	.	H	α-helix	trans	-50	-37.9	-171.1	36.7	0	0	0	0	114.4	H147 E151 L152 E153	H147-T149 PolarHBondContact O-N 3.49Å; T149-E151 VanDerWaalsContact C-N 3.25Å; T149-E151 PolarHBondContact O-N 2.97Å; T149-L152 WeakPolarHBondContact O-CB 3.35Å; T149-L152 PolarHBondContact O-N 3.43Å; T149-E153 WeakPolarHBondContact O-CB 3.42Å; T149-E153 VanDerWaalsContact O-CG 3.28Å; T149-E153 WeakPolarHBondContact O-CG 3.29Å; T149-E153 PolarHBondContact O-N 2.82Å
150	G	80.1	Confident	84.5	Confident	19 Å²	19	56.8 Å²	56.8	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-18.9	178.5	0	0	0	0	0	115.5	P148 E153 R154	P148-G150 PolarHBondContact O-N 3.4Å; G150-E153 WeakPolarHBondContact CA-OE2 3.26Å; G150-R154 VanDerWaalsContact C-NH1 3.35Å; G150-R154 WeakPolarHBondContact O-CD 3.33Å; G150-R154 VanDerWaalsContact O-CG 3.32Å; G150-R154 WeakPolarHBondContact O-CG 3.45Å; G150-R154 PolarHBondContact O-NH1 2.63Å
151	E	82.6	Confident	84.5	Confident	79 Å²	79	56.2 Å²	56.2	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-80	-46.3	170.4	-168.1	172.9	167.8	0	0	110	L144 H147 P148 T149 E153 R154 T155	L144-E151 HydrophobicContact CD2-CG 4.48Å; H147-E151 IonicContact CD2-OE2 3.1Å; P148-E151 PolarHBondContact O-N 3.41Å; T149-E151 VanDerWaalsContact C-N 3.25Å; T149-E151 PolarHBondContact O-N 2.97Å; E151-E153 PolarHBondContact O-N 3.13Å; E151-R154 PolarHBondContact O-N 2.83Å; E151-T155 PolarHBondContact O-N 2.79Å; E151-T155 PolarHBondContact O-OG1 3.25Å
152	L	84.9	Confident	84.7	Confident	14 Å²	14	56.4 Å²	56.4	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-57.1	-45.3	175.2	-174.5	65	0	0	0	112.5	L144 T149 T155 T156 F188	L144-L152 HydrophobicContact CB-CD1 3.67Å; T149-L152 WeakPolarHBondContact O-CB 3.35Å; T149-L152 PolarHBondContact O-N 3.43Å; L152-T155 PolarHBondContact O-N 2.83Å; L152-T156 VanDerWaalsContact O-CB 3.28Å; L152-T156 WeakPolarHBondContact O-CB 3.33Å; L152-T156 PolarHBondContact O-N 2.87Å; L152-T156 PolarHBondContact O-OG1 2.82Å; L152-F188 HydrophobicContact CD1-CZ 3.96Å
153	E	84.2	Confident	84.7	Confident	86 Å²	86	53.1 Å²	53.1	40%	0.402	29%	0.293	S	S	.	.	H	α-helix	trans	-51.6	-56.9	174	-76.9	163.7	-170.9	0	0	110.9	T149 G150 E151 T155 T156 E157 Y194	T149-E153 WeakPolarHBondContact O-CB 3.42Å; T149-E153 VanDerWaalsContact O-CG 3.28Å; T149-E153 WeakPolarHBondContact O-CG 3.29Å; T149-E153 PolarHBondContact O-N 2.82Å; G150-E153 WeakPolarHBondContact CA-OE2 3.26Å; E151-E153 PolarHBondContact O-N 3.13Å; E153-T155 PolarHBondContact O-N 2.8Å; E153-T156 PolarHBondContact O-N 2.85Å; E153-E157 WeakPolarHBondContact O-CG 3.45Å; E153-E157 PolarHBondContact O-N 2.79Å; E153-Y194 VanDerWaalsContact CA-OH 3.26Å; E153-Y194 WeakPolarHBondContact CA-OH 3.07Å; E153-Y194 HydrophobicContact CG-CE1 4.35Å; E153-Y194 WeakPolarHBondContact CG-OH 3.34Å
154	R	85.9	Confident	84.7	Confident	142 Å²	142	52.9 Å²	52.9	54%	0.536	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-42.2	-176.4	-69.1	175.9	-176.7	104.1	-0.8	112.7	T107 G150 E151 T156 E157 V158	T107-R154 HydrophobicContact CG2-CB 3.81Å; G150-R154 VanDerWaalsContact C-NH1 3.35Å; G150-R154 WeakPolarHBondContact O-CD 3.33Å; G150-R154 VanDerWaalsContact O-CG 3.32Å; G150-R154 WeakPolarHBondContact O-CG 3.45Å; G150-R154 PolarHBondContact O-NH1 2.63Å; E151-R154 PolarHBondContact O-N 2.83Å; R154-T156 VanDerWaalsContact C-N 3.3Å; R154-T156 PolarHBondContact O-N 2.87Å; R154-E157 PolarHBondContact O-N 2.69Å; R154-V158 WeakPolarHBondContact O-CG2 3.36Å; R154-V158 PolarHBondContact O-N 3.14Å; R154-V158 VanDerWaalsContact O-N 3.08Å
155	T	88.2	Confident	84.9	Confident	13 Å²	13	55.1 Å²	55.1	8%	0.08	30%	0.302	C	S	.	.	H	α-helix	trans	-67.4	-33.8	177.3	-56.6	0	0	0	0	111.6	L105 L141 L144 E151 L152 E153 V158 A159	L105-T155 HydrophobicContact CB-CG2 4.04Å; L105-T155 HydrophobicContact CD1-CG2 4.48Å; L141-T155 HydrophobicContact CD2-CG2 4.04Å; L144-T155 HydrophobicContact CD1-CG2 3.71Å; E151-T155 PolarHBondContact O-N 2.79Å; E151-T155 PolarHBondContact O-OG1 3.25Å; L152-T155 PolarHBondContact O-N 2.83Å; E153-T155 PolarHBondContact O-N 2.8Å; T155-V158 PolarHBondContact O-N 3.42Å; T155-A159 WeakPolarHBondContact O-CB 3.19Å; T155-A159 PolarHBondContact O-N 3.15Å
156	T	87.1	Confident	85.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.7	-42.6	175.6	-55.3	0	0	0	0	111.6	L152 E153 R154 V158 A159 I160 F188 L189 Y194	L152-T156 VanDerWaalsContact O-CB 3.28Å; L152-T156 WeakPolarHBondContact O-CB 3.33Å; L152-T156 PolarHBondContact O-N 2.87Å; L152-T156 PolarHBondContact O-OG1 2.82Å; E153-T156 PolarHBondContact O-N 2.85Å; R154-T156 VanDerWaalsContact C-N 3.3Å; R154-T156 PolarHBondContact O-N 2.87Å; T156-V158 PolarHBondContact O-N 2.83Å; T156-A159 PolarHBondContact O-N 3.3Å; T156-I160 HydrophobicContact CG2-CD1 4.03Å; T156-I160 WeakPolarHBondContact O-CG1 3.33Å; T156-I160 PolarHBondContact O-N 3.35Å; T156-F188 HydrophobicContact CG2-CE1 4.39Å; T156-L189 HydrophobicContact CG2-CD2 3.6Å; T156-Y194 HydrophobicContact CG2-CD1 4.39Å; T156-Y194 HydrophobicContact CG2-CD2 3.83Å; T156-Y194 HydrophobicContact CG2-CE2 4.02Å; T156-Y194 HydrophobicContact CG2-CG 4.04Å
157	E	85.8	Confident	85.9	Confident	127 Å²	127	47.2 Å²	47.2	59%	0.593	26%	0.255	S	S	*	.	H	α-helix	trans	-59.2	-44.6	173.4	-72.4	178.9	161.7	0	0	112.1	E153 R154 I160 S161	E153-E157 WeakPolarHBondContact O-CG 3.45Å; E153-E157 PolarHBondContact O-N 2.79Å; R154-E157 PolarHBondContact O-N 2.69Å; E157-I160 PolarHBondContact O-N 3.45Å; E157-S161 PolarHBondContact O-N 3.17Å
158	V	89.1	Confident	86.4	Confident	19 Å²	19	47.5 Å²	47.5	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-42.9	175.4	177.1	0	0	0	0	111.1	L105 T107 R154 T155 T156 I160 S161 V162	L105-V158 HydrophobicContact CD2-CG1 4.47Å; T107-V158 HydrophobicContact CG2-CG2 3.95Å; R154-V158 WeakPolarHBondContact O-CG2 3.36Å; R154-V158 PolarHBondContact O-N 3.14Å; R154-V158 VanDerWaalsContact O-N 3.08Å; T155-V158 PolarHBondContact O-N 3.42Å; T156-V158 PolarHBondContact O-N 2.83Å; V158-I160 PolarHBondContact O-N 3.35Å; V158-S161 WeakPolarHBondContact O-CB 3.36Å; V158-S161 PolarHBondContact O-N 3.08Å; V158-S161 VanDerWaalsContact O-N 3.15Å; V158-V162 HydrophobicContact CG1-CG2 4.19Å; V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 3.49Å
159	A	89.3	Confident	86.9	Confident	2 Å²	2	45 Å²	45	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-45	176.7	0	0	0	0	0	112.2	L105 L141 T155 T156 S161 V162 L163	L105-A159 HydrophobicContact CD2-CB 3.71Å; L141-A159 HydrophobicContact CD1-CB 4.03Å; L141-A159 HydrophobicContact CD2-CB 4.3Å; T155-A159 WeakPolarHBondContact O-CB 3.19Å; T155-A159 PolarHBondContact O-N 3.15Å; T156-A159 PolarHBondContact O-N 3.3Å; A159-S161 VanDerWaalsContact C-N 3.32Å; A159-S161 PolarHBondContact O-N 3.44Å; A159-V162 PolarHBondContact O-N 3.27Å; A159-L163 WeakPolarHBondContact O-CB 3.1Å; A159-L163 WeakPolarHBondContact O-CD1 3.37Å; A159-L163 VanDerWaalsContact O-CG 3.23Å; A159-L163 WeakPolarHBondContact O-CG 3.46Å; A159-L163 PolarHBondContact O-N 2.96Å
160	I	86.1	Confident	87.7	Confident	30 Å²	30	40.5 Å²	40.5	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-40.4	175.5	-68.7	165	0	0	0	110.9	T156 E157 V158 S164 L189 L207	T156-I160 HydrophobicContact CG2-CD1 4.03Å; T156-I160 WeakPolarHBondContact O-CG1 3.33Å; T156-I160 PolarHBondContact O-N 3.35Å; E157-I160 PolarHBondContact O-N 3.45Å; V158-I160 PolarHBondContact O-N 3.35Å; I160-S164 VanDerWaalsContact O-CB 3.28Å; I160-S164 WeakPolarHBondContact O-CB 3.47Å; I160-S164 PolarHBondContact O-N 3.22Å; I160-S164 PolarHBondContact O-OG 2.79Å; I160-L189 HydrophobicContact CD1-CD2 4.14Å; I160-L189 HydrophobicContact CG1-CD2 4.41Å; I160-L207 HydrophobicContact CG2-CD2 4.01Å
161	S	88.9	Confident	88.1	Confident	65 Å²	65	40.7 Å²	40.7	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-65.1	-45.6	176.5	-171.8	0	0	0	0	112.7	E157 V158 A159 S164 T165	E157-S161 PolarHBondContact O-N 3.17Å; V158-S161 WeakPolarHBondContact O-CB 3.36Å; V158-S161 PolarHBondContact O-N 3.08Å; V158-S161 VanDerWaalsContact O-N 3.15Å; A159-S161 VanDerWaalsContact C-N 3.32Å; A159-S161 PolarHBondContact O-N 3.44Å; S161-S164 PolarHBondContact O-N 3.48Å; S161-T165 WeakPolarHBondContact O-CB 3.26Å; S161-T165 PolarHBondContact O-N 3.07Å; S161-T165 PolarHBondContact O-OG1 2.88Å
162	V	91.4	Very high	88.3	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-48.7	176.1	169.7	0	0	0	0	110.5	L104 M117 L121 M137 V158 A159 T165 W166	L104-V162 HydrophobicContact CD1-CG1 4.16Å; L104-V162 HydrophobicContact CD1-CG2 4.19Å; L104-V162 HydrophobicContact CD2-CG1 3.9Å; L104-V162 HydrophobicContact CG-CG1 3.99Å; L104-V162 HydrophobicContact CG-CG2 4.13Å; M117-V162 HydrophobicContact SD-CB 4.47Å; M117-V162 HydrophobicContact SD-CG2 3.92Å; L121-V162 HydrophobicContact CD2-CG1 4.34Å; M137-V162 HydrophobicContact CE-CB 4.21Å; M137-V162 HydrophobicContact CE-CG1 3.76Å; V158-V162 HydrophobicContact CG1-CG2 4.19Å; V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 3.49Å; A159-V162 PolarHBondContact O-N 3.27Å; V162-T165 PolarHBondContact O-N 3.47Å; V162-W166 VanDerWaalsContact O-CB 3.28Å; V162-W166 WeakPolarHBondContact O-CB 3.28Å; V162-W166 PolarHBondContact O-N 3.27Å
163	L	90.1	Very high	88.4	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-38.4	179.8	-70.9	163.9	0	0	0	112.8	L134 M137 A159 W166 L167 L185 L207	L134-L163 HydrophobicContact CD2-CD2 3.6Å; M137-L163 HydrophobicContact CE-CD1 4.44Å; M137-L163 HydrophobicContact CE-CD2 4.15Å; M137-L163 HydrophobicContact CE-CG 3.94Å; M137-L163 HydrophobicContact SD-CD2 4.42Å; A159-L163 WeakPolarHBondContact O-CB 3.1Å; A159-L163 WeakPolarHBondContact O-CD1 3.37Å; A159-L163 VanDerWaalsContact O-CG 3.23Å; A159-L163 WeakPolarHBondContact O-CG 3.46Å; A159-L163 PolarHBondContact O-N 2.96Å; L163-W166 HydrophobicContact CD2-CE3 4.08Å; L163-W166 HydrophobicContact CD2-CZ3 4.42Å; L163-W166 PolarHBondContact O-N 3.27Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.21Å; L163-L185 HydrophobicContact CD1-CD2 3.39Å; L163-L207 HydrophobicContact CB-CD2 3.94Å
164	S	88.8	Confident	88.6	Confident	48 Å²	48	37.5 Å²	37.5	34%	0.336	21%	0.21	S	C	.	.	H	α-helix	trans	-63	-44.5	174.2	-59.6	0	0	0	0	111.2	I160 S161 A168	I160-S164 VanDerWaalsContact O-CB 3.28Å; I160-S164 WeakPolarHBondContact O-CB 3.47Å; I160-S164 PolarHBondContact O-N 3.22Å; I160-S164 PolarHBondContact O-OG 2.79Å; S161-S164 PolarHBondContact O-N 3.48Å; S164-A168 VanDerWaalsContact O-CB 3.22Å; S164-A168 WeakPolarHBondContact O-CB 3.39Å; S164-A168 PolarHBondContact O-N 3.48Å
165	T	90.7	Very high	88.4	Confident	46 Å²	46	32 Å²	32	28%	0.282	20%	0.198	S	C	.	.	H	α-helix	trans	-65.5	-41.1	176.6	-54.6	0	0	0	0	111.3	M117 S161 V162 A168 S169	M117-T165 HydrophobicContact CE-CG2 3.87Å; M117-T165 HydrophobicContact SD-CG2 4.32Å; S161-T165 WeakPolarHBondContact O-CB 3.26Å; S161-T165 PolarHBondContact O-N 3.07Å; S161-T165 PolarHBondContact O-OG1 2.88Å; V162-T165 PolarHBondContact O-N 3.47Å; T165-A168 PolarHBondContact O-N 2.82Å; T165-S169 WeakPolarHBondContact O-CB 3.17Å; T165-S169 PolarHBondContact O-N 2.88Å; T165-S169 VanDerWaalsContact O-N 3.08Å; T165-S169 PolarHBondContact O-OG 3.05Å
166	W	92.4	Very high	88	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-50.9	178.1	-169.4	5.4	0	0	0	111.2	L121 H124 T130 L133 L134 M137 V162 L163 A168 S169 H170 D173 F174	L121-W166 HydrophobicContact CD1-CB 3.84Å; L121-W166 HydrophobicContact CD1-CG 4.28Å; L121-W166 HydrophobicContact CD2-CB 3.96Å; L121-W166 HydrophobicContact CD2-CD2 3.64Å; L121-W166 HydrophobicContact CD2-CE3 3.91Å; L121-W166 HydrophobicContact CD2-CG 3.66Å; L121-W166 HydrophobicContact CG-CB 4.47Å; L121-W166 HydrophobicContact CG-CG 4.42Å; H124-W166 AromaticContact CE1-CE2 3.99Å; H124-W166 AromaticContact CE1-CZ2 3.55Å; H124-W166 AromaticContact CE1-NE1 3.94Å; H124-W166 AromaticContact NE2-CZ2 3.6Å; T130-W166 HydrophobicContact CG2-CH2 3.75Å; T130-W166 HydrophobicContact CG2-CZ2 3.59Å; L133-W166 HydrophobicContact CB-CH2 4.12Å; L133-W166 HydrophobicContact CD2-CH2 3.39Å; L133-W166 HydrophobicContact CD2-CZ2 3.93Å; L133-W166 HydrophobicContact CD2-CZ3 3.74Å; L133-W166 HydrophobicContact CG-CH2 3.68Å; L133-W166 HydrophobicContact CG-CZ3 3.84Å; L134-W166 HydrophobicContact CD2-CE3 4.42Å; L134-W166 HydrophobicContact CD2-CH2 4.22Å; L134-W166 HydrophobicContact CD2-CZ3 3.65Å; L134-W166 HydrophobicContact CG-CH2 4.03Å; L134-W166 HydrophobicContact CG-CZ3 3.97Å; M137-W166 HydrophobicContact SD-CZ3 4.25Å; V162-W166 VanDerWaalsContact O-CB 3.28Å; V162-W166 WeakPolarHBondContact O-CB 3.28Å; V162-W166 PolarHBondContact O-N 3.27Å; L163-W166 HydrophobicContact CD2-CE3 4.08Å; L163-W166 HydrophobicContact CD2-CZ3 4.42Å; L163-W166 PolarHBondContact O-N 3.27Å; W166-A168 VanDerWaalsContact C-N 3.34Å; W166-A168 PolarHBondContact O-N 2.97Å; W166-S169 PolarHBondContact O-N 2.68Å; W166-H170 CarbonylContact O-C 3.49Å; W166-H170 WeakPolarHBondContact O-CA 3.28Å; W166-H170 PolarHBondContact O-N 3.44Å; W166-D173 HydrophobicContact CZ2-CB 4.44Å; W166-D173 PolarHBondContact NE1-OD2 3.49Å; W166-F174 HydrophobicContact CB-CE2 4.4Å; W166-F174 HydrophobicContact CB-CZ 4.15Å; W166-F174 AromaticContact CD1-CE2 3.85Å; W166-F174 HydrophobicContact CD2-CE1 4.48Å; W166-F174 HydrophobicContact CD2-CE2 4.08Å; W166-F174 AromaticContact CD2-CZ 3.54Å; W166-F174 HydrophobicContact CD2-CZ 3.54Å; W166-F174 AromaticContact CE2-CZ 3.9Å; W166-F174 AromaticContact CE3-CZ 3.9Å; W166-F174 HydrophobicContact CE3-CZ 3.9Å; W166-F174 AromaticContact CG-CE2 3.86Å; W166-F174 HydrophobicContact CG-CE2 3.86Å; W166-F174 AromaticContact CG-CZ 3.67Å; W166-F174 HydrophobicContact CG-CZ 3.67Å; W166-F174 HydrophobicContact CZ2-CZ 4.5Å; W166-F174 HydrophobicContact CZ3-CZ 4.5Å
167	L	89.6	Confident	87.8	Confident	19 Å²	19	41.1 Å²	41.1	10%	0.099	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-38.5	176.7	178.9	62.7	0	0	0	112.8	L163 S169 P171 F174 L207 N210 L211 R214	L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.21Å; L167-S169 VanDerWaalsContact C-N 3.3Å; L167-S169 PolarHBondContact O-N 2.92Å; L167-P171 HydrophobicContact CD1-CB 4.34Å; L167-P171 WeakPolarHBondContact O-CB 3.31Å; L167-P171 WeakPolarHBondContact O-CD 3.34Å; L167-F174 HydrophobicContact CB-CE2 4.15Å; L167-F174 HydrophobicContact CD1-CD2 3.86Å; L167-F174 HydrophobicContact CD1-CE2 4.28Å; L167-F174 HydrophobicContact CD1-CG 4.32Å; L167-L207 HydrophobicContact CD2-CD1 4.11Å; L167-N210 HydrophobicContact CD2-CB 3.67Å; L167-L211 HydrophobicContact CB-CD2 4.22Å; L167-L211 HydrophobicContact CD1-CD2 4.1Å; L167-L211 HydrophobicContact CD2-CD2 3.89Å; L167-L211 HydrophobicContact CD2-CG 3.95Å; L167-L211 HydrophobicContact CG-CD2 4.29Å; L167-R214 HydrophobicContact CD1-CG 4.06Å
168	A	88.1	Confident	87.6	Confident	87 Å²	87	35 Å²	35	72%	0.719	22%	0.222	S	C	*	.	H	α-helix	trans	-70	-25.6	179.6	0	0	0	0	0	113.4	S164 T165 W166	S164-A168 VanDerWaalsContact O-CB 3.22Å; S164-A168 WeakPolarHBondContact O-CB 3.39Å; S164-A168 PolarHBondContact O-N 3.48Å; T165-A168 PolarHBondContact O-N 2.82Å; W166-A168 VanDerWaalsContact C-N 3.34Å; W166-A168 PolarHBondContact O-N 2.97Å
169	S	87.8	Confident	87.3	Confident	41 Å²	41	37.5 Å²	37.5	29%	0.287	23%	0.231	S	C	.	.	H	α-helix	trans	-116.4	-14	-173.6	65.4	0	0	0	0	115.2	T165 W166 L167 R471	T165-S169 WeakPolarHBondContact O-CB 3.17Å; T165-S169 PolarHBondContact O-N 2.88Å; T165-S169 VanDerWaalsContact O-N 3.08Å; T165-S169 PolarHBondContact O-OG 3.05Å; W166-S169 PolarHBondContact O-N 2.68Å; L167-S169 VanDerWaalsContact C-N 3.3Å; L167-S169 PolarHBondContact O-N 2.92Å; S169-R471 VanDerWaalsContact O-CZ 3.24Å; S169-R471 PolarHBondContact O-NH1 3.14Å; S169-R471 VanDerWaalsContact O-NH1 3.13Å; S169-R471 PolarHBondContact O-NH2 2.96Å
170	H	90.2	Very high	87.1	Confident	6 Å²	6	40 Å²	40	3%	0.028	26%	0.257	C	S	.	.			trans	-141.6	58	172.2	-52.3	-100.8	0	0	0	111	A122 W166 E172 D173 R471	A122-H170 WeakPolarHBondContact CA-CE1 3.1Å; W166-H170 CarbonylContact O-C 3.49Å; W166-H170 WeakPolarHBondContact O-CA 3.28Å; W166-H170 PolarHBondContact O-N 3.44Å; H170-E172 VanDerWaalsContact C-OE2 3.28Å; H170-E172 WeakPolarHBondContact CA-OE2 3.44Å; H170-E172 PolarHBondContact O-N 2.83Å; H170-D173 WeakPolarHBondContact CB-OD2 3.26Å; H170-D173 IonicContact CG-OD2 3.97Å; H170-D173 PolarHBondContact O-N 3.19Å; H170-D173 VanDerWaalsContact O-N 3.11Å; H170-R471 PolarHBondContact CE1-NH1 3.25Å; H170-R471 PolarHBondContact CE1-NH2 3.14Å; H170-R471 PolarHBondContact ND1-NH2 2.98Å; H170-R471 VanDerWaalsContact ND1-NH2 3.12Å; H170-R471 PolarHBondContact NE2-NH1 2.9Å
171	P	88.5	Confident	87	Confident	23 Å²	23	41.1 Å²	41.1	15%	0.149	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-62.5	-13.7	-178.6	26.7	-34.2	0	0	0	113.8	L167 D173	L167-P171 HydrophobicContact CD1-CB 4.34Å; L167-P171 WeakPolarHBondContact O-CB 3.31Å; L167-P171 WeakPolarHBondContact O-CD 3.34Å; P171-D173 VanDerWaalsContact C-N 3.32Å
172	E	86.2	Confident	86.7	Confident	100 Å²	100	38.5 Å²	38.5	47%	0.467	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-77	-16.8	178.1	-46.4	77.5	-164	0	0	112.9	H170 F174 I263	H170-E172 VanDerWaalsContact C-OE2 3.28Å; H170-E172 WeakPolarHBondContact CA-OE2 3.44Å; H170-E172 PolarHBondContact O-N 2.83Å; E172-F174 VanDerWaalsContact C-N 3.31Å; E172-I263 HydrophobicContact CB-CD1 3.89Å; E172-I263 HydrophobicContact CB-CG1 4.42Å; E172-I263 HydrophobicContact CG-CD1 3.88Å; E172-I263 HydrophobicContact CG-CG1 4.04Å
173	D	88.5	Confident	86.4	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.032	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-72.3	-25.3	178.2	-76.5	-33.9	0	0	0	112.7	H124 R125 T130 W166 H170 P171 G175	H124-D173 IonicContact CE1-OD1 2.7Å; H124-D173 IonicContact CE1-OD2 3.04Å; H124-D173 PolarHBondContact CE1-OD2 3.29Å; R125-D173 IonicContact CZ-OD1 2.69Å; R125-D173 IonicContact NE-OD1 2.65Å; R125-D173 PolarHBondContact NE-OD1 3.32Å; R125-D173 PolarHBondContact NH2-O 3.24Å; R125-D173 VanDerWaalsContact NH2-O 3.12Å; R125-D173 IonicContact NH2-OD1 3.09Å; T130-D173 HydrophobicContact CG2-CB 4.15Å; T130-D173 WeakPolarHBondContact CG2-O 3.22Å; W166-D173 HydrophobicContact CZ2-CB 4.44Å; W166-D173 PolarHBondContact NE1-OD2 3.49Å; H170-D173 WeakPolarHBondContact CB-OD2 3.26Å; H170-D173 IonicContact CG-OD2 3.97Å; H170-D173 PolarHBondContact O-N 3.19Å; H170-D173 VanDerWaalsContact O-N 3.11Å; P171-D173 VanDerWaalsContact C-N 3.32Å; D173-G175 VanDerWaalsContact C-N 3.32Å; D173-G175 PolarHBondContact O-N 3Å; D173-G175 VanDerWaalsContact O-N 3.09Å
174	F	87.1	Confident	86.2	Confident	6 Å²	6	44 Å²	44	3%	0.026	27%	0.267	C	S	.	.			trans	-90	55	-169.1	-64.7	-85.9	0	0	0	113.2	L134 W166 L167 E172 L211 R214	L134-F174 HydrophobicContact CD1-CE1 4.39Å; L134-F174 HydrophobicContact CD2-CE1 4.37Å; W166-F174 HydrophobicContact CB-CE2 4.4Å; W166-F174 HydrophobicContact CB-CZ 4.15Å; W166-F174 AromaticContact CD1-CE2 3.85Å; W166-F174 HydrophobicContact CD2-CE1 4.48Å; W166-F174 HydrophobicContact CD2-CE2 4.08Å; W166-F174 AromaticContact CD2-CZ 3.54Å; W166-F174 HydrophobicContact CD2-CZ 3.54Å; W166-F174 AromaticContact CE2-CZ 3.9Å; W166-F174 AromaticContact CE3-CZ 3.9Å; W166-F174 HydrophobicContact CE3-CZ 3.9Å; W166-F174 AromaticContact CG-CE2 3.86Å; W166-F174 HydrophobicContact CG-CE2 3.86Å; W166-F174 AromaticContact CG-CZ 3.67Å; W166-F174 HydrophobicContact CG-CZ 3.67Å; W166-F174 HydrophobicContact CZ2-CZ 4.5Å; W166-F174 HydrophobicContact CZ3-CZ 4.5Å; L167-F174 HydrophobicContact CB-CE2 4.15Å; L167-F174 HydrophobicContact CD1-CD2 3.86Å; L167-F174 HydrophobicContact CD1-CE2 4.28Å; L167-F174 HydrophobicContact CD1-CG 4.32Å; E172-F174 VanDerWaalsContact C-N 3.31Å; F174-L211 HydrophobicContact CD1-CD2 3.45Å; F174-L211 VanDerWaalsContact CD1-CD2 3.45Å; F174-L211 HydrophobicContact CD2-CD2 4.49Å; F174-L211 HydrophobicContact CE1-CD2 3.48Å; F174-L211 VanDerWaalsContact CE1-CD2 3.48Å; F174-L211 HydrophobicContact CG-CD2 3.98Å; F174-L211 HydrophobicContact CZ-CD2 4.05Å; F174-R214 HydrophobicContact CB-CB 3.97Å; F174-R214 CarbonylContact O-C 3.32Å; F174-R214 VanDerWaalsContact O-C 3.32Å; F174-R214 WeakPolarHBondContact O-CB 3.27Å
175	G	81.6	Confident	85.9	Confident	28 Å²	28	42.1 Å²	42.1	29%	0.289	25%	0.253	S	S	.	.	S	Bend	trans	-77.5	-179.3	173.9	0	0	0	0	0	113.8	D173 E177 A178	D173-G175 VanDerWaalsContact C-N 3.32Å; D173-G175 PolarHBondContact O-N 3Å; D173-G175 VanDerWaalsContact O-N 3.09Å; G175-E177 PolarHBondContact O-N 3.09Å; G175-E177 VanDerWaalsContact O-N 3.1Å; G175-A178 WeakPolarHBondContact O-CB 3.48Å; G175-A178 PolarHBondContact O-N 3.29Å
176	S	80.8	Confident	85.5	Confident	98 Å²	98	41.5 Å²	41.5	69%	0.685	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-58	-23.6	177	55	0	0	0	0	113.9	A178 K179	S176-A178 PolarHBondContact O-N 3.33Å; S176-K179 VanDerWaalsContact O-CB 3.32Å; S176-K179 WeakPolarHBondContact O-CB 3.49Å; S176-K179 PolarHBondContact O-N 2.99Å; S176-K179 VanDerWaalsContact O-N 3.15Å
177	E	81.9	Confident	85.2	Confident	105 Å²	105	44.9 Å²	44.9	49%	0.491	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-58.1	-27.4	171.7	62.5	177.9	-171.6	0	0	113.6	R125 P131 G175	R125-E177 IonicContact CZ-OE1 2.69Å; R125-E177 IonicContact NH1-OE1 3.38Å; R125-E177 PolarHBondContact NH1-OE1 2.86Å; R125-E177 IonicContact NH2-OE1 3.74Å; R125-E177 PolarHBondContact NH2-OE1 3.44Å; P131-E177 HydrophobicContact CG-CB 4.02Å; P131-E177 HydrophobicContact CG-CG 3.98Å; P131-E177 VanDerWaalsContact CG-O 3.26Å; P131-E177 WeakPolarHBondContact CG-O 3.21Å; G175-E177 PolarHBondContact O-N 3.09Å; G175-E177 VanDerWaalsContact O-N 3.1Å
178	A	82.3	Confident	84.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-82.5	-11	179.6	0	0	0	0	0	113.8	L134 G175 S176 G180 Q181 L182 V215	L134-A178 HydrophobicContact CD1-CB 3.75Å; G175-A178 WeakPolarHBondContact O-CB 3.48Å; G175-A178 PolarHBondContact O-N 3.29Å; S176-A178 PolarHBondContact O-N 3.33Å; A178-G180 PolarHBondContact O-N 3.08Å; A178-Q181 PolarHBondContact O-N 2.98Å; A178-Q181 VanDerWaalsContact O-N 3.14Å; A178-L182 PolarHBondContact O-N 3.08Å; A178-V215 HydrophobicContact CB-CG2 4.48Å
179	K	83.7	Confident	84.3	Confident	70 Å²	70	40.4 Å²	40.4	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-54	-54	-163.1	-172.8	162.3	-168.2	167.8	0	114.6	S176 Q181 L182 D183 V215 D216	S176-K179 VanDerWaalsContact O-CB 3.32Å; S176-K179 WeakPolarHBondContact O-CB 3.49Å; S176-K179 PolarHBondContact O-N 2.99Å; S176-K179 VanDerWaalsContact O-N 3.15Å; K179-Q181 PolarHBondContact O-N 3.15Å; K179-L182 WeakPolarHBondContact O-CB 3.38Å; K179-L182 PolarHBondContact O-N 3.19Å; K179-L182 VanDerWaalsContact O-N 3.08Å; K179-D183 WeakPolarHBondContact CG-OD2 3.38Å; K179-D183 PolarHBondContact O-N 2.79Å; K179-V215 HydrophobicContact CB-CG1 3.48Å; K179-V215 VanDerWaalsContact CB-CG1 3.48Å; K179-V215 HydrophobicContact CD-CG1 3.95Å; K179-V215 HydrophobicContact CG-CG1 3.67Å; K179-D216 IonicContact NZ-OD1 3Å; K179-D216 PolarHBondContact NZ-OD1 3.46Å; K179-D216 IonicContact NZ-OD2 3.93Å; K179-D216 PolarHBondContact NZ-OD2 3.04Å
180	G	84.3	Confident	83.8	Confident	54 Å²	54	43.5 Å²	43.5	56%	0.557	25%	0.247	S	C	*	.	H	α-helix	trans	-62.8	-28.2	-176.4	0	0	0	0	0	114.2	A178 R184	A178-G180 PolarHBondContact O-N 3.08Å; G180-R184 WeakPolarHBondContact O-CB 3.39Å; G180-R184 PolarHBondContact O-N 3.24Å
181	Q	84.3	Confident	83.2	Confident	55 Å²	55	50 Å²	50	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-83.5	-29.9	175.9	-59.2	-68.9	5.2	0	0	111.8	L134 A178 K179 L185	L134-Q181 HydrophobicContact CB-CB 3.78Å; L134-Q181 HydrophobicContact CB-CG 4.46Å; A178-Q181 PolarHBondContact O-N 2.98Å; A178-Q181 VanDerWaalsContact O-N 3.14Å; K179-Q181 PolarHBondContact O-N 3.15Å; Q181-L185 WeakPolarHBondContact O-CB 3.48Å; Q181-L185 PolarHBondContact O-N 3.43Å
182	L	82.3	Confident	82.4	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.052	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-47.2	169.5	179.1	62.2	0	0	0	111.4	A178 K179 R184 L185 E186 I208 L211 R212 V215	A178-L182 PolarHBondContact O-N 3.08Å; K179-L182 WeakPolarHBondContact O-CB 3.38Å; K179-L182 PolarHBondContact O-N 3.19Å; K179-L182 VanDerWaalsContact O-N 3.08Å; L182-R184 VanDerWaalsContact C-N 3.28Å; L182-R184 PolarHBondContact O-N 3.34Å; L182-L185 PolarHBondContact O-N 2.88Å; L182-E186 WeakPolarHBondContact O-CB 3.34Å; L182-E186 PolarHBondContact O-N 2.96Å; L182-I208 HydrophobicContact CD1-CD1 4.11Å; L182-L211 HydrophobicContact CD1-CB 3.76Å; L182-L211 HydrophobicContact CD1-CD1 3.64Å; L182-L211 HydrophobicContact CD1-CG 4.23Å; L182-L211 HydrophobicContact CD2-CB 3.81Å; L182-L211 HydrophobicContact CG-CB 4.47Å; L182-R212 HydrophobicContact CD2-CG 4.36Å; L182-V215 HydrophobicContact CD2-CB 4.16Å; L182-V215 HydrophobicContact CD2-CG2 3.71Å
183	D	85.1	Confident	81.4	Confident	54 Å²	54	47.5 Å²	47.5	29%	0.289	27%	0.274	S	S	.	.	H	α-helix	trans	-61.3	-37	177.1	-72.4	-45.3	0	0	0	111.3	K179 S187 R212	K179-D183 WeakPolarHBondContact CG-OD2 3.38Å; K179-D183 PolarHBondContact O-N 2.79Å; D183-S187 WeakPolarHBondContact O-CB 3.4Å; D183-S187 PolarHBondContact O-N 3.4Å; D183-S187 PolarHBondContact O-OG 3.22Å; D183-R212 IonicContact OD1-CZ 2.78Å; D183-R212 IonicContact OD1-NH1 2.71Å; D183-R212 IonicContact OD1-NH2 3.48Å; D183-R212 PolarHBondContact OD1-NH2 3.01Å
184	R	87.3	Confident	80.2	Confident	67 Å²	67	49.7 Å²	49.7	25%	0.253	28%	0.283	S	S	.	.	H	α-helix	trans	-63.1	-51.7	172.7	-177.8	-175.8	-179.1	-164.4	2.8	112	A138 D139 E142 G180 L182 E186 S187 F188	A138-R184 HydrophobicContact CB-CG 4.32Å; D139-R184 IonicContact OD1-CZ 3.53Å; D139-R184 IonicContact OD1-NH1 3.17Å; D139-R184 PolarHBondContact OD1-NH1 3.43Å; D139-R184 IonicContact OD1-NH2 3.28Å; D139-R184 PolarHBondContact OD1-NH2 3.41Å; E142-R184 IonicContact OE1-CZ 3.86Å; E142-R184 IonicContact OE1-NE 2.69Å; E142-R184 PolarHBondContact OE1-NE 3.07Å; E142-R184 IonicContact OE1-NH2 2.8Å; E142-R184 PolarHBondContact OE1-NH2 3.07Å; E142-R184 IonicContact OE2-CZ 3.97Å; E142-R184 IonicContact OE2-NE 2.87Å; E142-R184 IonicContact OE2-NH2 2.92Å; E142-R184 PolarHBondContact OE2-NH2 3.04Å; G180-R184 WeakPolarHBondContact O-CB 3.39Å; G180-R184 PolarHBondContact O-N 3.24Å; L182-R184 VanDerWaalsContact C-N 3.28Å; L182-R184 PolarHBondContact O-N 3.34Å; R184-E186 VanDerWaalsContact C-N 3.35Å; R184-E186 PolarHBondContact O-N 3.33Å; R184-S187 WeakPolarHBondContact O-CB 3.29Å; R184-S187 PolarHBondContact O-N 2.84Å; R184-F188 PolarHBondContact O-N 2.79Å
185	L	81.8	Confident	78.6	Confident	9 Å²	9	51 Å²	51	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-41.1	179	180	74.1	0	0	0	112.3	L141 L163 Q181 L182 F188 L189	L141-L185 HydrophobicContact CD1-CD1 3.73Å; L163-L185 HydrophobicContact CD1-CD2 3.39Å; Q181-L185 WeakPolarHBondContact O-CB 3.48Å; Q181-L185 PolarHBondContact O-N 3.43Å; L182-L185 PolarHBondContact O-N 2.88Å; L185-F188 WeakPolarHBondContact O-CB 3.43Å; L185-F188 PolarHBondContact O-N 3.49Å; L185-L189 HydrophobicContact CG-CD1 4.17Å; L185-L189 WeakPolarHBondContact O-CG 3.39Å; L185-L189 PolarHBondContact O-N 2.81Å
186	E	82.7	Confident	77	Confident	34 Å²	34	53.3 Å²	53.3	16%	0.159	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-43	175.5	-174.8	174.6	165.7	0	0	111.3	L182 R184 F188 L189 L190 I208 R212	L182-E186 WeakPolarHBondContact O-CB 3.34Å; L182-E186 PolarHBondContact O-N 2.96Å; R184-E186 VanDerWaalsContact C-N 3.35Å; R184-E186 PolarHBondContact O-N 3.33Å; E186-F188 VanDerWaalsContact C-N 3.33Å; E186-F188 PolarHBondContact O-N 2.95Å; E186-L189 PolarHBondContact O-N 3.31Å; E186-L190 HydrophobicContact CG-CD1 3.98Å; E186-L190 WeakPolarHBondContact O-CB 3.36Å; E186-L190 VanDerWaalsContact O-CG 3.3Å; E186-L190 WeakPolarHBondContact O-CG 3.39Å; E186-L190 PolarHBondContact O-N 3.06Å; E186-I208 HydrophobicContact CB-CD1 4Å; E186-I208 HydrophobicContact CG-CD1 4.24Å; E186-I208 HydrophobicContact CG-CG1 4.4Å; E186-I208 HydrophobicContact CG-CG2 3.8Å; E186-I208 WeakPolarHBondContact OE2-CG2 3.27Å; E186-R212 VanDerWaalsContact CD-NH2 3.32Å; E186-R212 IonicContact OE1-CZ 3.58Å; E186-R212 IonicContact OE1-NE 2.79Å; E186-R212 PolarHBondContact OE1-NE 3.17Å; E186-R212 IonicContact OE1-NH2 3.67Å; E186-R212 PolarHBondContact OE1-NH2 3.46Å; E186-R212 IonicContact OE2-CZ 2.78Å; E186-R212 IonicContact OE2-NE 2.72Å; E186-R212 PolarHBondContact OE2-NE 3.37Å; E186-R212 IonicContact OE2-NH2 3.67Å; E186-R212 PolarHBondContact OE2-NH2 2.85Å
187	S	84.5	Confident	75.5	Confident	71 Å²	71	51.2 Å²	51.2	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-43.9	174.9	-58.8	0	0	0	0	111.5	D183 R184 L190 Q191	D183-S187 WeakPolarHBondContact O-CB 3.4Å; D183-S187 PolarHBondContact O-N 3.4Å; D183-S187 PolarHBondContact O-OG 3.22Å; R184-S187 WeakPolarHBondContact O-CB 3.29Å; R184-S187 PolarHBondContact O-N 2.84Å; S187-L190 PolarHBondContact O-N 2.59Å; S187-Q191 VanDerWaalsContact O-CB 3.26Å; S187-Q191 WeakPolarHBondContact O-CB 3.45Å; S187-Q191 PolarHBondContact O-N 3.31Å
188	F	82.9	Confident	73.7	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.035	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-49.3	173.7	171	-89.2	0	0	0	112.2	L141 E142 E145 L152 T156 R184 L185 E186 L190 Q191 T192	L141-F188 HydrophobicContact CB-CD1 4.35Å; L141-F188 HydrophobicContact CB-CD2 4.47Å; L141-F188 HydrophobicContact CB-CE1 3.87Å; L141-F188 HydrophobicContact CB-CE2 3.98Å; L141-F188 HydrophobicContact CB-CZ 3.67Å; L141-F188 HydrophobicContact CD1-CD1 4.27Å; L141-F188 HydrophobicContact CD1-CE1 4.04Å; L141-F188 HydrophobicContact CD2-CE1 4.22Å; L141-F188 HydrophobicContact CD2-CZ 4.31Å; L141-F188 HydrophobicContact CG-CE1 4.27Å; L141-F188 HydrophobicContact CG-CZ 4.42Å; E142-F188 HydrophobicContact CG-CD2 4.12Å; E145-F188 HydrophobicContact CG-CE2 3.89Å; E145-F188 WeakPolarHBondContact OE1-CD2 3.17Å; E145-F188 WeakPolarHBondContact OE1-CE2 3.3Å; L152-F188 HydrophobicContact CD1-CZ 3.96Å; T156-F188 HydrophobicContact CG2-CE1 4.39Å; R184-F188 PolarHBondContact O-N 2.79Å; L185-F188 WeakPolarHBondContact O-CB 3.43Å; L185-F188 PolarHBondContact O-N 3.49Å; E186-F188 VanDerWaalsContact C-N 3.33Å; E186-F188 PolarHBondContact O-N 2.95Å; F188-L190 VanDerWaalsContact C-N 3.28Å; F188-L190 PolarHBondContact O-N 2.87Å; F188-Q191 PolarHBondContact O-N 3.26Å; F188-T192 HydrophobicContact CD2-CG2 4.14Å; F188-T192 HydrophobicContact CE1-CG2 4.3Å; F188-T192 HydrophobicContact CE2-CG2 3.73Å; F188-T192 HydrophobicContact CZ-CG2 3.81Å; F188-T192 WeakPolarHBondContact O-CB 3.11Å; F188-T192 PolarHBondContact O-N 3.25Å; F188-T192 PolarHBondContact O-OG1 2.98Å
189	L	77.8	Confident	71.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-27.5	-179.2	-70.7	171	0	0	0	113.3	T156 I160 L185 E186 G193 Y194 A195 I208	T156-L189 HydrophobicContact CG2-CD2 3.6Å; I160-L189 HydrophobicContact CD1-CD2 4.14Å; I160-L189 HydrophobicContact CG1-CD2 4.41Å; L185-L189 HydrophobicContact CG-CD1 4.17Å; L185-L189 WeakPolarHBondContact O-CG 3.39Å; L185-L189 PolarHBondContact O-N 2.81Å; E186-L189 PolarHBondContact O-N 3.31Å; L189-G193 PolarHBondContact O-N 3.4Å; L189-Y194 PolarHBondContact O-N 2.84Å; L189-A195 HydrophobicContact CB-CB 4.46Å; L189-A195 WeakPolarHBondContact O-CB 3.23Å; L189-A195 PolarHBondContact O-N 2.85Å; L189-I208 HydrophobicContact CD1-CD1 4.21Å; L189-I208 HydrophobicContact CD1-CG1 4.44Å
190	L	77.3	Confident	69.7	Low	105 Å²	105	62.7 Å²	62.7	55%	0.55	38%	0.38	S	S	.	.	H	α-helix	trans	-73.8	-50.1	170.4	-73.9	164.1	0	0	0	111.5	E186 S187 F188 T192 G193 A195	E186-L190 HydrophobicContact CG-CD1 3.98Å; E186-L190 WeakPolarHBondContact O-CB 3.36Å; E186-L190 VanDerWaalsContact O-CG 3.3Å; E186-L190 WeakPolarHBondContact O-CG 3.39Å; E186-L190 PolarHBondContact O-N 3.06Å; S187-L190 PolarHBondContact O-N 2.59Å; F188-L190 VanDerWaalsContact C-N 3.28Å; F188-L190 PolarHBondContact O-N 2.87Å; L190-T192 VanDerWaalsContact C-N 3.35Å; L190-T192 PolarHBondContact O-N 2.77Å; L190-G193 PolarHBondContact O-N 2.94Å; L190-G193 VanDerWaalsContact O-N 3.17Å; L190-A195 HydrophobicContact CD2-CB 3.78Å; L190-A195 HydrophobicContact CG-CB 4.13Å
191	Q	77.2	Confident	67.9	Low	143 Å²	143	63 Å²	63	67%	0.668	38%	0.383	S	S	*	.	H	α-helix	trans	-61.6	-40.1	-178.4	177.6	169.3	-52.8	0	0	112.6	S187 F188 G193	S187-Q191 VanDerWaalsContact O-CB 3.26Å; S187-Q191 WeakPolarHBondContact O-CB 3.45Å; S187-Q191 PolarHBondContact O-N 3.31Å; F188-Q191 PolarHBondContact O-N 3.26Å; Q191-G193 VanDerWaalsContact C-N 3.34Å
192	T	71.8	Confident	66.3	Low	41 Å²	41	62.8 Å²	62.8	25%	0.252	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.3	178.6	55.4	0	0	0	0	113.8	F188 L190 Y194	F188-T192 HydrophobicContact CD2-CG2 4.14Å; F188-T192 HydrophobicContact CE1-CG2 4.3Å; F188-T192 HydrophobicContact CE2-CG2 3.73Å; F188-T192 HydrophobicContact CZ-CG2 3.81Å; F188-T192 WeakPolarHBondContact O-CB 3.11Å; F188-T192 PolarHBondContact O-N 3.25Å; F188-T192 PolarHBondContact O-OG1 2.98Å; L190-T192 VanDerWaalsContact C-N 3.35Å; L190-T192 PolarHBondContact O-N 2.77Å; T192-Y194 VanDerWaalsContact OG1-CD2 3.27Å; T192-Y194 WeakPolarHBondContact OG1-CD2 3.44Å
193	G	65.6	Low	65.2	Low	29 Å²	29	64.2 Å²	64.2	30%	0.299	41%	0.412	S	S	.	.	S	Bend	trans	87	-2.3	168.3	0	0	0	0	0	116.8	L189 L190 Q191 A195 A196	L189-G193 PolarHBondContact O-N 3.4Å; L190-G193 PolarHBondContact O-N 2.94Å; L190-G193 VanDerWaalsContact O-N 3.17Å; Q191-G193 VanDerWaalsContact C-N 3.34Å; G193-A195 VanDerWaalsContact C-N 3.33Å; G193-A195 PolarHBondContact O-N 2.81Å; G193-A196 WeakPolarHBondContact O-CB 3.4Å; G193-A196 PolarHBondContact O-N 2.87Å
194	Y	63.2	Low	64.3	Low	53 Å²	53	62.1 Å²	62.1	21%	0.208	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-65.2	-36.3	177.3	-60.8	-85.8	0	0	0	112.2	E153 T156 L189 T192 A196 G197	E153-Y194 VanDerWaalsContact CA-OH 3.26Å; E153-Y194 WeakPolarHBondContact CA-OH 3.07Å; E153-Y194 HydrophobicContact CG-CE1 4.35Å; E153-Y194 WeakPolarHBondContact CG-OH 3.34Å; T156-Y194 HydrophobicContact CG2-CD1 4.39Å; T156-Y194 HydrophobicContact CG2-CD2 3.83Å; T156-Y194 HydrophobicContact CG2-CE2 4.02Å; T156-Y194 HydrophobicContact CG2-CG 4.04Å; L189-Y194 PolarHBondContact O-N 2.84Å; T192-Y194 VanDerWaalsContact OG1-CD2 3.27Å; T192-Y194 WeakPolarHBondContact OG1-CD2 3.44Å; Y194-A196 PolarHBondContact O-N 2.84Å; Y194-G197 PolarHBondContact O-N 2.89Å
195	A	53	Low	63.5	Low	33 Å²	33	61.5 Å²	61.5	27%	0.273	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-64.4	-16.6	173.3	0	0	0	0	0	113.5	L189 L190 G193 G197	L189-A195 HydrophobicContact CB-CB 4.46Å; L189-A195 WeakPolarHBondContact O-CB 3.23Å; L189-A195 PolarHBondContact O-N 2.85Å; L190-A195 HydrophobicContact CD2-CB 3.78Å; L190-A195 HydrophobicContact CG-CB 4.13Å; G193-A195 VanDerWaalsContact C-N 3.33Å; G193-A195 PolarHBondContact O-N 2.81Å; A195-G197 VanDerWaalsContact C-N 3.34Å
196	A	47.7	Very low	63.3	Low	77 Å²	77	64.4 Å²	64.4	64%	0.636	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-88.6	8.2	178.2	0	0	0	0	0	114.1	G193 Y194 K198	G193-A196 WeakPolarHBondContact O-CB 3.4Å; G193-A196 PolarHBondContact O-N 2.87Å; Y194-A196 PolarHBondContact O-N 2.84Å; A196-K198 VanDerWaalsContact C-N 3.35Å; A196-K198 PolarHBondContact O-N 2.82Å
197	G	49.4	Very low	63.1	Low	53 Å²	53	63.1 Å²	63.1	55%	0.546	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	22.3	167.2	0	0	0	0	0	116	Y194 A195	Y194-G197 PolarHBondContact O-N 2.89Å; A195-G197 VanDerWaalsContact C-N 3.34Å
198	K	44.2	Very low	62.9	Low	208 Å²	208	60.5 Å²	60.5	90%	0.904	40%	0.402	S	S	*	.			trans	-82.8	-9.1	173.9	-85.5	-173.3	172.7	-179.7	0	114.6	A196	A196-K198 VanDerWaalsContact C-N 3.35Å; A196-K198 PolarHBondContact O-N 2.82Å
199	G	41.3	Very low	62.8	Low	50 Å²	50	66.9 Å²	66.9	52%	0.515	43%	0.425	S	S	.	.	S	Bend	trans	-100	173.1	167.6	0	0	0	0	0	112.1	G201	G199-G201 PolarHBondContact O-N 2.94Å
200	V	39.7	Very low	63.1	Low	159 Å²	159	70 Å²	70	96%	0.964	44%	0.442	S	S	*	.	S	Bend	trans	-73.2	110	-174.6	178.1	0	0	0	0	111.7
201	G	46.6	Very low	63.2	Low	60 Å²	60	65 Å²	65	62%	0.619	42%	0.416	S	S	*	.			trans	102.7	128.9	165.7	0	0	0	0	0	114.8	G199 G203	G199-G201 PolarHBondContact O-N 2.94Å; G201-G203 PolarHBondContact O-N 3.15Å
202	G	51.3	Low	63.3	Low	50 Å²	50	62.4 Å²	62.4	52%	0.515	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	2.9	-178.7	0	0	0	0	0	116.1	S204 A205 D206	G202-S204 PolarHBondContact O-N 3.49Å; G202-S204 VanDerWaalsContact O-N 3.1Å; G202-A205 PolarHBondContact O-N 3.04Å; G202-D206 PolarHBondContact O-N 3.48Å
203	G	59.7	Low	63.8	Low	40 Å²	40	64 Å²	64	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-58.1	-27.8	-171.3	0	0	0	0	0	114.8	G201 A205 D206 L207	G201-G203 PolarHBondContact O-N 3.15Å; G203-A205 VanDerWaalsContact C-N 3.34Å; G203-A205 PolarHBondContact O-N 2.71Å; G203-D206 PolarHBondContact O-N 2.81Å; G203-L207 WeakPolarHBondContact O-CB 3.18Å; G203-L207 PolarHBondContact O-N 3.37Å
204	S	65.8	Low	64.4	Low	11 Å²	11	68.7 Å²	68.7	8%	0.077	42%	0.421	C	S	.	.	H	α-helix	trans	-64.5	-35.6	176.2	-169	0	0	0	0	112.9	G202 I208	G202-S204 PolarHBondContact O-N 3.49Å; G202-S204 VanDerWaalsContact O-N 3.1Å; S204-I208 WeakPolarHBondContact O-CG1 3.28Å; S204-I208 PolarHBondContact O-N 3.44Å
205	A	70.3	Confident	65	Low	54 Å²	54	66.3 Å²	66.3	45%	0.446	41%	0.412	S	S	.	.	H	α-helix	trans	-78.6	-39.3	178.9	0	0	0	0	0	111.4	G202 G203 L207 I208 R209	G202-A205 PolarHBondContact O-N 3.04Å; G203-A205 VanDerWaalsContact C-N 3.34Å; G203-A205 PolarHBondContact O-N 2.71Å; A205-L207 VanDerWaalsContact C-N 3.34Å; A205-I208 PolarHBondContact O-N 3.24Å; A205-R209 PolarHBondContact O-N 3.39Å
206	D	77.1	Confident	65.9	Low	69 Å²	69	68.6 Å²	68.6	37%	0.369	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-41.2	172.2	-73.9	-53.9	0	0	0	111.7	G202 G203 R209 N210	G202-D206 PolarHBondContact O-N 3.48Å; G203-D206 PolarHBondContact O-N 2.81Å; D206-R209 PolarHBondContact O-N 2.76Å; D206-R209 IonicContact OD1-CZ 2.71Å; D206-R209 IonicContact OD1-NH1 2.76Å; D206-R209 PolarHBondContact OD1-NH1 2.95Å; D206-R209 IonicContact OD1-NH2 2.71Å; D206-R209 PolarHBondContact OD1-NH2 3.32Å; D206-N210 WeakPolarHBondContact O-CB 3.43Å; D206-N210 PolarHBondContact O-N 3.43Å; D206-N210 PolarHBondContact O-ND2 3.37Å; D206-N210 PolarHBondContact O-OD1 2.86Å
207	L	79.8	Confident	66.6	Low	8 Å²	8	69.1 Å²	69.1	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-58.4	-52.9	175.3	174.8	62	0	0	0	111.5	I160 L163 L167 G203 A205 R209 N210 L211	I160-L207 HydrophobicContact CG2-CD2 4.01Å; L163-L207 HydrophobicContact CB-CD2 3.94Å; L167-L207 HydrophobicContact CD2-CD1 4.11Å; G203-L207 WeakPolarHBondContact O-CB 3.18Å; G203-L207 PolarHBondContact O-N 3.37Å; A205-L207 VanDerWaalsContact C-N 3.34Å; L207-R209 VanDerWaalsContact C-N 3.35Å; L207-R209 PolarHBondContact O-N 2.78Å; L207-N210 PolarHBondContact O-N 3.45Å; L207-N210 VanDerWaalsContact O-N 3.15Å; L207-L211 HydrophobicContact CD1-CD1 3.87Å; L207-L211 HydrophobicContact CD1-CG 4.09Å; L207-L211 HydrophobicContact CG-CD1 3.81Å; L207-L211 HydrophobicContact CG-CG 4.43Å; L207-L211 WeakPolarHBondContact O-CG 3.36Å; L207-L211 PolarHBondContact O-N 3.01Å
208	I	79.4	Confident	66.8	Low	16 Å²	16	75.5 Å²	75.5	8%	0.082	43%	0.432	C	S	.	.	H	α-helix	trans	-60.3	-42.7	179.1	-71.2	-62.1	0	0	0	111.6	L182 E186 L189 S204 A205 N210 L211 R212	L182-I208 HydrophobicContact CD1-CD1 4.11Å; E186-I208 HydrophobicContact CB-CD1 4Å; E186-I208 HydrophobicContact CG-CD1 4.24Å; E186-I208 HydrophobicContact CG-CG1 4.4Å; E186-I208 HydrophobicContact CG-CG2 3.8Å; E186-I208 WeakPolarHBondContact OE2-CG2 3.27Å; L189-I208 HydrophobicContact CD1-CD1 4.21Å; L189-I208 HydrophobicContact CD1-CG1 4.44Å; S204-I208 WeakPolarHBondContact O-CG1 3.28Å; S204-I208 PolarHBondContact O-N 3.44Å; A205-I208 PolarHBondContact O-N 3.24Å; I208-N210 VanDerWaalsContact C-N 3.33Å; I208-N210 PolarHBondContact O-N 2.92Å; I208-L211 HydrophobicContact CD1-CD1 4.34Å; I208-L211 PolarHBondContact O-N 2.91Å; I208-R212 WeakPolarHBondContact O-CB 3.47Å; I208-R212 PolarHBondContact O-N 2.98Å
209	R	81.8	Confident	66.8	Low	142 Å²	142	70.1 Å²	70.1	54%	0.536	43%	0.426	S	S	.	.	H	α-helix	trans	-59.3	-44.5	174.5	-173.8	-170.5	65.5	-126.2	-15.9	111.6	A205 D206 L207 R212 S213	A205-R209 PolarHBondContact O-N 3.39Å; D206-R209 PolarHBondContact O-N 2.76Å; D206-R209 IonicContact OD1-CZ 2.71Å; D206-R209 IonicContact OD1-NH1 2.76Å; D206-R209 PolarHBondContact OD1-NH1 2.95Å; D206-R209 IonicContact OD1-NH2 2.71Å; D206-R209 PolarHBondContact OD1-NH2 3.32Å; L207-R209 VanDerWaalsContact C-N 3.35Å; L207-R209 PolarHBondContact O-N 2.78Å; R209-R212 PolarHBondContact O-N 3.23Å; R209-S213 PolarHBondContact O-N 3.39Å; R209-S213 VanDerWaalsContact O-N 3.12Å
210	N	82.6	Confident	67.1	Low	68 Å²	68	72.8 Å²	72.8	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-70.4	-34.6	-178.6	-62.3	-10.7	0	0	0	111.6	L167 D206 L207 I208 S213	L167-N210 HydrophobicContact CD2-CB 3.67Å; D206-N210 WeakPolarHBondContact O-CB 3.43Å; D206-N210 PolarHBondContact O-N 3.43Å; D206-N210 PolarHBondContact O-ND2 3.37Å; D206-N210 PolarHBondContact O-OD1 2.86Å; L207-N210 PolarHBondContact O-N 3.45Å; L207-N210 VanDerWaalsContact O-N 3.15Å; I208-N210 VanDerWaalsContact C-N 3.33Å; I208-N210 PolarHBondContact O-N 2.92Å; N210-S213 PolarHBondContact O-OG 3.28Å
211	L	79.6	Confident	66.9	Low	1 Å²	1	73 Å²	73	1%	0.005	43%	0.431	C	S	.	.	H	α-helix	trans	-65.6	-49	171.8	-71.8	166.7	0	0	0	111.6	L167 F174 L182 L207 I208 S213 R214 V215	L167-L211 HydrophobicContact CB-CD2 4.22Å; L167-L211 HydrophobicContact CD1-CD2 4.1Å; L167-L211 HydrophobicContact CD2-CD2 3.89Å; L167-L211 HydrophobicContact CD2-CG 3.95Å; L167-L211 HydrophobicContact CG-CD2 4.29Å; F174-L211 HydrophobicContact CD1-CD2 3.45Å; F174-L211 VanDerWaalsContact CD1-CD2 3.45Å; F174-L211 HydrophobicContact CD2-CD2 4.49Å; F174-L211 HydrophobicContact CE1-CD2 3.48Å; F174-L211 VanDerWaalsContact CE1-CD2 3.48Å; F174-L211 HydrophobicContact CG-CD2 3.98Å; F174-L211 HydrophobicContact CZ-CD2 4.05Å; L182-L211 HydrophobicContact CD1-CB 3.76Å; L182-L211 HydrophobicContact CD1-CD1 3.64Å; L182-L211 HydrophobicContact CD1-CG 4.23Å; L182-L211 HydrophobicContact CD2-CB 3.81Å; L182-L211 HydrophobicContact CG-CB 4.47Å; L207-L211 HydrophobicContact CD1-CD1 3.87Å; L207-L211 HydrophobicContact CD1-CG 4.09Å; L207-L211 HydrophobicContact CG-CD1 3.81Å; L207-L211 HydrophobicContact CG-CG 4.43Å; L207-L211 WeakPolarHBondContact O-CG 3.36Å; L207-L211 PolarHBondContact O-N 3.01Å; I208-L211 HydrophobicContact CD1-CD1 4.34Å; I208-L211 PolarHBondContact O-N 2.91Å; L211-S213 PolarHBondContact O-N 3.27Å; L211-R214 PolarHBondContact O-N 3.43Å; L211-V215 PolarHBondContact O-N 2.96Å
212	R	80	Confident	66.3	Low	89 Å²	89	77.2 Å²	77.2	34%	0.336	44%	0.438	S	S	.	.	H	α-helix	trans	-55.8	-38.3	176.5	-79.6	-174.8	171.4	-84.2	-17.2	112.3	L182 D183 E186 I208 R209 R214 V215 D216	L182-R212 HydrophobicContact CD2-CG 4.36Å; D183-R212 IonicContact OD1-CZ 2.78Å; D183-R212 IonicContact OD1-NH1 2.71Å; D183-R212 IonicContact OD1-NH2 3.48Å; D183-R212 PolarHBondContact OD1-NH2 3.01Å; E186-R212 VanDerWaalsContact CD-NH2 3.32Å; E186-R212 IonicContact OE1-CZ 3.58Å; E186-R212 IonicContact OE1-NE 2.79Å; E186-R212 PolarHBondContact OE1-NE 3.17Å; E186-R212 IonicContact OE1-NH2 3.67Å; E186-R212 PolarHBondContact OE1-NH2 3.46Å; E186-R212 IonicContact OE2-CZ 2.78Å; E186-R212 IonicContact OE2-NE 2.72Å; E186-R212 PolarHBondContact OE2-NE 3.37Å; E186-R212 IonicContact OE2-NH2 3.67Å; E186-R212 PolarHBondContact OE2-NH2 2.85Å; I208-R212 WeakPolarHBondContact O-CB 3.47Å; I208-R212 PolarHBondContact O-N 2.98Å; R209-R212 PolarHBondContact O-N 3.23Å; R212-R214 PolarHBondContact O-N 3.47Å; R212-V215 PolarHBondContact O-N 3.3Å; R212-D216 PolarHBondContact O-N 3.06Å
213	S	81.9	Confident	65.8	Low	73 Å²	73	80.2 Å²	80.2	51%	0.51	45%	0.448	S	S	.	.	H	α-helix	trans	-66.3	-14.2	177.9	75.8	0	0	0	0	115.4	R209 N210 L211	R209-S213 PolarHBondContact O-N 3.39Å; R209-S213 VanDerWaalsContact O-N 3.12Å; N210-S213 PolarHBondContact O-OG 3.28Å; L211-S213 PolarHBondContact O-N 3.27Å
214	R	78.1	Confident	64.6	Low	128 Å²	128	87.1 Å²	87.1	48%	0.483	47%	0.467	S	S	.	.	H	α-helix	trans	-95.5	-37.4	172.9	-63.7	-60.1	-172.2	159.6	2.4	112.6	L167 F174 L211 R212 P217	L167-R214 HydrophobicContact CD1-CG 4.06Å; F174-R214 HydrophobicContact CB-CB 3.97Å; F174-R214 CarbonylContact O-C 3.32Å; F174-R214 VanDerWaalsContact O-C 3.32Å; F174-R214 WeakPolarHBondContact O-CB 3.27Å; L211-R214 PolarHBondContact O-N 3.43Å; R212-R214 PolarHBondContact O-N 3.47Å; R214-P217 WeakPolarHBondContact O-CD 3.11Å
215	V	75.6	Confident	63.2	Low	4 Å²	4	92 Å²	92	2%	0.024	50%	0.498	C	S	.	.	H	α-helix	trans	-78.1	-38.4	-176.9	173.4	0	0	0	0	112.6	A178 K179 L182 L211 R212 P217	A178-V215 HydrophobicContact CB-CG2 4.48Å; K179-V215 HydrophobicContact CB-CG1 3.48Å; K179-V215 VanDerWaalsContact CB-CG1 3.48Å; K179-V215 HydrophobicContact CD-CG1 3.95Å; K179-V215 HydrophobicContact CG-CG1 3.67Å; L182-V215 HydrophobicContact CD2-CB 4.16Å; L182-V215 HydrophobicContact CD2-CG2 3.71Å; L211-V215 PolarHBondContact O-N 2.96Å; R212-V215 PolarHBondContact O-N 3.3Å; V215-P217 WeakPolarHBondContact O-CD 3.19Å
216	D	72.2	Confident	62.2	Low	81 Å²	81	96.5 Å²	96.5	43%	0.433	51%	0.514	S	S	.	.	S	Bend	trans	-111.4	71.4	170.6	-75.2	-32.5	0	0	0	109.8	K179 R212 Q218	K179-D216 IonicContact NZ-OD1 3Å; K179-D216 PolarHBondContact NZ-OD1 3.46Å; K179-D216 IonicContact NZ-OD2 3.93Å; K179-D216 PolarHBondContact NZ-OD2 3.04Å; R212-D216 PolarHBondContact O-N 3.06Å; D216-Q218 PolarHBondContact O-N 3.32Å
217	P	63	Low	60.5	Low	87 Å²	87	96.4 Å²	96.4	57%	0.565	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-67.1	129	177.2	29.5	-33.1	0	0	0	109.4	R214 V215 A219	R214-P217 WeakPolarHBondContact O-CD 3.11Å; V215-P217 WeakPolarHBondContact O-CD 3.19Å; P217-A219 PolarHBondContact O-N 3Å
218	Q	52.7	Low	58.9	Low	188 Å²	188	102.3 Å²	102.3	88%	0.879	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-59.8	136.3	161.2	-73.2	-156.6	-42	0	0	108.4	D216 P220	D216-Q218 PolarHBondContact O-N 3.32Å; Q218-P220 WeakPolarHBondContact O-CD 3.42Å; Q218-P220 VanDerWaalsContact O-N 3.11Å
219	A	43.4	Very low	57.1	Low	94 Å²	94	108.2 Å²	108.2	78%	0.777	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-56.1	118.7	-177.9	0	0	0	0	0	109.5	P217 D221	P217-A219 PolarHBondContact O-N 3Å; A219-D221 PolarHBondContact O-N 3.38Å
220	P	47.8	Very low	55.9	Low	106 Å²	106	104.9 Å²	104.9	69%	0.688	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-66.7	136.1	179.2	27	-33.3	0	0	0	109.3	Q218 L222	Q218-P220 WeakPolarHBondContact O-CD 3.42Å; Q218-P220 VanDerWaalsContact O-N 3.11Å; P220-L222 PolarHBondContact O-N 2.82Å
221	D	36	Very low	54.9	Low	165 Å²	165	106.3 Å²	106.3	88%	0.882	61%	0.611	S	S	*	*			trans	-58.3	105.4	168.7	-90.7	-44.4	0	0	0	108.6	A219 P223	A219-D221 PolarHBondContact O-N 3.38Å; D221-P223 VanDerWaalsContact O-CD 3.32Å; D221-P223 WeakPolarHBondContact O-CD 3.37Å
222	L	34.2	Very low	54.4	Low	148 Å²	148	111.3 Å²	111.3	78%	0.775	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-64.4	121.1	-171.6	-152.1	81.3	0	0	0	109.2	P220 K224	P220-L222 PolarHBondContact O-N 2.82Å; L222-K224 PolarHBondContact O-N 3.19Å; L222-K224 VanDerWaalsContact O-N 3.1Å
223	P	41.1	Very low	54.5	Low	112 Å²	112	109.8 Å²	109.8	73%	0.727	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-57	121.4	176	-25	35	0	0	0	109.6	D221	D221-P223 VanDerWaalsContact O-CD 3.32Å; D221-P223 WeakPolarHBondContact O-CD 3.37Å
224	K	33.8	Very low	54.9	Low	186 Å²	186	107.2 Å²	107.2	81%	0.809	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-58.9	131.4	178.4	-74.9	178.3	178.3	173.1	0	109.1	L222 L226	L222-K224 PolarHBondContact O-N 3.19Å; L222-K224 VanDerWaalsContact O-N 3.1Å; K224-L226 PolarHBondContact O-N 2.67Å; K224-L226 VanDerWaalsContact O-N 3.17Å
225	P	37.5	Very low	55.7	Low	113 Å²	113	103.2 Å²	103.2	73%	0.734	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-52.8	123.6	172.6	-26.9	35.1	0	0	0	110.5	A227	P225-A227 PolarHBondContact O-N 3.16Å
226	L	48.1	Very low	56.6	Low	149 Å²	149	103.1 Å²	103.1	78%	0.78	62%	0.616	S	S	*	*	S	Bend	trans	-75.3	-12	177	-68.7	174.1	0	0	0	112.6	K224	K224-L226 PolarHBondContact O-N 2.67Å; K224-L226 VanDerWaalsContact O-N 3.17Å
227	A	42.5	Very low	57.8	Low	67 Å²	67	99.6 Å²	99.6	55%	0.554	60%	0.597	S	S	*	*			trans	-81.9	114.1	173	0	0	0	0	0	110.5	P225	P225-A227 PolarHBondContact O-N 3.16Å
228	L	46.3	Very low	59.4	Low	132 Å²	132	98.5 Å²	98.5	69%	0.691	59%	0.587	S	S	*	*			trans	-76.6	131.4	166.1	-72.2	169.6	0	0	0	109.2	G230	L228-G230 PolarHBondContact O-N 3.09Å
229	P	41.8	Very low	61.5	Low	139 Å²	139	89.6 Å²	89.6	90%	0.903	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	99.5	173.7	-21.5	33.6	0	0	0	110.9
230	G	54.8	Low	64.1	Low	73 Å²	73	89.1 Å²	89.1	75%	0.753	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.2	-14.3	178.1	0	0	0	0	0	116.1	L228	L228-G230 PolarHBondContact O-N 3.09Å
231	D	61.7	Low	66.5	Low	97 Å²	97	89.2 Å²	89.2	52%	0.519	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-62.2	140.3	179.5	-78.8	-25.6	0	0	0	112.3
232	P	69.4	Low	69.4	Low	106 Å²	106	83.4 Å²	83.4	69%	0.688	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-66.7	150.3	178.5	28.6	-35	0	0	0	111.4	A234	P232-A234 PolarHBondContact O-N 2.89Å
233	P	81.9	Confident	72.4	Confident	57 Å²	57	81.3 Å²	81.3	37%	0.37	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-62.7	136.9	177	28.1	-34.8	0	0	0	110.7	T309	P233-T309 HydrophobicContact CB-CG2 3.93Å; P233-T309 HydrophobicContact CG-CG2 4.13Å
234	A	91.3	Very high	75.2	Confident	20 Å²	20	76.5 Å²	76.5	17%	0.165	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-65.6	140.1	-178.7	0	0	0	0	0	111.6	P232 P236 W491 G494 L495	P232-A234 PolarHBondContact O-N 2.89Å; A234-P236 WeakPolarHBondContact O-CD 3.23Å; A234-W491 HydrophobicContact CB-CG 4.49Å; A234-G494 PolarHBondContact N-O 2.95Å; A234-L495 HydrophobicContact CB-CD2 4.18Å
235	D	94.7	Very high	78.2	Confident	44 Å²	44	69.7 Å²	69.7	24%	0.235	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-71.8	120.5	174	-172.2	-42.7	0	0	0	109	T237 D238 R321 W491	D235-T237 PolarHBondContact O-N 3.44Å; D235-T237 WeakPolarHBondContact OD1-CA 3.46Å; D235-T237 VanDerWaalsContact OD1-CB 3.31Å; D235-T237 WeakPolarHBondContact OD1-CB 3.34Å; D235-T237 PolarHBondContact OD1-N 3.05Å; D235-T237 PolarHBondContact OD1-OG1 2.84Å; D235-D238 WeakPolarHBondContact O-CB 3.39Å; D235-D238 PolarHBondContact O-N 3.07Å; D235-D238 VanDerWaalsContact O-N 3.15Å; D235-R321 IonicContact OD1-NH1 2.74Å; D235-R321 IonicContact OD2-CZ 2.72Å; D235-R321 IonicContact OD2-NH1 3.19Å; D235-R321 PolarHBondContact OD2-NH1 2.7Å; D235-W491 PolarHBondContact O-NE1 3.3Å
236	P	94.8	Very high	81.1	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.013	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-71.5	-10.6	-176.5	33.3	-38.7	0	0	0	112.8	A234 S304 T309 L495	A234-P236 WeakPolarHBondContact O-CD 3.23Å; P236-S304 WeakPolarHBondContact O-CB 3.33Å; P236-S304 PolarHBondContact O-OG 2.7Å; P236-T309 WeakPolarHBondContact CD-OG1 3.27Å; P236-L495 HydrophobicContact CB-CD2 3.88Å
237	T	96.3	Very high	83.5	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.037	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-84.6	-12.4	173.6	69.7	0	0	0	0	113.6	D235 V239 L240 R321 L323 L331	D235-T237 PolarHBondContact O-N 3.44Å; D235-T237 WeakPolarHBondContact OD1-CA 3.46Å; D235-T237 VanDerWaalsContact OD1-CB 3.31Å; D235-T237 WeakPolarHBondContact OD1-CB 3.34Å; D235-T237 PolarHBondContact OD1-N 3.05Å; D235-T237 PolarHBondContact OD1-OG1 2.84Å; T237-V239 PolarHBondContact O-N 3.28Å; T237-V239 VanDerWaalsContact O-N 3.07Å; T237-L240 WeakPolarHBondContact O-CG 3.44Å; T237-L240 PolarHBondContact O-N 3.06Å; T237-L240 VanDerWaalsContact O-N 3.15Å; T237-R321 VanDerWaalsContact OG1-CZ 3.32Å; T237-R321 PolarHBondContact OG1-NH1 3.37Å; T237-L323 HydrophobicContact CG2-CD1 4.23Å; T237-L331 HydrophobicContact CG2-CD1 4.13Å; T237-L331 HydrophobicContact CG2-CD2 4.38Å
238	D	96.6	Very high	86.1	Confident	65 Å²	65	57.6 Å²	57.6	35%	0.348	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-67.3	-6	174.7	-71.1	-14.7	0	0	0	113.3	D235 L240 V241 F242	D235-D238 WeakPolarHBondContact O-CB 3.39Å; D235-D238 PolarHBondContact O-N 3.07Å; D235-D238 VanDerWaalsContact O-N 3.15Å; D238-L240 PolarHBondContact O-N 3.09Å; D238-V241 HydrophobicContact CB-CG2 4.31Å; D238-V241 WeakPolarHBondContact O-CB 3.27Å; D238-V241 PolarHBondContact O-N 3.2Å; D238-F242 WeakPolarHBondContact O-CD2 3.42Å
239	V	97.6	Very high	88.6	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-48.8	-28.2	163.6	73.5	0	0	0	0	112.4	T237 V241 L247 S304 L331 K334 W335 W491	T237-V239 PolarHBondContact O-N 3.28Å; T237-V239 VanDerWaalsContact O-N 3.07Å; V239-V241 VanDerWaalsContact C-N 3.3Å; V239-V241 PolarHBondContact O-N 3.22Å; V239-L247 HydrophobicContact CG2-CD1 3.62Å; V239-S304 VanDerWaalsContact CG1-OG 3.29Å; V239-S304 WeakPolarHBondContact CG1-OG 3.45Å; V239-L331 HydrophobicContact CG1-CD2 3.67Å; V239-K334 HydrophobicContact CG1-CG 4.25Å; V239-K334 HydrophobicContact CG2-CG 4.15Å; V239-K334 WeakPolarHBondContact O-CE 3.31Å; V239-W335 HydrophobicContact CB-CZ2 4.24Å; V239-W335 HydrophobicContact CG2-CD2 4.43Å; V239-W335 HydrophobicContact CG2-CH2 4.09Å; V239-W335 HydrophobicContact CG2-CZ2 3.69Å; V239-W491 HydrophobicContact CB-CH2 3.63Å; V239-W491 HydrophobicContact CB-CZ2 3.7Å; V239-W491 HydrophobicContact CG2-CH2 3.78Å; V239-W491 HydrophobicContact CG2-CZ2 4.38Å
240	L	97.8	Very high	91.3	Very high	84 Å²	84	46.7 Å²	46.7	44%	0.44	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-70.1	-21.7	177.6	-65	174.3	0	0	0	113.8	T237 D238 R330 L331 K334	T237-L240 WeakPolarHBondContact O-CG 3.44Å; T237-L240 PolarHBondContact O-N 3.06Å; T237-L240 VanDerWaalsContact O-N 3.15Å; D238-L240 PolarHBondContact O-N 3.09Å; L240-R330 HydrophobicContact CD2-CB 4.41Å; L240-L331 HydrophobicContact CD1-CD2 3.83Å; L240-L331 HydrophobicContact CD1-CG 4.13Å; L240-L331 HydrophobicContact CD2-CD2 4.04Å; L240-L331 HydrophobicContact CD2-CG 4.38Å; L240-L331 HydrophobicContact CG-CD2 3.71Å; L240-L331 HydrophobicContact CG-CG 4.37Å; L240-K334 HydrophobicContact CD2-CB 3.92Å; L240-K334 HydrophobicContact CD2-CG 4.1Å
241	V	97.4	Very high	93.3	Very high	109 Å²	109	43.3 Å²	43.3	66%	0.661	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-42.8	-176.4	-177.8	0	0	0	0	111.4	D238 V239	D238-V241 HydrophobicContact CB-CG2 4.31Å; D238-V241 WeakPolarHBondContact O-CB 3.27Å; D238-V241 PolarHBondContact O-N 3.2Å; V239-V241 VanDerWaalsContact C-N 3.3Å; V239-V241 PolarHBondContact O-N 3.22Å
242	F	97.5	Very high	95.1	Very high	42 Å²	42	38.7 Å²	38.7	18%	0.184	22%	0.217	C	C	.	.	S	Bend	trans	-75.2	160.2	-178.9	-53.1	-69.8	0	0	0	112.1	D238 L247 K334 D487 I488 W491	D238-F242 WeakPolarHBondContact O-CD2 3.42Å; F242-L247 HydrophobicContact CB-CD1 4.03Å; F242-L247 HydrophobicContact CB-CD2 4.1Å; F242-L247 HydrophobicContact CB-CG 3.82Å; F242-L247 HydrophobicContact CD2-CD2 4.16Å; F242-L247 HydrophobicContact CG-CD2 4.4Å; F242-K334 PolarHBondContact O-NZ 3.43Å; F242-D487 HydrophobicContact CE1-CB 4.48Å; F242-I488 HydrophobicContact CB-CD1 4.19Å; F242-I488 HydrophobicContact CB-CG1 4.2Å; F242-I488 HydrophobicContact CD1-CD1 4.02Å; F242-I488 HydrophobicContact CD1-CG1 3.32Å; F242-I488 HydrophobicContact CD2-CG1 4.32Å; F242-I488 HydrophobicContact CE1-CG1 3.63Å; F242-I488 HydrophobicContact CG-CD1 4.23Å; F242-I488 HydrophobicContact CG-CG1 3.69Å; F242-I488 HydrophobicContact CZ-CG1 4.26Å; F242-W491 HydrophobicContact CD2-CD2 4.5Å; F242-W491 HydrophobicContact CD2-CE3 4.45Å; F242-W491 HydrophobicContact CE2-CB 4Å; F242-W491 AromaticContact CE2-CD2 3.84Å; F242-W491 HydrophobicContact CE2-CD2 3.84Å; F242-W491 HydrophobicContact CE2-CE3 4.13Å; F242-W491 AromaticContact CE2-CG 3.75Å; F242-W491 HydrophobicContact CE2-CG 3.75Å; F242-W491 HydrophobicContact CZ-CB 4.02Å; F242-W491 HydrophobicContact CZ-CG 4.25Å
243	L	98.3	Very high	96.4	Very high	104 Å²	104	35.7 Å²	35.7	55%	0.545	20%	0.196	S	C	.	.			trans	-75.6	150.2	171.4	-65.3	179.3	0	0	0	111.3	H246 L247	L243-H246 HydrophobicContact CB-CB 4.08Å; L243-L247 WeakPolarHBondContact O-CB 3.2Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 3.12Å
244	A	98.4	Very high	97.2	Very high	12 Å²	12	34.9 Å²	34.9	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-72.9	-32.8	-171.9	0	0	0	0	0	113	A248 K334 R337 V338 E341	A244-A248 PolarHBondContact O-N 2.94Å; A244-A248 VanDerWaalsContact O-N 3.14Å; A244-K334 HydrophobicContact CB-CD 4.44Å; A244-R337 HydrophobicContact CB-CB 4.13Å; A244-R337 HydrophobicContact CB-CG 3.63Å; A244-V338 HydrophobicContact CB-CG2 4.08Å; A244-E341 HydrophobicContact CB-CG 4.42Å
245	D	97.4	Very high	97.5	Very high	42 Å²	42	34.1 Å²	34.1	23%	0.225	18%	0.181	C	C	.	.	H	α-helix	trans	-78	-37.8	174.8	63.5	-39.8	0	0	0	111.6	L247 A248 E249 E341 R424	D245-L247 VanDerWaalsContact C-N 3.33Å; D245-L247 PolarHBondContact O-N 3.24Å; D245-A248 PolarHBondContact O-N 3.18Å; D245-A248 VanDerWaalsContact O-N 3.15Å; D245-E249 WeakPolarHBondContact O-CG 3.47Å; D245-E249 PolarHBondContact O-N 3.1Å; D245-E341 HydrophobicContact CB-CB 4.25Å; D245-E341 HydrophobicContact CB-CG 3.88Å; D245-R424 IonicContact OD2-NH2 3.18Å; D245-R424 PolarHBondContact OD2-NH2 2.64Å
246	H	97.6	Very high	97.6	Very high	75 Å²	75	32.3 Å²	32.3	35%	0.347	17%	0.172	S	C	.	.	H	α-helix	trans	-57.9	-44.9	169.6	-73	-139.3	0	0	0	111.5	L243 A248 E249 Q250 I488	L243-H246 HydrophobicContact CB-CB 4.08Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.49Å; H246-E249 PolarHBondContact O-N 2.77Å; H246-Q250 WeakPolarHBondContact O-CG 3.35Å; H246-Q250 PolarHBondContact O-N 2.96Å; H246-I488 HydrophobicContact CB-CD1 3.87Å
247	L	98.5	Very high	97.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-44.7	173.4	-78.2	164.7	0	0	0	111.8	V239 F242 L243 D245 Q250 L251 V338 I488 W491	V239-L247 HydrophobicContact CG2-CD1 3.62Å; F242-L247 HydrophobicContact CB-CD1 4.03Å; F242-L247 HydrophobicContact CB-CD2 4.1Å; F242-L247 HydrophobicContact CB-CG 3.82Å; F242-L247 HydrophobicContact CD2-CD2 4.16Å; F242-L247 HydrophobicContact CG-CD2 4.4Å; L243-L247 WeakPolarHBondContact O-CB 3.2Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 3.12Å; D245-L247 VanDerWaalsContact C-N 3.33Å; D245-L247 PolarHBondContact O-N 3.24Å; L247-Q250 PolarHBondContact O-N 2.71Å; L247-L251 WeakPolarHBondContact O-CG 3.38Å; L247-L251 PolarHBondContact O-N 3.13Å; L247-V338 HydrophobicContact CB-CG1 4.32Å; L247-V338 HydrophobicContact CB-CG2 4Å; L247-V338 HydrophobicContact CD1-CG2 3.83Å; L247-I488 HydrophobicContact CD2-CG2 3.94Å; L247-W491 HydrophobicContact CD2-CE3 4.25Å; L247-W491 HydrophobicContact CD2-CZ3 3.75Å
248	A	98.4	Very high	97.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-37.1	178	0	0	0	0	0	112.9	A244 D245 H246 T252 E341 C342 L345	A244-A248 PolarHBondContact O-N 2.94Å; A244-A248 VanDerWaalsContact O-N 3.14Å; D245-A248 PolarHBondContact O-N 3.18Å; D245-A248 VanDerWaalsContact O-N 3.15Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.49Å; A248-T252 WeakPolarHBondContact O-CB 3.49Å; A248-T252 PolarHBondContact O-N 3.37Å; A248-T252 PolarHBondContact O-OG1 2.93Å; A248-E341 HydrophobicContact CB-CB 3.51Å; A248-C342 HydrophobicContact CB-CB 4.48Å; A248-C342 VanDerWaalsContact CB-SG 3.51Å; A248-L345 HydrophobicContact CB-CD1 3.92Å
249	E	97.8	Very high	97.9	Very high	36 Å²	36	36.4 Å²	36.4	17%	0.168	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-44.4	172.6	-72.8	-179.9	166.2	0	0	111.4	D245 H246 T252 L253 L345 R424 L482	D245-E249 WeakPolarHBondContact O-CG 3.47Å; D245-E249 PolarHBondContact O-N 3.1Å; H246-E249 PolarHBondContact O-N 2.77Å; E249-T252 PolarHBondContact O-N 2.97Å; E249-L253 WeakPolarHBondContact O-CB 3.29Å; E249-L253 PolarHBondContact O-N 2.71Å; E249-L345 HydrophobicContact CG-CD1 3.97Å; E249-R424 IonicContact OE1-CZ 3.46Å; E249-R424 IonicContact OE1-NE 3.36Å; E249-R424 PolarHBondContact OE1-NE 3.37Å; E249-R424 IonicContact OE1-NH2 3.58Å; E249-R424 PolarHBondContact OE1-NH2 3.44Å; E249-L482 HydrophobicContact CB-CD2 4.23Å; E249-L482 HydrophobicContact CG-CD2 3.89Å
250	Q	98.1	Very high	97.8	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.023	20%	0.204	C	C	.	.	H	α-helix	trans	-70.8	-35.9	179.8	-64.5	-48.6	-57	0	0	113.7	H246 L247 L254 Q483 D485 I488 Q489 L492	H246-Q250 WeakPolarHBondContact O-CG 3.35Å; H246-Q250 PolarHBondContact O-N 2.96Å; L247-Q250 PolarHBondContact O-N 2.71Å; Q250-L254 PolarHBondContact O-N 2.88Å; Q250-Q483 PolarHBondContact NE2-O 3.27Å; Q250-D485 VanDerWaalsContact CD-N 3.26Å; Q250-D485 HydrophobicContact CG-CB 3.88Å; Q250-I488 HydrophobicContact CB-CB 4.42Å; Q250-I488 HydrophobicContact CB-CG2 3.62Å; Q250-I488 HydrophobicContact CG-CB 3.89Å; Q250-I488 HydrophobicContact CG-CD1 3.96Å; Q250-I488 HydrophobicContact CG-CG2 3.63Å; Q250-Q489 PolarHBondContact O-NE2 3.25Å; Q250-L492 HydrophobicContact CB-CD1 4.36Å
251	L	98.3	Very high	97.7	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-43.3	169.5	-70.5	179.2	0	0	0	110.9	L247 L253 L254 D255 V297 V338 L492	L247-L251 WeakPolarHBondContact O-CG 3.38Å; L247-L251 PolarHBondContact O-N 3.13Å; L251-L253 PolarHBondContact O-N 3.2Å; L251-L254 PolarHBondContact O-N 2.89Å; L251-D255 WeakPolarHBondContact O-CB 3.16Å; L251-D255 PolarHBondContact O-N 2.87Å; L251-V297 HydrophobicContact CD1-CG1 4.24Å; L251-V297 HydrophobicContact CD2-CG1 4.49Å; L251-V297 HydrophobicContact CD2-CG2 3.71Å; L251-V338 HydrophobicContact CD1-CG1 3.95Å; L251-L492 HydrophobicContact CD2-CD1 4.03Å; L251-L492 HydrophobicContact CD2-CD2 3.93Å
252	T	98.4	Very high	97.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.9	-34.3	178.3	-56	0	0	0	0	112.7	A248 E249 A256 N347 V429 Y480 L482	A248-T252 WeakPolarHBondContact O-CB 3.49Å; A248-T252 PolarHBondContact O-N 3.37Å; A248-T252 PolarHBondContact O-OG1 2.93Å; E249-T252 PolarHBondContact O-N 2.97Å; T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 3.29Å; T252-N347 VanDerWaalsContact CA-ND2 3.29Å; T252-N347 WeakPolarHBondContact CA-ND2 3.43Å; T252-N347 HydrophobicContact CG2-CB 3.96Å; T252-N347 VanDerWaalsContact OG1-CB 3.31Å; T252-N347 WeakPolarHBondContact OG1-CB 3.3Å; T252-N347 PolarHBondContact OG1-ND2 3.01Å; T252-V429 HydrophobicContact CG2-CG2 4.41Å; T252-Y480 HydrophobicContact CG2-CD1 4.19Å; T252-Y480 HydrophobicContact CG2-CD2 4.37Å; T252-Y480 HydrophobicContact CG2-CE1 3.66Å; T252-Y480 HydrophobicContact CG2-CE2 3.87Å; T252-Y480 VanDerWaalsContact CG2-CZ 3.47Å; T252-L482 HydrophobicContact CG2-CD1 3.8Å
253	L	97.6	Very high	97.6	Very high	44 Å²	44	34.6 Å²	34.6	23%	0.23	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-48.8	173.3	-176.8	65	0	0	0	111.4	E249 L251 E257 L482 P484	E249-L253 WeakPolarHBondContact O-CB 3.29Å; E249-L253 PolarHBondContact O-N 2.71Å; L251-L253 PolarHBondContact O-N 3.2Å; L253-E257 WeakPolarHBondContact O-CB 3.39Å; L253-E257 PolarHBondContact O-N 2.9Å; L253-L482 HydrophobicContact CD1-CB 4.27Å; L253-P484 HydrophobicContact CD2-CB 3.92Å
254	L	97.6	Very high	97.4	Very high	39 Å²	39	29.8 Å²	29.8	20%	0.204	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-46.1	177.9	-68.3	173.1	0	0	0	112.5	Q250 L251 A256 E257 L258 L492	Q250-L254 PolarHBondContact O-N 2.88Å; L251-L254 PolarHBondContact O-N 2.89Å; L254-A256 VanDerWaalsContact C-N 3.34Å; L254-A256 PolarHBondContact O-N 3.24Å; L254-E257 PolarHBondContact O-N 3.38Å; L254-L258 WeakPolarHBondContact O-CG 3.4Å; L254-L258 PolarHBondContact O-N 2.84Å; L254-L258 VanDerWaalsContact O-N 3.14Å; L254-L492 HydrophobicContact CD1-CD1 3.97Å
255	D	98.2	Very high	97.3	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.027	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-36.6	-178.7	-62.8	-15.8	0	0	0	111.2	L251 F259 Q293 N347 S350 V429	L251-D255 WeakPolarHBondContact O-CB 3.16Å; L251-D255 PolarHBondContact O-N 2.87Å; D255-F259 VanDerWaalsContact O-CB 3.27Å; D255-F259 WeakPolarHBondContact O-CB 3.38Å; D255-F259 PolarHBondContact O-N 2.76Å; D255-Q293 WeakPolarHBondContact OD1-CG 3.49Å; D255-Q293 PolarHBondContact OD1-NE2 3.44Å; D255-N347 PolarHBondContact OD2-ND2 3.44Å; D255-N347 PolarHBondContact OD2-OD1 3.34Å; D255-S350 VanDerWaalsContact OD2-CB 3.32Å; D255-S350 WeakPolarHBondContact OD2-CB 3.49Å; D255-S350 PolarHBondContact OD2-OG 3.01Å; D255-V429 HydrophobicContact CB-CG1 4.14Å; D255-V429 HydrophobicContact CB-CG2 4.44Å
256	A	97.8	Very high	97.2	Very high	6 Å²	6	29.1 Å²	29.1	5%	0.05	15%	0.147	C	C	.	.	H	α-helix	trans	-69.8	-42	175.8	0	0	0	0	0	112.3	T252 L254 L258 F259 L260 V429 Y480	T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 3.29Å; L254-A256 VanDerWaalsContact C-N 3.34Å; L254-A256 PolarHBondContact O-N 3.24Å; A256-L258 PolarHBondContact O-N 3.17Å; A256-F259 PolarHBondContact O-N 3.36Å; A256-L260 WeakPolarHBondContact O-CB 3.22Å; A256-L260 VanDerWaalsContact O-CG 3.26Å; A256-L260 WeakPolarHBondContact O-CG 3.41Å; A256-L260 PolarHBondContact O-N 3.34Å; A256-V429 HydrophobicContact CB-CG2 4.06Å; A256-Y480 HydrophobicContact CB-CD2 3.81Å; A256-Y480 HydrophobicContact CB-CE2 4.12Å
257	E	96.9	Very high	97.1	Very high	112 Å²	112	25.5 Å²	25.5	52%	0.523	13%	0.131	S	C	.	.	H	α-helix	trans	-58.8	-47.7	175.3	-175.1	-176.9	159.4	0	0	110.9	L253 L254 F259 L260 N261	L253-E257 WeakPolarHBondContact O-CB 3.39Å; L253-E257 PolarHBondContact O-N 2.9Å; L254-E257 PolarHBondContact O-N 3.38Å; E257-F259 PolarHBondContact O-N 2.72Å; E257-L260 PolarHBondContact O-N 2.95Å; E257-N261 WeakPolarHBondContact O-CB 3.41Å; E257-N261 VanDerWaalsContact O-CG 3.31Å; E257-N261 PolarHBondContact O-N 3.13Å; E257-N261 PolarHBondContact O-ND2 3.32Å; E257-N261 VanDerWaalsContact O-ND2 3.16Å
258	L	97.6	Very high	97.1	Very high	45 Å²	45	25.5 Å²	25.5	24%	0.236	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-36.1	177.6	-68.4	174.3	0	0	0	112.8	L254 A256 N261 L262 A289 Q293	L254-L258 WeakPolarHBondContact O-CG 3.4Å; L254-L258 PolarHBondContact O-N 2.84Å; L254-L258 VanDerWaalsContact O-N 3.14Å; A256-L258 PolarHBondContact O-N 3.17Å; L258-N261 CarbonylContact O-C 3.55Å; L258-N261 PolarHBondContact O-N 3.29Å; L258-L262 PolarHBondContact O-N 3Å; L258-A289 HydrophobicContact CD2-CB 3.91Å; L258-Q293 HydrophobicContact CD1-CB 3.37Å; L258-Q293 HydrophobicContact CD1-CG 3.74Å
259	F	98	Very high	96.8	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-72.8	-32.7	176.2	-177.2	-121.6	0	0	0	113.1	D255 A256 E257 L262 V429 P430 L470 L473 Q474 C477	D255-F259 VanDerWaalsContact O-CB 3.27Å; D255-F259 WeakPolarHBondContact O-CB 3.38Å; D255-F259 PolarHBondContact O-N 2.76Å; A256-F259 PolarHBondContact O-N 3.36Å; E257-F259 PolarHBondContact O-N 2.72Å; F259-L262 HydrophobicContact CD2-CB 4.41Å; F259-L262 HydrophobicContact CD2-CD2 3.81Å; F259-L262 HydrophobicContact CE2-CD2 3.86Å; F259-L262 WeakPolarHBondContact O-CB 3.47Å; F259-L262 PolarHBondContact O-N 2.79Å; F259-V429 HydrophobicContact CB-CG1 4.02Å; F259-V429 HydrophobicContact CD1-CG1 4.41Å; F259-V429 HydrophobicContact CG-CG1 4.25Å; F259-P430 HydrophobicContact CD2-CG 4.27Å; F259-P430 VanDerWaalsContact CE1-CD 3.41Å; F259-P430 HydrophobicContact CE1-CG 3.93Å; F259-P430 HydrophobicContact CE2-CG 3.61Å; F259-P430 VanDerWaalsContact CZ-CD 3.5Å; F259-P430 HydrophobicContact CZ-CG 3.43Å; F259-P430 VanDerWaalsContact CZ-CG 3.43Å; F259-L470 HydrophobicContact CE2-CD2 4.09Å; F259-L473 HydrophobicContact CE1-CB 4.02Å; F259-L473 HydrophobicContact CZ-CB 3.81Å; F259-Q474 HydrophobicContact CD1-CG 4.29Å; F259-Q474 HydrophobicContact CE1-CB 4.42Å; F259-Q474 HydrophobicContact CE1-CG 3.81Å; F259-Q474 HydrophobicContact CE2-CG 4.08Å; F259-Q474 HydrophobicContact CZ-CG 3.67Å; F259-Q474 PolarHBondContact O-NE2 3.4Å; F259-C477 HydrophobicContact CD1-CB 3.88Å; F259-C477 HydrophobicContact CE1-CB 4.08Å
260	L	96.2	Very high	96.4	Very high	56 Å²	56	24.8 Å²	24.8	29%	0.293	13%	0.133	S	C	.	.	H	α-helix	trans	-71.3	-32.6	171.6	-70.8	174.3	0	0	0	112.1	A256 E257 L262 Q474 C477 R478	A256-L260 WeakPolarHBondContact O-CB 3.22Å; A256-L260 VanDerWaalsContact O-CG 3.26Å; A256-L260 WeakPolarHBondContact O-CG 3.41Å; A256-L260 PolarHBondContact O-N 3.34Å; E257-L260 PolarHBondContact O-N 2.95Å; L260-L262 VanDerWaalsContact C-N 3.28Å; L260-Q474 VanDerWaalsContact CD2-O 3.24Å; L260-Q474 WeakPolarHBondContact CD2-O 3.46Å; L260-C477 HydrophobicContact CD2-CB 3.98Å; L260-C477 HydrophobicContact CG-CB 4.44Å; L260-R478 HydrophobicContact CD1-CG 4.23Å; L260-R478 HydrophobicContact CD2-CG 3.48Å; L260-R478 VanDerWaalsContact CD2-CG 3.48Å
261	N	95.8	Very high	96.1	Very high	97 Å²	97	26.8 Å²	26.8	52%	0.519	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	2.4	172.3	-69	-33.4	0	0	0	113.7	E257 L258 I263 S286	E257-N261 WeakPolarHBondContact O-CB 3.41Å; E257-N261 VanDerWaalsContact O-CG 3.31Å; E257-N261 PolarHBondContact O-N 3.13Å; E257-N261 PolarHBondContact O-ND2 3.32Å; E257-N261 VanDerWaalsContact O-ND2 3.16Å; L258-N261 CarbonylContact O-C 3.55Å; L258-N261 PolarHBondContact O-N 3.29Å; N261-I263 PolarHBondContact O-N 3.21Å; N261-S286 VanDerWaalsContact O-CB 3.32Å; N261-S286 WeakPolarHBondContact O-CB 3.23Å
262	L	96.6	Very high	95.8	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	14%	0.144	C	C	.	.			trans	-72.3	119.5	177.4	-177	70.9	0	0	0	110.8	L258 F259 L260 P264 V287 L432 Q474	L258-L262 PolarHBondContact O-N 3Å; F259-L262 HydrophobicContact CD2-CB 4.41Å; F259-L262 HydrophobicContact CD2-CD2 3.81Å; F259-L262 HydrophobicContact CE2-CD2 3.86Å; F259-L262 WeakPolarHBondContact O-CB 3.47Å; F259-L262 PolarHBondContact O-N 2.79Å; L260-L262 VanDerWaalsContact C-N 3.28Å; L262-P264 VanDerWaalsContact O-CD 3.23Å; L262-P264 WeakPolarHBondContact O-CD 3.33Å; L262-V287 HydrophobicContact CD1-CB 4.49Å; L262-V287 HydrophobicContact CD1-CG2 3.96Å; L262-L432 HydrophobicContact CD1-CD2 3.81Å; L262-L432 HydrophobicContact CD2-CD1 3.65Å; L262-L432 HydrophobicContact CD2-CD2 3.93Å; L262-L432 HydrophobicContact CD2-CG 4.45Å; L262-Q474 PolarHBondContact O-NE2 3.03Å
263	I	95.4	Very high	95.4	Very high	39 Å²	39	28.2 Å²	28.2	20%	0.2	16%	0.157	C	C	.	.			trans	-87.1	108.2	175.9	-62.4	172.9	0	0	0	108.1	E172 N261 S265 Q266 S286	E172-I263 HydrophobicContact CB-CD1 3.89Å; E172-I263 HydrophobicContact CB-CG1 4.42Å; E172-I263 HydrophobicContact CG-CD1 3.88Å; E172-I263 HydrophobicContact CG-CG1 4.04Å; N261-I263 PolarHBondContact O-N 3.21Å; I263-S265 VanDerWaalsContact C-N 3.3Å; I263-S265 WeakPolarHBondContact CG2-OG 3.41Å; I263-S265 PolarHBondContact O-N 2.83Å; I263-Q266 HydrophobicContact CB-CG 4.01Å; I263-Q266 HydrophobicContact CG2-CG 4.02Å; I263-Q266 WeakPolarHBondContact O-CB 3.45Å; I263-Q266 PolarHBondContact O-N 3.3Å; I263-S286 PolarHBondContact N-OG 2.94Å
264	P	95.8	Very high	94.9	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.026	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-65.4	-29.8	-165.4	-25.7	38	0	0	0	114.1	L262 Q266 C267 L467 R471	L262-P264 VanDerWaalsContact O-CD 3.23Å; L262-P264 WeakPolarHBondContact O-CD 3.33Å; P264-Q266 PolarHBondContact O-N 2.88Å; P264-C267 VanDerWaalsContact O-CB 3.24Å; P264-C267 WeakPolarHBondContact O-CB 3.41Å; P264-C267 PolarHBondContact O-N 3.16Å; P264-L467 HydrophobicContact CB-CB 4.39Å; P264-L467 HydrophobicContact CB-CD2 4.09Å; P264-L467 WeakPolarHBondContact O-CD2 3.46Å; P264-R471 HydrophobicContact CG-CG 4.12Å
265	S	94.7	Very high	94.5	Very high	7 Å²	7	27 Å²	27	5%	0.049	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-61	-27.2	175	54.6	0	0	0	0	112.8	I263 C267 L268	I263-S265 VanDerWaalsContact C-N 3.3Å; I263-S265 WeakPolarHBondContact CG2-OG 3.41Å; I263-S265 PolarHBondContact O-N 2.83Å; S265-C267 PolarHBondContact O-N 3.46Å; S265-L268 WeakPolarHBondContact O-CB 3.32Å; S265-L268 WeakPolarHBondContact O-CD1 3.44Å; S265-L268 VanDerWaalsContact O-CG 3.24Å; S265-L268 WeakPolarHBondContact O-CG 3.48Å; S265-L268 PolarHBondContact O-N 2.66Å
266	Q	95.6	Very high	94	Very high	32 Å²	32	31.1 Å²	31.1	15%	0.15	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-68.7	-15	173.8	-61.2	-177.4	4.3	0	0	113.2	I263 P264 L268 C284 S286 V287	I263-Q266 HydrophobicContact CB-CG 4.01Å; I263-Q266 HydrophobicContact CG2-CG 4.02Å; I263-Q266 WeakPolarHBondContact O-CB 3.45Å; I263-Q266 PolarHBondContact O-N 3.3Å; P264-Q266 PolarHBondContact O-N 2.88Å; Q266-L268 VanDerWaalsContact C-N 3.34Å; Q266-C284 HydrophobicContact CB-CB 4.07Å; Q266-C284 PolarHBondContact O-SG 3.08Å; Q266-C284 VanDerWaalsContact O-SG 3.35Å; Q266-C284 VanDerWaalsContact OE1-C 3.23Å; Q266-S286 VanDerWaalsContact OE1-N 3.13Å; Q266-S286 PolarHBondContact OE1-OG 3.07Å; Q266-V287 HydrophobicContact CB-CG2 3.7Å
267	C	96.9	Very high	93.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-81.8	-12.5	176.6	-59	0	0	0	0	113.2	P264 S265 L436 L439 L467 L470	P264-C267 VanDerWaalsContact O-CB 3.24Å; P264-C267 WeakPolarHBondContact O-CB 3.41Å; P264-C267 PolarHBondContact O-N 3.16Å; S265-C267 PolarHBondContact O-N 3.46Å; C267-L436 HydrophobicContact CB-CD2 3.74Å; C267-L439 HydrophobicContact CB-CD1 3.7Å; C267-L439 VanDerWaalsContact O-CD1 3.25Å; C267-L439 WeakPolarHBondContact O-CD1 3.48Å; C267-L467 HydrophobicContact CB-CD2 4.45Å; C267-L470 HydrophobicContact CB-CD1 4.46Å
268	L	96.5	Very high	93	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-57.9	138.8	-177.4	-69.4	171	0	0	0	111.5	T123 A126 S265 Q266 G270 L271 W272 L439 E463 L467	T123-L268 HydrophobicContact CG2-CD2 4.42Å; A126-L268 HydrophobicContact CB-CD1 3.99Å; S265-L268 WeakPolarHBondContact O-CB 3.32Å; S265-L268 WeakPolarHBondContact O-CD1 3.44Å; S265-L268 VanDerWaalsContact O-CG 3.24Å; S265-L268 WeakPolarHBondContact O-CG 3.48Å; S265-L268 PolarHBondContact O-N 2.66Å; Q266-L268 VanDerWaalsContact C-N 3.34Å; L268-G270 VanDerWaalsContact C-N 3.32Å; L268-G270 PolarHBondContact O-N 2.7Å; L268-L271 PolarHBondContact O-N 2.96Å; L268-W272 PolarHBondContact O-N 3.15Å; L268-L439 HydrophobicContact CD2-CD2 4.31Å; L268-E463 HydrophobicContact CD2-CB 3.71Å; L268-E463 HydrophobicContact CD2-CG 4.13Å; L268-L467 HydrophobicContact CD1-CD1 4.44Å; L268-L467 HydrophobicContact CD2-CD1 3.89Å; L268-L467 HydrophobicContact CD2-CD2 4.41Å; L268-L467 HydrophobicContact CD2-CG 4.27Å; L268-L467 HydrophobicContact CG-CD1 4.17Å
269	G	92.5	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.3	-42.6	-173.5	0	0	0	0	0	113.1	L271 G273	G269-L271 PolarHBondContact O-N 3.31Å; G269-L271 VanDerWaalsContact O-N 3.08Å; G269-G273 WeakPolarHBondContact O-CA 3.39Å; G269-G273 PolarHBondContact O-N 3.02Å
270	G	90.1	Very high	91.7	Very high	22 Å²	22	39.5 Å²	39.5	23%	0.227	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-10.2	175.6	0	0	0	0	0	115.5	L268 H274 D443	L268-G270 VanDerWaalsContact C-N 3.32Å; L268-G270 PolarHBondContact O-N 2.7Å; G270-H274 PolarHBondContact O-ND1 3.43Å; G270-D443 VanDerWaalsContact N-CG 3.33Å; G270-D443 PolarHBondContact N-OD1 3.01Å; G270-D443 PolarHBondContact N-OD2 3.45Å
271	L	91.4	Very high	91	Very high	46 Å²	46	40.9 Å²	40.9	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-107.9	-58.4	171.2	-59.8	-179.1	0	0	0	110.9	L268 G269 G273 H274 R275	L268-L271 PolarHBondContact O-N 2.96Å; G269-L271 PolarHBondContact O-N 3.31Å; G269-L271 VanDerWaalsContact O-N 3.08Å; L271-G273 PolarHBondContact O-N 3.18Å; L271-H274 PolarHBondContact O-N 2.91Å; L271-H274 VanDerWaalsContact O-N 3.09Å; L271-R275 PolarHBondContact O-N 3.45Å
272	W	92.9	Very high	90.3	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.019	25%	0.249	C	C	.	.	H	α-helix	trans	-67.4	-32.3	-175.3	-179.9	-113.9	0	0	0	113.9	L268 H274 R275 C284 V287 R288 V291 L436	L268-W272 PolarHBondContact O-N 3.15Å; W272-H274 PolarHBondContact O-N 3.45Å; W272-R275 VanDerWaalsContact CE2-NH1 3.31Å; W272-R275 HydrophobicContact CE3-CB 4.3Å; W272-R275 HydrophobicContact CE3-CG 4.49Å; W272-R275 VanDerWaalsContact CH2-CD 3.47Å; W272-R275 HydrophobicContact CZ3-CB 4.48Å; W272-R275 VanDerWaalsContact CZ3-CD 3.45Å; W272-R275 WeakPolarHBondContact O-CB 3.41Å; W272-R275 WeakPolarHBondContact O-CD 3.19Å; W272-R275 WeakPolarHBondContact O-CG 3.37Å; W272-C284 HydrophobicContact CE3-CB 3.74Å; W272-C284 HydrophobicContact CZ3-CB 4.1Å; W272-V287 HydrophobicContact CD2-CG1 3.83Å; W272-V287 HydrophobicContact CE3-CB 3.96Å; W272-V287 HydrophobicContact CE3-CG1 3.61Å; W272-V287 HydrophobicContact CH2-CB 4.41Å; W272-V287 HydrophobicContact CH2-CG1 3.75Å; W272-V287 HydrophobicContact CZ2-CG1 3.96Å; W272-V287 HydrophobicContact CZ3-CB 3.85Å; W272-V287 HydrophobicContact CZ3-CG1 3.57Å; W272-R288 HydrophobicContact CH2-CG 4.38Å; W272-R288 HydrophobicContact CZ3-CG 3.97Å; W272-V291 HydrophobicContact CH2-CG2 4.35Å; W272-V291 HydrophobicContact CZ2-CG2 4.31Å; W272-L436 HydrophobicContact CD2-CD2 4.33Å; W272-L436 HydrophobicContact CG-CD2 3.93Å; W272-L436 HydrophobicContact CZ2-CD1 4.24Å
273	G	89.8	Confident	89.8	Confident	27 Å²	27	45.3 Å²	45.3	28%	0.278	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-14.9	174.2	0	0	0	0	0	113.8	G269 L271	G269-G273 WeakPolarHBondContact O-CA 3.39Å; G269-G273 PolarHBondContact O-N 3.02Å; L271-G273 PolarHBondContact O-N 3.18Å
274	H	87.4	Confident	89.6	Confident	48 Å²	48	43.8 Å²	43.8	22%	0.222	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-2.1	-178.2	-63.3	138.7	0	0	0	114.2	G270 L271 W272 D276 R277 H280	G270-H274 PolarHBondContact O-ND1 3.43Å; L271-H274 PolarHBondContact O-N 2.91Å; L271-H274 VanDerWaalsContact O-N 3.09Å; W272-H274 PolarHBondContact O-N 3.45Å; H274-D276 PolarHBondContact O-N 3.22Å; H274-R277 PolarHBondContact CD2-NH1 3.17Å; H274-R277 VanDerWaalsContact CD2-NH1 3.33Å; H274-R277 PolarHBondContact CD2-NH2 3.44Å; H274-R277 PolarHBondContact NE2-NH1 3.21Å; H274-R277 PolarHBondContact NE2-NH2 3.45Å; H274-R277 VanDerWaalsContact O-CB 3.32Å; H274-R277 WeakPolarHBondContact O-CB 3.43Å; H274-R277 WeakPolarHBondContact O-CG 3.28Å; H274-R277 PolarHBondContact O-N 3.24Å; H274-H280 WeakPolarHBondContact O-CB 3.32Å; H274-H280 PolarHBondContact O-CD2 3.06Å; H274-H280 VanDerWaalsContact O-CD2 3.26Å
275	R	88.1	Confident	89.5	Confident	10 Å²	10	47.2 Å²	47.2	4%	0.038	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-23.2	-177.9	82.2	-174	179.7	-106.9	-15.3	115.3	L271 W272 R288 I530	L271-R275 PolarHBondContact O-N 3.45Å; W272-R275 VanDerWaalsContact CE2-NH1 3.31Å; W272-R275 HydrophobicContact CE3-CB 4.3Å; W272-R275 HydrophobicContact CE3-CG 4.49Å; W272-R275 VanDerWaalsContact CH2-CD 3.47Å; W272-R275 HydrophobicContact CZ3-CB 4.48Å; W272-R275 VanDerWaalsContact CZ3-CD 3.45Å; W272-R275 WeakPolarHBondContact O-CB 3.41Å; W272-R275 WeakPolarHBondContact O-CD 3.19Å; W272-R275 WeakPolarHBondContact O-CG 3.37Å; R275-R288 PolarHBondContact O-NH2 2.93Å; R275-I530 PolarHBondContact NH2-O 3.36Å
276	D	87.1	Confident	89.5	Confident	91 Å²	91	47.7 Å²	47.7	49%	0.487	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.3	-177.1	-56.4	-30.4	0	0	0	111.9	H274	H274-D276 PolarHBondContact O-N 3.22Å
277	R	88.9	Confident	89.6	Confident	104 Å²	104	46.1 Å²	46.1	39%	0.392	27%	0.273	S	S	.	.	S	Bend	trans	-78.3	154.3	175	-70.1	-176.2	174.8	159.7	3.7	111.7	H274 G279 H280	H274-R277 PolarHBondContact CD2-NH1 3.17Å; H274-R277 VanDerWaalsContact CD2-NH1 3.33Å; H274-R277 PolarHBondContact CD2-NH2 3.44Å; H274-R277 PolarHBondContact NE2-NH1 3.21Å; H274-R277 PolarHBondContact NE2-NH2 3.45Å; H274-R277 VanDerWaalsContact O-CB 3.32Å; H274-R277 WeakPolarHBondContact O-CB 3.43Å; H274-R277 WeakPolarHBondContact O-CG 3.28Å; H274-R277 PolarHBondContact O-N 3.24Å; R277-G279 PolarHBondContact O-N 3.09Å; R277-H280 HydrophobicContact CB-CB 4.34Å; R277-H280 WeakPolarHBondContact O-CB 3.28Å; R277-H280 PolarHBondContact O-N 3.29Å
278	P	85.6	Confident	89.5	Confident	127 Å²	127	48.9 Å²	48.9	83%	0.825	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	136.8	171.5	-27.5	35.8	0	0	0	112.4	H280	P278-H280 PolarHBondContact O-N 3.45Å; P278-H280 PolarHBondContact O-ND1 3.17Å
279	G	83.7	Confident	89.4	Confident	56 Å²	56	50.7 Å²	50.7	58%	0.577	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-10.4	-176.4	0	0	0	0	0	115.9	R277 S281 H282	R277-G279 PolarHBondContact O-N 3.09Å; G279-S281 VanDerWaalsContact C-N 3.35Å; G279-S281 PolarHBondContact O-N 3.17Å; G279-H282 PolarHBondContact O-CE1 3.08Å; G279-H282 PolarHBondContact O-ND1 3.3Å
280	H	84.6	Confident	89.6	Confident	55 Å²	55	51.4 Å²	51.4	26%	0.255	30%	0.303	S	S	.	.			trans	-92.1	10	-175.4	-62.8	48.8	0	0	0	113.6	H274 R277 P278 H282 L283 R288	H274-H280 WeakPolarHBondContact O-CB 3.32Å; H274-H280 PolarHBondContact O-CD2 3.06Å; H274-H280 VanDerWaalsContact O-CD2 3.26Å; R277-H280 HydrophobicContact CB-CB 4.34Å; R277-H280 WeakPolarHBondContact O-CB 3.28Å; R277-H280 PolarHBondContact O-N 3.29Å; P278-H280 PolarHBondContact O-N 3.45Å; P278-H280 PolarHBondContact O-ND1 3.17Å; H280-H282 PolarHBondContact O-N 3.5Å; H280-L283 HydrophobicContact CB-CD1 3.84Å; H280-L283 HydrophobicContact CB-CG 4.33Å; H280-L283 WeakPolarHBondContact O-CB 3.39Å; H280-L283 PolarHBondContact O-N 3.5Å; H280-R288 PolarHBondContact O-NH2 3.26Å
281	S	81.1	Confident	89.8	Confident	85 Å²	85	51.7 Å²	51.7	59%	0.594	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-40.3	-178.7	50	0	0	0	0	113.4	G279 L283 R288	G279-S281 VanDerWaalsContact C-N 3.35Å; G279-S281 PolarHBondContact O-N 3.17Å; S281-L283 VanDerWaalsContact C-N 3.33Å; S281-R288 PolarHBondContact O-NE 2.96Å; S281-R288 PolarHBondContact O-NH2 3.43Å; S281-R288 VanDerWaalsContact O-NH2 3.14Å
282	H	81.9	Confident	90	Very high	135 Å²	135	53.7 Å²	53.7	63%	0.625	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.6	179.7	64.8	-89.1	0	0	0	113.8	G279 H280	G279-H282 PolarHBondContact O-CE1 3.08Å; G279-H282 PolarHBondContact O-ND1 3.3Å; H280-H282 PolarHBondContact O-N 3.5Å
283	L	86.2	Confident	90.1	Very high	58 Å²	58	54.6 Å²	54.6	30%	0.304	32%	0.319	S	S	.	.	S	Bend	trans	-76.2	151.8	-179.3	-63.2	-176.4	0	0	0	112.1	H280 S281 R288	H280-L283 HydrophobicContact CB-CD1 3.84Å; H280-L283 HydrophobicContact CB-CG 4.33Å; H280-L283 WeakPolarHBondContact O-CB 3.39Å; H280-L283 PolarHBondContact O-N 3.5Å; S281-L283 VanDerWaalsContact C-N 3.33Å; L283-R288 PolarHBondContact O-NE 3.35Å
284	C	91	Very high	90.5	Very high	8 Å²	8	54.4 Å²	54.4	5%	0.054	31%	0.311	C	S	.	.	S	Bend	trans	57.1	46.4	179.9	-48	0	0	0	0	114.6	Q266 W272 S286 V287 R288	Q266-C284 HydrophobicContact CB-CB 4.07Å; Q266-C284 PolarHBondContact O-SG 3.08Å; Q266-C284 VanDerWaalsContact O-SG 3.35Å; Q266-C284 VanDerWaalsContact OE1-C 3.23Å; W272-C284 HydrophobicContact CE3-CB 3.74Å; W272-C284 HydrophobicContact CZ3-CB 4.1Å; C284-S286 VanDerWaalsContact C-N 3.32Å; C284-S286 PolarHBondContact O-N 3.08Å; C284-V287 HydrophobicContact CB-CB 4.11Å; C284-V287 HydrophobicContact CB-CG2 4.04Å; C284-V287 WeakPolarHBondContact O-CB 3.38Å; C284-V287 PolarHBondContact O-N 3.39Å; C284-V287 VanDerWaalsContact O-N 3.14Å; C284-R288 PolarHBondContact O-N 2.81Å
285	P	93.7	Very high	90.8	Very high	76 Å²	76	55.2 Å²	55.2	49%	0.494	32%	0.317	S	S	.	.	H	α-helix	trans	-59.3	-36	-171.2	24.2	-35.3	0	0	0	114	R288 A289	P285-R288 PolarHBondContact O-N 2.92Å; P285-A289 WeakPolarHBondContact O-CB 3.46Å; P285-A289 PolarHBondContact O-N 2.89Å
286	S	95.3	Very high	91.2	Very high	16 Å²	16	57.8 Å²	57.8	11%	0.112	33%	0.328	C	S	.	.	H	α-helix	trans	-69.9	-35.8	178.8	66.5	0	0	0	0	112.5	N261 I263 Q266 C284 T290	N261-S286 VanDerWaalsContact O-CB 3.32Å; N261-S286 WeakPolarHBondContact O-CB 3.23Å; I263-S286 PolarHBondContact N-OG 2.94Å; Q266-S286 VanDerWaalsContact OE1-N 3.13Å; Q266-S286 PolarHBondContact OE1-OG 3.07Å; C284-S286 VanDerWaalsContact C-N 3.32Å; C284-S286 PolarHBondContact O-N 3.08Å; S286-T290 PolarHBondContact O-N 3Å; S286-T290 VanDerWaalsContact O-N 3.15Å; S286-T290 PolarHBondContact O-OG1 2.71Å
287	V	96.6	Very high	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-44.6	172.5	-169.6	0	0	0	0	110.2	L262 Q266 W272 C284 T290 V291 L432 L436	L262-V287 HydrophobicContact CD1-CB 4.49Å; L262-V287 HydrophobicContact CD1-CG2 3.96Å; Q266-V287 HydrophobicContact CB-CG2 3.7Å; W272-V287 HydrophobicContact CD2-CG1 3.83Å; W272-V287 HydrophobicContact CE3-CB 3.96Å; W272-V287 HydrophobicContact CE3-CG1 3.61Å; W272-V287 HydrophobicContact CH2-CB 4.41Å; W272-V287 HydrophobicContact CH2-CG1 3.75Å; W272-V287 HydrophobicContact CZ2-CG1 3.96Å; W272-V287 HydrophobicContact CZ3-CB 3.85Å; W272-V287 HydrophobicContact CZ3-CG1 3.57Å; C284-V287 HydrophobicContact CB-CB 4.11Å; C284-V287 HydrophobicContact CB-CG2 4.04Å; C284-V287 WeakPolarHBondContact O-CB 3.38Å; C284-V287 PolarHBondContact O-N 3.39Å; C284-V287 VanDerWaalsContact O-N 3.14Å; V287-T290 PolarHBondContact O-N 3.2Å; V287-V291 WeakPolarHBondContact O-CG2 3.41Å; V287-V291 PolarHBondContact O-N 3Å; V287-L432 HydrophobicContact CG1-CD2 4.16Å; V287-L436 HydrophobicContact CG1-CD1 3.76Å; V287-L436 HydrophobicContact CG1-CD2 3.84Å; V287-L436 HydrophobicContact CG1-CG 4.46Å
288	R	94.7	Very high	92.1	Very high	57 Å²	57	49.5 Å²	49.5	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-60	-47.4	176	-70.1	-175.2	-175.6	-98.1	7.9	111.6	W272 R275 H280 S281 L283 C284 P285 T290 V291 T292	W272-R288 HydrophobicContact CH2-CG 4.38Å; W272-R288 HydrophobicContact CZ3-CG 3.97Å; R275-R288 PolarHBondContact O-NH2 2.93Å; H280-R288 PolarHBondContact O-NH2 3.26Å; S281-R288 PolarHBondContact O-NE 2.96Å; S281-R288 PolarHBondContact O-NH2 3.43Å; S281-R288 VanDerWaalsContact O-NH2 3.14Å; L283-R288 PolarHBondContact O-NE 3.35Å; C284-R288 PolarHBondContact O-N 2.81Å; P285-R288 PolarHBondContact O-N 2.92Å; R288-T290 VanDerWaalsContact C-N 3.34Å; R288-T290 PolarHBondContact O-N 2.88Å; R288-V291 PolarHBondContact O-N 3.06Å; R288-T292 WeakPolarHBondContact O-CB 3.36Å; R288-T292 PolarHBondContact O-N 2.69Å; R288-T292 PolarHBondContact O-OG1 3.25Å; R288-T292 VanDerWaalsContact O-OG1 3.12Å
289	A	95.3	Very high	92.6	Very high	38 Å²	38	44 Å²	44	31%	0.314	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-45.3	178.3	0	0	0	0	0	112.1	L258 P285 V291 T292 Q293	L258-A289 HydrophobicContact CD2-CB 3.91Å; P285-A289 WeakPolarHBondContact O-CB 3.46Å; P285-A289 PolarHBondContact O-N 2.89Å; A289-V291 PolarHBondContact O-N 2.62Å; A289-T292 PolarHBondContact O-N 3.37Å; A289-Q293 PolarHBondContact O-N 3.31Å
290	T	96.4	Very high	93.2	Very high	16 Å²	16	41.6 Å²	41.6	10%	0.098	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-43.9	175.5	-52.2	0	0	0	0	112.1	S286 V287 R288 F294 L432	S286-T290 PolarHBondContact O-N 3Å; S286-T290 VanDerWaalsContact O-N 3.15Å; S286-T290 PolarHBondContact O-OG1 2.71Å; V287-T290 PolarHBondContact O-N 3.2Å; R288-T290 VanDerWaalsContact C-N 3.34Å; R288-T290 PolarHBondContact O-N 2.88Å; T290-F294 PolarHBondContact O-N 2.78Å; T290-F294 VanDerWaalsContact O-N 3.09Å; T290-L432 HydrophobicContact CG2-CB 4.41Å; T290-L432 HydrophobicContact CG2-CD2 3.85Å
291	V	94.7	Very high	93.9	Very high	27 Å²	27	39 Å²	39	16%	0.164	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-37.8	177.3	170.9	0	0	0	0	111.9	W272 V287 R288 A289 F294 N295 V579	W272-V291 HydrophobicContact CH2-CG2 4.35Å; W272-V291 HydrophobicContact CZ2-CG2 4.31Å; V287-V291 WeakPolarHBondContact O-CG2 3.41Å; V287-V291 PolarHBondContact O-N 3Å; R288-V291 PolarHBondContact O-N 3.06Å; A289-V291 PolarHBondContact O-N 2.62Å; V291-F294 PolarHBondContact O-N 2.93Å; V291-N295 WeakPolarHBondContact O-CB 3.26Å; V291-N295 PolarHBondContact O-N 3.35Å; V291-N295 PolarHBondContact O-ND2 3.15Å; V291-V579 HydrophobicContact CG1-CB 4.36Å; V291-V579 HydrophobicContact CG1-CG2 4.42Å
292	T	94.6	Very high	94.7	Very high	88 Å²	88	35.7 Å²	35.7	54%	0.54	20%	0.199	S	C	.	.	H	α-helix	trans	-64.3	-42.5	176.3	-67.7	0	0	0	0	111.5	R288 A289 N295 K296	R288-T292 WeakPolarHBondContact O-CB 3.36Å; R288-T292 PolarHBondContact O-N 2.69Å; R288-T292 PolarHBondContact O-OG1 3.25Å; R288-T292 VanDerWaalsContact O-OG1 3.12Å; A289-T292 PolarHBondContact O-N 3.37Å; T292-N295 PolarHBondContact O-N 2.88Å; T292-K296 WeakPolarHBondContact O-CB 3.48Å; T292-K296 PolarHBondContact O-N 3.28Å
293	Q	96.5	Very high	95.5	Very high	24 Å²	24	29.4 Å²	29.4	11%	0.112	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-47.3	173.9	169.2	64.1	1	0	0	111.8	D255 L258 A289 N295 K296 V297	D255-Q293 WeakPolarHBondContact OD1-CG 3.49Å; D255-Q293 PolarHBondContact OD1-NE2 3.44Å; L258-Q293 HydrophobicContact CD1-CB 3.37Å; L258-Q293 HydrophobicContact CD1-CG 3.74Å; A289-Q293 PolarHBondContact O-N 3.31Å; Q293-N295 VanDerWaalsContact C-N 3.29Å; Q293-N295 PolarHBondContact O-N 2.84Å; Q293-K296 WeakPolarHBondContact O-CA 3.23Å; Q293-K296 WeakPolarHBondContact O-CB 3.42Å; Q293-K296 PolarHBondContact O-N 2.88Å; Q293-V297 PolarHBondContact O-N 3.46Å
294	F	97.3	Very high	96	Very high	23 Å²	23	26.6 Å²	26.6	10%	0.101	16%	0.156	C	C	.	.	H	α-helix	trans	-53.7	-46.5	174.2	177.5	-85.1	0	0	0	111.8	T290 V291 K296 V297 A298 S349 Y352 A353 Y431	T290-F294 PolarHBondContact O-N 2.78Å; T290-F294 VanDerWaalsContact O-N 3.09Å; V291-F294 PolarHBondContact O-N 2.93Å; F294-K296 VanDerWaalsContact C-N 3.32Å; F294-K296 PolarHBondContact O-N 3.34Å; F294-V297 PolarHBondContact O-N 3.46Å; F294-A298 PolarHBondContact O-N 2.93Å; F294-S349 WeakPolarHBondContact CE2-O 3.24Å; F294-Y352 AromaticContact CE2-CD1 3.8Å; F294-Y352 HydrophobicContact CE2-CD1 3.8Å; F294-Y352 HydrophobicContact CE2-CG 4.41Å; F294-Y352 AromaticContact CZ-CD1 3.62Å; F294-Y352 HydrophobicContact CZ-CD1 3.62Å; F294-Y352 HydrophobicContact CZ-CE1 4.18Å; F294-Y352 HydrophobicContact CZ-CG 4.42Å; F294-A353 HydrophobicContact CD2-CB 3.75Å; F294-A353 HydrophobicContact CE2-CB 3.66Å; F294-A353 VanDerWaalsContact CE2-N 3.33Å; F294-A353 HydrophobicContact CG-CB 4.26Å; F294-A353 HydrophobicContact CZ-CB 4.1Å; F294-Y431 HydrophobicContact CD2-CD2 4.02Å; F294-Y431 AromaticContact CD2-CE2 3.86Å; F294-Y431 HydrophobicContact CD2-CE2 3.86Å; F294-Y431 HydrophobicContact CE1-CE2 4.36Å; F294-Y431 AromaticContact CE2-CD2 3.64Å; F294-Y431 HydrophobicContact CE2-CD2 3.64Å; F294-Y431 AromaticContact CE2-CE2 3.42Å; F294-Y431 HydrophobicContact CE2-CE2 3.42Å; F294-Y431 VanDerWaalsContact CE2-CE2 3.42Å; F294-Y431 HydrophobicContact CZ-CD2 4.35Å; F294-Y431 AromaticContact CZ-CE2 3.72Å; F294-Y431 HydrophobicContact CZ-CE2 3.72Å
295	N	94.4	Very high	96.4	Very high	66 Å²	66	26.2 Å²	26.2	35%	0.353	15%	0.153	S	C	.	.	H	α-helix	trans	-65.8	-32.5	176.3	-69.3	-28	0	0	0	112.5	V291 T292 Q293 G299	V291-N295 WeakPolarHBondContact O-CB 3.26Å; V291-N295 PolarHBondContact O-N 3.35Å; V291-N295 PolarHBondContact O-ND2 3.15Å; T292-N295 PolarHBondContact O-N 2.88Å; Q293-N295 VanDerWaalsContact C-N 3.29Å; Q293-N295 PolarHBondContact O-N 2.84Å; N295-G299 PolarHBondContact O-N 3.03Å
296	K	95.6	Very high	96.6	Very high	63 Å²	63	22.6 Å²	22.6	27%	0.274	13%	0.13	S	C	.	.	H	α-helix	trans	-67.5	-42.2	175.4	-164.4	177.7	-168.7	-175.8	0	111.6	T292 Q293 F294 G299 A300 L492 Q493	T292-K296 WeakPolarHBondContact O-CB 3.48Å; T292-K296 PolarHBondContact O-N 3.28Å; Q293-K296 WeakPolarHBondContact O-CA 3.23Å; Q293-K296 WeakPolarHBondContact O-CB 3.42Å; Q293-K296 PolarHBondContact O-N 2.88Å; F294-K296 VanDerWaalsContact C-N 3.32Å; F294-K296 PolarHBondContact O-N 3.34Å; K296-G299 PolarHBondContact O-N 2.96Å; K296-A300 WeakPolarHBondContact O-CB 3.38Å; K296-A300 PolarHBondContact O-N 3.4Å; K296-L492 WeakPolarHBondContact CE-O 3.2Å; K296-L492 PolarHBondContact NZ-O 2.91Å; K296-Q493 PolarHBondContact NZ-O 2.92Å
297	V	97.5	Very high	96.6	Very high	6 Å²	6	22 Å²	22	4%	0.036	13%	0.125	C	C	.	.	H	α-helix	trans	-64.6	-46.8	174.8	179.3	0	0	0	0	110.9	L251 Q293 F294 G299 A300 V301 A353 V354	L251-V297 HydrophobicContact CD1-CG1 4.24Å; L251-V297 HydrophobicContact CD2-CG1 4.49Å; L251-V297 HydrophobicContact CD2-CG2 3.71Å; Q293-V297 PolarHBondContact O-N 3.46Å; F294-V297 PolarHBondContact O-N 3.46Å; V297-G299 VanDerWaalsContact C-N 3.34Å; V297-G299 PolarHBondContact O-N 3.14Å; V297-A300 WeakPolarHBondContact O-CB 3.48Å; V297-A300 PolarHBondContact O-N 2.94Å; V297-V301 WeakPolarHBondContact O-CG2 3.42Å; V297-V301 PolarHBondContact O-N 2.81Å; V297-V301 VanDerWaalsContact O-N 3.14Å; V297-A353 HydrophobicContact CB-CB 3.9Å; V297-A353 HydrophobicContact CG1-CB 3.76Å; V297-V354 HydrophobicContact CG1-CG2 4.1Å
298	A	97.6	Very high	96.6	Very high	16 Å²	16	22 Å²	22	13%	0.132	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-42.1	176.1	0	0	0	0	0	112.1	F294 V301 V302 A357	F294-A298 PolarHBondContact O-N 2.93Å; A298-V301 PolarHBondContact O-N 2.96Å; A298-V302 WeakPolarHBondContact O-CG2 3.49Å; A298-V302 PolarHBondContact O-N 2.98Å; A298-A357 HydrophobicContact CB-CB 4.1Å; A298-A357 WeakPolarHBondContact O-CB 3.42Å
299	G	96.4	Very high	96.6	Very high	11 Å²	11	20.1 Å²	20.1	11%	0.113	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-41	175.1	0	0	0	0	0	113.1	N295 K296 V297 V301 V302 S303	N295-G299 PolarHBondContact O-N 3.03Å; K296-G299 PolarHBondContact O-N 2.96Å; V297-G299 VanDerWaalsContact C-N 3.34Å; V297-G299 PolarHBondContact O-N 3.14Å; G299-V301 VanDerWaalsContact C-N 3.35Å; G299-V301 PolarHBondContact O-N 2.97Å; G299-V302 PolarHBondContact O-N 3.36Å; G299-S303 WeakPolarHBondContact O-CB 3.41Å; G299-S303 PolarHBondContact O-N 3.34Å; G299-S303 PolarHBondContact O-OG 3.29Å
300	A	96.7	Very high	96.4	Very high	6 Å²	6	18.9 Å²	18.9	5%	0.05	11%	0.11	C	C	.	.	H	α-helix	trans	-57.9	-45.5	175.1	0	0	0	0	0	111.8	K296 V297 V302 S304 W335 L495	K296-A300 WeakPolarHBondContact O-CB 3.38Å; K296-A300 PolarHBondContact O-N 3.4Å; V297-A300 WeakPolarHBondContact O-CB 3.48Å; V297-A300 PolarHBondContact O-N 2.94Å; A300-V302 PolarHBondContact O-N 3.09Å; A300-S304 WeakPolarHBondContact O-CB 3.41Å; A300-S304 PolarHBondContact O-N 3.43Å; A300-W335 HydrophobicContact CB-CH2 4.2Å; A300-W335 HydrophobicContact CB-CZ2 4.34Å; A300-L495 HydrophobicContact CB-CD1 3.64Å
301	V	98.4	Very high	96	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.6	-46.3	175.8	176.3	0	0	0	0	111.1	V297 A298 G299 S304 V305 W335 V354 A357 L358	V297-V301 WeakPolarHBondContact O-CG2 3.42Å; V297-V301 PolarHBondContact O-N 2.81Å; V297-V301 VanDerWaalsContact O-N 3.14Å; A298-V301 PolarHBondContact O-N 2.96Å; G299-V301 VanDerWaalsContact C-N 3.35Å; G299-V301 PolarHBondContact O-N 2.97Å; V301-S304 PolarHBondContact O-N 3.03Å; V301-V305 HydrophobicContact CG1-CG2 4.5Å; V301-V305 WeakPolarHBondContact O-CG2 3.48Å; V301-V305 PolarHBondContact O-N 2.72Å; V301-W335 HydrophobicContact CB-CD2 4.27Å; V301-W335 HydrophobicContact CB-CG 4.48Å; V301-W335 HydrophobicContact CG1-CB 4.38Å; V301-W335 HydrophobicContact CG1-CD2 4.38Å; V301-W335 HydrophobicContact CG1-CG 4.09Å; V301-W335 HydrophobicContact CG2-CD2 3.58Å; V301-W335 HydrophobicContact CG2-CE3 3.52Å; V301-W335 HydrophobicContact CG2-CG 4.12Å; V301-W335 HydrophobicContact CG2-CH2 4.1Å; V301-W335 HydrophobicContact CG2-CZ2 4.16Å; V301-W335 HydrophobicContact CG2-CZ3 3.79Å; V301-V354 HydrophobicContact CG2-CB 4.22Å; V301-V354 HydrophobicContact CG2-CG1 4.06Å; V301-V354 HydrophobicContact CG2-CG2 3.83Å; V301-A357 HydrophobicContact CB-CB 3.67Å; V301-A357 HydrophobicContact CG1-CB 3.67Å; V301-A357 HydrophobicContact CG2-CB 4.29Å; V301-L358 HydrophobicContact CG1-CD2 3.82Å; V301-L358 HydrophobicContact CG1-CG 4.04Å
302	V	98.3	Very high	95.6	Very high	15 Å²	15	21.6 Å²	21.6	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-65.3	-50.6	-179.8	173.7	0	0	0	0	111.6	A298 G299 A300 S304 L306 A357 P362 I363	A298-V302 WeakPolarHBondContact O-CG2 3.49Å; A298-V302 PolarHBondContact O-N 2.98Å; G299-V302 PolarHBondContact O-N 3.36Å; A300-V302 PolarHBondContact O-N 3.09Å; V302-S304 VanDerWaalsContact C-N 3.26Å; V302-S304 PolarHBondContact O-N 2.81Å; V302-L306 HydrophobicContact CG1-CD1 3.73Å; V302-L306 WeakPolarHBondContact O-CB 3.26Å; V302-L306 VanDerWaalsContact O-CG 3.29Å; V302-L306 WeakPolarHBondContact O-CG 3.25Å; V302-L306 PolarHBondContact O-N 3.04Å; V302-A357 HydrophobicContact CG2-CB 4.14Å; V302-P362 HydrophobicContact CG1-CG 4.41Å; V302-I363 HydrophobicContact CG1-CD1 4.33Å; V302-I363 HydrophobicContact CG2-CG1 4.1Å
303	S	97.5	Very high	95.1	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-56.7	-41.6	175.3	-62.2	0	0	0	0	111.7	G299 G307 A308 R496 L498	G299-S303 WeakPolarHBondContact O-CB 3.41Å; G299-S303 PolarHBondContact O-N 3.34Å; G299-S303 PolarHBondContact O-OG 3.29Å; S303-G307 PolarHBondContact O-N 3.28Å; S303-A308 WeakPolarHBondContact CB-O 3.39Å; S303-A308 PolarHBondContact O-N 3.37Å; S303-R496 PolarHBondContact OG-O 3.26Å; S303-L498 PolarHBondContact OG-N 2.87Å
304	S	98.1	Very high	94.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67	-51.8	-177.9	-175.7	0	0	0	0	112.8	P236 V239 A300 V301 V302 L306 G307 W335	P236-S304 WeakPolarHBondContact O-CB 3.33Å; P236-S304 PolarHBondContact O-OG 2.7Å; V239-S304 VanDerWaalsContact CG1-OG 3.29Å; V239-S304 WeakPolarHBondContact CG1-OG 3.45Å; A300-S304 WeakPolarHBondContact O-CB 3.41Å; A300-S304 PolarHBondContact O-N 3.43Å; V301-S304 PolarHBondContact O-N 3.03Å; V302-S304 VanDerWaalsContact C-N 3.26Å; V302-S304 PolarHBondContact O-N 2.81Å; S304-L306 PolarHBondContact O-N 2.94Å; S304-G307 PolarHBondContact O-N 2.76Å; S304-W335 PolarHBondContact OG-NE1 3.06Å
305	V	98.4	Very high	93.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.3	-33.8	-178.9	174.6	0	0	0	0	111.9	V301 G307 R328 L331 L332 L358 I363 L366	V301-V305 HydrophobicContact CG1-CG2 4.5Å; V301-V305 WeakPolarHBondContact O-CG2 3.48Å; V301-V305 PolarHBondContact O-N 2.72Å; V305-G307 PolarHBondContact O-N 2.72Å; V305-R328 HydrophobicContact CG1-CG 3.9Å; V305-R328 VanDerWaalsContact O-CD 3.27Å; V305-R328 WeakPolarHBondContact O-CD 3.29Å; V305-R328 VanDerWaalsContact O-CG 3.3Å; V305-R328 WeakPolarHBondContact O-CG 3.38Å; V305-R328 PolarHBondContact O-NE 2.94Å; V305-L331 HydrophobicContact CG2-CB 4.29Å; V305-L332 HydrophobicContact CG1-CD2 3.63Å; V305-L332 HydrophobicContact CG1-CG 4.07Å; V305-L332 HydrophobicContact CG2-CD2 4.03Å; V305-L358 HydrophobicContact CG2-CD2 4.33Å; V305-I363 HydrophobicContact CB-CD1 3.98Å; V305-I363 HydrophobicContact CG1-CD1 3.95Å; V305-I363 HydrophobicContact CG1-CG2 4.05Å; V305-L366 HydrophobicContact CG1-CD1 4.15Å
306	L	97.8	Very high	92.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.7	-18.1	171.8	-66.7	175.2	0	0	0	112.7	V302 S304 A308 I363 L366 L498 V506 V510	V302-L306 HydrophobicContact CG1-CD1 3.73Å; V302-L306 WeakPolarHBondContact O-CB 3.26Å; V302-L306 VanDerWaalsContact O-CG 3.29Å; V302-L306 WeakPolarHBondContact O-CG 3.25Å; V302-L306 PolarHBondContact O-N 3.04Å; S304-L306 PolarHBondContact O-N 2.94Å; L306-A308 HydrophobicContact CB-CB 4.13Å; L306-I363 HydrophobicContact CD1-CD1 4.43Å; L306-I363 HydrophobicContact CD2-CD1 4.07Å; L306-I363 HydrophobicContact CG-CD1 3.84Å; L306-L366 HydrophobicContact CD2-CD1 3.98Å; L306-L498 HydrophobicContact CD1-CD1 4Å; L306-V506 HydrophobicContact CB-CG1 3.88Å; L306-V506 HydrophobicContact CD1-CB 4.3Å; L306-V506 HydrophobicContact CD1-CG1 4.34Å; L306-V506 HydrophobicContact CD2-CG1 4.31Å; L306-V506 HydrophobicContact CG-CG1 4.4Å; L306-V510 HydrophobicContact CD2-CG2 4.28Å
307	G	96.6	Very high	92.7	Very high	2 Å²	2	27 Å²	27	2%	0.021	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	67	37.9	-175	0	0	0	0	0	112.3	S303 S304 V305 R321	S303-G307 PolarHBondContact O-N 3.28Å; S304-G307 PolarHBondContact O-N 2.76Å; V305-G307 PolarHBondContact O-N 2.72Å; G307-R321 VanDerWaalsContact O-CB 3.3Å; G307-R321 WeakPolarHBondContact O-CB 3.26Å; G307-R321 PolarHBondContact O-N 2.85Å
308	A	95.9	Very high	92.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.1	-164.1	0	0	0	0	0	113.6	S303 L306 V318 T319 I320 L498 V506	S303-A308 WeakPolarHBondContact CB-O 3.39Å; S303-A308 PolarHBondContact O-N 3.37Å; L306-A308 HydrophobicContact CB-CB 4.13Å; A308-V318 HydrophobicContact CB-CG1 3.78Å; A308-T319 CarbonylContact C-O 3.57Å; A308-T319 VanDerWaalsContact CA-O 3.26Å; A308-T319 WeakPolarHBondContact CA-O 3.15Å; A308-I320 HydrophobicContact CB-CG1 4.33Å; A308-L498 HydrophobicContact CB-CD1 3.98Å; A308-V506 HydrophobicContact CB-CG1 3.87Å; A308-V506 HydrophobicContact CB-CG2 4.25Å
309	T	94.1	Very high	92.2	Very high	18 Å²	18	30.9 Å²	30.9	11%	0.11	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.5	-174.8	-54.8	0	0	0	0	110.2	P233 P236 T311 V318 T319	P233-T309 HydrophobicContact CB-CG2 3.93Å; P233-T309 HydrophobicContact CG-CG2 4.13Å; P236-T309 WeakPolarHBondContact CD-OG1 3.27Å; T309-T311 PolarHBondContact O-N 3.28Å; T309-V318 WeakPolarHBondContact O-CA 3.47Å; T309-T319 PolarHBondContact N-O 2.88Å; T309-T319 PolarHBondContact O-N 2.83Å; T309-T319 PolarHBondContact O-OG1 2.74Å
310	S	92.2	Very high	92.1	Very high	12 Å²	12	33.4 Å²	33.4	8%	0.084	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125.8	176.3	-177.7	0	0	0	0	111.4	G312	S310-G312 PolarHBondContact OG-O 3.27Å
311	T	87.6	Confident	92	Very high	77 Å²	77	38.7 Å²	38.7	47%	0.472	22%	0.224	S	C	.	.			trans	-101.6	-8.9	172.8	64.3	0	0	0	0	113	T309 E317 T319	T309-T311 PolarHBondContact O-N 3.28Å; T311-E317 PolarHBondContact N-O 3.46Å; T311-E317 WeakPolarHBondContact OG1-CA 3.24Å; T311-E317 PolarHBondContact OG1-O 2.93Å; T311-E317 VanDerWaalsContact OG1-O 3.09Å; T311-T319 HydrophobicContact CG2-CG2 3.96Å
312	G	86.1	Confident	91.9	Very high	24 Å²	24	44.5 Å²	44.5	25%	0.247	26%	0.262	C	S	.	.	S	Bend	trans	-176.6	-174.9	-178.8	0	0	0	0	0	112.4	S310 E317 Q502	S310-G312 PolarHBondContact OG-O 3.27Å; G312-E317 VanDerWaalsContact C-OE2 3.28Å; G312-E317 VanDerWaalsContact CA-OE2 3.27Å; G312-E317 WeakPolarHBondContact CA-OE2 3.41Å; G312-E317 PolarHBondContact N-O 2.86Å; G312-Q502 PolarHBondContact O-NE2 3.28Å
313	E	83.2	Confident	91.8	Very high	143 Å²	143	45.1 Å²	45.1	67%	0.668	26%	0.264	S	S	*	.	S	Bend	trans	-80	-20.3	-178.2	-63.3	-168.3	156.4	0	0	112.9	E317 S584	E313-E317 PolarHBondContact N-OE2 3.12Å; E313-E317 VanDerWaalsContact N-OE2 3.12Å; E313-S584 WeakPolarHBondContact OE1-CB 3.21Å; E313-S584 PolarHBondContact OE1-OG 2.85Å
314	G	82.4	Confident	91.8	Very high	14 Å²	14	54 Å²	54	14%	0.144	30%	0.297	C	S	.	.	S	Bend	trans	-69.3	146.9	-174.3	0	0	0	0	0	114.1	G316 E317 Q502	G314-G316 PolarHBondContact O-N 3.37Å; G314-E317 WeakPolarHBondContact CA-OE2 3.36Å; G314-E317 PolarHBondContact N-OE2 3.45Å; G314-E317 PolarHBondContact O-N 3.3Å; G314-Q502 PolarHBondContact O-NE2 3.44Å
315	P	79.5	Confident	91.8	Very high	80 Å²	80	56.1 Å²	56.1	52%	0.519	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	9.4	179.9	31.7	-37.3	0	0	0	114.4	A501 R505	P315-A501 HydrophobicContact CB-CB 4.18Å; P315-R505 WeakPolarHBondContact O-CD 3.34Å; P315-R505 PolarHBondContact O-NH1 3.5Å
316	G	81.8	Confident	91.7	Very high	47 Å²	47	59 Å²	59	49%	0.485	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	3.1	167.4	0	0	0	0	0	114.3	G314 V318	G314-G316 PolarHBondContact O-N 3.37Å; G316-V318 PolarHBondContact O-N 3.15Å; G316-V318 VanDerWaalsContact O-N 3.11Å
317	E	89.6	Confident	91.8	Very high	94 Å²	94	63.2 Å²	63.2	44%	0.439	35%	0.35	S	S	.	.			trans	-90.8	62.3	-178.6	-69	160.1	-159.3	0	0	109.3	T311 G312 E313 G314	T311-E317 PolarHBondContact N-O 3.46Å; T311-E317 WeakPolarHBondContact OG1-CA 3.24Å; T311-E317 PolarHBondContact OG1-O 2.93Å; T311-E317 VanDerWaalsContact OG1-O 3.09Å; G312-E317 VanDerWaalsContact C-OE2 3.28Å; G312-E317 VanDerWaalsContact CA-OE2 3.27Å; G312-E317 WeakPolarHBondContact CA-OE2 3.41Å; G312-E317 PolarHBondContact N-O 2.86Å; E313-E317 PolarHBondContact N-OE2 3.12Å; E313-E317 VanDerWaalsContact N-OE2 3.12Å; G314-E317 WeakPolarHBondContact CA-OE2 3.36Å; G314-E317 PolarHBondContact N-OE2 3.45Å; G314-E317 PolarHBondContact O-N 3.3Å
318	V	92.9	Very high	91.8	Very high	24 Å²	24	63.4 Å²	63.4	15%	0.145	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	128.3	-176.2	-175.6	0	0	0	0	109.4	A308 T309 G316 I320 L498 Q502 V506	A308-V318 HydrophobicContact CB-CG1 3.78Å; T309-V318 WeakPolarHBondContact O-CA 3.47Å; G316-V318 PolarHBondContact O-N 3.15Å; G316-V318 VanDerWaalsContact O-N 3.11Å; V318-I320 HydrophobicContact CG1-CG1 4.28Å; V318-L498 HydrophobicContact CB-CD2 4.46Å; V318-L498 HydrophobicContact CG1-CD2 3.7Å; V318-L498 HydrophobicContact CG2-CD2 3.86Å; V318-Q502 HydrophobicContact CG2-CB 3.8Å; V318-Q502 HydrophobicContact CG2-CG 3.5Å; V318-V506 HydrophobicContact CB-CG2 4.48Å; V318-V506 HydrophobicContact CG1-CG2 3.9Å
319	T	92.9	Very high	92	Very high	79 Å²	79	63.4 Å²	63.4	49%	0.485	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.1	167.3	49.4	0	0	0	0	109.7	A308 T309 T311	A308-T319 CarbonylContact C-O 3.57Å; A308-T319 VanDerWaalsContact CA-O 3.26Å; A308-T319 WeakPolarHBondContact CA-O 3.15Å; T309-T319 PolarHBondContact N-O 2.88Å; T309-T319 PolarHBondContact O-N 2.83Å; T309-T319 PolarHBondContact O-OG1 2.74Å; T311-T319 HydrophobicContact CG2-CG2 3.96Å
320	I	94.8	Very high	92.2	Very high	63 Å²	63	69.1 Å²	69.1	32%	0.323	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.6	-177.1	-52.7	167.7	0	0	0	109	A308 V318 V506 E509 V510	A308-I320 HydrophobicContact CB-CG1 4.33Å; V318-I320 HydrophobicContact CG1-CG1 4.28Å; I320-V506 HydrophobicContact CD1-CB 4.4Å; I320-V506 HydrophobicContact CD1-CG1 4.01Å; I320-V506 HydrophobicContact CD1-CG2 3.92Å; I320-V506 HydrophobicContact CG1-CG1 4.1Å; I320-V506 HydrophobicContact CG1-CG2 4.09Å; I320-V506 HydrophobicContact CG2-CG1 4.3Å; I320-E509 VanDerWaalsContact CD1-OE2 3.27Å; I320-E509 WeakPolarHBondContact CD1-OE2 3.41Å; I320-V510 HydrophobicContact CG2-CG1 4.02Å
321	R	94.7	Very high	92.5	Very high	117 Å²	117	68.6 Å²	68.6	44%	0.442	37%	0.366	S	S	.	.			trans	-77.3	121.9	172.3	-173.5	167.6	172.8	163.3	-8.9	108.7	D235 T237 G307 L323	D235-R321 IonicContact OD1-NH1 2.74Å; D235-R321 IonicContact OD2-CZ 2.72Å; D235-R321 IonicContact OD2-NH1 3.19Å; D235-R321 PolarHBondContact OD2-NH1 2.7Å; T237-R321 VanDerWaalsContact OG1-CZ 3.32Å; T237-R321 PolarHBondContact OG1-NH1 3.37Å; G307-R321 VanDerWaalsContact O-CB 3.3Å; G307-R321 WeakPolarHBondContact O-CB 3.26Å; G307-R321 PolarHBondContact O-N 2.85Å; R321-L323 PolarHBondContact O-N 2.97Å; R321-L323 VanDerWaalsContact O-N 3.13Å
322	P	94.8	Very high	93	Very high	123 Å²	123	65 Å²	65	80%	0.799	34%	0.343	S	S	*	.			trans	-69.9	112.8	-177.2	26.4	-33.5	0	0	0	111.1
323	L	96.9	Very high	93.6	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.141	34%	0.336	C	S	.	.			trans	-120.2	127.2	-179.4	-64.3	172.4	0	0	0	110.7	T237 R321 Q327 R328 L331	T237-L323 HydrophobicContact CG2-CD1 4.23Å; R321-L323 PolarHBondContact O-N 2.97Å; R321-L323 VanDerWaalsContact O-N 3.13Å; L323-Q327 HydrophobicContact CD2-CB 4.21Å; L323-R328 PolarHBondContact O-NH2 2.85Å; L323-R328 VanDerWaalsContact O-NH2 3.12Å; L323-L331 HydrophobicContact CD1-CD1 3.55Å
324	R	97.1	Very high	94.4	Very high	189 Å²	189	59.4 Å²	59.4	71%	0.713	31%	0.31	S	S	*	.			trans	-73.5	156.4	170.5	-56.8	176.4	-164.2	158.1	6	110.3	P326 Q327 R328	R324-P326 VanDerWaalsContact C-CD 3.49Å; R324-Q327 HydrophobicContact CB-CG 4.46Å; R324-Q327 WeakPolarHBondContact O-CA 3.32Å; R324-Q327 WeakPolarHBondContact O-CB 3.45Å; R324-Q327 PolarHBondContact O-N 3.45Å; R324-R328 PolarHBondContact O-N 3.4Å
325	P	97.6	Very high	95.2	Very high	45 Å²	45	58.9 Å²	58.9	29%	0.292	30%	0.304	S	S	.	.	H	α-helix	trans	-50.2	-42.3	179.3	-27.5	35.1	0	0	0	115.3	Q327 R328 A329 A368 E372	P325-Q327 VanDerWaalsContact C-N 3.28Å; P325-Q327 PolarHBondContact O-N 3.48Å; P325-R328 PolarHBondContact O-N 3.1Å; P325-A329 WeakPolarHBondContact O-CB 3.22Å; P325-A329 PolarHBondContact O-N 3.5Å; P325-A368 HydrophobicContact CB-CB 3.84Å; P325-A368 HydrophobicContact CG-CB 3.74Å; P325-E372 HydrophobicContact CB-CG 4.05Å
326	P	97.9	Very high	96.1	Very high	62 Å²	62	55.1 Å²	55.1	40%	0.403	28%	0.28	S	S	.	.	H	α-helix	trans	-69.1	-22.7	177	-16.9	29.8	0	0	0	114.2	R324 E372	R324-P326 VanDerWaalsContact C-CD 3.49Å; P326-E372 HydrophobicContact CB-CB 4.48Å; P326-E372 HydrophobicContact CB-CG 4.4Å; P326-E372 HydrophobicContact CG-CG 3.97Å
327	Q	98.2	Very high	96.9	Very high	88 Å²	88	58.8 Å²	58.8	41%	0.411	28%	0.279	S	S	.	.	H	α-helix	trans	-79.2	-39.8	173.6	-61.6	172.6	-73.2	0	0	110.3	L323 R324 P325 A329 R330	L323-Q327 HydrophobicContact CD2-CB 4.21Å; R324-Q327 HydrophobicContact CB-CG 4.46Å; R324-Q327 WeakPolarHBondContact O-CA 3.32Å; R324-Q327 WeakPolarHBondContact O-CB 3.45Å; R324-Q327 PolarHBondContact O-N 3.45Å; P325-Q327 VanDerWaalsContact C-N 3.28Å; P325-Q327 PolarHBondContact O-N 3.48Å; Q327-A329 VanDerWaalsContact C-N 3.32Å; Q327-R330 PolarHBondContact O-N 3.48Å
328	R	98.4	Very high	97.3	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-36.3	172.9	-169.9	171.9	-55.9	115.3	12.7	112.1	V305 L323 R324 P325 R330 L331 L332 A369 E511	V305-R328 HydrophobicContact CG1-CG 3.9Å; V305-R328 VanDerWaalsContact O-CD 3.27Å; V305-R328 WeakPolarHBondContact O-CD 3.29Å; V305-R328 VanDerWaalsContact O-CG 3.3Å; V305-R328 WeakPolarHBondContact O-CG 3.38Å; V305-R328 PolarHBondContact O-NE 2.94Å; L323-R328 PolarHBondContact O-NH2 2.85Å; L323-R328 VanDerWaalsContact O-NH2 3.12Å; R324-R328 PolarHBondContact O-N 3.4Å; P325-R328 PolarHBondContact O-N 3.1Å; R328-R330 VanDerWaalsContact C-N 3.28Å; R328-R330 PolarHBondContact O-N 2.75Å; R328-L331 WeakPolarHBondContact O-CB 3.21Å; R328-L331 PolarHBondContact O-N 3.04Å; R328-L331 VanDerWaalsContact O-N 3.07Å; R328-L332 PolarHBondContact O-N 3.18Å; R328-A369 HydrophobicContact CB-CB 3.72Å; R328-A369 HydrophobicContact CG-CB 3.6Å; R328-E511 IonicContact CZ-OE1 2.69Å; R328-E511 IonicContact NH1-OE1 3.73Å; R328-E511 PolarHBondContact NH1-OE1 2.84Å
329	A	98.5	Very high	97.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.8	-40.5	172	0	0	0	0	0	112.4	P325 Q327 L331 L332 E333 E372 A373	P325-A329 WeakPolarHBondContact O-CB 3.22Å; P325-A329 PolarHBondContact O-N 3.5Å; Q327-A329 VanDerWaalsContact C-N 3.32Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.31Å; A329-L332 WeakPolarHBondContact O-CB 3.47Å; A329-L332 PolarHBondContact O-N 2.87Å; A329-E333 WeakPolarHBondContact O-CB 3.39Å; A329-E333 VanDerWaalsContact O-CG 3.27Å; A329-E333 WeakPolarHBondContact O-CG 3.41Å; A329-E333 PolarHBondContact O-N 3.43Å; A329-E372 HydrophobicContact CB-CB 3.75Å; A329-A373 HydrophobicContact CB-CB 4.45Å
330	R	98.7	Very high	97.8	Very high	138 Å²	138	50.8 Å²	50.8	52%	0.521	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-30.9	176.5	-58.6	-44.7	-177.9	-175.4	-4.6	113.2	L240 Q327 R328 E333 K334	L240-R330 HydrophobicContact CD2-CB 4.41Å; Q327-R330 PolarHBondContact O-N 3.48Å; R328-R330 VanDerWaalsContact C-N 3.28Å; R328-R330 PolarHBondContact O-N 2.75Å; R330-E333 WeakPolarHBondContact CD-OE2 3.4Å; R330-E333 IonicContact CZ-OE2 3.22Å; R330-E333 IonicContact NE-OE2 2.69Å; R330-E333 IonicContact NH1-OE1 3.75Å; R330-E333 PolarHBondContact NH1-OE1 3.26Å; R330-E333 IonicContact NH1-OE2 2.81Å; R330-E333 PolarHBondContact NH1-OE2 3.14Å; R330-K334 WeakPolarHBondContact O-CB 3.41Å; R330-K334 PolarHBondContact O-N 3.33Å
331	L	98.8	Very high	98	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-72.4	-41.7	173.9	-68.4	153.5	0	0	0	111.2	T237 V239 L240 V305 L323 R328 A329 K334 W335	T237-L331 HydrophobicContact CG2-CD1 4.13Å; T237-L331 HydrophobicContact CG2-CD2 4.38Å; V239-L331 HydrophobicContact CG1-CD2 3.67Å; L240-L331 HydrophobicContact CD1-CD2 3.83Å; L240-L331 HydrophobicContact CD1-CG 4.13Å; L240-L331 HydrophobicContact CD2-CD2 4.04Å; L240-L331 HydrophobicContact CD2-CG 4.38Å; L240-L331 HydrophobicContact CG-CD2 3.71Å; L240-L331 HydrophobicContact CG-CG 4.37Å; V305-L331 HydrophobicContact CG2-CB 4.29Å; L323-L331 HydrophobicContact CD1-CD1 3.55Å; R328-L331 WeakPolarHBondContact O-CB 3.21Å; R328-L331 PolarHBondContact O-N 3.04Å; R328-L331 VanDerWaalsContact O-N 3.07Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.31Å; L331-K334 PolarHBondContact O-N 3.2Å; L331-W335 PolarHBondContact O-N 3.45Å
332	L	98.8	Very high	98.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-53.5	171.1	-68	171.9	0	0	0	111.2	V305 R328 A329 K334 W335 I336 L358 I363 A369 W370	V305-L332 HydrophobicContact CG1-CD2 3.63Å; V305-L332 HydrophobicContact CG1-CG 4.07Å; V305-L332 HydrophobicContact CG2-CD2 4.03Å; R328-L332 PolarHBondContact O-N 3.18Å; A329-L332 WeakPolarHBondContact O-CB 3.47Å; A329-L332 PolarHBondContact O-N 2.87Å; L332-K334 VanDerWaalsContact C-N 3.3Å; L332-K334 PolarHBondContact O-N 3.45Å; L332-W335 PolarHBondContact O-N 3.26Å; L332-I336 WeakPolarHBondContact O-CD1 3.44Å; L332-I336 WeakPolarHBondContact O-CG1 3.22Å; L332-I336 PolarHBondContact O-N 3.41Å; L332-L358 HydrophobicContact CD2-CD2 3.67Å; L332-I363 HydrophobicContact CD2-CG2 3.87Å; L332-A369 HydrophobicContact CD1-CB 3.98Å; L332-W370 HydrophobicContact CD1-CD2 3.83Å; L332-W370 HydrophobicContact CD1-CE3 4.05Å; L332-W370 HydrophobicContact CD1-CG 4.14Å; L332-W370 HydrophobicContact CD2-CD2 4.49Å; L332-W370 HydrophobicContact CD2-CH2 4.03Å; L332-W370 HydrophobicContact CD2-CZ2 3.73Å
333	E	98.8	Very high	98.2	Very high	20 Å²	20	41.1 Å²	41.1	9%	0.093	18%	0.179	C	C	.	.	H	α-helix	trans	-59.7	-38.5	178.7	-68.7	176.8	149	0	0	112.7	A329 R330 I336 R337 A373 T374	A329-E333 WeakPolarHBondContact O-CB 3.39Å; A329-E333 VanDerWaalsContact O-CG 3.27Å; A329-E333 WeakPolarHBondContact O-CG 3.41Å; A329-E333 PolarHBondContact O-N 3.43Å; R330-E333 WeakPolarHBondContact CD-OE2 3.4Å; R330-E333 IonicContact CZ-OE2 3.22Å; R330-E333 IonicContact NE-OE2 2.69Å; R330-E333 IonicContact NH1-OE1 3.75Å; R330-E333 PolarHBondContact NH1-OE1 3.26Å; R330-E333 IonicContact NH1-OE2 2.81Å; R330-E333 PolarHBondContact NH1-OE2 3.14Å; E333-I336 PolarHBondContact O-N 2.99Å; E333-R337 PolarHBondContact O-N 3.47Å; E333-A373 HydrophobicContact CG-CB 4.44Å; E333-T374 VanDerWaalsContact OE1-CB 3.24Å; E333-T374 WeakPolarHBondContact OE1-CB 3.23Å; E333-T374 WeakPolarHBondContact OE1-CG2 3.37Å; E333-T374 PolarHBondContact OE1-N 2.97Å; E333-T374 PolarHBondContact OE1-OG1 3.44Å
334	K	98.8	Very high	98.1	Very high	31 Å²	31	44.7 Å²	44.7	14%	0.135	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-50	176.6	-178.9	58.5	163.1	-178.3	0	111.5	V239 L240 F242 A244 R330 L331 L332 R337 V338	V239-K334 HydrophobicContact CG1-CG 4.25Å; V239-K334 HydrophobicContact CG2-CG 4.15Å; V239-K334 WeakPolarHBondContact O-CE 3.31Å; L240-K334 HydrophobicContact CD2-CB 3.92Å; L240-K334 HydrophobicContact CD2-CG 4.1Å; F242-K334 PolarHBondContact O-NZ 3.43Å; A244-K334 HydrophobicContact CB-CD 4.44Å; R330-K334 WeakPolarHBondContact O-CB 3.41Å; R330-K334 PolarHBondContact O-N 3.33Å; L331-K334 PolarHBondContact O-N 3.2Å; L332-K334 VanDerWaalsContact C-N 3.3Å; L332-K334 PolarHBondContact O-N 3.45Å; K334-R337 PolarHBondContact O-N 3.05Å; K334-R337 VanDerWaalsContact O-N 3.16Å; K334-V338 WeakPolarHBondContact O-CG2 3.32Å; K334-V338 PolarHBondContact O-N 3.12Å
335	W	98.8	Very high	98	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-37.6	178.2	-77.1	113.4	0	0	0	112.5	V239 A300 V301 S304 L331 L332 R337 V338 A339 V354 W491	V239-W335 HydrophobicContact CB-CZ2 4.24Å; V239-W335 HydrophobicContact CG2-CD2 4.43Å; V239-W335 HydrophobicContact CG2-CH2 4.09Å; V239-W335 HydrophobicContact CG2-CZ2 3.69Å; A300-W335 HydrophobicContact CB-CH2 4.2Å; A300-W335 HydrophobicContact CB-CZ2 4.34Å; V301-W335 HydrophobicContact CB-CD2 4.27Å; V301-W335 HydrophobicContact CB-CG 4.48Å; V301-W335 HydrophobicContact CG1-CB 4.38Å; V301-W335 HydrophobicContact CG1-CD2 4.38Å; V301-W335 HydrophobicContact CG1-CG 4.09Å; V301-W335 HydrophobicContact CG2-CD2 3.58Å; V301-W335 HydrophobicContact CG2-CE3 3.52Å; V301-W335 HydrophobicContact CG2-CG 4.12Å; V301-W335 HydrophobicContact CG2-CH2 4.1Å; V301-W335 HydrophobicContact CG2-CZ2 4.16Å; V301-W335 HydrophobicContact CG2-CZ3 3.79Å; S304-W335 PolarHBondContact OG-NE1 3.06Å; L331-W335 PolarHBondContact O-N 3.45Å; L332-W335 PolarHBondContact O-N 3.26Å; W335-R337 VanDerWaalsContact C-N 3.28Å; W335-R337 PolarHBondContact O-N 2.68Å; W335-V338 HydrophobicContact CE3-CB 4.2Å; W335-V338 HydrophobicContact CE3-CG1 4.22Å; W335-V338 HydrophobicContact CZ3-CG1 4.25Å; W335-V338 PolarHBondContact O-N 3.14Å; W335-A339 WeakPolarHBondContact O-CB 3.35Å; W335-A339 PolarHBondContact O-N 3.13Å; W335-V354 HydrophobicContact CB-CG1 3.95Å; W335-V354 HydrophobicContact CE3-CG1 4.39Å; W335-V354 HydrophobicContact CE3-CG2 4.02Å; W335-V354 HydrophobicContact CZ3-CG2 4.34Å; W335-W491 HydrophobicContact CH2-CH2 4.25Å; W335-W491 HydrophobicContact CZ2-CH2 4.2Å
336	I	98.8	Very high	97.9	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-58.1	-41.1	170.6	-67.8	162.4	0	0	0	110.9	L332 E333 E340 L358 W370 S377 V380 F381	L332-I336 WeakPolarHBondContact O-CD1 3.44Å; L332-I336 WeakPolarHBondContact O-CG1 3.22Å; L332-I336 PolarHBondContact O-N 3.41Å; E333-I336 PolarHBondContact O-N 2.99Å; I336-E340 PolarHBondContact O-N 2.88Å; I336-L358 HydrophobicContact CG1-CD1 3.75Å; I336-W370 HydrophobicContact CD1-CZ3 4.14Å; I336-S377 WeakPolarHBondContact CG2-O 3.46Å; I336-V380 HydrophobicContact CG2-CB 4.1Å; I336-V380 HydrophobicContact CG2-CG1 3.88Å; I336-F381 HydrophobicContact CD1-CB 3.88Å; I336-F381 HydrophobicContact CD1-CG 4.23Å; I336-F381 HydrophobicContact CG1-CB 3.98Å; I336-F381 HydrophobicContact CG1-CD2 4.1Å; I336-F381 HydrophobicContact CG1-CG 4.23Å; I336-F381 HydrophobicContact CG2-CB 4.14Å
337	R	98.8	Very high	97.9	Very high	123 Å²	123	32.9 Å²	32.9	46%	0.464	14%	0.14	S	C	.	.	H	α-helix	trans	-69.5	-42	176.1	-172.5	62.7	-172.7	-171.9	8.1	112.4	A244 E333 K334 W335 A339 E340 E341	A244-R337 HydrophobicContact CB-CB 4.13Å; A244-R337 HydrophobicContact CB-CG 3.63Å; E333-R337 PolarHBondContact O-N 3.47Å; K334-R337 PolarHBondContact O-N 3.05Å; K334-R337 VanDerWaalsContact O-N 3.16Å; W335-R337 VanDerWaalsContact C-N 3.28Å; W335-R337 PolarHBondContact O-N 2.68Å; R337-A339 VanDerWaalsContact C-N 3.29Å; R337-A339 PolarHBondContact O-N 3.03Å; R337-E340 PolarHBondContact O-N 3.34Å; R337-E340 VanDerWaalsContact O-N 3.15Å; R337-E341 HydrophobicContact CG-CG 4.43Å; R337-E341 IonicContact CZ-OE1 2.77Å; R337-E341 IonicContact NE-OE1 2.73Å; R337-E341 PolarHBondContact NE-OE1 3.31Å; R337-E341 IonicContact NH2-OE1 3.84Å; R337-E341 PolarHBondContact NH2-OE1 3.16Å; R337-E341 WeakPolarHBondContact O-CG 3.41Å; R337-E341 PolarHBondContact O-N 3.35Å
338	V	98.8	Very high	97.8	Very high	0 Å²	0	29 Å²	29	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.1	-43.2	174.7	173	0	0	0	0	110.7	A244 L247 L251 K334 W335 E340 E341 C342	A244-V338 HydrophobicContact CB-CG2 4.08Å; L247-V338 HydrophobicContact CB-CG1 4.32Å; L247-V338 HydrophobicContact CB-CG2 4Å; L247-V338 HydrophobicContact CD1-CG2 3.83Å; L251-V338 HydrophobicContact CD1-CG1 3.95Å; K334-V338 WeakPolarHBondContact O-CG2 3.32Å; K334-V338 PolarHBondContact O-N 3.12Å; W335-V338 HydrophobicContact CE3-CB 4.2Å; W335-V338 HydrophobicContact CE3-CG1 4.22Å; W335-V338 HydrophobicContact CZ3-CG1 4.25Å; W335-V338 PolarHBondContact O-N 3.14Å; V338-E340 PolarHBondContact O-N 2.93Å; V338-E341 PolarHBondContact O-N 3.35Å; V338-C342 PolarHBondContact O-N 3.14Å; V338-C342 PolarHBondContact O-SG 3.08Å
339	A	98.5	Very high	97.8	Very high	1 Å²	1	29 Å²	29	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-62.3	-40	175.2	0	0	0	0	0	112.8	W335 R337 C342 R343 V351 V354 L384	W335-A339 WeakPolarHBondContact O-CB 3.35Å; W335-A339 PolarHBondContact O-N 3.13Å; R337-A339 VanDerWaalsContact C-N 3.29Å; R337-A339 PolarHBondContact O-N 3.03Å; A339-C342 PolarHBondContact O-N 3.11Å; A339-R343 PolarHBondContact O-N 2.75Å; A339-V351 WeakPolarHBondContact O-CG2 3.18Å; A339-V354 HydrophobicContact CB-CB 3.98Å; A339-V354 HydrophobicContact CB-CG1 3.88Å; A339-L384 HydrophobicContact CB-CD1 3.78Å
340	E	97.9	Very high	97.8	Very high	28 Å²	28	29 Å²	29	13%	0.131	12%	0.123	C	C	.	.	H	α-helix	trans	-65.5	-39.5	174.8	175.9	62.9	177.7	0	0	112.3	I336 R337 V338 R343 L344 V380	I336-E340 PolarHBondContact O-N 2.88Å; R337-E340 PolarHBondContact O-N 3.34Å; R337-E340 VanDerWaalsContact O-N 3.15Å; V338-E340 PolarHBondContact O-N 2.93Å; E340-R343 WeakPolarHBondContact O-CB 3.46Å; E340-R343 PolarHBondContact O-N 3.42Å; E340-R343 IonicContact OE1-CZ 3.87Å; E340-R343 IonicContact OE1-NE 2.97Å; E340-R343 IonicContact OE1-NH2 3.12Å; E340-R343 PolarHBondContact OE1-NH2 3.23Å; E340-R343 IonicContact OE2-CZ 2.84Å; E340-R343 IonicContact OE2-NE 2.77Å; E340-R343 PolarHBondContact OE2-NE 2.95Å; E340-R343 IonicContact OE2-NH2 3.36Å; E340-R343 PolarHBondContact OE2-NH2 2.83Å; E340-L344 WeakPolarHBondContact O-CG 3.38Å; E340-L344 PolarHBondContact O-N 3.44Å; E340-V380 HydrophobicContact CB-CG1 3.89Å; E340-V380 HydrophobicContact CG-CG1 4.16Å
341	E	98.3	Very high	97.8	Very high	19 Å²	19	22.5 Å²	22.5	9%	0.089	10%	0.098	C	C	.	.	H	α-helix	trans	-67.8	-38.5	174.3	-58.7	-69.8	173.4	0	0	111.5	A244 D245 A248 R337 V338 R343 L344 L345	A244-E341 HydrophobicContact CB-CG 4.42Å; D245-E341 HydrophobicContact CB-CB 4.25Å; D245-E341 HydrophobicContact CB-CG 3.88Å; A248-E341 HydrophobicContact CB-CB 3.51Å; R337-E341 HydrophobicContact CG-CG 4.43Å; R337-E341 IonicContact CZ-OE1 2.77Å; R337-E341 IonicContact NE-OE1 2.73Å; R337-E341 PolarHBondContact NE-OE1 3.31Å; R337-E341 IonicContact NH2-OE1 3.84Å; R337-E341 PolarHBondContact NH2-OE1 3.16Å; R337-E341 WeakPolarHBondContact O-CG 3.41Å; R337-E341 PolarHBondContact O-N 3.35Å; V338-E341 PolarHBondContact O-N 3.35Å; E341-R343 VanDerWaalsContact C-N 3.27Å; E341-R343 PolarHBondContact O-N 3.06Å; E341-L344 PolarHBondContact O-N 3.35Å; E341-L345 WeakPolarHBondContact O-CG 3.36Å; E341-L345 PolarHBondContact O-N 2.74Å
342	C	97.9	Very high	97.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.5	-35.8	170.9	-70.4	0	0	0	0	111.9	A248 V338 A339 L345 R346 N347 V351	A248-C342 HydrophobicContact CB-CB 4.48Å; A248-C342 VanDerWaalsContact CB-SG 3.51Å; V338-C342 PolarHBondContact O-N 3.14Å; V338-C342 PolarHBondContact O-SG 3.08Å; A339-C342 PolarHBondContact O-N 3.11Å; C342-L345 CarbonylContact O-C 3.48Å; C342-L345 PolarHBondContact O-N 3.03Å; C342-R346 PolarHBondContact O-N 2.87Å; C342-R346 VanDerWaalsContact O-N 3.13Å; C342-N347 HydrophobicContact CB-CB 4.41Å; C342-N347 PolarHBondContact O-N 3.21Å; C342-V351 HydrophobicContact CB-CG2 3.71Å
343	R	95.7	Very high	97.6	Very high	82 Å²	82	23.2 Å²	23.2	31%	0.309	10%	0.101	S	C	.	.	H	α-helix	trans	-66.4	-42.1	174.2	-172.3	-174.1	69.1	87.6	0.8	111.4	A339 E340 E341 L345 R346 V351 L384 I387	A339-R343 PolarHBondContact O-N 2.75Å; E340-R343 WeakPolarHBondContact O-CB 3.46Å; E340-R343 PolarHBondContact O-N 3.42Å; E340-R343 IonicContact OE1-CZ 3.87Å; E340-R343 IonicContact OE1-NE 2.97Å; E340-R343 IonicContact OE1-NH2 3.12Å; E340-R343 PolarHBondContact OE1-NH2 3.23Å; E340-R343 IonicContact OE2-CZ 2.84Å; E340-R343 IonicContact OE2-NE 2.77Å; E340-R343 PolarHBondContact OE2-NE 2.95Å; E340-R343 IonicContact OE2-NH2 3.36Å; E340-R343 PolarHBondContact OE2-NH2 2.83Å; E341-R343 VanDerWaalsContact C-N 3.27Å; E341-R343 PolarHBondContact O-N 3.06Å; R343-L345 VanDerWaalsContact C-N 3.25Å; R343-L345 PolarHBondContact O-N 3.07Å; R343-R346 PolarHBondContact O-N 3.19Å; R343-V351 HydrophobicContact CB-CG2 3.91Å; R343-L384 HydrophobicContact CB-CD2 4.21Å; R343-L384 HydrophobicContact CG-CD2 4.5Å; R343-I387 HydrophobicContact CG-CD1 4.43Å
344	L	94.4	Very high	97.6	Very high	102 Å²	102	22.3 Å²	22.3	53%	0.534	10%	0.097	S	C	.	.	H	α-helix	trans	-64.1	-30.9	174.5	-66	174.5	0	0	0	112.3	E340 E341 R346	E340-L344 WeakPolarHBondContact O-CG 3.38Å; E340-L344 PolarHBondContact O-N 3.44Å; E341-L344 PolarHBondContact O-N 3.35Å; L344-R346 VanDerWaalsContact C-N 3.31Å
345	L	95.3	Very high	97.6	Very high	15 Å²	15	20.9 Å²	20.9	8%	0.079	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.4	170.9	-67.5	173.3	0	0	0	114.2	A248 E249 E341 C342 R343 N347 Y480	A248-L345 HydrophobicContact CB-CD1 3.92Å; E249-L345 HydrophobicContact CG-CD1 3.97Å; E341-L345 WeakPolarHBondContact O-CG 3.36Å; E341-L345 PolarHBondContact O-N 2.74Å; C342-L345 CarbonylContact O-C 3.48Å; C342-L345 PolarHBondContact O-N 3.03Å; R343-L345 VanDerWaalsContact C-N 3.25Å; R343-L345 PolarHBondContact O-N 3.07Å; L345-N347 PolarHBondContact O-N 3.08Å; L345-Y480 VanDerWaalsContact O-CE1 3.29Å; L345-Y480 WeakPolarHBondContact O-CE1 3.49Å; L345-Y480 PolarHBondContact O-OH 3.15Å
346	R	95.8	Very high	97.5	Very high	32 Å²	32	22.2 Å²	22.2	12%	0.121	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	26.5	-173.3	-63.2	169.4	76.3	-131.6	18.3	114.2	C342 R343 L344 F348 Q403 G427 I428 V429 E476	C342-R346 PolarHBondContact O-N 2.87Å; C342-R346 VanDerWaalsContact O-N 3.13Å; R343-R346 PolarHBondContact O-N 3.19Å; L344-R346 VanDerWaalsContact C-N 3.31Å; R346-F348 HydrophobicContact CB-CE2 3.82Å; R346-F348 HydrophobicContact CB-CZ 4.18Å; R346-F348 HydrophobicContact CG-CE2 4.22Å; R346-F348 HydrophobicContact CG-CZ 4.18Å; R346-F348 VanDerWaalsContact O-CD2 3.3Å; R346-F348 WeakPolarHBondContact O-CD2 3.49Å; R346-F348 PolarHBondContact O-N 3Å; R346-Q403 PolarHBondContact NH2-O 2.95Å; R346-G427 PolarHBondContact NH1-O 3.27Å; R346-I428 HydrophobicContact CB-CB 4.45Å; R346-I428 HydrophobicContact CB-CG1 4.27Å; R346-V429 PolarHBondContact O-N 3.45Å; R346-E476 IonicContact CZ-OE1 3.98Å; R346-E476 IonicContact NH1-OE1 2.71Å; R346-E476 PolarHBondContact NH1-OE1 2.99Å; R346-E476 IonicContact NH2-OE1 3.74Å; R346-E476 PolarHBondContact NH2-OE1 3.38Å
347	N	97.7	Very high	97.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-85.5	78.5	168.7	179.9	-2.7	0	0	0	110.1	T252 D255 C342 L345 S349 S350 V351 V429	T252-N347 VanDerWaalsContact CA-ND2 3.29Å; T252-N347 WeakPolarHBondContact CA-ND2 3.43Å; T252-N347 HydrophobicContact CG2-CB 3.96Å; T252-N347 VanDerWaalsContact OG1-CB 3.31Å; T252-N347 WeakPolarHBondContact OG1-CB 3.3Å; T252-N347 PolarHBondContact OG1-ND2 3.01Å; D255-N347 PolarHBondContact OD2-ND2 3.44Å; D255-N347 PolarHBondContact OD2-OD1 3.34Å; C342-N347 HydrophobicContact CB-CB 4.41Å; C342-N347 PolarHBondContact O-N 3.21Å; L345-N347 PolarHBondContact O-N 3.08Å; N347-S349 PolarHBondContact O-N 2.97Å; N347-S349 WeakPolarHBondContact OD1-CB 3.41Å; N347-S349 PolarHBondContact OD1-N 3.26Å; N347-S350 WeakPolarHBondContact ND2-CB 3.23Å; N347-S350 PolarHBondContact O-N 2.7Å; N347-S350 PolarHBondContact OD1-N 2.88Å; N347-V351 WeakPolarHBondContact O-CG2 3.41Å; N347-V351 PolarHBondContact O-N 3.22Å; N347-V429 HydrophobicContact CB-CB 4.41Å; N347-V429 HydrophobicContact CB-CG2 4.43Å
348	F	97.3	Very high	97.4	Very high	7 Å²	7	16.5 Å²	16.5	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-67.3	-20.5	179.7	-60.8	-67.9	0	0	0	113.2	R346 Y352 F388 L400 L401 I428 V429	R346-F348 HydrophobicContact CB-CE2 3.82Å; R346-F348 HydrophobicContact CB-CZ 4.18Å; R346-F348 HydrophobicContact CG-CE2 4.22Å; R346-F348 HydrophobicContact CG-CZ 4.18Å; R346-F348 VanDerWaalsContact O-CD2 3.3Å; R346-F348 WeakPolarHBondContact O-CD2 3.49Å; R346-F348 PolarHBondContact O-N 3Å; F348-Y352 PolarHBondContact O-N 3.25Å; F348-F388 HydrophobicContact CB-CE1 4.34Å; F348-F388 HydrophobicContact CB-CZ 3.91Å; F348-F388 HydrophobicContact CD1-CZ 4.05Å; F348-F388 HydrophobicContact CG-CZ 4.46Å; F348-F388 WeakPolarHBondContact O-CZ 3.49Å; F348-L400 HydrophobicContact CE1-CB 4.11Å; F348-L400 HydrophobicContact CE1-CD1 3.9Å; F348-L400 HydrophobicContact CE2-CB 4.38Å; F348-L400 HydrophobicContact CZ-CB 3.77Å; F348-L400 HydrophobicContact CZ-CD1 4.31Å; F348-L401 HydrophobicContact CD2-CD2 3.68Å; F348-L401 HydrophobicContact CE2-CD2 4.12Å; F348-L401 HydrophobicContact CG-CD2 4.45Å; F348-I428 HydrophobicContact CD2-CD1 4.19Å; F348-I428 HydrophobicContact CD2-CG1 4.09Å; F348-I428 HydrophobicContact CE2-CD1 3.87Å; F348-I428 HydrophobicContact CE2-CG1 4.08Å; F348-V429 WeakPolarHBondContact CB-O 3.47Å; F348-V429 PolarHBondContact N-O 3.07Å
349	S	97.4	Very high	97.2	Very high	5 Å²	5	20.2 Å²	20.2	4%	0.035	10%	0.097	C	C	.	.	H	α-helix	trans	-62.6	-59.7	172.3	-170.7	0	0	0	0	111.5	F294 N347 V351 Y352 A353 V429	F294-S349 WeakPolarHBondContact CE2-O 3.24Å; N347-S349 PolarHBondContact O-N 2.97Å; N347-S349 WeakPolarHBondContact OD1-CB 3.41Å; N347-S349 PolarHBondContact OD1-N 3.26Å; S349-V351 PolarHBondContact O-N 3.16Å; S349-Y352 PolarHBondContact O-N 2.91Å; S349-A353 PolarHBondContact O-N 3.41Å; S349-V429 PolarHBondContact N-O 3.32Å
350	S	98.3	Very high	97.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.007	11%	0.107	C	C	.	.	H	α-helix	trans	-67.8	-30.4	178.8	-90.5	0	0	0	0	113.5	D255 N347 Y352 A353 V354	D255-S350 VanDerWaalsContact OD2-CB 3.32Å; D255-S350 WeakPolarHBondContact OD2-CB 3.49Å; D255-S350 PolarHBondContact OD2-OG 3.01Å; N347-S350 WeakPolarHBondContact ND2-CB 3.23Å; N347-S350 PolarHBondContact O-N 2.7Å; N347-S350 PolarHBondContact OD1-N 2.88Å; S350-Y352 VanDerWaalsContact C-N 3.33Å; S350-Y352 PolarHBondContact O-N 2.79Å; S350-A353 PolarHBondContact O-N 2.94Å; S350-V354 WeakPolarHBondContact O-CG2 3.34Å; S350-V354 PolarHBondContact O-N 3.48Å
351	V	98.1	Very high	97	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.5	-49.3	171.9	-179.2	0	0	0	0	110.1	A339 C342 R343 N347 S349 V354 V355 L384 F388	A339-V351 WeakPolarHBondContact O-CG2 3.18Å; C342-V351 HydrophobicContact CB-CG2 3.71Å; R343-V351 HydrophobicContact CB-CG2 3.91Å; N347-V351 WeakPolarHBondContact O-CG2 3.41Å; N347-V351 PolarHBondContact O-N 3.22Å; S349-V351 PolarHBondContact O-N 3.16Å; V351-V354 PolarHBondContact O-N 3.45Å; V351-V355 HydrophobicContact CG1-CG2 4.26Å; V351-V355 WeakPolarHBondContact O-CB 3.37Å; V351-V355 VanDerWaalsContact O-CG2 3.29Å; V351-V355 WeakPolarHBondContact O-CG2 3.38Å; V351-V355 PolarHBondContact O-N 2.81Å; V351-L384 HydrophobicContact CG1-CD2 3.94Å; V351-F388 HydrophobicContact CB-CE2 3.96Å; V351-F388 HydrophobicContact CB-CZ 4.18Å; V351-F388 HydrophobicContact CG1-CD2 4.32Å; V351-F388 HydrophobicContact CG1-CE2 3.5Å; V351-F388 VanDerWaalsContact CG1-CE2 3.5Å; V351-F388 HydrophobicContact CG1-CZ 4.22Å
352	Y	97.5	Very high	96.9	Very high	18 Å²	18	22.8 Å²	22.8	7%	0.071	12%	0.12	C	C	.	.	H	α-helix	trans	-71.2	-32.4	-179.4	-170.4	-123	0	0	0	112.8	F294 F348 S349 S350 V354 V355 S356 F388 Y431	F294-Y352 AromaticContact CE2-CD1 3.8Å; F294-Y352 HydrophobicContact CE2-CD1 3.8Å; F294-Y352 HydrophobicContact CE2-CG 4.41Å; F294-Y352 AromaticContact CZ-CD1 3.62Å; F294-Y352 HydrophobicContact CZ-CD1 3.62Å; F294-Y352 HydrophobicContact CZ-CE1 4.18Å; F294-Y352 HydrophobicContact CZ-CG 4.42Å; F348-Y352 PolarHBondContact O-N 3.25Å; S349-Y352 PolarHBondContact O-N 2.91Å; S350-Y352 VanDerWaalsContact C-N 3.33Å; S350-Y352 PolarHBondContact O-N 2.79Å; Y352-V354 PolarHBondContact O-N 3.02Å; Y352-V355 PolarHBondContact O-N 2.83Å; Y352-S356 VanDerWaalsContact O-CB 3.25Å; Y352-S356 WeakPolarHBondContact O-CB 3.37Å; Y352-S356 PolarHBondContact O-N 2.87Å; Y352-S356 PolarHBondContact O-OG 3.08Å; Y352-F388 HydrophobicContact CD2-CB 3.49Å; Y352-F388 VanDerWaalsContact CD2-CB 3.49Å; Y352-F388 AromaticContact CD2-CD1 3.62Å; Y352-F388 HydrophobicContact CD2-CD1 3.62Å; Y352-F388 HydrophobicContact CD2-CD2 4.23Å; Y352-F388 HydrophobicContact CD2-CE1 4.42Å; Y352-F388 AromaticContact CD2-CG 3.5Å; Y352-F388 HydrophobicContact CD2-CG 3.5Å; Y352-F388 VanDerWaalsContact CD2-CG 3.5Å; Y352-F388 HydrophobicContact CE2-CB 3.72Å; Y352-F388 HydrophobicContact CE2-CD1 4.4Å; Y352-F388 HydrophobicContact CE2-CG 4.23Å; Y352-F388 AromaticContact CG-CD1 3.81Å; Y352-F388 HydrophobicContact CG-CD1 3.81Å; Y352-F388 HydrophobicContact CG-CE1 4.23Å; Y352-F388 HydrophobicContact CG-CG 4.12Å; Y352-Y431 AromaticContact CD1-CD1 3.87Å; Y352-Y431 HydrophobicContact CD1-CD1 3.87Å; Y352-Y431 AromaticContact CD1-CD2 3.75Å; Y352-Y431 HydrophobicContact CD1-CD2 3.75Å; Y352-Y431 AromaticContact CD1-CE1 3.72Å; Y352-Y431 HydrophobicContact CD1-CE1 3.72Å; Y352-Y431 AromaticContact CD1-CE2 3.61Å; Y352-Y431 HydrophobicContact CD1-CE2 3.61Å; Y352-Y431 AromaticContact CD1-CG 3.89Å; Y352-Y431 HydrophobicContact CD1-CG 3.89Å; Y352-Y431 AromaticContact CD1-CZ 3.57Å; Y352-Y431 HydrophobicContact CE1-CD1 4.19Å; Y352-Y431 AromaticContact CE1-CE1 3.63Å; Y352-Y431 HydrophobicContact CE1-CE1 3.63Å; Y352-Y431 HydrophobicContact CE1-CE2 4.05Å; Y352-Y431 AromaticContact CE1-CZ 3.55Å
353	A	97.6	Very high	96.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.6	-45.4	173.2	0	0	0	0	0	111.5	F294 V297 S349 S350 S356 A357	F294-A353 HydrophobicContact CD2-CB 3.75Å; F294-A353 HydrophobicContact CE2-CB 3.66Å; F294-A353 VanDerWaalsContact CE2-N 3.33Å; F294-A353 HydrophobicContact CG-CB 4.26Å; F294-A353 HydrophobicContact CZ-CB 4.1Å; V297-A353 HydrophobicContact CB-CB 3.9Å; V297-A353 HydrophobicContact CG1-CB 3.76Å; S349-A353 PolarHBondContact O-N 3.41Å; S350-A353 PolarHBondContact O-N 2.94Å; A353-S356 PolarHBondContact O-OG 2.95Å; A353-A357 VanDerWaalsContact O-CB 3.24Å; A353-A357 WeakPolarHBondContact O-CB 3.36Å; A353-A357 PolarHBondContact O-N 3.44Å; A353-A357 VanDerWaalsContact O-N 3.15Å
354	V	98.5	Very high	96.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.5	-44.7	177.5	-179.8	0	0	0	0	111.9	V297 V301 W335 A339 S350 V351 Y352 A357 L358	V297-V354 HydrophobicContact CG1-CG2 4.1Å; V301-V354 HydrophobicContact CG2-CB 4.22Å; V301-V354 HydrophobicContact CG2-CG1 4.06Å; V301-V354 HydrophobicContact CG2-CG2 3.83Å; W335-V354 HydrophobicContact CB-CG1 3.95Å; W335-V354 HydrophobicContact CE3-CG1 4.39Å; W335-V354 HydrophobicContact CE3-CG2 4.02Å; W335-V354 HydrophobicContact CZ3-CG2 4.34Å; A339-V354 HydrophobicContact CB-CB 3.98Å; A339-V354 HydrophobicContact CB-CG1 3.88Å; S350-V354 WeakPolarHBondContact O-CG2 3.34Å; S350-V354 PolarHBondContact O-N 3.48Å; V351-V354 PolarHBondContact O-N 3.45Å; Y352-V354 PolarHBondContact O-N 3.02Å; V354-A357 PolarHBondContact O-N 3.09Å; V354-L358 HydrophobicContact CG1-CD1 3.93Å; V354-L358 HydrophobicContact CG1-CG 4.3Å; V354-L358 VanDerWaalsContact O-CG 3.32Å; V354-L358 WeakPolarHBondContact O-CG 3.28Å; V354-L358 PolarHBondContact O-N 2.83Å
355	V	97.6	Very high	97	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-60.8	-48.5	179.1	169	0	0	0	0	111.3	V351 Y352 A357 L358 Q359 L384	V351-V355 HydrophobicContact CG1-CG2 4.26Å; V351-V355 WeakPolarHBondContact O-CB 3.37Å; V351-V355 VanDerWaalsContact O-CG2 3.29Å; V351-V355 WeakPolarHBondContact O-CG2 3.38Å; V351-V355 PolarHBondContact O-N 2.81Å; Y352-V355 PolarHBondContact O-N 2.83Å; V355-A357 VanDerWaalsContact C-N 3.35Å; V355-A357 PolarHBondContact O-N 2.77Å; V355-L358 PolarHBondContact O-N 3.4Å; V355-Q359 HydrophobicContact CG1-CG 4.37Å; V355-Q359 WeakPolarHBondContact O-CB 3.4Å; V355-Q359 VanDerWaalsContact O-CG 3.3Å; V355-Q359 WeakPolarHBondContact O-CG 3.46Å; V355-Q359 PolarHBondContact O-N 3.28Å; V355-L384 HydrophobicContact CG2-CB 3.79Å
356	S	96.6	Very high	97.1	Very high	30 Å²	30	20.2 Å²	20.2	21%	0.21	11%	0.105	C	C	.	.	H	α-helix	trans	-66.4	-34.4	179.8	61.4	0	0	0	0	112.8	Y352 A353 Q359 S360	Y352-S356 VanDerWaalsContact O-CB 3.25Å; Y352-S356 WeakPolarHBondContact O-CB 3.37Å; Y352-S356 PolarHBondContact O-N 2.87Å; Y352-S356 PolarHBondContact O-OG 3.08Å; A353-S356 PolarHBondContact O-OG 2.95Å; S356-Q359 PolarHBondContact O-N 3.01Å; S356-S360 PolarHBondContact O-N 3.49Å
357	A	97.6	Very high	97.2	Very high	4 Å²	4	25.8 Å²	25.8	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-65.6	-42.9	172.2	0	0	0	0	0	112.8	A298 V301 V302 A353 V354 V355 S360 I363	A298-A357 HydrophobicContact CB-CB 4.1Å; A298-A357 WeakPolarHBondContact O-CB 3.42Å; V301-A357 HydrophobicContact CB-CB 3.67Å; V301-A357 HydrophobicContact CG1-CB 3.67Å; V301-A357 HydrophobicContact CG2-CB 4.29Å; V302-A357 HydrophobicContact CG2-CB 4.14Å; A353-A357 VanDerWaalsContact O-CB 3.24Å; A353-A357 WeakPolarHBondContact O-CB 3.36Å; A353-A357 PolarHBondContact O-N 3.44Å; A353-A357 VanDerWaalsContact O-N 3.15Å; V354-A357 PolarHBondContact O-N 3.09Å; V355-A357 VanDerWaalsContact C-N 3.35Å; V355-A357 PolarHBondContact O-N 2.77Å; A357-S360 VanDerWaalsContact O-CB 3.24Å; A357-S360 WeakPolarHBondContact O-CB 3.33Å; A357-S360 PolarHBondContact O-N 3.13Å; A357-S360 PolarHBondContact O-OG 3.33Å; A357-I363 WeakPolarHBondContact O-CG1 3.29Å
358	L	97.9	Very high	97.1	Very high	2 Å²	2	28 Å²	28	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-68.9	-33.2	176.2	-68.3	176.2	0	0	0	112.7	V301 V305 L332 I336 V354 V355 S360 I363 W370 F381	V301-L358 HydrophobicContact CG1-CD2 3.82Å; V301-L358 HydrophobicContact CG1-CG 4.04Å; V305-L358 HydrophobicContact CG2-CD2 4.33Å; L332-L358 HydrophobicContact CD2-CD2 3.67Å; I336-L358 HydrophobicContact CG1-CD1 3.75Å; V354-L358 HydrophobicContact CG1-CD1 3.93Å; V354-L358 HydrophobicContact CG1-CG 4.3Å; V354-L358 VanDerWaalsContact O-CG 3.32Å; V354-L358 WeakPolarHBondContact O-CG 3.28Å; V354-L358 PolarHBondContact O-N 2.83Å; V355-L358 PolarHBondContact O-N 3.4Å; L358-S360 VanDerWaalsContact C-N 3.3Å; L358-I363 HydrophobicContact CD2-CG2 4.09Å; L358-W370 HydrophobicContact CB-CH2 4.25Å; L358-W370 HydrophobicContact CB-CZ2 4.31Å; L358-W370 HydrophobicContact CD2-CH2 4.5Å; L358-F381 HydrophobicContact CB-CE2 3.6Å; L358-F381 HydrophobicContact CB-CZ 3.71Å; L358-F381 HydrophobicContact CD1-CD2 3.96Å; L358-F381 HydrophobicContact CD1-CE2 3.7Å; L358-F381 HydrophobicContact CD1-CZ 4.49Å; L358-F381 HydrophobicContact CG-CE2 4.32Å
359	Q	96.3	Very high	97.1	Very high	77 Å²	77	27.6 Å²	27.6	36%	0.36	14%	0.142	S	C	.	.	H	α-helix	trans	-75.8	-14.1	172.3	-71	179.1	-10.6	0	0	113.6	V355 S356 F381 C385	V355-Q359 HydrophobicContact CG1-CG 4.37Å; V355-Q359 WeakPolarHBondContact O-CB 3.4Å; V355-Q359 VanDerWaalsContact O-CG 3.3Å; V355-Q359 WeakPolarHBondContact O-CG 3.46Å; V355-Q359 PolarHBondContact O-N 3.28Å; S356-Q359 PolarHBondContact O-N 3.01Å; Q359-F381 HydrophobicContact CG-CZ 4.03Å; Q359-C385 PolarHBondContact NE2-SG 3.01Å
360	S	95.4	Very high	97.1	Very high	31 Å²	31	28.8 Å²	28.8	22%	0.217	15%	0.146	C	C	.	.	S	Bend	trans	-62.1	150.1	-175.9	76.7	0	0	0	0	112.3	S356 A357 L358 I363 H364	S356-S360 PolarHBondContact O-N 3.49Å; A357-S360 VanDerWaalsContact O-CB 3.24Å; A357-S360 WeakPolarHBondContact O-CB 3.33Å; A357-S360 PolarHBondContact O-N 3.13Å; A357-S360 PolarHBondContact O-OG 3.33Å; L358-S360 VanDerWaalsContact C-N 3.3Å; S360-I363 PolarHBondContact O-N 3.26Å; S360-H364 WeakPolarHBondContact O-CB 3.5Å; S360-H364 PolarHBondContact O-N 2.77Å
361	S	95.5	Very high	97.1	Very high	58 Å²	58	31.8 Å²	31.8	41%	0.406	18%	0.177	S	C	.	.	H	α-helix	trans	-45.8	-49.8	-179	-173.7	0	0	0	0	114.8	I363 R365	S361-I363 VanDerWaalsContact C-N 3.27Å; S361-I363 PolarHBondContact O-N 2.72Å; S361-R365 VanDerWaalsContact O-CG 3.28Å; S361-R365 WeakPolarHBondContact O-CG 3.24Å; S361-R365 PolarHBondContact O-N 3.42Å
362	P	95.9	Very high	97.1	Very high	13 Å²	13	36.9 Å²	36.9	8%	0.084	20%	0.201	C	C	.	.	H	α-helix	trans	-69.6	-16	-179.5	28.5	-36.4	0	0	0	114.8	V302 L366 S503 S507	V302-P362 HydrophobicContact CG1-CG 4.41Å; P362-L366 WeakPolarHBondContact O-CD1 3.39Å; P362-L366 WeakPolarHBondContact O-CG 3.46Å; P362-S503 WeakPolarHBondContact CB-O 3.41Å; P362-S507 WeakPolarHBondContact CA-OG 3.44Å; P362-S507 WeakPolarHBondContact O-CB 3.27Å; P362-S507 PolarHBondContact O-OG 3.08Å
363	I	98.1	Very high	97.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-102.8	-44.6	179.2	-54.6	-53.2	0	0	0	111.7	V302 V305 L306 L332 A357 L358 S360 S361 R365 L366 W370	V302-I363 HydrophobicContact CG1-CD1 4.33Å; V302-I363 HydrophobicContact CG2-CG1 4.1Å; V305-I363 HydrophobicContact CB-CD1 3.98Å; V305-I363 HydrophobicContact CG1-CD1 3.95Å; V305-I363 HydrophobicContact CG1-CG2 4.05Å; L306-I363 HydrophobicContact CD1-CD1 4.43Å; L306-I363 HydrophobicContact CD2-CD1 4.07Å; L306-I363 HydrophobicContact CG-CD1 3.84Å; L332-I363 HydrophobicContact CD2-CG2 3.87Å; A357-I363 WeakPolarHBondContact O-CG1 3.29Å; L358-I363 HydrophobicContact CD2-CG2 4.09Å; S360-I363 PolarHBondContact O-N 3.26Å; S361-I363 VanDerWaalsContact C-N 3.27Å; S361-I363 PolarHBondContact O-N 2.72Å; I363-R365 PolarHBondContact O-N 3.01Å; I363-L366 HydrophobicContact CD1-CD1 4.15Å; I363-L366 WeakPolarHBondContact O-CB 3.35Å; I363-L366 WeakPolarHBondContact O-CG 3.3Å; I363-L366 PolarHBondContact O-N 2.92Å; I363-L366 VanDerWaalsContact O-N 3.12Å; I363-W370 HydrophobicContact CG2-CZ2 4.19Å; I363-W370 PolarHBondContact O-NE1 3.38Å
364	H	95.9	Very high	97.1	Very high	72 Å²	72	39.4 Å²	39.4	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-59.9	-29.3	178.8	173.2	-122.1	0	0	0	112.9	S360 L366 R367	S360-H364 WeakPolarHBondContact O-CB 3.5Å; S360-H364 PolarHBondContact O-N 2.77Å; H364-L366 VanDerWaalsContact C-N 3.28Å; H364-L366 PolarHBondContact O-N 3.18Å; H364-R367 PolarHBondContact CD2-NH1 2.81Å; H364-R367 PolarHBondContact CE1-NH2 2.72Å; H364-R367 PolarHBondContact NE2-NH1 3.27Å; H364-R367 PolarHBondContact NE2-NH2 2.69Å; H364-R367 VanDerWaalsContact NE2-NH2 3.18Å; H364-R367 PolarHBondContact O-NH1 3.41Å
365	R	96.9	Very high	97.1	Very high	73 Å²	73	49.2 Å²	49.2	28%	0.275	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-10.6	177.8	70.5	173.6	-89.2	145.9	5.1	115.6	S361 I363 R367 S507 C508 E511	S361-R365 VanDerWaalsContact O-CG 3.28Å; S361-R365 WeakPolarHBondContact O-CG 3.24Å; S361-R365 PolarHBondContact O-N 3.42Å; I363-R365 PolarHBondContact O-N 3.01Å; R365-R367 PolarHBondContact O-N 3.28Å; R365-S507 WeakPolarHBondContact CD-OG 3.34Å; R365-S507 VanDerWaalsContact CG-OG 3.22Å; R365-S507 WeakPolarHBondContact CG-OG 3.35Å; R365-S507 PolarHBondContact NE-OG 3.13Å; R365-C508 PolarHBondContact NH1-SG 3.28Å; R365-C508 VanDerWaalsContact NH1-SG 3.38Å; R365-E511 PolarHBondContact NH2-O 2.65Å
366	L	97	Very high	97.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.			trans	-79.6	62.7	-172.7	-58	177.7	0	0	0	111.7	V305 L306 P362 I363 H364 A368 A369 W370 S507 V510 E511	V305-L366 HydrophobicContact CG1-CD1 4.15Å; L306-L366 HydrophobicContact CD2-CD1 3.98Å; P362-L366 WeakPolarHBondContact O-CD1 3.39Å; P362-L366 WeakPolarHBondContact O-CG 3.46Å; I363-L366 HydrophobicContact CD1-CD1 4.15Å; I363-L366 WeakPolarHBondContact O-CB 3.35Å; I363-L366 WeakPolarHBondContact O-CG 3.3Å; I363-L366 PolarHBondContact O-N 2.92Å; I363-L366 VanDerWaalsContact O-N 3.12Å; H364-L366 VanDerWaalsContact C-N 3.28Å; H364-L366 PolarHBondContact O-N 3.18Å; L366-A368 VanDerWaalsContact C-N 3.28Å; L366-A368 PolarHBondContact O-N 3.21Å; L366-A369 HydrophobicContact CB-CB 4.25Å; L366-A369 PolarHBondContact O-N 3.07Å; L366-A369 VanDerWaalsContact O-N 3.13Å; L366-W370 PolarHBondContact O-N 2.92Å; L366-S507 WeakPolarHBondContact CD2-OG 3.48Å; L366-V510 HydrophobicContact CD2-CG2 4.01Å; L366-E511 WeakPolarHBondContact CA-OE2 3.3Å; L366-E511 WeakPolarHBondContact CB-OE1 3.27Å; L366-E511 HydrophobicContact CD2-CB 3.86Å; L366-E511 HydrophobicContact CD2-CG 4.08Å
367	R	97.2	Very high	97.2	Very high	150 Å²	150	53.5 Å²	53.5	57%	0.566	28%	0.278	S	S	*	.	H	α-helix	trans	-60.9	-31	-169	-64.2	-49.3	-165.1	-161.4	7.7	113.7	H364 R365 G371 E511	H364-R367 PolarHBondContact CD2-NH1 2.81Å; H364-R367 PolarHBondContact CE1-NH2 2.72Å; H364-R367 PolarHBondContact NE2-NH1 3.27Å; H364-R367 PolarHBondContact NE2-NH2 2.69Å; H364-R367 VanDerWaalsContact NE2-NH2 3.18Å; H364-R367 PolarHBondContact O-NH1 3.41Å; R365-R367 PolarHBondContact O-N 3.28Å; R367-G371 PolarHBondContact O-N 3.18Å; R367-E511 PolarHBondContact N-OE2 3.35Å
368	A	96.6	Very high	97.2	Very high	45 Å²	45	56.3 Å²	56.3	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-69.6	-45.4	175.3	0	0	0	0	0	110.7	P325 L366 G371 E372 E511	P325-A368 HydrophobicContact CB-CB 3.84Å; P325-A368 HydrophobicContact CG-CB 3.74Å; L366-A368 VanDerWaalsContact C-N 3.28Å; L366-A368 PolarHBondContact O-N 3.21Å; A368-G371 PolarHBondContact O-N 2.84Å; A368-E372 WeakPolarHBondContact O-CG 3.27Å; A368-E372 PolarHBondContact O-N 2.89Å; A368-E511 WeakPolarHBondContact CB-OE2 3.38Å; A368-E511 PolarHBondContact N-OE2 2.86Å
369	A	97.4	Very high	97.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.4	-37	177.4	0	0	0	0	0	113.3	R328 L332 L366 G371 E511	R328-A369 HydrophobicContact CB-CB 3.72Å; R328-A369 HydrophobicContact CG-CB 3.6Å; L332-A369 HydrophobicContact CD1-CB 3.98Å; L366-A369 HydrophobicContact CB-CB 4.25Å; L366-A369 PolarHBondContact O-N 3.07Å; L366-A369 VanDerWaalsContact O-N 3.13Å; A369-G371 VanDerWaalsContact C-N 3.35Å; A369-E511 WeakPolarHBondContact CB-OE1 3.21Å; A369-E511 PolarHBondContact N-OE1 3.32Å
370	W	98	Very high	97.2	Very high	29 Å²	29	62.7 Å²	62.7	11%	0.11	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-30.4	173.4	-76	109.6	0	0	0	112.9	L332 I336 L358 I363 L366 A373 L378 F381	L332-W370 HydrophobicContact CD1-CD2 3.83Å; L332-W370 HydrophobicContact CD1-CE3 4.05Å; L332-W370 HydrophobicContact CD1-CG 4.14Å; L332-W370 HydrophobicContact CD2-CD2 4.49Å; L332-W370 HydrophobicContact CD2-CH2 4.03Å; L332-W370 HydrophobicContact CD2-CZ2 3.73Å; I336-W370 HydrophobicContact CD1-CZ3 4.14Å; L358-W370 HydrophobicContact CB-CH2 4.25Å; L358-W370 HydrophobicContact CB-CZ2 4.31Å; L358-W370 HydrophobicContact CD2-CH2 4.5Å; I363-W370 HydrophobicContact CG2-CZ2 4.19Å; I363-W370 PolarHBondContact O-NE1 3.38Å; L366-W370 PolarHBondContact O-N 2.92Å; W370-A373 PolarHBondContact O-N 3.1Å; W370-L378 HydrophobicContact CE3-CD2 3.72Å; W370-L378 HydrophobicContact CZ3-CD2 3.98Å; W370-F381 AromaticContact CH2-CD1 3.88Å; W370-F381 HydrophobicContact CH2-CD1 3.88Å; W370-F381 AromaticContact CH2-CE1 3.56Å; W370-F381 HydrophobicContact CH2-CE1 3.56Å; W370-F381 HydrophobicContact CH2-CE2 4.49Å; W370-F381 HydrophobicContact CH2-CG 4.47Å; W370-F381 AromaticContact CH2-CZ 3.9Å; W370-F381 HydrophobicContact CH2-CZ 3.9Å; W370-F381 HydrophobicContact CZ2-CE1 4.33Å; W370-F381 AromaticContact CZ3-CD1 3.91Å; W370-F381 HydrophobicContact CZ3-CD1 3.91Å; W370-F381 HydrophobicContact CZ3-CE1 4Å
371	G	97.6	Very high	97.3	Very high	64 Å²	64	62.5 Å²	62.5	66%	0.66	31%	0.313	S	S	*	.	H	α-helix	trans	-71	-28.3	176.2	0	0	0	0	0	114.2	R367 A368 A369	R367-G371 PolarHBondContact O-N 3.18Å; A368-G371 PolarHBondContact O-N 2.84Å; A369-G371 VanDerWaalsContact C-N 3.35Å
372	E	98.3	Very high	97.3	Very high	108 Å²	108	62.7 Å²	62.7	51%	0.505	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.2	176.5	-67.3	-71.4	155.8	0	0	113.4	P325 P326 A329 A368	P325-E372 HydrophobicContact CB-CG 4.05Å; P326-E372 HydrophobicContact CB-CB 4.48Å; P326-E372 HydrophobicContact CB-CG 4.4Å; P326-E372 HydrophobicContact CG-CG 3.97Å; A329-E372 HydrophobicContact CB-CB 3.75Å; A368-E372 WeakPolarHBondContact O-CG 3.27Å; A368-E372 PolarHBondContact O-N 2.89Å
373	A	97.6	Very high	97.3	Very high	8 Å²	8	65 Å²	65	7%	0.066	33%	0.331	C	S	.	.	S	Bend	trans	-78.4	140.1	179.6	0	0	0	0	0	112.1	A329 E333 W370 L378	A329-A373 HydrophobicContact CB-CB 4.45Å; E333-A373 HydrophobicContact CG-CB 4.44Å; W370-A373 PolarHBondContact O-N 3.1Å; A373-L378 HydrophobicContact CB-CD2 4.2Å; A373-L378 HydrophobicContact CB-CG 4.34Å
374	T	98.1	Very high	97	Very high	62 Å²	62	65 Å²	65	38%	0.38	33%	0.331	S	S	.	.			trans	-64.1	143.4	-178.4	52	0	0	0	0	112.9	E333 D376 S377 L378	E333-T374 VanDerWaalsContact OE1-CB 3.24Å; E333-T374 WeakPolarHBondContact OE1-CB 3.23Å; E333-T374 WeakPolarHBondContact OE1-CG2 3.37Å; E333-T374 PolarHBondContact OE1-N 2.97Å; E333-T374 PolarHBondContact OE1-OG1 3.44Å; T374-D376 PolarHBondContact O-N 3.22Å; T374-S377 PolarHBondContact O-N 3.15Å; T374-S377 PolarHBondContact OG1-OG 3.43Å; T374-L378 WeakPolarHBondContact O-CG 3.49Å; T374-L378 PolarHBondContact O-N 3.43Å
375	R	97.6	Very high	96.8	Very high	207 Å²	207	62.9 Å²	62.9	78%	0.781	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-15	178.9	-63.1	-177.4	67.3	162.1	1.4	114	R379	R375-R379 VanDerWaalsContact O-CG 3.27Å; R375-R379 WeakPolarHBondContact O-CG 3.45Å; R375-R379 PolarHBondContact O-N 2.75Å; R375-R379 PolarHBondContact O-NE 3.27Å
376	D	97.8	Very high	96.5	Very high	98 Å²	98	64.4 Å²	64.4	52%	0.524	33%	0.334	S	S	.	.	H	α-helix	trans	-86	-48.3	179.5	-66.1	4.3	0	0	0	109.8	T374 L378 R379 V380	T374-D376 PolarHBondContact O-N 3.22Å; D376-L378 VanDerWaalsContact C-N 3.31Å; D376-L378 PolarHBondContact O-N 3.42Å; D376-R379 PolarHBondContact O-N 3.03Å; D376-R379 VanDerWaalsContact O-N 3.13Å; D376-R379 IonicContact OD1-CZ 3.74Å; D376-R379 IonicContact OD1-NE 3.2Å; D376-R379 IonicContact OD1-NH2 3.4Å; D376-R379 PolarHBondContact OD1-NH2 3.37Å; D376-V380 WeakPolarHBondContact O-CG2 3.33Å; D376-V380 PolarHBondContact O-N 3.01Å
377	S	97.8	Very high	96	Very high	23 Å²	23	65.1 Å²	65.1	16%	0.161	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-40.4	169.7	-64.8	0	0	0	0	112.1	I336 T374 R379 V380 F381	I336-S377 WeakPolarHBondContact CG2-O 3.46Å; T374-S377 PolarHBondContact O-N 3.15Å; T374-S377 PolarHBondContact OG1-OG 3.43Å; S377-R379 VanDerWaalsContact C-N 3.32Å; S377-R379 PolarHBondContact O-N 2.84Å; S377-V380 PolarHBondContact O-N 3.08Å; S377-F381 WeakPolarHBondContact O-CB 3.39Å; S377-F381 PolarHBondContact O-N 2.94Å
378	L	97.4	Very high	95.3	Very high	62 Å²	62	58.7 Å²	58.7	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-35.9	174.9	-66.4	176.1	0	0	0	112.8	W370 A373 T374 D376 S382	W370-L378 HydrophobicContact CE3-CD2 3.72Å; W370-L378 HydrophobicContact CZ3-CD2 3.98Å; A373-L378 HydrophobicContact CB-CD2 4.2Å; A373-L378 HydrophobicContact CB-CG 4.34Å; T374-L378 WeakPolarHBondContact O-CG 3.49Å; T374-L378 PolarHBondContact O-N 3.43Å; D376-L378 VanDerWaalsContact C-N 3.31Å; D376-L378 PolarHBondContact O-N 3.42Å; L378-S382 WeakPolarHBondContact O-CB 3.48Å; L378-S382 PolarHBondContact O-N 3.31Å
379	R	97.7	Very high	94.6	Very high	167 Å²	167	57.9 Å²	57.9	63%	0.63	31%	0.306	S	S	*	.	H	α-helix	trans	-69.3	-44.3	174.6	-80.3	-175.4	-71.4	167.4	-4.6	112.1	R375 D376 S377 S382 S383	R375-R379 VanDerWaalsContact O-CG 3.27Å; R375-R379 WeakPolarHBondContact O-CG 3.45Å; R375-R379 PolarHBondContact O-N 2.75Å; R375-R379 PolarHBondContact O-NE 3.27Å; D376-R379 PolarHBondContact O-N 3.03Å; D376-R379 VanDerWaalsContact O-N 3.13Å; D376-R379 IonicContact OD1-CZ 3.74Å; D376-R379 IonicContact OD1-NE 3.2Å; D376-R379 IonicContact OD1-NH2 3.4Å; D376-R379 PolarHBondContact OD1-NH2 3.37Å; S377-R379 VanDerWaalsContact C-N 3.32Å; S377-R379 PolarHBondContact O-N 2.84Å; R379-S382 PolarHBondContact O-N 3.35Å; R379-S383 PolarHBondContact O-N 2.92Å; R379-S383 VanDerWaalsContact O-N 3.07Å
380	V	97.5	Very high	93.6	Very high	46 Å²	46	62.3 Å²	62.3	28%	0.279	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-48.1	174.6	172.7	0	0	0	0	110.2	I336 E340 D376 S377 S382 S383 L384	I336-V380 HydrophobicContact CG2-CB 4.1Å; I336-V380 HydrophobicContact CG2-CG1 3.88Å; E340-V380 HydrophobicContact CB-CG1 3.89Å; E340-V380 HydrophobicContact CG-CG1 4.16Å; D376-V380 WeakPolarHBondContact O-CG2 3.33Å; D376-V380 PolarHBondContact O-N 3.01Å; S377-V380 PolarHBondContact O-N 3.08Å; V380-S382 VanDerWaalsContact C-N 3.34Å; V380-S382 PolarHBondContact O-N 3.18Å; V380-S383 PolarHBondContact O-N 3.35Å; V380-S383 VanDerWaalsContact O-N 3.1Å; V380-L384 HydrophobicContact CG1-CD1 3.92Å; V380-L384 HydrophobicContact CG1-CG 4.32Å; V380-L384 WeakPolarHBondContact O-CG 3.37Å; V380-L384 PolarHBondContact O-N 3.29Å
381	F	97.5	Very high	92.5	Very high	28 Å²	28	66.5 Å²	66.5	12%	0.123	35%	0.347	C	S	.	.	H	α-helix	trans	-58.1	-43.8	176.7	-178	-121.4	0	0	0	112.4	I336 L358 Q359 W370 S377 S383 L384 C385	I336-F381 HydrophobicContact CD1-CB 3.88Å; I336-F381 HydrophobicContact CD1-CG 4.23Å; I336-F381 HydrophobicContact CG1-CB 3.98Å; I336-F381 HydrophobicContact CG1-CD2 4.1Å; I336-F381 HydrophobicContact CG1-CG 4.23Å; I336-F381 HydrophobicContact CG2-CB 4.14Å; L358-F381 HydrophobicContact CB-CE2 3.6Å; L358-F381 HydrophobicContact CB-CZ 3.71Å; L358-F381 HydrophobicContact CD1-CD2 3.96Å; L358-F381 HydrophobicContact CD1-CE2 3.7Å; L358-F381 HydrophobicContact CD1-CZ 4.49Å; L358-F381 HydrophobicContact CG-CE2 4.32Å; Q359-F381 HydrophobicContact CG-CZ 4.03Å; W370-F381 AromaticContact CH2-CD1 3.88Å; W370-F381 HydrophobicContact CH2-CD1 3.88Å; W370-F381 AromaticContact CH2-CE1 3.56Å; W370-F381 HydrophobicContact CH2-CE1 3.56Å; W370-F381 HydrophobicContact CH2-CE2 4.49Å; W370-F381 HydrophobicContact CH2-CG 4.47Å; W370-F381 AromaticContact CH2-CZ 3.9Å; W370-F381 HydrophobicContact CH2-CZ 3.9Å; W370-F381 HydrophobicContact CZ2-CE1 4.33Å; W370-F381 AromaticContact CZ3-CD1 3.91Å; W370-F381 HydrophobicContact CZ3-CD1 3.91Å; W370-F381 HydrophobicContact CZ3-CE1 4Å; S377-F381 WeakPolarHBondContact O-CB 3.39Å; S377-F381 PolarHBondContact O-N 2.94Å; F381-S383 VanDerWaalsContact C-N 3.3Å; F381-S383 PolarHBondContact O-N 2.84Å; F381-L384 PolarHBondContact O-N 2.79Å; F381-C385 PolarHBondContact O-N 2.9Å; F381-C385 PolarHBondContact O-SG 3.12Å
382	S	95.8	Very high	91.6	Very high	62 Å²	62	69.6 Å²	69.6	43%	0.434	35%	0.349	S	S	.	.	H	α-helix	trans	-61.3	-36.2	176	-171.3	0	0	0	0	112.9	L378 R379 V380 Q386	L378-S382 WeakPolarHBondContact O-CB 3.48Å; L378-S382 PolarHBondContact O-N 3.31Å; R379-S382 PolarHBondContact O-N 3.35Å; V380-S382 VanDerWaalsContact C-N 3.34Å; V380-S382 PolarHBondContact O-N 3.18Å; S382-Q386 WeakPolarHBondContact O-CG 3.45Å; S382-Q386 PolarHBondContact O-N 3.19Å
383	S	94.8	Very high	90.6	Very high	60 Å²	60	65.7 Å²	65.7	42%	0.42	33%	0.331	S	S	.	.	H	α-helix	trans	-71.2	-41.9	175.6	-176.2	0	0	0	0	111.8	R379 V380 F381 C385 Q386 I387	R379-S383 PolarHBondContact O-N 2.92Å; R379-S383 VanDerWaalsContact O-N 3.07Å; V380-S383 PolarHBondContact O-N 3.35Å; V380-S383 VanDerWaalsContact O-N 3.1Å; F381-S383 VanDerWaalsContact C-N 3.3Å; F381-S383 PolarHBondContact O-N 2.84Å; S383-C385 VanDerWaalsContact C-N 3.26Å; S383-C385 PolarHBondContact O-N 3.25Å; S383-Q386 PolarHBondContact O-N 3.33Å; S383-Q386 VanDerWaalsContact O-N 3.14Å; S383-I387 PolarHBondContact O-N 2.93Å
384	L	93.4	Very high	89.7	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-34.9	173.9	-66.6	170.6	0	0	0	112.1	A339 R343 V351 V355 V380 F381	A339-L384 HydrophobicContact CB-CD1 3.78Å; R343-L384 HydrophobicContact CB-CD2 4.21Å; R343-L384 HydrophobicContact CG-CD2 4.5Å; V351-L384 HydrophobicContact CG1-CD2 3.94Å; V355-L384 HydrophobicContact CG2-CB 3.79Å; V380-L384 HydrophobicContact CG1-CD1 3.92Å; V380-L384 HydrophobicContact CG1-CG 4.32Å; V380-L384 WeakPolarHBondContact O-CG 3.37Å; V380-L384 PolarHBondContact O-N 3.29Å; F381-L384 PolarHBondContact O-N 2.79Å
385	C	91.7	Very high	88.8	Confident	28 Å²	28	64.9 Å²	64.9	19%	0.189	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-34.8	175.3	-66.9	0	0	0	0	113	Q359 F381 S383 S389	Q359-C385 PolarHBondContact NE2-SG 3.01Å; F381-C385 PolarHBondContact O-N 2.9Å; F381-C385 PolarHBondContact O-SG 3.12Å; S383-C385 VanDerWaalsContact C-N 3.26Å; S383-C385 PolarHBondContact O-N 3.25Å; C385-S389 PolarHBondContact O-N 2.73Å
386	Q	89.6	Confident	88	Confident	105 Å²	105	58.6 Å²	58.6	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-68.3	-39.1	-178.3	-74.6	166.1	-18.2	0	0	112.2	S382 S383 F388 S389 Q396	S382-Q386 WeakPolarHBondContact O-CG 3.45Å; S382-Q386 PolarHBondContact O-N 3.19Å; S383-Q386 PolarHBondContact O-N 3.33Å; S383-Q386 VanDerWaalsContact O-N 3.14Å; Q386-F388 PolarHBondContact O-N 3.45Å; Q386-S389 WeakPolarHBondContact O-CB 3.26Å; Q386-S389 PolarHBondContact O-N 2.7Å; Q386-Q396 PolarHBondContact O-NE2 2.97Å; Q386-Q396 PolarHBondContact O-OE1 3.25Å
387	I	86.5	Confident	87.3	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-39.2	178.8	-64.2	169	0	0	0	111.8	R343 S383 S397 L400	R343-I387 HydrophobicContact CG-CD1 4.43Å; S383-I387 PolarHBondContact O-N 2.93Å; I387-S397 VanDerWaalsContact O-CB 3.31Å; I387-S397 WeakPolarHBondContact O-CB 3.39Å; I387-S397 PolarHBondContact O-N 3.33Å; I387-S397 VanDerWaalsContact O-N 3.08Å; I387-L400 HydrophobicContact CD1-CD1 4.36Å; I387-L400 HydrophobicContact CG1-CD1 4.32Å; I387-L400 HydrophobicContact CG2-CD1 3.63Å
388	F	82.8	Confident	86.7	Confident	14 Å²	14	54.9 Å²	54.9	6%	0.061	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	22	-178.4	-62.3	-86.3	0	0	0	113.4	F348 V351 Y352 Q386	F348-F388 HydrophobicContact CB-CE1 4.34Å; F348-F388 HydrophobicContact CB-CZ 3.91Å; F348-F388 HydrophobicContact CD1-CZ 4.05Å; F348-F388 HydrophobicContact CG-CZ 4.46Å; F348-F388 WeakPolarHBondContact O-CZ 3.49Å; V351-F388 HydrophobicContact CB-CE2 3.96Å; V351-F388 HydrophobicContact CB-CZ 4.18Å; V351-F388 HydrophobicContact CG1-CD2 4.32Å; V351-F388 HydrophobicContact CG1-CE2 3.5Å; V351-F388 VanDerWaalsContact CG1-CE2 3.5Å; V351-F388 HydrophobicContact CG1-CZ 4.22Å; Y352-F388 HydrophobicContact CD2-CB 3.49Å; Y352-F388 VanDerWaalsContact CD2-CB 3.49Å; Y352-F388 AromaticContact CD2-CD1 3.62Å; Y352-F388 HydrophobicContact CD2-CD1 3.62Å; Y352-F388 HydrophobicContact CD2-CD2 4.23Å; Y352-F388 HydrophobicContact CD2-CE1 4.42Å; Y352-F388 AromaticContact CD2-CG 3.5Å; Y352-F388 HydrophobicContact CD2-CG 3.5Å; Y352-F388 VanDerWaalsContact CD2-CG 3.5Å; Y352-F388 HydrophobicContact CE2-CB 3.72Å; Y352-F388 HydrophobicContact CE2-CD1 4.4Å; Y352-F388 HydrophobicContact CE2-CG 4.23Å; Y352-F388 AromaticContact CG-CD1 3.81Å; Y352-F388 HydrophobicContact CG-CD1 3.81Å; Y352-F388 HydrophobicContact CG-CE1 4.23Å; Y352-F388 HydrophobicContact CG-CG 4.12Å; Q386-F388 PolarHBondContact O-N 3.45Å
389	S	81.8	Confident	86.1	Confident	28 Å²	28	58.1 Å²	58.1	20%	0.196	30%	0.295	C	S	.	.			trans	-58.6	140.4	171.1	-172.7	0	0	0	0	111.1	C385 Q386 E391 Y394	C385-S389 PolarHBondContact O-N 2.73Å; Q386-S389 WeakPolarHBondContact O-CB 3.26Å; Q386-S389 PolarHBondContact O-N 2.7Å; S389-E391 WeakPolarHBondContact CB-OE2 3.41Å; S389-E391 PolarHBondContact O-N 3.05Å; S389-E391 WeakPolarHBondContact OG-CB 3.48Å; S389-E391 VanDerWaalsContact OG-CG 3.23Å; S389-E391 WeakPolarHBondContact OG-CG 3.32Å; S389-E391 PolarHBondContact OG-N 3.22Å; S389-E391 PolarHBondContact OG-OE2 2.99Å; S389-Y394 WeakPolarHBondContact O-CA 3.34Å; S389-Y394 VanDerWaalsContact O-CD1 3.23Å; S389-Y394 WeakPolarHBondContact O-CD1 3.47Å
390	E	77.1	Confident	85.5	Confident	93 Å²	93	52.2 Å²	52.2	44%	0.435	28%	0.276	S	S	.	.	S	Bend	trans	-68.8	-8.1	173.1	-62.5	-169.3	-167	0	0	112.4	N393 Y394 T527	E390-N393 PolarHBondContact O-N 3.4Å; E390-Y394 HydrophobicContact CB-CE1 4.27Å; E390-Y394 HydrophobicContact CG-CE1 3.76Å; E390-T527 PolarHBondContact OE1-N 3.18Å
391	E	74.4	Confident	84.9	Confident	117 Å²	117	50.7 Å²	50.7	55%	0.547	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-53.8	138.6	176.4	-72.2	164.9	143.9	0	0	112.4	S389 N393 Y394 S395	S389-E391 WeakPolarHBondContact CB-OE2 3.41Å; S389-E391 PolarHBondContact O-N 3.05Å; S389-E391 WeakPolarHBondContact OG-CB 3.48Å; S389-E391 VanDerWaalsContact OG-CG 3.23Å; S389-E391 WeakPolarHBondContact OG-CG 3.32Å; S389-E391 PolarHBondContact OG-N 3.22Å; S389-E391 PolarHBondContact OG-OE2 2.99Å; E391-N393 PolarHBondContact O-N 3.12Å; E391-Y394 PolarHBondContact O-N 2.75Å; E391-S395 PolarHBondContact O-N 2.88Å
392	D	77.6	Confident	84	Confident	130 Å²	130	54.1 Å²	54.1	70%	0.695	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	41.2	37.7	-174.8	-71.6	-48.1	0	0	0	115.1
393	N	78.9	Confident	82.9	Confident	26 Å²	26	57.2 Å²	57.2	14%	0.139	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	60.6	47.7	-178.9	-170.3	52.2	0	0	0	113.5	P5 E390 E391 R398 K437	P5-N393 HydrophobicContact CG-CB 4.06Å; E390-N393 PolarHBondContact O-N 3.4Å; E391-N393 PolarHBondContact O-N 3.12Å; N393-R398 PolarHBondContact ND2-NH2 3.1Å; N393-R398 PolarHBondContact O-NE 3.09Å; N393-K437 PolarHBondContact OD1-NZ 3.38Å
394	Y	77.8	Confident	81.1	Confident	12 Å²	12	61 Å²	61	5%	0.047	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	37.4	-179.2	-47.8	-77.1	0	0	0	113.7	S389 E390 E391 Q396 S397 R398 T434 K437	S389-Y394 WeakPolarHBondContact O-CA 3.34Å; S389-Y394 VanDerWaalsContact O-CD1 3.23Å; S389-Y394 WeakPolarHBondContact O-CD1 3.47Å; E390-Y394 HydrophobicContact CB-CE1 4.27Å; E390-Y394 HydrophobicContact CG-CE1 3.76Å; E391-Y394 PolarHBondContact O-N 2.75Å; Y394-Q396 VanDerWaalsContact C-N 3.35Å; Y394-Q396 PolarHBondContact O-N 3.35Å; Y394-S397 PolarHBondContact O-N 3.15Å; Y394-S397 PolarHBondContact O-OG 2.96Å; Y394-R398 WeakPolarHBondContact O-CG 3.14Å; Y394-R398 PolarHBondContact O-N 3.14Å; Y394-R398 VanDerWaalsContact O-N 3.09Å; Y394-T434 HydrophobicContact CD2-CG2 4.49Å; Y394-K437 HydrophobicContact CE2-CD 4.3Å
395	S	78.9	Confident	79.3	Confident	40 Å²	40	64 Å²	64	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-49.8	-50.2	-175.2	54.1	0	0	0	0	113	E391 R398 E399	E391-S395 PolarHBondContact O-N 2.88Å; S395-R398 PolarHBondContact O-N 3.21Å; S395-E399 WeakPolarHBondContact O-CB 3.26Å; S395-E399 PolarHBondContact O-N 2.78Å
396	Q	81	Confident	77.1	Confident	76 Å²	76	71.8 Å²	71.8	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-50.7	-178.4	-64.3	178.8	45	0	0	112.5	Q386 Y394 R398 E399 L400	Q386-Q396 PolarHBondContact O-NE2 2.97Å; Q386-Q396 PolarHBondContact O-OE1 3.25Å; Y394-Q396 VanDerWaalsContact C-N 3.35Å; Y394-Q396 PolarHBondContact O-N 3.35Å; Q396-R398 VanDerWaalsContact C-N 3.3Å; Q396-R398 PolarHBondContact O-N 2.78Å; Q396-E399 PolarHBondContact O-N 3.31Å; Q396-L400 WeakPolarHBondContact O-CG 3.42Å; Q396-L400 PolarHBondContact O-N 2.76Å; Q396-L400 VanDerWaalsContact O-N 3.17Å
397	S	83.1	Confident	74.8	Confident	9 Å²	9	73.9 Å²	73.9	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-65.6	-30.9	178.3	67.5	0	0	0	0	113.1	I387 Y394 L401	I387-S397 VanDerWaalsContact O-CB 3.31Å; I387-S397 WeakPolarHBondContact O-CB 3.39Å; I387-S397 PolarHBondContact O-N 3.33Å; I387-S397 VanDerWaalsContact O-N 3.08Å; Y394-S397 PolarHBondContact O-N 3.15Å; Y394-S397 PolarHBondContact O-OG 2.96Å; S397-L401 WeakPolarHBondContact O-CG 3.39Å
398	R	85.5	Confident	72.4	Confident	33 Å²	33	82 Å²	82	13%	0.125	41%	0.408	C	S	.	.	H	α-helix	trans	-70.1	-43.4	174.4	-69.4	175.2	-173.8	-89.6	4.7	112.1	N393 Y394 S395 Q396 L400 L401 V402 T434 D438	N393-R398 PolarHBondContact ND2-NH2 3.1Å; N393-R398 PolarHBondContact O-NE 3.09Å; Y394-R398 WeakPolarHBondContact O-CG 3.14Å; Y394-R398 PolarHBondContact O-N 3.14Å; Y394-R398 VanDerWaalsContact O-N 3.09Å; S395-R398 PolarHBondContact O-N 3.21Å; Q396-R398 VanDerWaalsContact C-N 3.3Å; Q396-R398 PolarHBondContact O-N 2.78Å; R398-L400 VanDerWaalsContact C-N 3.26Å; R398-L400 PolarHBondContact O-N 2.84Å; R398-L401 WeakPolarHBondContact O-CB 3.46Å; R398-L401 PolarHBondContact O-N 3.04Å; R398-V402 PolarHBondContact O-N 2.97Å; R398-T434 VanDerWaalsContact CZ-CG2 3.41Å; R398-T434 VanDerWaalsContact NH2-CG2 3.32Å; R398-D438 IonicContact CZ-OD2 3.83Å; R398-D438 IonicContact NH1-OD2 3.98Å; R398-D438 PolarHBondContact NH1-OD2 3.49Å; R398-D438 VanDerWaalsContact NH2-CG 3.29Å; R398-D438 IonicContact NH2-OD1 2.67Å; R398-D438 PolarHBondContact NH2-OD1 3.12Å; R398-D438 IonicContact NH2-OD2 3.79Å; R398-D438 PolarHBondContact NH2-OD2 3.31Å
399	E	84.8	Confident	69.7	Low	130 Å²	130	86.1 Å²	86.1	61%	0.607	44%	0.439	S	S	*	.	H	α-helix	trans	-58.6	-39.1	177.3	-172.3	176	-178.6	0	0	111.4	S395 Q396 L401 V402 Q403	S395-E399 WeakPolarHBondContact O-CB 3.26Å; S395-E399 PolarHBondContact O-N 2.78Å; Q396-E399 PolarHBondContact O-N 3.31Å; E399-L401 VanDerWaalsContact C-N 3.26Å; E399-L401 PolarHBondContact O-N 3.29Å; E399-V402 PolarHBondContact O-N 3.26Å; E399-V402 VanDerWaalsContact O-N 3.13Å; E399-Q403 PolarHBondContact O-N 2.85Å
400	L	85.2	Confident	67.7	Low	43 Å²	43	90.6 Å²	90.6	23%	0.225	47%	0.467	C	S	.	.	H	α-helix	trans	-68.3	-15.3	174.6	-66.6	174.8	0	0	0	115	F348 I387 Q396 R398	F348-L400 HydrophobicContact CE1-CB 4.11Å; F348-L400 HydrophobicContact CE1-CD1 3.9Å; F348-L400 HydrophobicContact CE2-CB 4.38Å; F348-L400 HydrophobicContact CZ-CB 3.77Å; F348-L400 HydrophobicContact CZ-CD1 4.31Å; I387-L400 HydrophobicContact CD1-CD1 4.36Å; I387-L400 HydrophobicContact CG1-CD1 4.32Å; I387-L400 HydrophobicContact CG2-CD1 3.63Å; Q396-L400 WeakPolarHBondContact O-CG 3.42Å; Q396-L400 PolarHBondContact O-N 2.76Å; Q396-L400 VanDerWaalsContact O-N 3.17Å; R398-L400 VanDerWaalsContact C-N 3.26Å; R398-L400 PolarHBondContact O-N 2.84Å
401	L	83.9	Confident	66	Low	14 Å²	14	92.9 Å²	92.9	7%	0.073	48%	0.482	C	S	.	.	H	α-helix	trans	-82.9	-31.9	169.7	-54.2	-174.9	0	0	0	112	F348 S397 R398 E399 I428 P430 F435 R472 L473	F348-L401 HydrophobicContact CD2-CD2 3.68Å; F348-L401 HydrophobicContact CE2-CD2 4.12Å; F348-L401 HydrophobicContact CG-CD2 4.45Å; S397-L401 WeakPolarHBondContact O-CG 3.39Å; R398-L401 WeakPolarHBondContact O-CB 3.46Å; R398-L401 PolarHBondContact O-N 3.04Å; E399-L401 VanDerWaalsContact C-N 3.26Å; E399-L401 PolarHBondContact O-N 3.29Å; L401-I428 HydrophobicContact CD2-CD1 3.76Å; L401-I428 HydrophobicContact CD2-CG1 4.39Å; L401-P430 HydrophobicContact CD1-CB 4.01Å; L401-P430 HydrophobicContact CD2-CB 3.98Å; L401-F435 HydrophobicContact CD1-CE2 3.7Å; L401-F435 HydrophobicContact CD1-CZ 3.7Å; L401-R472 PolarHBondContact O-NH2 3Å; L401-L473 HydrophobicContact CB-CD2 4.3Å; L401-L473 HydrophobicContact CD1-CD1 4.23Å
402	V	78.8	Confident	63.9	Low	101 Å²	101	95.2 Å²	95.2	61%	0.612	49%	0.492	S	S	*	.	H	α-helix	trans	-82	-25.4	178.2	-179.4	0	0	0	0	111.5	R398 E399 E404	R398-V402 PolarHBondContact O-N 2.97Å; E399-V402 PolarHBondContact O-N 3.26Å; E399-V402 VanDerWaalsContact O-N 3.13Å; V402-E404 PolarHBondContact O-N 3.14Å
403	Q	73.1	Confident	62	Low	126 Å²	126	93.4 Å²	93.4	59%	0.589	49%	0.488	S	S	*	.	S	Bend	trans	-66.6	93.2	175	-174.4	168.1	84.2	0	0	111	R346 E399	R346-Q403 PolarHBondContact NH2-O 2.95Å; E399-Q403 PolarHBondContact O-N 2.85Å
404	E	56.7	Low	59.9	Low	141 Å²	141	100.1 Å²	100.1	66%	0.659	52%	0.518	S	S	*	.			trans	-56	140.7	173.3	-64.1	-170.1	144.2	0	0	111.4	V402 K406	V402-E404 PolarHBondContact O-N 3.14Å; E404-K406 VanDerWaalsContact C-N 3.31Å; E404-K406 PolarHBondContact O-N 3.03Å
405	V	56.7	Low	57.8	Low	64 Å²	64	104.3 Å²	104.3	39%	0.388	55%	0.549	S	S	.	.			trans	-70.1	95.1	162.6	-179.9	0	0	0	0	107.5	L407	V405-L407 VanDerWaalsContact C-N 3.29Å; V405-L407 PolarHBondContact O-N 3.46Å
406	K	45.1	Very low	55.8	Low	191 Å²	191	113 Å²	113	83%	0.83	58%	0.582	S	S	*	*			trans	-55.4	99.9	159.7	-71.9	-172	177.8	-176.2	0	107.2	E404 Q408	E404-K406 VanDerWaalsContact C-N 3.31Å; E404-K406 PolarHBondContact O-N 3.03Å; K406-Q408 PolarHBondContact O-N 3.02Å; K406-Q408 VanDerWaalsContact O-N 3.15Å
407	L	40.3	Very low	53.7	Low	149 Å²	149	118 Å²	118	78%	0.78	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-51.7	123.3	178.7	-122.8	75.2	0	0	0	107.8	V405 S409	V405-L407 VanDerWaalsContact C-N 3.29Å; V405-L407 PolarHBondContact O-N 3.46Å; L407-S409 PolarHBondContact O-N 2.66Å; L407-S409 VanDerWaalsContact O-N 3.12Å
408	Q	36.5	Very low	51.2	Low	184 Å²	184	122 Å²	122	86%	0.86	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-60.8	122.3	177.7	-70.2	-175.9	-8.1	0	0	108	K406	K406-Q408 PolarHBondContact O-N 3.02Å; K406-Q408 VanDerWaalsContact O-N 3.15Å
409	S	26.8	Very low	48.9	Very low	102 Å²	102	125.4 Å²	125.4	71%	0.713	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-51.2	122.8	-176.4	-178.1	0	0	0	0	110	L407 L411	L407-S409 PolarHBondContact O-N 2.66Å; L407-S409 VanDerWaalsContact O-N 3.12Å; S409-L411 PolarHBondContact O-N 3.21Å
410	P	39.8	Very low	47.1	Very low	122 Å²	122	131 Å²	131	79%	0.792	68%	0.678	S	S	*	*	S	Bend	trans	-79.8	68.6	-176.9	33.2	-35.9	0	0	0	110.8
411	L	41	Very low	45.2	Very low	140 Å²	140	131.5 Å²	131.5	73%	0.733	69%	0.685	S	S	*	*			trans	-171	105	162.9	-105.6	158.3	0	0	0	111.6	S409	S409-L411 PolarHBondContact O-N 3.21Å
412	E	30.4	Very low	43.3	Very low	166 Å²	166	133.7 Å²	133.7	78%	0.776	71%	0.711	S	S	*	*			trans	-161.1	100.4	143.6	-106.1	-47.9	125.6	0	0	108.1	H414	E412-H414 PolarHBondContact O-N 2.95Å; E412-H414 VanDerWaalsContact O-N 3.08Å
413	P	38.7	Very low	41.7	Very low	93 Å²	93	134.6 Å²	134.6	60%	0.604	72%	0.722	S	S	*	*			trans	-79.6	9.9	-160.5	30.8	-36.1	0	0	0	115.5
414	H	34.8	Very low	41.1	Very low	167 Å²	167	132.3 Å²	132.3	77%	0.773	71%	0.708	S	S	*	*			trans	-130.8	63.2	-161.8	-68.2	-20	0	0	0	115.7	E412	E412-H414 PolarHBondContact O-N 2.95Å; E412-H414 VanDerWaalsContact O-N 3.08Å
415	S	33	Very low	41.3	Very low	100 Å²	100	126.7 Å²	126.7	70%	0.699	69%	0.687	S	S	*	*			trans	-139.2	118.1	159.1	-165.6	0	0	0	0	112.6	K417	S415-K417 PolarHBondContact O-N 3.28Å
416	K	37.6	Very low	42.3	Very low	222 Å²	222	125.4 Å²	125.4	97%	0.965	69%	0.687	S	S	*	*			trans	-81.9	52.5	-176.4	-68.5	-175.8	178.3	178	0	113
417	K	36.3	Very low	44.5	Very low	181 Å²	181	116.4 Å²	116.4	79%	0.787	65%	0.649	S	S	*	*	S	Bend	trans	-130.4	112	165.7	-73.7	-179.1	179.2	174.6	0	107.8	S415	S415-K417 PolarHBondContact O-N 3.28Å
418	A	29.4	Very low	47.1	Very low	93 Å²	93	109.3 Å²	109.3	77%	0.769	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.7	130.4	175	0	0	0	0	0	109.6	R420	A418-R420 PolarHBondContact O-N 3.22Å
419	P	38.2	Very low	50	Low	104 Å²	104	100.7 Å²	100.7	68%	0.675	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-62.6	127.6	173.2	27.1	-33.3	0	0	0	108.6	S421	P419-S421 PolarHBondContact O-N 3Å
420	R	45.9	Very low	53.4	Low	249 Å²	249	96 Å²	96	94%	0.94	54%	0.539	S	S	*	.	S	Bend	trans	-74.1	117.5	170.3	-80	-172.1	169.4	126.7	-2.5	107.6	A418	A418-R420 PolarHBondContact O-N 3.22Å
421	S	47.2	Very low	56	Low	53 Å²	53	91.4 Å²	91.4	37%	0.371	51%	0.506	S	S	.	.	S	Bend	trans	66.4	121.8	-157.6	-159.9	0	0	0	0	113.5	P419 R424	P419-S421 PolarHBondContact O-N 3Å; S421-R424 VanDerWaalsContact OG-CD 3.26Å; S421-R424 WeakPolarHBondContact OG-CD 3.26Å; S421-R424 VanDerWaalsContact OG-CG 3.29Å; S421-R424 WeakPolarHBondContact OG-CG 3.29Å; S421-R424 PolarHBondContact OG-NE 2.95Å
422	G	42.1	Very low	58.7	Low	60 Å²	60	85 Å²	85	62%	0.619	47%	0.472	S	S	*	.	S	Bend	trans	-94.6	119.7	178.7	0	0	0	0	0	110.7	R424	G422-R424 VanDerWaalsContact C-N 3.33Å; G422-R424 PolarHBondContact O-N 3.18Å; G422-R424 VanDerWaalsContact O-N 3.14Å
423	S	46.7	Very low	61.6	Low	119 Å²	119	77.5 Å²	77.5	83%	0.832	44%	0.44	S	S	*	.			trans	46.6	45.7	167.9	-165.5	0	0	0	0	115.7	G425	S423-G425 PolarHBondContact O-N 3.32Å
424	R	60.6	Low	64	Low	78 Å²	78	73.5 Å²	73.5	29%	0.294	41%	0.413	S	S	.	.			trans	-50.3	114.5	163.5	-84.5	169.1	175.9	160.8	3.9	107.9	D245 E249 S421 G422	D245-R424 IonicContact OD2-NH2 3.18Å; D245-R424 PolarHBondContact OD2-NH2 2.64Å; E249-R424 IonicContact OE1-CZ 3.46Å; E249-R424 IonicContact OE1-NE 3.36Å; E249-R424 PolarHBondContact OE1-NE 3.37Å; E249-R424 IonicContact OE1-NH2 3.58Å; E249-R424 PolarHBondContact OE1-NH2 3.44Å; S421-R424 VanDerWaalsContact OG-CD 3.26Å; S421-R424 WeakPolarHBondContact OG-CD 3.26Å; S421-R424 VanDerWaalsContact OG-CG 3.29Å; S421-R424 WeakPolarHBondContact OG-CG 3.29Å; S421-R424 PolarHBondContact OG-NE 2.95Å; G422-R424 VanDerWaalsContact C-N 3.33Å; G422-R424 PolarHBondContact O-N 3.18Å; G422-R424 VanDerWaalsContact O-N 3.14Å
425	G	60.4	Low	66.9	Low	23 Å²	23	66.1 Å²	66.1	24%	0.237	38%	0.379	C	S	.	.			trans	-62	138.3	-175	0	0	0	0	0	111.8	S423 G427 G479	S423-G425 PolarHBondContact O-N 3.32Å; G425-G427 PolarHBondContact O-N 3.21Å; G425-G479 CarbonylContact C-O 3.52Å; G425-G479 WeakPolarHBondContact CA-O 3.44Å
426	G	78.3	Confident	69.9	Low	37 Å²	37	61.5 Å²	61.5	38%	0.381	35%	0.346	S	S	.	.			trans	-74.6	91.6	-173	0	0	0	0	0	112.4
427	G	90.7	Very high	72.4	Confident	3 Å²	3	53 Å²	53	3%	0.031	31%	0.31	C	S	.	.			trans	-103.4	-175.8	171.3	0	0	0	0	0	114	R346 G425 E476 Y480	R346-G427 PolarHBondContact NH1-O 3.27Å; G425-G427 PolarHBondContact O-N 3.21Å; G427-E476 WeakPolarHBondContact CA-O 3.35Å; G427-Y480 VanDerWaalsContact C-CZ 3.44Å
428	I	95.1	Very high	75	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.274	C	S	.	.			trans	-152.5	144.1	170.5	-170.1	157.4	0	0	0	110.2	R346 F348 L401 L473 E476 C477 Y480	R346-I428 HydrophobicContact CB-CB 4.45Å; R346-I428 HydrophobicContact CB-CG1 4.27Å; F348-I428 HydrophobicContact CD2-CD1 4.19Å; F348-I428 HydrophobicContact CD2-CG1 4.09Å; F348-I428 HydrophobicContact CE2-CD1 3.87Å; F348-I428 HydrophobicContact CE2-CG1 4.08Å; L401-I428 HydrophobicContact CD2-CD1 3.76Å; L401-I428 HydrophobicContact CD2-CG1 4.39Å; I428-L473 HydrophobicContact CD1-CD2 3.8Å; I428-L473 HydrophobicContact CG1-CD2 4.31Å; I428-L473 HydrophobicContact CG2-CB 4.39Å; I428-L473 HydrophobicContact CG2-CD2 3.73Å; I428-E476 HydrophobicContact CB-CG 4.46Å; I428-E476 HydrophobicContact CG2-CB 3.79Å; I428-E476 HydrophobicContact CG2-CG 3.74Å; I428-C477 VanDerWaalsContact O-CB 3.29Å; I428-C477 WeakPolarHBondContact O-CB 3.48Å; I428-C477 PolarHBondContact O-SG 3Å; I428-Y480 VanDerWaalsContact CA-OH 3.26Å; I428-Y480 WeakPolarHBondContact CA-OH 3.37Å; I428-Y480 PolarHBondContact N-OH 3.3Å
429	V	97.6	Very high	78.1	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.018	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-127.2	112.3	163.2	-167.5	0	0	0	0	109.2	T252 D255 A256 F259 R346 N347 F348 S349 Y480	T252-V429 HydrophobicContact CG2-CG2 4.41Å; D255-V429 HydrophobicContact CB-CG1 4.14Å; D255-V429 HydrophobicContact CB-CG2 4.44Å; A256-V429 HydrophobicContact CB-CG2 4.06Å; F259-V429 HydrophobicContact CB-CG1 4.02Å; F259-V429 HydrophobicContact CD1-CG1 4.41Å; F259-V429 HydrophobicContact CG-CG1 4.25Å; R346-V429 PolarHBondContact O-N 3.45Å; N347-V429 HydrophobicContact CB-CB 4.41Å; N347-V429 HydrophobicContact CB-CG2 4.43Å; F348-V429 WeakPolarHBondContact CB-O 3.47Å; F348-V429 PolarHBondContact N-O 3.07Å; S349-V429 PolarHBondContact N-O 3.32Å; V429-Y480 HydrophobicContact CG2-CE2 3.67Å; V429-Y480 PolarHBondContact N-OH 2.83Å
430	P	96.8	Very high	80.8	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.013	22%	0.217	C	C	.	.			trans	-76	155.1	-179.9	31.8	-35.3	0	0	0	112.1	F259 L401 L432 F435 L473	F259-P430 HydrophobicContact CD2-CG 4.27Å; F259-P430 VanDerWaalsContact CE1-CD 3.41Å; F259-P430 HydrophobicContact CE1-CG 3.93Å; F259-P430 HydrophobicContact CE2-CG 3.61Å; F259-P430 VanDerWaalsContact CZ-CD 3.5Å; F259-P430 HydrophobicContact CZ-CG 3.43Å; F259-P430 VanDerWaalsContact CZ-CG 3.43Å; L401-P430 HydrophobicContact CD1-CB 4.01Å; L401-P430 HydrophobicContact CD2-CB 3.98Å; P430-L432 PolarHBondContact O-N 3.33Å; P430-L432 VanDerWaalsContact O-N 3.12Å; P430-F435 HydrophobicContact CB-CE2 3.89Å; P430-F435 HydrophobicContact CG-CE2 4.49Å; P430-L473 HydrophobicContact CB-CD1 4.18Å; P430-L473 HydrophobicContact CG-CD1 4.13Å
431	Y	96.2	Very high	83	Confident	26 Å²	26	29.2 Å²	29.2	10%	0.102	19%	0.191	C	C	.	.			trans	-73.5	103	164.8	174.9	-117.6	0	0	0	110.3	F294 Y352 G433 T434	F294-Y431 HydrophobicContact CD2-CD2 4.02Å; F294-Y431 AromaticContact CD2-CE2 3.86Å; F294-Y431 HydrophobicContact CD2-CE2 3.86Å; F294-Y431 HydrophobicContact CE1-CE2 4.36Å; F294-Y431 AromaticContact CE2-CD2 3.64Å; F294-Y431 HydrophobicContact CE2-CD2 3.64Å; F294-Y431 AromaticContact CE2-CE2 3.42Å; F294-Y431 HydrophobicContact CE2-CE2 3.42Å; F294-Y431 VanDerWaalsContact CE2-CE2 3.42Å; F294-Y431 HydrophobicContact CZ-CD2 4.35Å; F294-Y431 AromaticContact CZ-CE2 3.72Å; F294-Y431 HydrophobicContact CZ-CE2 3.72Å; Y352-Y431 AromaticContact CD1-CD1 3.87Å; Y352-Y431 HydrophobicContact CD1-CD1 3.87Å; Y352-Y431 AromaticContact CD1-CD2 3.75Å; Y352-Y431 HydrophobicContact CD1-CD2 3.75Å; Y352-Y431 AromaticContact CD1-CE1 3.72Å; Y352-Y431 HydrophobicContact CD1-CE1 3.72Å; Y352-Y431 AromaticContact CD1-CE2 3.61Å; Y352-Y431 HydrophobicContact CD1-CE2 3.61Å; Y352-Y431 AromaticContact CD1-CG 3.89Å; Y352-Y431 HydrophobicContact CD1-CG 3.89Å; Y352-Y431 AromaticContact CD1-CZ 3.57Å; Y352-Y431 HydrophobicContact CE1-CD1 4.19Å; Y352-Y431 AromaticContact CE1-CE1 3.63Å; Y352-Y431 HydrophobicContact CE1-CE1 3.63Å; Y352-Y431 HydrophobicContact CE1-CE2 4.05Å; Y352-Y431 AromaticContact CE1-CZ 3.55Å; Y431-G433 PolarHBondContact O-N 2.96Å; Y431-G433 VanDerWaalsContact O-N 3.14Å; Y431-T434 PolarHBondContact O-N 3.42Å
432	L	96.1	Very high	85.2	Confident	6 Å²	6	27.6 Å²	27.6	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-27.6	-173.6	-174.6	60.6	0	0	0	113.8	L262 V287 T290 P430 T434 F435 L436 L470	L262-L432 HydrophobicContact CD1-CD2 3.81Å; L262-L432 HydrophobicContact CD2-CD1 3.65Å; L262-L432 HydrophobicContact CD2-CD2 3.93Å; L262-L432 HydrophobicContact CD2-CG 4.45Å; V287-L432 HydrophobicContact CG1-CD2 4.16Å; T290-L432 HydrophobicContact CG2-CB 4.41Å; T290-L432 HydrophobicContact CG2-CD2 3.85Å; P430-L432 PolarHBondContact O-N 3.33Å; P430-L432 VanDerWaalsContact O-N 3.12Å; L432-T434 PolarHBondContact O-N 2.99Å; L432-T434 VanDerWaalsContact O-N 3.16Å; L432-F435 HydrophobicContact CD1-CB 4.38Å; L432-F435 PolarHBondContact O-N 3.15Å; L432-F435 VanDerWaalsContact O-N 3.08Å; L432-L436 HydrophobicContact CD1-CG 4.47Å; L432-L436 HydrophobicContact CD2-CD1 4.18Å; L432-L436 HydrophobicContact CG-CD1 3.84Å; L432-L436 HydrophobicContact CG-CG 4Å; L432-L436 WeakPolarHBondContact O-CG 3.45Å; L432-L436 PolarHBondContact O-N 3.4Å; L432-L470 HydrophobicContact CD1-CD2 3.95Å
433	G	91.8	Very high	87.7	Confident	9 Å²	9	26 Å²	26	9%	0.093	16%	0.155	C	C	.	.	H	α-helix	trans	-58.5	-29.3	-179.1	0	0	0	0	0	114.3	Y431 K437	Y431-G433 PolarHBondContact O-N 2.96Å; Y431-G433 VanDerWaalsContact O-N 3.14Å; G433-K437 WeakPolarHBondContact O-CB 3.26Å; G433-K437 PolarHBondContact O-N 3.13Å
434	T	90	Very high	89.9	Confident	8 Å²	8	24.1 Å²	24.1	5%	0.049	15%	0.147	C	C	.	.	H	α-helix	trans	-64.8	-46.5	174.6	-59.3	0	0	0	0	111.6	Y394 R398 Y431 L432 K437 D438	Y394-T434 HydrophobicContact CD2-CG2 4.49Å; R398-T434 VanDerWaalsContact CZ-CG2 3.41Å; R398-T434 VanDerWaalsContact NH2-CG2 3.32Å; Y431-T434 PolarHBondContact O-N 3.42Å; L432-T434 PolarHBondContact O-N 2.99Å; L432-T434 VanDerWaalsContact O-N 3.16Å; T434-K437 WeakPolarHBondContact O-CB 3.22Å; T434-K437 PolarHBondContact O-N 2.85Å; T434-D438 PolarHBondContact O-N 3.19Å
435	F	94.6	Very high	91.4	Very high	12 Å²	12	23.8 Å²	23.8	5%	0.053	16%	0.161	C	C	.	.	H	α-helix	trans	-67.1	-41.2	178.9	-66.3	-98.4	0	0	0	111.7	L401 P430 L432 K437 D438 L439 V466 E469 L470 L473	L401-F435 HydrophobicContact CD1-CE2 3.7Å; L401-F435 HydrophobicContact CD1-CZ 3.7Å; P430-F435 HydrophobicContact CB-CE2 3.89Å; P430-F435 HydrophobicContact CG-CE2 4.49Å; L432-F435 HydrophobicContact CD1-CB 4.38Å; L432-F435 PolarHBondContact O-N 3.15Å; L432-F435 VanDerWaalsContact O-N 3.08Å; F435-K437 VanDerWaalsContact C-N 3.33Å; F435-K437 PolarHBondContact O-N 3.07Å; F435-D438 PolarHBondContact O-N 2.88Å; F435-L439 WeakPolarHBondContact O-CB 3.29Å; F435-L439 WeakPolarHBondContact O-CG 3.47Å; F435-L439 PolarHBondContact O-N 3.17Å; F435-V466 HydrophobicContact CB-CG1 4.47Å; F435-V466 HydrophobicContact CD1-CG1 3.75Å; F435-E469 HydrophobicContact CE1-CB 4.49Å; F435-E469 HydrophobicContact CE1-CG 4Å; F435-E469 HydrophobicContact CZ-CG 4.4Å; F435-L470 HydrophobicContact CB-CD1 4.28Å; F435-L470 HydrophobicContact CB-CD2 4.23Å; F435-L470 HydrophobicContact CB-CG 4.49Å; F435-L470 HydrophobicContact CD1-CD1 4.12Å; F435-L470 HydrophobicContact CD1-CD2 3.66Å; F435-L470 HydrophobicContact CD1-CG 3.59Å; F435-L470 HydrophobicContact CD2-CD2 4.07Å; F435-L470 HydrophobicContact CE1-CD2 3.97Å; F435-L470 HydrophobicContact CE1-CG 3.97Å; F435-L470 HydrophobicContact CE2-CD2 4.38Å; F435-L470 HydrophobicContact CG-CD1 4.41Å; F435-L470 HydrophobicContact CG-CD2 3.72Å; F435-L470 HydrophobicContact CG-CG 4.09Å; F435-L470 HydrophobicContact CZ-CD2 4.33Å; F435-L473 HydrophobicContact CE1-CD1 4.3Å; F435-L473 HydrophobicContact CE2-CD1 4.38Å; F435-L473 HydrophobicContact CZ-CD1 3.62Å
436	L	95.6	Very high	93	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-37.3	176.1	-62.8	170	0	0	0	111.9	C267 W272 V287 L432 V440	C267-L436 HydrophobicContact CB-CD2 3.74Å; W272-L436 HydrophobicContact CD2-CD2 4.33Å; W272-L436 HydrophobicContact CG-CD2 3.93Å; W272-L436 HydrophobicContact CZ2-CD1 4.24Å; V287-L436 HydrophobicContact CG1-CD1 3.76Å; V287-L436 HydrophobicContact CG1-CD2 3.84Å; V287-L436 HydrophobicContact CG1-CG 4.46Å; L432-L436 HydrophobicContact CD1-CG 4.47Å; L432-L436 HydrophobicContact CD2-CD1 4.18Å; L432-L436 HydrophobicContact CG-CD1 3.84Å; L432-L436 HydrophobicContact CG-CG 4Å; L432-L436 WeakPolarHBondContact O-CG 3.45Å; L432-L436 PolarHBondContact O-N 3.4Å; L436-V440 WeakPolarHBondContact O-CB 3.31Å; L436-V440 VanDerWaalsContact O-CG2 3.28Å; L436-V440 WeakPolarHBondContact O-CG2 3.01Å; L436-V440 PolarHBondContact O-N 3.46Å
437	K	91	Very high	93.8	Very high	45 Å²	45	28 Å²	28	20%	0.196	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-47.2	173.2	-173.3	-167.9	177.2	-169	0	110.9	N393 Y394 G433 T434 F435 M441	N393-K437 PolarHBondContact OD1-NZ 3.38Å; Y394-K437 HydrophobicContact CE2-CD 4.3Å; G433-K437 WeakPolarHBondContact O-CB 3.26Å; G433-K437 PolarHBondContact O-N 3.13Å; T434-K437 WeakPolarHBondContact O-CB 3.22Å; T434-K437 PolarHBondContact O-N 2.85Å; F435-K437 VanDerWaalsContact C-N 3.33Å; F435-K437 PolarHBondContact O-N 3.07Å; K437-M441 HydrophobicContact CD-CE 4.45Å; K437-M441 HydrophobicContact CG-CE 4.05Å; K437-M441 HydrophobicContact CG-SD 4.32Å; K437-M441 WeakPolarHBondContact O-CB 3.38Å; K437-M441 VanDerWaalsContact O-CG 3.26Å; K437-M441 WeakPolarHBondContact O-CG 3.29Å; K437-M441 PolarHBondContact O-N 2.95Å
438	D	90.6	Very high	94	Very high	8 Å²	8	30.8 Å²	30.8	4%	0.043	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-44.2	-180	-67.6	-25.4	0	0	0	112.1	R398 T434 F435 M441 L442	R398-D438 IonicContact CZ-OD2 3.83Å; R398-D438 IonicContact NH1-OD2 3.98Å; R398-D438 PolarHBondContact NH1-OD2 3.49Å; R398-D438 VanDerWaalsContact NH2-CG 3.29Å; R398-D438 IonicContact NH2-OD1 2.67Å; R398-D438 PolarHBondContact NH2-OD1 3.12Å; R398-D438 IonicContact NH2-OD2 3.79Å; R398-D438 PolarHBondContact NH2-OD2 3.31Å; T434-D438 PolarHBondContact O-N 3.19Å; F435-D438 PolarHBondContact O-N 2.88Å; D438-M441 PolarHBondContact O-N 3.05Å; D438-M441 WeakPolarHBondContact OD1-CE 3.38Å; D438-L442 VanDerWaalsContact O-CB 3.29Å; D438-L442 WeakPolarHBondContact O-CB 3.32Å; D438-L442 PolarHBondContact O-N 2.81Å
439	L	95.1	Very high	94	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-40.4	178.2	-74.2	168.2	0	0	0	112.8	C267 L268 F435 L442 D443 E463 V466 L467	C267-L439 HydrophobicContact CB-CD1 3.7Å; C267-L439 VanDerWaalsContact O-CD1 3.25Å; C267-L439 WeakPolarHBondContact O-CD1 3.48Å; L268-L439 HydrophobicContact CD2-CD2 4.31Å; F435-L439 WeakPolarHBondContact O-CB 3.29Å; F435-L439 WeakPolarHBondContact O-CG 3.47Å; F435-L439 PolarHBondContact O-N 3.17Å; L439-L442 PolarHBondContact O-N 2.66Å; L439-D443 VanDerWaalsContact O-CB 3.26Å; L439-D443 WeakPolarHBondContact O-CB 3.48Å; L439-D443 PolarHBondContact O-N 2.86Å; L439-E463 HydrophobicContact CD2-CB 4.37Å; L439-E463 HydrophobicContact CD2-CG 4.45Å; L439-V466 HydrophobicContact CD1-CG1 4.15Å; L439-V466 HydrophobicContact CD2-CB 3.95Å; L439-V466 HydrophobicContact CD2-CG1 4.14Å; L439-V466 HydrophobicContact CD2-CG2 4.41Å; L439-V466 HydrophobicContact CG-CB 4.32Å; L439-V466 HydrophobicContact CG-CG1 3.93Å; L439-L467 HydrophobicContact CD1-CD2 3.87Å
440	V	94.1	Very high	93.9	Very high	38 Å²	38	39.1 Å²	39.1	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-69.1	-35.8	174.8	171	0	0	0	0	111.9	L436 A444	L436-V440 WeakPolarHBondContact O-CB 3.31Å; L436-V440 VanDerWaalsContact O-CG2 3.28Å; L436-V440 WeakPolarHBondContact O-CG2 3.01Å; L436-V440 PolarHBondContact O-N 3.46Å; V440-A444 WeakPolarHBondContact O-CB 3.45Å; V440-A444 PolarHBondContact O-N 2.83Å; V440-A444 VanDerWaalsContact O-N 3.1Å
441	M	92.4	Very high	93.8	Very high	80 Å²	80	47.5 Å²	47.5	39%	0.394	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-37.9	173.7	-73.3	-173.2	-52.6	0	0	112.5	K437 D438 A445	K437-M441 HydrophobicContact CD-CE 4.45Å; K437-M441 HydrophobicContact CG-CE 4.05Å; K437-M441 HydrophobicContact CG-SD 4.32Å; K437-M441 WeakPolarHBondContact O-CB 3.38Å; K437-M441 VanDerWaalsContact O-CG 3.26Å; K437-M441 WeakPolarHBondContact O-CG 3.29Å; K437-M441 PolarHBondContact O-N 2.95Å; D438-M441 PolarHBondContact O-N 3.05Å; D438-M441 WeakPolarHBondContact OD1-CE 3.38Å; M441-A445 WeakPolarHBondContact O-CB 3.43Å; M441-A445 PolarHBondContact O-N 3.28Å; M441-A445 VanDerWaalsContact O-N 3.09Å
442	L	93.6	Very high	93.6	Very high	20 Å²	20	50.2 Å²	50.2	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-67.7	-42.7	177.7	175.1	61.3	0	0	0	111.9	D438 L439 A445 S446 K462 E463	D438-L442 VanDerWaalsContact O-CB 3.29Å; D438-L442 WeakPolarHBondContact O-CB 3.32Å; D438-L442 PolarHBondContact O-N 2.81Å; L439-L442 PolarHBondContact O-N 2.66Å; L442-A445 PolarHBondContact O-N 3.48Å; L442-S446 PolarHBondContact O-N 3.48Å; L442-S446 PolarHBondContact O-OG 3.4Å; L442-K462 HydrophobicContact CD1-CB 3.83Å; L442-K462 HydrophobicContact CD1-CD 3.94Å; L442-K462 VanDerWaalsContact CD2-C 3.49Å; L442-K462 HydrophobicContact CD2-CB 3.67Å; L442-K462 HydrophobicContact CG-CB 4.36Å; L442-E463 HydrophobicContact CD2-CB 4.33Å; L442-E463 HydrophobicContact CD2-CG 3.64Å; L442-E463 HydrophobicContact CG-CG 4.28Å
443	D	94	Very high	93.5	Very high	25 Å²	25	52 Å²	52	13%	0.134	29%	0.294	C	S	.	.	H	α-helix	trans	-58.1	-52.6	174	179	63.1	0	0	0	111.5	G270 L439 A445 S446 K459	G270-D443 VanDerWaalsContact N-CG 3.33Å; G270-D443 PolarHBondContact N-OD1 3.01Å; G270-D443 PolarHBondContact N-OD2 3.45Å; L439-D443 VanDerWaalsContact O-CB 3.26Å; L439-D443 WeakPolarHBondContact O-CB 3.48Å; L439-D443 PolarHBondContact O-N 2.86Å; D443-A445 PolarHBondContact O-N 3.12Å; D443-S446 PolarHBondContact O-N 3.46Å; D443-K459 PolarHBondContact O-NZ 3.5Å; D443-K459 WeakPolarHBondContact OD1-CE 3.32Å; D443-K459 IonicContact OD1-NZ 3.47Å; D443-K459 PolarHBondContact OD1-NZ 3.48Å
444	A	93.1	Very high	93.8	Very high	80 Å²	80	54 Å²	54	66%	0.661	30%	0.299	S	S	*	.	H	α-helix	trans	-65.7	-18.8	176.6	0	0	0	0	0	114.3	V440	V440-A444 WeakPolarHBondContact O-CB 3.45Å; V440-A444 PolarHBondContact O-N 2.83Å; V440-A444 VanDerWaalsContact O-N 3.1Å
445	A	93.4	Very high	94.2	Very high	71 Å²	71	54.4 Å²	54.4	59%	0.587	30%	0.301	S	S	*	.	H	α-helix	trans	-91.3	-12.8	178.8	0	0	0	0	0	114.1	M441 L442 D443	M441-A445 WeakPolarHBondContact O-CB 3.43Å; M441-A445 PolarHBondContact O-N 3.28Å; M441-A445 VanDerWaalsContact O-N 3.09Å; L442-A445 PolarHBondContact O-N 3.48Å; D443-A445 PolarHBondContact O-N 3.12Å
446	S	93.1	Very high	94.3	Very high	24 Å²	24	54.7 Å²	54.7	17%	0.168	30%	0.303	C	S	.	.	S	Bend	trans	-135.7	120.2	-172.2	-49.4	0	0	0	0	111	L442 D443 K459	L442-S446 PolarHBondContact O-N 3.48Å; L442-S446 PolarHBondContact O-OG 3.4Å; D443-S446 PolarHBondContact O-N 3.46Å; S446-K459 WeakPolarHBondContact O-CD 3.35Å; S446-K459 WeakPolarHBondContact O-CE 3.38Å; S446-K459 PolarHBondContact O-NZ 3.24Å
447	K	94.9	Very high	94.4	Very high	124 Å²	124	54.6 Å²	54.6	54%	0.539	30%	0.303	S	S	.	.			trans	-57.6	143	170.4	-62.3	-178.8	-177.7	175.2	0	110.2	E449 E451 N456	K447-E449 VanDerWaalsContact C-N 3.29Å; K447-E449 WeakPolarHBondContact CB-O 3.3Å; K447-E451 IonicContact NZ-OE1 2.73Å; K447-E451 PolarHBondContact NZ-OE1 3.02Å; K447-N456 WeakPolarHBondContact O-CB 3.21Å; K447-N456 PolarHBondContact O-ND2 3.05Å
448	D	94.7	Very high	94.6	Very high	63 Å²	63	54 Å²	54	34%	0.337	30%	0.302	S	S	.	.	S	Bend	trans	-69.6	-28	173.5	-64.6	-79.6	0	0	0	113.2	N456 K459 R460	D448-N456 WeakPolarHBondContact O-CB 3.43Å; D448-N456 PolarHBondContact O-N 3.35Å; D448-K459 WeakPolarHBondContact OD1-CE 3.49Å; D448-K459 IonicContact OD1-NZ 3.44Å; D448-K459 PolarHBondContact OD1-NZ 2.91Å; D448-K459 IonicContact OD2-NZ 2.72Å; D448-K459 PolarHBondContact OD2-NZ 3.45Å; D448-R460 IonicContact OD1-CZ 3.92Å; D448-R460 IonicContact OD1-NH1 3.51Å; D448-R460 PolarHBondContact OD1-NH1 3.15Å; D448-R460 VanDerWaalsContact OD1-NH1 3.12Å; D448-R460 IonicContact OD1-NH2 2.66Å; D448-R460 PolarHBondContact OD1-NH2 2.93Å
449	E	96.5	Very high	94.9	Very high	115 Å²	115	53.7 Å²	53.7	54%	0.537	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-126.5	151.3	178.7	-70.5	166.4	-150.5	0	0	111.3	K447 Y454	K447-E449 VanDerWaalsContact C-N 3.29Å; K447-E449 WeakPolarHBondContact CB-O 3.3Å; E449-Y454 CarbonylContact C-O 3.57Å; E449-Y454 VanDerWaalsContact CA-O 3.28Å; E449-Y454 WeakPolarHBondContact CA-O 3.24Å
450	L	94.6	Very high	95	Very high	63 Å²	63	53.7 Å²	53.7	33%	0.33	30%	0.3	S	S	.	.			trans	-81.7	173.3	168.1	-59.5	-171.5	0	0	0	110.9	A94 N452 G453 Y454 N456	A94-L450 HydrophobicContact CB-CD1 3.42Å; A94-L450 VanDerWaalsContact CB-CD1 3.42Å; A94-L450 HydrophobicContact CB-CG 4.1Å; L450-N452 WeakPolarHBondContact CB-OD1 3.42Å; L450-N452 PolarHBondContact O-N 3.43Å; L450-N452 VanDerWaalsContact O-N 3.15Å; L450-G453 PolarHBondContact O-N 2.97Å; L450-Y454 PolarHBondContact N-O 3.32Å; L450-N456 HydrophobicContact CD2-CB 4.18Å; L450-N456 HydrophobicContact CG-CB 4.48Å
451	E	94.1	Very high	95	Very high	178 Å²	178	53.6 Å²	53.6	83%	0.832	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.8	-172.2	-49.5	-163.2	148.1	0	0	113.9	K447	K447-E451 IonicContact NZ-OE1 2.73Å; K447-E451 PolarHBondContact NZ-OE1 3.02Å
452	N	93	Very high	95.2	Very high	83 Å²	83	53.1 Å²	53.1	44%	0.444	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	8.8	169.9	64.3	-7.7	0	0	0	113.4	L450 Y454	L450-N452 WeakPolarHBondContact CB-OD1 3.42Å; L450-N452 PolarHBondContact O-N 3.43Å; L450-N452 VanDerWaalsContact O-N 3.15Å; N452-Y454 VanDerWaalsContact C-N 3.32Å; N452-Y454 VanDerWaalsContact ND2-CD2 3.26Å; N452-Y454 WeakPolarHBondContact ND2-CD2 3.25Å; N452-Y454 WeakPolarHBondContact ND2-CE2 3.32Å; N452-Y454 PolarHBondContact O-N 3.35Å; N452-Y454 WeakPolarHBondContact OD1-CB 3.32Å; N452-Y454 PolarHBondContact OD1-N 2.99Å
453	G	94.4	Very high	95.3	Very high	42 Å²	42	52.2 Å²	52.2	43%	0.433	29%	0.286	S	S	.	.	S	Bend	trans	78.3	7.9	-178.6	0	0	0	0	0	115.1	L450	L450-G453 PolarHBondContact O-N 2.97Å
454	Y	97.8	Very high	95.4	Very high	51 Å²	51	52.6 Å²	52.6	20%	0.2	29%	0.287	C	S	.	.			trans	-77.3	135.9	177.5	-70.5	7	0	0	0	111	G64 V66 T96 E449 L450 N452 N456	G64-Y454 WeakPolarHBondContact CA-OH 3.4Å; V66-Y454 HydrophobicContact CG2-CD2 4.03Å; V66-Y454 HydrophobicContact CG2-CE2 4.01Å; T96-Y454 HydrophobicContact CG2-CD1 4.04Å; T96-Y454 HydrophobicContact CG2-CE1 3.92Å; E449-Y454 CarbonylContact C-O 3.57Å; E449-Y454 VanDerWaalsContact CA-O 3.28Å; E449-Y454 WeakPolarHBondContact CA-O 3.24Å; L450-Y454 PolarHBondContact N-O 3.32Å; N452-Y454 VanDerWaalsContact C-N 3.32Å; N452-Y454 VanDerWaalsContact ND2-CD2 3.26Å; N452-Y454 WeakPolarHBondContact ND2-CD2 3.25Å; N452-Y454 WeakPolarHBondContact ND2-CE2 3.32Å; N452-Y454 PolarHBondContact O-N 3.35Å; N452-Y454 WeakPolarHBondContact OD1-CB 3.32Å; N452-Y454 PolarHBondContact OD1-N 2.99Å; Y454-N456 PolarHBondContact O-N 3.47Å
455	I	98	Very high	95.6	Very high	17 Å²	17	50.8 Å²	50.8	9%	0.087	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	123.4	175.4	-60.7	159.8	0	0	0	108.8	A94 G95 L97 L100 F127 F457	A94-I455 WeakPolarHBondContact CA-O 3.21Å; A94-I455 VanDerWaalsContact CB-O 3.25Å; A94-I455 WeakPolarHBondContact CB-O 3.39Å; G95-I455 PolarHBondContact N-O 2.97Å; G95-I455 WeakPolarHBondContact O-CB 3.49Å; G95-I455 PolarHBondContact O-N 2.57Å; L97-I455 HydrophobicContact CB-CD1 3.96Å; L97-I455 HydrophobicContact CD1-CD1 4.23Å; L100-I455 HydrophobicContact CD1-CB 4.07Å; L100-I455 HydrophobicContact CD1-CD1 3.74Å; L100-I455 HydrophobicContact CD1-CG2 4.08Å; F127-I455 HydrophobicContact CB-CG2 4.4Å; F127-I455 HydrophobicContact CD1-CG2 4.33Å; F127-I455 HydrophobicContact CD2-CD1 3.76Å; F127-I455 HydrophobicContact CD2-CG1 4.49Å; F127-I455 HydrophobicContact CD2-CG2 4.1Å; F127-I455 HydrophobicContact CE2-CD1 4.2Å; F127-I455 HydrophobicContact CE2-CG2 4.43Å; F127-I455 HydrophobicContact CG-CG2 4.03Å; I455-F457 PolarHBondContact O-N 3.43Å
456	N	97.3	Very high	95.7	Very high	19 Å²	19	48.8 Å²	48.8	10%	0.102	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	89.9	-176	-180	5.4	0	0	0	111.1	K447 D448 L450 Y454 D458 K459	K447-N456 WeakPolarHBondContact O-CB 3.21Å; K447-N456 PolarHBondContact O-ND2 3.05Å; D448-N456 WeakPolarHBondContact O-CB 3.43Å; D448-N456 PolarHBondContact O-N 3.35Å; L450-N456 HydrophobicContact CD2-CB 4.18Å; L450-N456 HydrophobicContact CG-CB 4.48Å; Y454-N456 PolarHBondContact O-N 3.47Å; N456-D458 VanDerWaalsContact C-N 3.3Å; N456-D458 PolarHBondContact O-N 3.16Å; N456-D458 WeakPolarHBondContact OD1-CB 3.44Å; N456-D458 PolarHBondContact OD1-N 2.95Å; N456-K459 HydrophobicContact CB-CB 4.38Å; N456-K459 VanDerWaalsContact O-CB 3.3Å; N456-K459 WeakPolarHBondContact O-CB 3.38Å; N456-K459 PolarHBondContact O-N 3.2Å; N456-K459 PolarHBondContact OD1-N 2.92Å
457	F	97.1	Very high	95.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.6	-23	-177.4	-152.4	-100.1	0	0	0	113	L92 R93 L100 F116 A119 F120 I455 K459 R460 R461	L92-F457 HydrophobicContact CD2-CB 3.84Å; L92-F457 HydrophobicContact CD2-CG 4.17Å; R93-F457 WeakPolarHBondContact O-CA 3.36Å; R93-F457 VanDerWaalsContact O-CB 3.29Å; R93-F457 WeakPolarHBondContact O-CB 3.39Å; R93-F457 PolarHBondContact O-N 3.07Å; L100-F457 HydrophobicContact CD1-CD2 4.48Å; L100-F457 HydrophobicContact CD2-CD2 4.24Å; F116-F457 AromaticContact CD2-CD1 3.89Å; F116-F457 HydrophobicContact CD2-CD1 3.89Å; F116-F457 AromaticContact CD2-CE1 3.32Å; F116-F457 HydrophobicContact CD2-CE1 3.32Å; F116-F457 HydrophobicContact CD2-CE2 4.31Å; F116-F457 AromaticContact CD2-CZ 3.56Å; F116-F457 HydrophobicContact CD2-CZ 3.56Å; F116-F457 AromaticContact CE2-CD1 3.98Å; F116-F457 HydrophobicContact CE2-CD1 3.98Å; F116-F457 HydrophobicContact CE2-CD2 4.16Å; F116-F457 AromaticContact CE2-CE1 3.65Å; F116-F457 HydrophobicContact CE2-CE1 3.65Å; F116-F457 AromaticContact CE2-CE2 3.85Å; F116-F457 HydrophobicContact CE2-CE2 3.85Å; F116-F457 HydrophobicContact CE2-CG 4.23Å; F116-F457 AromaticContact CE2-CZ 3.58Å; F116-F457 HydrophobicContact CE2-CZ 3.58Å; F116-F457 HydrophobicContact CG-CE1 4.34Å; F116-F457 HydrophobicContact CG-CZ 4.44Å; F116-F457 HydrophobicContact CZ-CZ 4.48Å; A119-F457 HydrophobicContact CB-CE1 4.16Å; A119-F457 HydrophobicContact CB-CZ 3.9Å; F120-F457 HydrophobicContact CB-CE2 3.98Å; F120-F457 HydrophobicContact CB-CZ 3.91Å; F120-F457 AromaticContact CD2-CE2 3.92Å; F120-F457 HydrophobicContact CD2-CE2 3.92Å; F120-F457 HydrophobicContact CG-CE2 4.45Å; I455-F457 PolarHBondContact O-N 3.43Å; F457-K459 PolarHBondContact O-N 3.3Å; F457-R460 HydrophobicContact CD2-CB 3.87Å; F457-R460 HydrophobicContact CD2-CG 3.97Å; F457-R460 HydrophobicContact CE2-CB 3.91Å; F457-R460 HydrophobicContact CE2-CG 4.29Å; F457-R460 HydrophobicContact CG-CB 4.31Å; F457-R460 HydrophobicContact CZ-CB 4.41Å; F457-R460 PolarHBondContact O-N 3.14Å; F457-R461 HydrophobicContact CD1-CG 3.91Å; F457-R461 HydrophobicContact CE1-CG 3.84Å; F457-R461 PolarHBondContact O-N 2.88Å
458	D	95	Very high	95.7	Very high	34 Å²	34	43.7 Å²	43.7	18%	0.182	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-24.8	166.7	-81.5	-20.3	0	0	0	112.8	R93 N456 K462	R93-D458 WeakPolarHBondContact CG-OD2 3.44Å; R93-D458 IonicContact CZ-OD2 2.72Å; R93-D458 IonicContact NE-OD2 3.2Å; R93-D458 PolarHBondContact NE-OD2 3.15Å; R93-D458 IonicContact NH2-OD2 2.69Å; R93-D458 PolarHBondContact O-N 3.22Å; R93-D458 VanDerWaalsContact O-N 3.16Å; N456-D458 VanDerWaalsContact C-N 3.3Å; N456-D458 PolarHBondContact O-N 3.16Å; N456-D458 WeakPolarHBondContact OD1-CB 3.44Å; N456-D458 PolarHBondContact OD1-N 2.95Å; D458-K462 WeakPolarHBondContact O-CG 3.26Å; D458-K462 PolarHBondContact O-NZ 3.29Å
459	K	96.2	Very high	95.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-73.2	-50.6	168.8	180	177.9	-179	168.9	0	110.2	D443 S446 D448 N456 F457 R461 K462 E463	D443-K459 PolarHBondContact O-NZ 3.5Å; D443-K459 WeakPolarHBondContact OD1-CE 3.32Å; D443-K459 IonicContact OD1-NZ 3.47Å; D443-K459 PolarHBondContact OD1-NZ 3.48Å; S446-K459 WeakPolarHBondContact O-CD 3.35Å; S446-K459 WeakPolarHBondContact O-CE 3.38Å; S446-K459 PolarHBondContact O-NZ 3.24Å; D448-K459 WeakPolarHBondContact OD1-CE 3.49Å; D448-K459 IonicContact OD1-NZ 3.44Å; D448-K459 PolarHBondContact OD1-NZ 2.91Å; D448-K459 IonicContact OD2-NZ 2.72Å; D448-K459 PolarHBondContact OD2-NZ 3.45Å; N456-K459 HydrophobicContact CB-CB 4.38Å; N456-K459 VanDerWaalsContact O-CB 3.3Å; N456-K459 WeakPolarHBondContact O-CB 3.38Å; N456-K459 PolarHBondContact O-N 3.2Å; N456-K459 PolarHBondContact OD1-N 2.92Å; F457-K459 PolarHBondContact O-N 3.3Å; K459-R461 VanDerWaalsContact C-N 3.35Å; K459-R461 PolarHBondContact O-N 3.27Å; K459-K462 WeakPolarHBondContact O-CB 3.49Å; K459-K462 PolarHBondContact O-N 3.47Å; K459-E463 WeakPolarHBondContact CE-OE1 3.36Å; K459-E463 HydrophobicContact CG-CG 4.38Å; K459-E463 PolarHBondContact O-N 2.7Å
460	R	97	Very high	95.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-38.2	-175.2	-54.8	-46.4	172.2	-154.7	-2.3	113.5	T123 F127 D448 F457 K462 E463 F464	T123-R460 HydrophobicContact CG2-CB 4.46Å; F127-R460 HydrophobicContact CD1-CG 4.31Å; F127-R460 HydrophobicContact CE1-CG 3.95Å; D448-R460 IonicContact OD1-CZ 3.92Å; D448-R460 IonicContact OD1-NH1 3.51Å; D448-R460 PolarHBondContact OD1-NH1 3.15Å; D448-R460 VanDerWaalsContact OD1-NH1 3.12Å; D448-R460 IonicContact OD1-NH2 2.66Å; D448-R460 PolarHBondContact OD1-NH2 2.93Å; F457-R460 HydrophobicContact CD2-CB 3.87Å; F457-R460 HydrophobicContact CD2-CG 3.97Å; F457-R460 HydrophobicContact CE2-CB 3.91Å; F457-R460 HydrophobicContact CE2-CG 4.29Å; F457-R460 HydrophobicContact CG-CB 4.31Å; F457-R460 HydrophobicContact CZ-CB 4.41Å; F457-R460 PolarHBondContact O-N 3.14Å; R460-K462 PolarHBondContact O-N 2.96Å; R460-E463 WeakPolarHBondContact CD-OE2 3.41Å; R460-E463 IonicContact CZ-OE2 3.37Å; R460-E463 IonicContact NE-OE2 2.97Å; R460-E463 IonicContact NH1-OE1 2.69Å; R460-E463 PolarHBondContact NH1-OE1 3.48Å; R460-E463 IonicContact NH1-OE2 2.78Å; R460-E463 PolarHBondContact NH1-OE2 3.09Å; R460-E463 PolarHBondContact O-N 3.36Å; R460-F464 VanDerWaalsContact O-CB 3.27Å; R460-F464 WeakPolarHBondContact O-CB 3.46Å; R460-F464 PolarHBondContact O-N 2.87Å
461	R	95.3	Very high	95.6	Very high	37 Å²	37	36.6 Å²	36.6	14%	0.14	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-39.6	173.9	-66.7	-179	-166.2	-87.2	-2.2	113.3	L92 D113 T115 F457 K459 F464 A465	L92-R461 PolarHBondContact O-NE 2.88Å; L92-R461 PolarHBondContact O-NH2 2.94Å; D113-R461 IonicContact OD1-CZ 3.44Å; D113-R461 IonicContact OD1-NH1 3.26Å; D113-R461 PolarHBondContact OD1-NH1 2.9Å; D113-R461 IonicContact OD1-NH2 3.66Å; D113-R461 PolarHBondContact OD1-NH2 2.81Å; D113-R461 IonicContact OD2-CZ 2.72Å; D113-R461 IonicContact OD2-NH1 3.77Å; D113-R461 PolarHBondContact OD2-NH1 3.46Å; D113-R461 IonicContact OD2-NH2 2.77Å; D113-R461 PolarHBondContact OD2-NH2 2.84Å; T115-R461 PolarHBondContact OG1-NH1 2.76Å; F457-R461 HydrophobicContact CD1-CG 3.91Å; F457-R461 HydrophobicContact CE1-CG 3.84Å; F457-R461 PolarHBondContact O-N 2.88Å; K459-R461 VanDerWaalsContact C-N 3.35Å; K459-R461 PolarHBondContact O-N 3.27Å; R461-F464 PolarHBondContact O-N 3.15Å; R461-A465 PolarHBondContact O-N 2.67Å
462	K	95.5	Very high	95.6	Very high	69 Å²	69	31.9 Å²	31.9	30%	0.3	17%	0.168	S	C	.	.	H	α-helix	trans	-71.1	-37.6	178.7	-61	-179.6	-172.3	95.6	0	111.2	L10 L442 D458 K459 R460	L10-K462 HydrophobicContact CD2-CB 4.22Å; L10-K462 HydrophobicContact CD2-CD 4.49Å; L10-K462 HydrophobicContact CD2-CG 4.02Å; L442-K462 HydrophobicContact CD1-CB 3.83Å; L442-K462 HydrophobicContact CD1-CD 3.94Å; L442-K462 VanDerWaalsContact CD2-C 3.49Å; L442-K462 HydrophobicContact CD2-CB 3.67Å; L442-K462 HydrophobicContact CG-CB 4.36Å; D458-K462 WeakPolarHBondContact O-CG 3.26Å; D458-K462 PolarHBondContact O-NZ 3.29Å; K459-K462 WeakPolarHBondContact O-CB 3.49Å; K459-K462 PolarHBondContact O-N 3.47Å; R460-K462 PolarHBondContact O-N 2.96Å
463	E	96.8	Very high	95.7	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-47.2	172.9	-69.4	174.4	146.7	0	0	110.2	T123 L268 L439 L442 K459 R460 A465 V466 L467	T123-E463 HydrophobicContact CG2-CB 4.15Å; L268-E463 HydrophobicContact CD2-CB 3.71Å; L268-E463 HydrophobicContact CD2-CG 4.13Å; L439-E463 HydrophobicContact CD2-CB 4.37Å; L439-E463 HydrophobicContact CD2-CG 4.45Å; L442-E463 HydrophobicContact CD2-CB 4.33Å; L442-E463 HydrophobicContact CD2-CG 3.64Å; L442-E463 HydrophobicContact CG-CG 4.28Å; K459-E463 WeakPolarHBondContact CE-OE1 3.36Å; K459-E463 HydrophobicContact CG-CG 4.38Å; K459-E463 PolarHBondContact O-N 2.7Å; R460-E463 WeakPolarHBondContact CD-OE2 3.41Å; R460-E463 IonicContact CZ-OE2 3.37Å; R460-E463 IonicContact NE-OE2 2.97Å; R460-E463 IonicContact NH1-OE1 2.69Å; R460-E463 PolarHBondContact NH1-OE1 3.48Å; R460-E463 IonicContact NH1-OE2 2.78Å; R460-E463 PolarHBondContact NH1-OE2 3.09Å; R460-E463 PolarHBondContact O-N 3.36Å; E463-A465 VanDerWaalsContact C-N 3.34Å; E463-A465 PolarHBondContact O-N 3.18Å; E463-V466 PolarHBondContact O-N 3.17Å; E463-L467 WeakPolarHBondContact O-CG 3.29Å; E463-L467 PolarHBondContact O-N 2.84Å
464	F	96.8	Very high	95.7	Very high	33 Å²	33	26.5 Å²	26.5	15%	0.145	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-35.8	177.1	173.8	-113.8	0	0	0	114	S118 A119 A122 T123 R460 R461 V466 L467 S468	S118-F464 WeakPolarHBondContact O-CE2 3.24Å; A119-F464 VanDerWaalsContact CA-CG 3.41Å; A119-F464 HydrophobicContact CB-CB 3.71Å; A119-F464 HydrophobicContact CB-CD1 3.58Å; A119-F464 HydrophobicContact CB-CD2 4.29Å; A119-F464 HydrophobicContact CB-CE1 4.26Å; A119-F464 HydrophobicContact CB-CG 3.59Å; A122-F464 HydrophobicContact CB-CD2 3.72Å; A122-F464 HydrophobicContact CB-CE2 4.1Å; T123-F464 HydrophobicContact CG2-CB 4.36Å; R460-F464 VanDerWaalsContact O-CB 3.27Å; R460-F464 WeakPolarHBondContact O-CB 3.46Å; R460-F464 PolarHBondContact O-N 2.87Å; R461-F464 PolarHBondContact O-N 3.15Å; F464-V466 VanDerWaalsContact C-N 3.29Å; F464-V466 PolarHBondContact O-N 3.41Å; F464-L467 PolarHBondContact O-N 3.38Å; F464-S468 WeakPolarHBondContact CE1-OG 3.43Å; F464-S468 WeakPolarHBondContact CE2-OG 3.21Å; F464-S468 WeakPolarHBondContact CZ-OG 3.08Å; F464-S468 WeakPolarHBondContact O-CB 3.2Å; F464-S468 PolarHBondContact O-N 2.69Å; F464-S468 PolarHBondContact O-OG 3.17Å
465	A	95.4	Very high	95.5	Very high	42 Å²	42	29 Å²	29	35%	0.347	15%	0.146	S	C	.	.	H	α-helix	trans	-57.7	-43.9	175.3	0	0	0	0	0	111.5	R461 E463 S468 E469	R461-A465 PolarHBondContact O-N 2.67Å; E463-A465 VanDerWaalsContact C-N 3.34Å; E463-A465 PolarHBondContact O-N 3.18Å; A465-S468 PolarHBondContact O-N 3.4Å; A465-E469 PolarHBondContact O-N 2.94Å
466	V	95.4	Very high	95.3	Very high	29 Å²	29	29.8 Å²	29.8	18%	0.176	15%	0.149	C	C	.	.	H	α-helix	trans	-70.5	-37.9	177	-174.7	0	0	0	0	111.7	F435 L439 E463 F464 S468 E469 L470	F435-V466 HydrophobicContact CB-CG1 4.47Å; F435-V466 HydrophobicContact CD1-CG1 3.75Å; L439-V466 HydrophobicContact CD1-CG1 4.15Å; L439-V466 HydrophobicContact CD2-CB 3.95Å; L439-V466 HydrophobicContact CD2-CG1 4.14Å; L439-V466 HydrophobicContact CD2-CG2 4.41Å; L439-V466 HydrophobicContact CG-CB 4.32Å; L439-V466 HydrophobicContact CG-CG1 3.93Å; E463-V466 PolarHBondContact O-N 3.17Å; F464-V466 VanDerWaalsContact C-N 3.29Å; F464-V466 PolarHBondContact O-N 3.41Å; V466-S468 VanDerWaalsContact C-N 3.32Å; V466-S468 PolarHBondContact O-N 3.21Å; V466-E469 PolarHBondContact O-N 3.02Å; V466-L470 PolarHBondContact O-N 3.35Å
467	L	95.9	Very high	95.2	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-68.6	-29.6	174.7	-61	-164.5	0	0	0	113.2	A122 P264 C267 L268 L439 E463 F464 L470 R471	A122-L467 HydrophobicContact CB-CD1 4.43Å; A122-L467 WeakPolarHBondContact O-CD1 3.22Å; P264-L467 HydrophobicContact CB-CB 4.39Å; P264-L467 HydrophobicContact CB-CD2 4.09Å; P264-L467 WeakPolarHBondContact O-CD2 3.46Å; C267-L467 HydrophobicContact CB-CD2 4.45Å; L268-L467 HydrophobicContact CD1-CD1 4.44Å; L268-L467 HydrophobicContact CD2-CD1 3.89Å; L268-L467 HydrophobicContact CD2-CD2 4.41Å; L268-L467 HydrophobicContact CD2-CG 4.27Å; L268-L467 HydrophobicContact CG-CD1 4.17Å; L439-L467 HydrophobicContact CD1-CD2 3.87Å; E463-L467 WeakPolarHBondContact O-CG 3.29Å; E463-L467 PolarHBondContact O-N 2.84Å; F464-L467 PolarHBondContact O-N 3.38Å; L467-L470 HydrophobicContact CD2-CD1 4.1Å; L467-R471 WeakPolarHBondContact O-CG 3.44Å; L467-R471 PolarHBondContact O-N 2.98Å; L467-R471 VanDerWaalsContact O-N 3.08Å
468	S	93.8	Very high	95.1	Very high	40 Å²	40	36 Å²	36	28%	0.28	17%	0.171	S	C	.	.	H	α-helix	trans	-69.5	-41.3	176.9	-61.9	0	0	0	0	111.4	F464 A465 V466 R471 R472	F464-S468 WeakPolarHBondContact CE1-OG 3.43Å; F464-S468 WeakPolarHBondContact CE2-OG 3.21Å; F464-S468 WeakPolarHBondContact CZ-OG 3.08Å; F464-S468 WeakPolarHBondContact O-CB 3.2Å; F464-S468 PolarHBondContact O-N 2.69Å; F464-S468 PolarHBondContact O-OG 3.17Å; A465-S468 PolarHBondContact O-N 3.4Å; V466-S468 VanDerWaalsContact C-N 3.32Å; V466-S468 PolarHBondContact O-N 3.21Å; S468-R471 WeakPolarHBondContact O-CB 3.39Å; S468-R471 PolarHBondContact O-N 3.17Å; S468-R471 VanDerWaalsContact O-N 3.16Å; S468-R472 PolarHBondContact O-N 2.96Å
469	E	93.9	Very high	95	Very high	42 Å²	42	36 Å²	36	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-66.2	-40.6	174.6	177.6	58.4	-172.3	0	0	111.7	F435 A465 V466 R471 R472 L473	F435-E469 HydrophobicContact CE1-CB 4.49Å; F435-E469 HydrophobicContact CE1-CG 4Å; F435-E469 HydrophobicContact CZ-CG 4.4Å; A465-E469 PolarHBondContact O-N 2.94Å; V466-E469 PolarHBondContact O-N 3.02Å; E469-R471 PolarHBondContact O-N 2.88Å; E469-R472 PolarHBondContact O-N 3.12Å; E469-R472 IonicContact OE1-CZ 3.99Å; E469-R472 IonicContact OE1-NE 2.99Å; E469-R472 PolarHBondContact OE1-NE 2.87Å; E469-R472 IonicContact OE1-NH2 3.85Å; E469-R472 PolarHBondContact OE1-NH2 3.41Å; E469-R472 IonicContact OE2-CZ 3.49Å; E469-R472 IonicContact OE2-NE 3.18Å; E469-R472 PolarHBondContact OE2-NE 2.96Å; E469-R472 IonicContact OE2-NH2 3.87Å; E469-L473 HydrophobicContact CG-CD1 4.11Å; E469-L473 WeakPolarHBondContact O-CB 3.43Å; E469-L473 VanDerWaalsContact O-CG 3.32Å; E469-L473 WeakPolarHBondContact O-CG 3.4Å; E469-L473 PolarHBondContact O-N 2.81Å
470	L	95	Very high	94.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.8	-40.2	170.1	-77.2	168.4	0	0	0	111.7	F259 C267 L432 F435 V466 L467 L473 Q474	F259-L470 HydrophobicContact CE2-CD2 4.09Å; C267-L470 HydrophobicContact CB-CD1 4.46Å; L432-L470 HydrophobicContact CD1-CD2 3.95Å; F435-L470 HydrophobicContact CB-CD1 4.28Å; F435-L470 HydrophobicContact CB-CD2 4.23Å; F435-L470 HydrophobicContact CB-CG 4.49Å; F435-L470 HydrophobicContact CD1-CD1 4.12Å; F435-L470 HydrophobicContact CD1-CD2 3.66Å; F435-L470 HydrophobicContact CD1-CG 3.59Å; F435-L470 HydrophobicContact CD2-CD2 4.07Å; F435-L470 HydrophobicContact CE1-CD2 3.97Å; F435-L470 HydrophobicContact CE1-CG 3.97Å; F435-L470 HydrophobicContact CE2-CD2 4.38Å; F435-L470 HydrophobicContact CG-CD1 4.41Å; F435-L470 HydrophobicContact CG-CD2 3.72Å; F435-L470 HydrophobicContact CG-CG 4.09Å; F435-L470 HydrophobicContact CZ-CD2 4.33Å; V466-L470 PolarHBondContact O-N 3.35Å; L467-L470 HydrophobicContact CD2-CD1 4.1Å; L470-L473 PolarHBondContact O-N 3.03Å; L470-Q474 WeakPolarHBondContact O-CG 3.34Å; L470-Q474 PolarHBondContact O-N 3.49Å
471	R	93.9	Very high	94.7	Very high	50 Å²	50	43 Å²	43	19%	0.189	21%	0.214	C	C	.	.	H	α-helix	trans	-70.7	-37.6	177	-75.7	174.7	167.8	-142.6	-22	113.7	S169 H170 P264 L467 S468 E469 L473 Q474 N475	S169-R471 VanDerWaalsContact O-CZ 3.24Å; S169-R471 PolarHBondContact O-NH1 3.14Å; S169-R471 VanDerWaalsContact O-NH1 3.13Å; S169-R471 PolarHBondContact O-NH2 2.96Å; H170-R471 PolarHBondContact CE1-NH1 3.25Å; H170-R471 PolarHBondContact CE1-NH2 3.14Å; H170-R471 PolarHBondContact ND1-NH2 2.98Å; H170-R471 VanDerWaalsContact ND1-NH2 3.12Å; H170-R471 PolarHBondContact NE2-NH1 2.9Å; P264-R471 HydrophobicContact CG-CG 4.12Å; L467-R471 WeakPolarHBondContact O-CG 3.44Å; L467-R471 PolarHBondContact O-N 2.98Å; L467-R471 VanDerWaalsContact O-N 3.08Å; S468-R471 WeakPolarHBondContact O-CB 3.39Å; S468-R471 PolarHBondContact O-N 3.17Å; S468-R471 VanDerWaalsContact O-N 3.16Å; E469-R471 PolarHBondContact O-N 2.88Å; R471-L473 VanDerWaalsContact C-N 3.32Å; R471-Q474 PolarHBondContact O-N 3.11Å; R471-N475 VanDerWaalsContact O-CG 3.26Å; R471-N475 PolarHBondContact O-N 3.23Å; R471-N475 PolarHBondContact O-OD1 2.94Å
472	R	94.3	Very high	94.6	Very high	79 Å²	79	42.2 Å²	42.2	30%	0.298	21%	0.213	S	C	.	.	H	α-helix	trans	-58.8	-47.6	171.6	-169.1	-165.8	66	73.6	0.3	110	L401 S468 E469 Q474 N475 E476	L401-R472 PolarHBondContact O-NH2 3Å; S468-R472 PolarHBondContact O-N 2.96Å; E469-R472 PolarHBondContact O-N 3.12Å; E469-R472 IonicContact OE1-CZ 3.99Å; E469-R472 IonicContact OE1-NE 2.99Å; E469-R472 PolarHBondContact OE1-NE 2.87Å; E469-R472 IonicContact OE1-NH2 3.85Å; E469-R472 PolarHBondContact OE1-NH2 3.41Å; E469-R472 IonicContact OE2-CZ 3.49Å; E469-R472 IonicContact OE2-NE 3.18Å; E469-R472 PolarHBondContact OE2-NE 2.96Å; E469-R472 IonicContact OE2-NH2 3.87Å; R472-Q474 PolarHBondContact O-N 3.49Å; R472-N475 WeakPolarHBondContact O-CB 3.39Å; R472-N475 PolarHBondContact O-N 3.06Å; R472-E476 IonicContact CZ-OE2 2.67Å; R472-E476 IonicContact NH1-OE2 2.65Å; R472-E476 PolarHBondContact NH1-OE2 3.19Å; R472-E476 IonicContact NH2-OE2 3.06Å; R472-E476 PolarHBondContact O-N 3.42Å
473	L	95.1	Very high	94.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-37.3	177	-68.4	166.5	0	0	0	112.4	F259 L401 I428 P430 F435 E469 L470 R471 E476 C477	F259-L473 HydrophobicContact CE1-CB 4.02Å; F259-L473 HydrophobicContact CZ-CB 3.81Å; L401-L473 HydrophobicContact CB-CD2 4.3Å; L401-L473 HydrophobicContact CD1-CD1 4.23Å; I428-L473 HydrophobicContact CD1-CD2 3.8Å; I428-L473 HydrophobicContact CG1-CD2 4.31Å; I428-L473 HydrophobicContact CG2-CB 4.39Å; I428-L473 HydrophobicContact CG2-CD2 3.73Å; P430-L473 HydrophobicContact CB-CD1 4.18Å; P430-L473 HydrophobicContact CG-CD1 4.13Å; F435-L473 HydrophobicContact CE1-CD1 4.3Å; F435-L473 HydrophobicContact CE2-CD1 4.38Å; F435-L473 HydrophobicContact CZ-CD1 3.62Å; E469-L473 HydrophobicContact CG-CD1 4.11Å; E469-L473 WeakPolarHBondContact O-CB 3.43Å; E469-L473 VanDerWaalsContact O-CG 3.32Å; E469-L473 WeakPolarHBondContact O-CG 3.4Å; E469-L473 PolarHBondContact O-N 2.81Å; L470-L473 PolarHBondContact O-N 3.03Å; R471-L473 VanDerWaalsContact C-N 3.32Å; L473-E476 PolarHBondContact O-N 3.32Å; L473-C477 VanDerWaalsContact O-CB 3.29Å; L473-C477 WeakPolarHBondContact O-CB 3.47Å; L473-C477 PolarHBondContact O-N 3.31Å
474	Q	95.1	Very high	94.3	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-37.9	172.1	-75.9	178.3	-49.4	0	0	112.4	F259 L260 L262 L470 R471 R472 C477 R478	F259-Q474 HydrophobicContact CD1-CG 4.29Å; F259-Q474 HydrophobicContact CE1-CB 4.42Å; F259-Q474 HydrophobicContact CE1-CG 3.81Å; F259-Q474 HydrophobicContact CE2-CG 4.08Å; F259-Q474 HydrophobicContact CZ-CG 3.67Å; F259-Q474 PolarHBondContact O-NE2 3.4Å; L260-Q474 VanDerWaalsContact CD2-O 3.24Å; L260-Q474 WeakPolarHBondContact CD2-O 3.46Å; L262-Q474 PolarHBondContact O-NE2 3.03Å; L470-Q474 WeakPolarHBondContact O-CG 3.34Å; L470-Q474 PolarHBondContact O-N 3.49Å; R471-Q474 PolarHBondContact O-N 3.11Å; R472-Q474 PolarHBondContact O-N 3.49Å; Q474-C477 WeakPolarHBondContact O-CB 3.45Å; Q474-C477 PolarHBondContact O-N 3.03Å; Q474-R478 PolarHBondContact O-N 3.04Å
475	N	93.2	Very high	94.3	Very high	103 Å²	103	49.3 Å²	49.3	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-65	-43.7	174.5	-67.6	-14.1	0	0	0	111.3	R471 R472 R478	R471-N475 VanDerWaalsContact O-CG 3.26Å; R471-N475 PolarHBondContact O-N 3.23Å; R471-N475 PolarHBondContact O-OD1 2.94Å; R472-N475 WeakPolarHBondContact O-CB 3.39Å; R472-N475 PolarHBondContact O-N 3.06Å; N475-R478 PolarHBondContact O-N 2.7Å; N475-R478 PolarHBondContact OD1-NH1 3.26Å
476	E	93.4	Very high	94.2	Very high	35 Å²	35	53.3 Å²	53.3	16%	0.164	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-38.6	174.9	-168.2	173.5	176.5	0	0	111.7	R346 G427 I428 R472 L473 R478 G479	R346-E476 IonicContact CZ-OE1 3.98Å; R346-E476 IonicContact NH1-OE1 2.71Å; R346-E476 PolarHBondContact NH1-OE1 2.99Å; R346-E476 IonicContact NH2-OE1 3.74Å; R346-E476 PolarHBondContact NH2-OE1 3.38Å; G427-E476 WeakPolarHBondContact CA-O 3.35Å; I428-E476 HydrophobicContact CB-CG 4.46Å; I428-E476 HydrophobicContact CG2-CB 3.79Å; I428-E476 HydrophobicContact CG2-CG 3.74Å; R472-E476 IonicContact CZ-OE2 2.67Å; R472-E476 IonicContact NH1-OE2 2.65Å; R472-E476 PolarHBondContact NH1-OE2 3.19Å; R472-E476 IonicContact NH2-OE2 3.06Å; R472-E476 PolarHBondContact O-N 3.42Å; L473-E476 PolarHBondContact O-N 3.32Å; E476-R478 PolarHBondContact O-N 2.69Å; E476-G479 PolarHBondContact O-N 2.65Å
477	C	95.4	Very high	94.1	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-27.2	174.9	-172.8	0	0	0	0	113.9	F259 L260 I428 L473 Q474 G479 Y480	F259-C477 HydrophobicContact CD1-CB 3.88Å; F259-C477 HydrophobicContact CE1-CB 4.08Å; L260-C477 HydrophobicContact CD2-CB 3.98Å; L260-C477 HydrophobicContact CG-CB 4.44Å; I428-C477 VanDerWaalsContact O-CB 3.29Å; I428-C477 WeakPolarHBondContact O-CB 3.48Å; I428-C477 PolarHBondContact O-SG 3Å; L473-C477 VanDerWaalsContact O-CB 3.29Å; L473-C477 WeakPolarHBondContact O-CB 3.47Å; L473-C477 PolarHBondContact O-N 3.31Å; Q474-C477 WeakPolarHBondContact O-CB 3.45Å; Q474-C477 PolarHBondContact O-N 3.03Å; C477-G479 PolarHBondContact O-N 2.78Å; C477-Y480 VanDerWaalsContact O-CD2 3.26Å; C477-Y480 WeakPolarHBondContact O-CD2 3.43Å; C477-Y480 PolarHBondContact O-N 3.44Å
478	R	93.9	Very high	94.1	Very high	148 Å²	148	56.1 Å²	56.1	56%	0.558	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-7.1	172.8	-61.5	-168.4	-168.7	88.6	5.3	113.4	L260 Q474 N475 E476 Y480	L260-R478 HydrophobicContact CD1-CG 4.23Å; L260-R478 HydrophobicContact CD2-CG 3.48Å; L260-R478 VanDerWaalsContact CD2-CG 3.48Å; Q474-R478 PolarHBondContact O-N 3.04Å; N475-R478 PolarHBondContact O-N 2.7Å; N475-R478 PolarHBondContact OD1-NH1 3.26Å; E476-R478 PolarHBondContact O-N 2.69Å; R478-Y480 VanDerWaalsContact C-N 3.29Å
479	G	92.8	Very high	94.1	Very high	33 Å²	33	55 Å²	55	34%	0.34	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.3	172.1	0	0	0	0	0	114.7	G425 E476 C477 N481	G425-G479 CarbonylContact C-O 3.52Å; G425-G479 WeakPolarHBondContact CA-O 3.44Å; E476-G479 PolarHBondContact O-N 2.65Å; C477-G479 PolarHBondContact O-N 2.78Å; G479-N481 PolarHBondContact O-N 3.14Å
480	Y	93.7	Very high	94	Very high	34 Å²	34	59.3 Å²	59.3	13%	0.133	29%	0.285	C	S	.	.			trans	-67.7	129.5	176.2	-73.8	-58.4	0	0	0	112.1	T252 A256 L345 G427 I428 V429 C477 R478 L482	T252-Y480 HydrophobicContact CG2-CD1 4.19Å; T252-Y480 HydrophobicContact CG2-CD2 4.37Å; T252-Y480 HydrophobicContact CG2-CE1 3.66Å; T252-Y480 HydrophobicContact CG2-CE2 3.87Å; T252-Y480 VanDerWaalsContact CG2-CZ 3.47Å; A256-Y480 HydrophobicContact CB-CD2 3.81Å; A256-Y480 HydrophobicContact CB-CE2 4.12Å; L345-Y480 VanDerWaalsContact O-CE1 3.29Å; L345-Y480 WeakPolarHBondContact O-CE1 3.49Å; L345-Y480 PolarHBondContact O-OH 3.15Å; G427-Y480 VanDerWaalsContact C-CZ 3.44Å; I428-Y480 VanDerWaalsContact CA-OH 3.26Å; I428-Y480 WeakPolarHBondContact CA-OH 3.37Å; I428-Y480 PolarHBondContact N-OH 3.3Å; V429-Y480 HydrophobicContact CG2-CE2 3.67Å; V429-Y480 PolarHBondContact N-OH 2.83Å; C477-Y480 VanDerWaalsContact O-CD2 3.26Å; C477-Y480 WeakPolarHBondContact O-CD2 3.43Å; C477-Y480 PolarHBondContact O-N 3.44Å; R478-Y480 VanDerWaalsContact C-N 3.29Å; Y480-L482 HydrophobicContact CD1-CD1 4.19Å; Y480-L482 HydrophobicContact CG-CD1 4.43Å
481	N	93.5	Very high	94	Very high	113 Å²	113	60 Å²	60	60%	0.604	29%	0.287	S	S	*	.			trans	-120	85.6	168	-178.3	13.8	0	0	0	108.6	G479	G479-N481 PolarHBondContact O-N 3.14Å
482	L	92.9	Very high	94	Very high	22 Å²	22	58.3 Å²	58.3	12%	0.115	28%	0.282	C	S	.	.			trans	-120	149.9	-178.3	-59.5	177.7	0	0	0	109.1	E249 T252 L253 Y480	E249-L482 HydrophobicContact CB-CD2 4.23Å; E249-L482 HydrophobicContact CG-CD2 3.89Å; T252-L482 HydrophobicContact CG2-CD1 3.8Å; L253-L482 HydrophobicContact CD1-CB 4.27Å; Y480-L482 HydrophobicContact CD1-CD1 4.19Å; Y480-L482 HydrophobicContact CG-CD1 4.43Å
483	Q	92.9	Very high	93.8	Very high	135 Å²	135	59.3 Å²	59.3	63%	0.631	29%	0.29	S	S	*	.			trans	-116.9	144.1	-178.2	-63.7	-61.7	-49.6	0	0	110.4	Q250	Q250-Q483 PolarHBondContact NE2-O 3.27Å
484	P	95.1	Very high	93.6	Very high	68 Å²	68	60.6 Å²	60.6	44%	0.442	30%	0.304	S	S	.	.			trans	-72.9	129	-178.6	28.3	-33.8	0	0	0	112.4	L253	L253-P484 HydrophobicContact CD2-CB 3.92Å
485	D	95.5	Very high	93.5	Very high	48 Å²	48	60.6 Å²	60.6	26%	0.257	30%	0.304	S	S	.	.			trans	-96.5	105.2	167.2	-179.6	-45	0	0	0	108.2	Q250 D487 I488 Q489	Q250-D485 VanDerWaalsContact CD-N 3.26Å; Q250-D485 HydrophobicContact CG-CB 3.88Å; D485-D487 PolarHBondContact O-N 2.82Å; D485-D487 PolarHBondContact OD1-N 3.32Å; D485-I488 HydrophobicContact CB-CB 4.2Å; D485-I488 HydrophobicContact CB-CD1 4.09Å; D485-I488 HydrophobicContact CB-CG1 4.31Å; D485-I488 PolarHBondContact O-N 2.94Å; D485-I488 PolarHBondContact OD1-N 2.83Å; D485-I488 WeakPolarHBondContact OD2-CD1 3.22Å; D485-Q489 WeakPolarHBondContact O-CB 3.28Å; D485-Q489 WeakPolarHBondContact O-CG 3.47Å; D485-Q489 PolarHBondContact O-N 2.91Å
486	H	93.5	Very high	93.4	Very high	127 Å²	127	61.8 Å²	61.8	59%	0.588	30%	0.3	S	S	*	.	H	α-helix	trans	-64.3	-22	-173.3	-67.9	-57.7	0	0	0	114.4	R490	H486-R490 VanDerWaalsContact O-CB 3.26Å; H486-R490 WeakPolarHBondContact O-CB 3.45Å; H486-R490 PolarHBondContact O-N 3.4Å
487	D	93.9	Very high	93.2	Very high	88 Å²	88	63.3 Å²	63.3	47%	0.471	31%	0.313	S	S	.	.	H	α-helix	trans	-85	-40.9	-178.9	-68.3	-24.6	0	0	0	111.1	F242 D485 R490 W491	F242-D487 HydrophobicContact CE1-CB 4.48Å; D485-D487 PolarHBondContact O-N 2.82Å; D485-D487 PolarHBondContact OD1-N 3.32Å; D487-R490 PolarHBondContact O-N 2.64Å; D487-R490 IonicContact OD1-CZ 3.28Å; D487-R490 VanDerWaalsContact OD1-CZ 3.22Å; D487-R490 IonicContact OD1-NH1 3.64Å; D487-R490 PolarHBondContact OD1-NH1 3.38Å; D487-R490 IonicContact OD1-NH2 2.76Å; D487-R490 PolarHBondContact OD1-NH2 3.32Å; D487-W491 WeakPolarHBondContact O-CB 3.24Å; D487-W491 PolarHBondContact O-N 3.49Å
488	I	95.3	Very high	93.1	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-43.1	168.5	-64.8	172.8	0	0	0	110.6	F242 H246 L247 Q250 D485 W491 L492	F242-I488 HydrophobicContact CB-CD1 4.19Å; F242-I488 HydrophobicContact CB-CG1 4.2Å; F242-I488 HydrophobicContact CD1-CD1 4.02Å; F242-I488 HydrophobicContact CD1-CG1 3.32Å; F242-I488 HydrophobicContact CD2-CG1 4.32Å; F242-I488 HydrophobicContact CE1-CG1 3.63Å; F242-I488 HydrophobicContact CG-CD1 4.23Å; F242-I488 HydrophobicContact CG-CG1 3.69Å; F242-I488 HydrophobicContact CZ-CG1 4.26Å; H246-I488 HydrophobicContact CB-CD1 3.87Å; L247-I488 HydrophobicContact CD2-CG2 3.94Å; Q250-I488 HydrophobicContact CB-CB 4.42Å; Q250-I488 HydrophobicContact CB-CG2 3.62Å; Q250-I488 HydrophobicContact CG-CB 3.89Å; Q250-I488 HydrophobicContact CG-CD1 3.96Å; Q250-I488 HydrophobicContact CG-CG2 3.63Å; D485-I488 HydrophobicContact CB-CB 4.2Å; D485-I488 HydrophobicContact CB-CD1 4.09Å; D485-I488 HydrophobicContact CB-CG1 4.31Å; D485-I488 PolarHBondContact O-N 2.94Å; D485-I488 PolarHBondContact OD1-N 2.83Å; D485-I488 WeakPolarHBondContact OD2-CD1 3.22Å; I488-W491 PolarHBondContact O-N 3.41Å; I488-L492 HydrophobicContact CG2-CD1 3.94Å; I488-L492 HydrophobicContact CG2-CG 4.26Å; I488-L492 WeakPolarHBondContact O-CB 3.36Å; I488-L492 WeakPolarHBondContact O-CG 3.11Å; I488-L492 PolarHBondContact O-N 2.89Å
489	Q	92.9	Very high	93	Very high	16 Å²	16	60 Å²	60	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-42	178.6	-70.2	-66.7	-14.5	0	0	111.8	Q250 D485 L492 Q493	Q250-Q489 PolarHBondContact O-NE2 3.25Å; D485-Q489 WeakPolarHBondContact O-CB 3.28Å; D485-Q489 WeakPolarHBondContact O-CG 3.47Å; D485-Q489 PolarHBondContact O-N 2.91Å; Q489-L492 PolarHBondContact O-N 3.48Å; Q489-Q493 WeakPolarHBondContact O-CB 3.5Å; Q489-Q493 WeakPolarHBondContact O-CG 3.41Å; Q489-Q493 PolarHBondContact O-N 3.45Å
490	R	92.4	Very high	92.9	Very high	132 Å²	132	62.7 Å²	62.7	50%	0.498	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-41	175.2	-163.7	-174.3	-45.3	98.9	8.3	111.9	H486 D487 Q493 G494	H486-R490 VanDerWaalsContact O-CB 3.26Å; H486-R490 WeakPolarHBondContact O-CB 3.45Å; H486-R490 PolarHBondContact O-N 3.4Å; D487-R490 PolarHBondContact O-N 2.64Å; D487-R490 IonicContact OD1-CZ 3.28Å; D487-R490 VanDerWaalsContact OD1-CZ 3.22Å; D487-R490 IonicContact OD1-NH1 3.64Å; D487-R490 PolarHBondContact OD1-NH1 3.38Å; D487-R490 IonicContact OD1-NH2 2.76Å; D487-R490 PolarHBondContact OD1-NH2 3.32Å; R490-Q493 PolarHBondContact O-N 3.29Å; R490-G494 PolarHBondContact O-N 3.16Å
491	W	95.2	Very high	92.9	Very high	14 Å²	14	63.7 Å²	63.7	5%	0.053	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-55.4	172.8	175.6	78.8	0	0	0	111	A234 D235 V239 F242 L247 W335 D487 I488 Q493 G494 L495	A234-W491 HydrophobicContact CB-CG 4.49Å; D235-W491 PolarHBondContact O-NE1 3.3Å; V239-W491 HydrophobicContact CB-CH2 3.63Å; V239-W491 HydrophobicContact CB-CZ2 3.7Å; V239-W491 HydrophobicContact CG2-CH2 3.78Å; V239-W491 HydrophobicContact CG2-CZ2 4.38Å; F242-W491 HydrophobicContact CD2-CD2 4.5Å; F242-W491 HydrophobicContact CD2-CE3 4.45Å; F242-W491 HydrophobicContact CE2-CB 4Å; F242-W491 AromaticContact CE2-CD2 3.84Å; F242-W491 HydrophobicContact CE2-CD2 3.84Å; F242-W491 HydrophobicContact CE2-CE3 4.13Å; F242-W491 AromaticContact CE2-CG 3.75Å; F242-W491 HydrophobicContact CE2-CG 3.75Å; F242-W491 HydrophobicContact CZ-CB 4.02Å; F242-W491 HydrophobicContact CZ-CG 4.25Å; L247-W491 HydrophobicContact CD2-CE3 4.25Å; L247-W491 HydrophobicContact CD2-CZ3 3.75Å; W335-W491 HydrophobicContact CH2-CH2 4.25Å; W335-W491 HydrophobicContact CZ2-CH2 4.2Å; D487-W491 WeakPolarHBondContact O-CB 3.24Å; D487-W491 PolarHBondContact O-N 3.49Å; I488-W491 PolarHBondContact O-N 3.41Å; W491-Q493 VanDerWaalsContact C-N 3.25Å; W491-Q493 PolarHBondContact O-N 2.91Å; W491-G494 PolarHBondContact O-N 2.96Å; W491-G494 VanDerWaalsContact O-N 3.11Å; W491-L495 HydrophobicContact CD2-CD1 4.29Å; W491-L495 HydrophobicContact CE3-CD1 4.3Å; W491-L495 HydrophobicContact CH2-CD1 3.83Å; W491-L495 HydrophobicContact CZ2-CD1 3.82Å; W491-L495 HydrophobicContact CZ2-CD2 4.08Å; W491-L495 HydrophobicContact CZ2-CG 4.4Å; W491-L495 HydrophobicContact CZ3-CD1 4.08Å; W491-L495 WeakPolarHBondContact O-CG 3.34Å; W491-L495 PolarHBondContact O-N 3.34Å; W491-L495 VanDerWaalsContact O-N 3.16Å
492	L	93.9	Very high	93	Very high	15 Å²	15	58.4 Å²	58.4	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-55.8	-36.8	176.8	-74.6	173.9	0	0	0	112.9	Q250 L251 L254 K296 I488 Q489 L495	Q250-L492 HydrophobicContact CB-CD1 4.36Å; L251-L492 HydrophobicContact CD2-CD1 4.03Å; L251-L492 HydrophobicContact CD2-CD2 3.93Å; L254-L492 HydrophobicContact CD1-CD1 3.97Å; K296-L492 WeakPolarHBondContact CE-O 3.2Å; K296-L492 PolarHBondContact NZ-O 2.91Å; I488-L492 HydrophobicContact CG2-CD1 3.94Å; I488-L492 HydrophobicContact CG2-CG 4.26Å; I488-L492 WeakPolarHBondContact O-CB 3.36Å; I488-L492 WeakPolarHBondContact O-CG 3.11Å; I488-L492 PolarHBondContact O-N 2.89Å; Q489-L492 PolarHBondContact O-N 3.48Å; L492-L495 HydrophobicContact CD2-CD1 4.29Å
493	Q	91.1	Very high	93.1	Very high	101 Å²	101	57.8 Å²	57.8	47%	0.472	30%	0.297	S	S	.	.	H	α-helix	trans	-66.5	-48.1	176.1	-75.4	169.7	20.5	0	0	111.4	K296 Q489 R490 W491 L495	K296-Q493 PolarHBondContact NZ-O 2.92Å; Q489-Q493 WeakPolarHBondContact O-CB 3.5Å; Q489-Q493 WeakPolarHBondContact O-CG 3.41Å; Q489-Q493 PolarHBondContact O-N 3.45Å; R490-Q493 PolarHBondContact O-N 3.29Å; W491-Q493 VanDerWaalsContact C-N 3.25Å; W491-Q493 PolarHBondContact O-N 2.91Å; Q493-L495 VanDerWaalsContact C-N 3.3Å; Q493-L495 PolarHBondContact O-N 3Å
494	G	90.9	Very high	93.2	Very high	27 Å²	27	56 Å²	56	28%	0.278	29%	0.288	S	S	.	.	H	α-helix	trans	-72.2	-8.2	-179.1	0	0	0	0	0	116.6	A234 R490 W491 R496	A234-G494 PolarHBondContact N-O 2.95Å; R490-G494 PolarHBondContact O-N 3.16Å; W491-G494 PolarHBondContact O-N 2.96Å; W491-G494 VanDerWaalsContact O-N 3.11Å; G494-R496 PolarHBondContact O-N 3.37Å
495	L	92	Very high	93.3	Very high	11 Å²	11	58 Å²	58	6%	0.058	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-69.3	125.4	175.2	-71.1	178	0	0	0	112.3	A234 P236 A300 W491 L492 Q493	A234-L495 HydrophobicContact CB-CD2 4.18Å; P236-L495 HydrophobicContact CB-CD2 3.88Å; A300-L495 HydrophobicContact CB-CD1 3.64Å; W491-L495 HydrophobicContact CD2-CD1 4.29Å; W491-L495 HydrophobicContact CE3-CD1 4.3Å; W491-L495 HydrophobicContact CH2-CD1 3.83Å; W491-L495 HydrophobicContact CZ2-CD1 3.82Å; W491-L495 HydrophobicContact CZ2-CD2 4.08Å; W491-L495 HydrophobicContact CZ2-CG 4.4Å; W491-L495 HydrophobicContact CZ3-CD1 4.08Å; W491-L495 WeakPolarHBondContact O-CG 3.34Å; W491-L495 PolarHBondContact O-N 3.34Å; W491-L495 VanDerWaalsContact O-N 3.16Å; L492-L495 HydrophobicContact CD2-CD1 4.29Å; Q493-L495 VanDerWaalsContact C-N 3.3Å; Q493-L495 PolarHBondContact O-N 3Å
496	R	90.4	Very high	93.3	Very high	128 Å²	128	55.9 Å²	55.9	48%	0.483	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-102.4	117.6	172.8	-60.9	-176.9	-178.5	-166.7	-0.7	110	S303 G494	S303-R496 PolarHBondContact OG-O 3.26Å; G494-R496 PolarHBondContact O-N 3.37Å
497	P	90.3	Very high	93.5	Very high	67 Å²	67	49.8 Å²	49.8	44%	0.435	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-69.7	145.1	177.8	29.7	-34.5	0	0	0	111
498	L	92.3	Very high	93.6	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.105	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-77	147.1	171.9	-64.7	166.5	0	0	0	110.9	S303 L306 A308 V318 Q502	S303-L498 PolarHBondContact OG-N 2.87Å; L306-L498 HydrophobicContact CD1-CD1 4Å; A308-L498 HydrophobicContact CB-CD1 3.98Å; V318-L498 HydrophobicContact CB-CD2 4.46Å; V318-L498 HydrophobicContact CG1-CD2 3.7Å; V318-L498 HydrophobicContact CG2-CD2 3.86Å; L498-Q502 HydrophobicContact CB-CB 4.14Å; L498-Q502 HydrophobicContact CD2-CB 4.09Å
499	T	93.6	Very high	93.5	Very high	59 Å²	59	51.6 Å²	51.6	36%	0.362	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-69.7	163.7	168.2	71.6	0	0	0	0	111.7	A501 Q502 S503	T499-A501 PolarHBondContact O-N 2.94Å; T499-Q502 PolarHBondContact O-N 3.41Å; T499-Q502 WeakPolarHBondContact OG1-CB 3.15Å; T499-Q502 VanDerWaalsContact OG1-CG 3.28Å; T499-Q502 WeakPolarHBondContact OG1-CG 3.05Å; T499-Q502 PolarHBondContact OG1-N 3.01Å; T499-S503 WeakPolarHBondContact O-CB 3.47Å; T499-S503 PolarHBondContact O-N 3.36Å; T499-S503 PolarHBondContact O-OG 2.95Å
500	E	90.4	Very high	93.6	Very high	91 Å²	91	52.6 Å²	52.6	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-56.6	-37.7	174.2	-66.9	178.9	-159.8	0	0	112.1	S503 H504 W576 S578	E500-S503 PolarHBondContact O-OG 3.45Å; E500-H504 WeakPolarHBondContact O-CB 2.88Å; E500-H504 PolarHBondContact O-N 3.42Å; E500-W576 WeakPolarHBondContact OE2-CB 3.38Å; E500-S578 PolarHBondContact OE1-OG 3.17Å
501	A	92.6	Very high	93.7	Very high	55 Å²	55	47.4 Å²	47.4	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-70.9	-43.9	178.6	0	0	0	0	0	112.1	P315 T499 R505	P315-A501 HydrophobicContact CB-CB 4.18Å; T499-A501 PolarHBondContact O-N 2.94Å; A501-R505 VanDerWaalsContact O-CB 3.29Å; A501-R505 WeakPolarHBondContact O-CB 3.27Å; A501-R505 PolarHBondContact O-N 3.32Å
502	Q	95.1	Very high	93.6	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-53.9	175.3	-74.6	173	-18.2	0	0	111.2	G312 G314 V318 L498 T499 H504 R505 V506	G312-Q502 PolarHBondContact O-NE2 3.28Å; G314-Q502 PolarHBondContact O-NE2 3.44Å; V318-Q502 HydrophobicContact CG2-CB 3.8Å; V318-Q502 HydrophobicContact CG2-CG 3.5Å; L498-Q502 HydrophobicContact CB-CB 4.14Å; L498-Q502 HydrophobicContact CD2-CB 4.09Å; T499-Q502 PolarHBondContact O-N 3.41Å; T499-Q502 WeakPolarHBondContact OG1-CB 3.15Å; T499-Q502 VanDerWaalsContact OG1-CG 3.28Å; T499-Q502 WeakPolarHBondContact OG1-CG 3.05Å; T499-Q502 PolarHBondContact OG1-N 3.01Å; Q502-H504 PolarHBondContact O-N 2.98Å; Q502-R505 PolarHBondContact O-N 3.14Å; Q502-V506 VanDerWaalsContact O-CG2 3.31Å; Q502-V506 WeakPolarHBondContact O-CG2 3.48Å; Q502-V506 PolarHBondContact O-N 3.27Å
503	S	96.4	Very high	93.2	Very high	10 Å²	10	54.8 Å²	54.8	7%	0.07	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-40.3	-178.1	54.1	0	0	0	0	113.1	P362 T499 E500 S507	P362-S503 WeakPolarHBondContact CB-O 3.41Å; T499-S503 WeakPolarHBondContact O-CB 3.47Å; T499-S503 PolarHBondContact O-N 3.36Å; T499-S503 PolarHBondContact O-OG 2.95Å; E500-S503 PolarHBondContact O-OG 3.45Å; S503-S507 VanDerWaalsContact O-CB 3.25Å; S503-S507 WeakPolarHBondContact O-CB 3.44Å; S503-S507 PolarHBondContact O-N 3.45Å
504	H	95.3	Very high	92.4	Very high	96 Å²	96	51.7 Å²	51.7	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-43.8	172.6	177.4	-90.3	0	0	0	112.3	E500 Q502 C508	E500-H504 WeakPolarHBondContact O-CB 2.88Å; E500-H504 PolarHBondContact O-N 3.42Å; Q502-H504 PolarHBondContact O-N 2.98Å; H504-C508 PolarHBondContact O-N 3.26Å; H504-C508 PolarHBondContact O-SG 3.19Å
505	R	95.6	Very high	90.5	Very high	112 Å²	112	57 Å²	57	42%	0.423	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-55.4	177.9	179.8	-169.7	166.7	171.3	-4.2	111.2	P315 A501 Q502 S507 C508 E509	P315-R505 WeakPolarHBondContact O-CD 3.34Å; P315-R505 PolarHBondContact O-NH1 3.5Å; A501-R505 VanDerWaalsContact O-CB 3.29Å; A501-R505 WeakPolarHBondContact O-CB 3.27Å; A501-R505 PolarHBondContact O-N 3.32Å; Q502-R505 PolarHBondContact O-N 3.14Å; R505-S507 PolarHBondContact O-N 3.03Å; R505-C508 WeakPolarHBondContact O-CA 3.5Å; R505-C508 WeakPolarHBondContact O-CB 3.45Å; R505-C508 PolarHBondContact O-N 3.36Å; R505-E509 IonicContact CZ-OE1 3.21Å; R505-E509 IonicContact NE-OE1 2.72Å; R505-E509 PolarHBondContact NE-OE1 2.97Å; R505-E509 IonicContact NE-OE2 2.7Å; R505-E509 IonicContact NH2-OE1 2.8Å; R505-E509 PolarHBondContact NH2-OE1 2.97Å; R505-E509 PolarHBondContact O-N 3.42Å
506	V	96.3	Very high	88.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.012	36%	0.358	C	S	.	.	H	α-helix	trans	-56.4	-42.4	-179.4	175.5	0	0	0	0	110.3	L306 A308 V318 I320 Q502 C508 E509 V510	L306-V506 HydrophobicContact CB-CG1 3.88Å; L306-V506 HydrophobicContact CD1-CB 4.3Å; L306-V506 HydrophobicContact CD1-CG1 4.34Å; L306-V506 HydrophobicContact CD2-CG1 4.31Å; L306-V506 HydrophobicContact CG-CG1 4.4Å; A308-V506 HydrophobicContact CB-CG1 3.87Å; A308-V506 HydrophobicContact CB-CG2 4.25Å; V318-V506 HydrophobicContact CB-CG2 4.48Å; V318-V506 HydrophobicContact CG1-CG2 3.9Å; I320-V506 HydrophobicContact CD1-CB 4.4Å; I320-V506 HydrophobicContact CD1-CG1 4.01Å; I320-V506 HydrophobicContact CD1-CG2 3.92Å; I320-V506 HydrophobicContact CG1-CG1 4.1Å; I320-V506 HydrophobicContact CG1-CG2 4.09Å; I320-V506 HydrophobicContact CG2-CG1 4.3Å; Q502-V506 VanDerWaalsContact O-CG2 3.31Å; Q502-V506 WeakPolarHBondContact O-CG2 3.48Å; Q502-V506 PolarHBondContact O-N 3.27Å; V506-C508 VanDerWaalsContact C-N 3.3Å; V506-C508 PolarHBondContact O-N 3.12Å; V506-E509 PolarHBondContact O-N 2.84Å; V506-V510 HydrophobicContact CG1-CG1 4.02Å; V506-V510 WeakPolarHBondContact O-CG1 3.39Å; V506-V510 WeakPolarHBondContact O-CG2 3.45Å; V506-V510 PolarHBondContact O-N 3.29Å
507	S	97.3	Very high	86.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-57.2	-40.6	175.8	-173.8	0	0	0	0	113.2	P362 R365 L366 S503 R505 E511	P362-S507 WeakPolarHBondContact CA-OG 3.44Å; P362-S507 WeakPolarHBondContact O-CB 3.27Å; P362-S507 PolarHBondContact O-OG 3.08Å; R365-S507 WeakPolarHBondContact CD-OG 3.34Å; R365-S507 VanDerWaalsContact CG-OG 3.22Å; R365-S507 WeakPolarHBondContact CG-OG 3.35Å; R365-S507 PolarHBondContact NE-OG 3.13Å; L366-S507 WeakPolarHBondContact CD2-OG 3.48Å; S503-S507 VanDerWaalsContact O-CB 3.25Å; S503-S507 WeakPolarHBondContact O-CB 3.44Å; S503-S507 PolarHBondContact O-N 3.45Å; R505-S507 PolarHBondContact O-N 3.03Å; S507-E511 PolarHBondContact O-N 2.85Å; S507-E511 VanDerWaalsContact O-N 3.09Å
508	C	95.7	Very high	83.8	Confident	36 Å²	36	62.6 Å²	62.6	24%	0.243	37%	0.374	C	S	.	.	H	α-helix	trans	-72.8	-27	174.9	-63.5	0	0	0	0	113.7	R365 H504 R505 V506 P512	R365-C508 PolarHBondContact NH1-SG 3.28Å; R365-C508 VanDerWaalsContact NH1-SG 3.38Å; H504-C508 PolarHBondContact O-N 3.26Å; H504-C508 PolarHBondContact O-SG 3.19Å; R505-C508 WeakPolarHBondContact O-CA 3.5Å; R505-C508 WeakPolarHBondContact O-CB 3.45Å; R505-C508 PolarHBondContact O-N 3.36Å; V506-C508 VanDerWaalsContact C-N 3.3Å; V506-C508 PolarHBondContact O-N 3.12Å; C508-P512 VanDerWaalsContact O-CA 3.31Å; C508-P512 WeakPolarHBondContact O-CA 3Å
509	E	94.9	Very high	81.4	Confident	91 Å²	91	67.8 Å²	67.8	43%	0.425	41%	0.409	S	S	.	.	H	α-helix	trans	-78.4	-36.8	175.6	-70.7	178.7	171.2	0	0	112.1	I320 R505 V506	I320-E509 VanDerWaalsContact CD1-OE2 3.27Å; I320-E509 WeakPolarHBondContact CD1-OE2 3.41Å; R505-E509 IonicContact CZ-OE1 3.21Å; R505-E509 IonicContact NE-OE1 2.72Å; R505-E509 PolarHBondContact NE-OE1 2.97Å; R505-E509 IonicContact NE-OE2 2.7Å; R505-E509 IonicContact NH2-OE1 2.8Å; R505-E509 PolarHBondContact NH2-OE1 2.97Å; R505-E509 PolarHBondContact O-N 3.42Å; V506-E509 PolarHBondContact O-N 2.84Å
510	V	94.8	Very high	79	Confident	36 Å²	36	68.9 Å²	68.9	22%	0.218	43%	0.425	C	S	.	.	H	α-helix	trans	-85.3	-28	-178.3	-56.2	0	0	0	0	114.4	L306 I320 L366 V506	L306-V510 HydrophobicContact CD2-CG2 4.28Å; I320-V510 HydrophobicContact CG2-CG1 4.02Å; L366-V510 HydrophobicContact CD2-CG2 4.01Å; V506-V510 HydrophobicContact CG1-CG1 4.02Å; V506-V510 WeakPolarHBondContact O-CG1 3.39Å; V506-V510 WeakPolarHBondContact O-CG2 3.45Å; V506-V510 PolarHBondContact O-N 3.29Å
511	E	94	Very high	76.6	Confident	23 Å²	23	70 Å²	70	11%	0.107	44%	0.44	C	S	.	.	S	Bend	trans	-138.6	88	168.3	-71.5	-177.3	-136.2	0	0	109.7	R328 R365 L366 R367 A368 A369 S507	R328-E511 IonicContact CZ-OE1 2.69Å; R328-E511 IonicContact NH1-OE1 3.73Å; R328-E511 PolarHBondContact NH1-OE1 2.84Å; R365-E511 PolarHBondContact NH2-O 2.65Å; L366-E511 WeakPolarHBondContact CA-OE2 3.3Å; L366-E511 WeakPolarHBondContact CB-OE1 3.27Å; L366-E511 HydrophobicContact CD2-CB 3.86Å; L366-E511 HydrophobicContact CD2-CG 4.08Å; R367-E511 PolarHBondContact N-OE2 3.35Å; A368-E511 WeakPolarHBondContact CB-OE2 3.38Å; A368-E511 PolarHBondContact N-OE2 2.86Å; A369-E511 WeakPolarHBondContact CB-OE1 3.21Å; A369-E511 PolarHBondContact N-OE1 3.32Å; S507-E511 PolarHBondContact O-N 2.85Å; S507-E511 VanDerWaalsContact O-N 3.09Å
512	P	92.4	Very high	74	Confident	93 Å²	93	79 Å²	79	60%	0.604	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-58.1	145.2	177.3	-25.9	35.4	0	0	0	112.7	C508	C508-P512 VanDerWaalsContact O-CA 3.31Å; C508-P512 WeakPolarHBondContact O-CA 3Å
513	P	85.2	Confident	71.4	Confident	92 Å²	92	83.9 Å²	83.9	60%	0.597	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-64.7	136.9	175.4	29.2	-33.3	0	0	0	110.7
514	G	74.9	Confident	68.3	Low	36 Å²	36	91.1 Å²	91.1	37%	0.371	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-73.5	142.8	-178	0	0	0	0	0	112.5	S516 D517	G514-S516 PolarHBondContact O-N 3.37Å; G514-S516 VanDerWaalsContact O-N 3.09Å; G514-D517 WeakPolarHBondContact CA-OD2 3.33Å; G514-D517 PolarHBondContact N-OD2 3.43Å; G514-D517 PolarHBondContact O-N 2.81Å
515	S	51.2	Low	65.2	Low	137 Å²	137	91.6 Å²	91.6	96%	0.958	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-4.1	175.2	54.3	0	0	0	0	114.5
516	S	46.3	Very low	62	Low	110 Å²	110	89.2 Å²	89.2	77%	0.769	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	6.9	176	59.2	0	0	0	0	113.6	G514 P518	G514-S516 PolarHBondContact O-N 3.37Å; G514-S516 VanDerWaalsContact O-N 3.09Å; S516-P518 WeakPolarHBondContact O-CD 3.11Å
517	D	43.1	Very low	58.7	Low	109 Å²	109	93.2 Å²	93.2	58%	0.583	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-67.2	124.3	173.7	-76.8	-37.5	0	0	0	109.4	G514	G514-D517 WeakPolarHBondContact CA-OD2 3.33Å; G514-D517 PolarHBondContact N-OD2 3.43Å; G514-D517 PolarHBondContact O-N 2.81Å
518	P	42	Very low	55.7	Low	105 Å²	105	95.9 Å²	95.9	68%	0.682	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-61.3	144.6	169.2	27.3	-33.3	0	0	0	109	S516 A520	S516-P518 WeakPolarHBondContact O-CD 3.11Å; P518-A520 PolarHBondContact O-N 3.21Å
519	P	42.3	Very low	52.5	Low	129 Å²	129	97.9 Å²	97.9	84%	0.838	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-55.6	119.3	-175.4	22.9	-33.8	0	0	0	109.6
520	A	44.4	Very low	49.7	Very low	83 Å²	83	94.8 Å²	94.8	69%	0.686	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-51.2	131.7	-166.6	0	0	0	0	0	111.1	P518 R522	P518-A520 PolarHBondContact O-N 3.21Å; A520-R522 PolarHBondContact O-N 3.09Å
521	P	38.3	Very low	46.7	Very low	114 Å²	114	95.2 Å²	95.2	74%	0.74	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-55.4	135	176.5	24.8	-33.7	0	0	0	108.1	V523	P521-V523 PolarHBondContact O-N 3.38Å
522	R	39.7	Very low	43.7	Very low	244 Å²	244	102 Å²	102	92%	0.921	60%	0.597	S	S	*	*			trans	-59	98	-176	-71.1	-178.1	179.8	172	0.6	109.3	A520 L524	A520-R522 PolarHBondContact O-N 3.09Å; R522-L524 PolarHBondContact O-N 2.69Å; R522-L524 VanDerWaalsContact O-N 3.12Å
523	V	39.9	Very low	40.6	Very low	103 Å²	103	105.3 Å²	105.3	62%	0.624	60%	0.598	S	S	*	*			trans	-56.6	119.9	177	178.8	0	0	0	0	107.1	P521 R525	P521-V523 PolarHBondContact O-N 3.38Å; V523-R525 PolarHBondContact O-N 3.01Å
524	L	31.5	Very low	38.2	Very low	163 Å²	163	104.2 Å²	104.2	85%	0.853	59%	0.589	S	S	*	*			trans	-59.2	113.6	168.2	-68.9	173.1	0	0	0	106.2	R522	R522-L524 PolarHBondContact O-N 2.69Å; R522-L524 VanDerWaalsContact O-N 3.12Å
525	R	30.3	Very low	36.1	Very low	105 Å²	105	111 Å²	111	40%	0.396	61%	0.612	S	S	.	*			trans	-57.7	134.4	176.3	-66.5	-178.1	177.5	-163	-3.9	107.7	V523 T527 M574 K575 W576	V523-R525 PolarHBondContact O-N 3.01Å; R525-T527 PolarHBondContact O-N 2.79Å; R525-T527 PolarHBondContact O-OG1 2.69Å; R525-M574 PolarHBondContact NH2-SD 3.47Å; R525-K575 PolarHBondContact NH1-O 3.03Å; R525-W576 HydrophobicContact CG-CH2 4.5Å
526	P	28.2	Very low	35.2	Very low	63 Å²	63	107.6 Å²	107.6	41%	0.409	59%	0.585	S	S	.	*			trans	-52.2	110	160.6	-22	33.1	0	0	0	106.8	L528	P526-L528 VanDerWaalsContact C-N 3.25Å; P526-L528 PolarHBondContact O-N 3.38Å
527	T	27.1	Very low	34.5	Very low	86 Å²	86	109.5 Å²	109.5	53%	0.528	59%	0.585	S	S	.	*			trans	-93.3	73.6	-166.1	-59.6	0	0	0	0	107.5	E390 R525 V529	E390-T527 PolarHBondContact OE1-N 3.18Å; R525-T527 PolarHBondContact O-N 2.79Å; R525-T527 PolarHBondContact O-OG1 2.69Å; T527-V529 HydrophobicContact CG2-CG2 3.82Å; T527-V529 WeakPolarHBondContact O-CG2 3.46Å; T527-V529 PolarHBondContact O-N 3.38Å
528	L	33	Very low	34	Very low	55 Å²	55	107.8 Å²	107.8	29%	0.288	59%	0.594	S	S	.	*			trans	-67.7	81.9	176.8	-158.5	82.3	0	0	0	109.6	P526 I530	P526-L528 VanDerWaalsContact C-N 3.25Å; P526-L528 PolarHBondContact O-N 3.38Å; L528-I530 HydrophobicContact CD1-CD1 4.44Å; L528-I530 HydrophobicContact CD2-CD1 4.19Å; L528-I530 HydrophobicContact CG-CD1 4.06Å; L528-I530 HydrophobicContact CG-CG1 4.15Å; L528-I530 PolarHBondContact O-N 2.93Å
529	V	29.2	Very low	33.5	Very low	79 Å²	79	108.2 Å²	108.2	48%	0.479	60%	0.599	S	S	.	*			trans	-71.6	78.1	177.9	-173	0	0	0	0	109.6	T527	T527-V529 HydrophobicContact CG2-CG2 3.82Å; T527-V529 WeakPolarHBondContact O-CG2 3.46Å; T527-V529 PolarHBondContact O-N 3.38Å
530	I	35.1	Very low	32.7	Very low	26 Å²	26	109.1 Å²	109.1	13%	0.133	60%	0.602	C	S	.	*			trans	-131.8	42.9	170	-41.9	179.2	0	0	0	110	R275 L528	R275-I530 PolarHBondContact NH2-O 3.36Å; L528-I530 HydrophobicContact CD1-CD1 4.44Å; L528-I530 HydrophobicContact CD2-CD1 4.19Å; L528-I530 HydrophobicContact CG-CD1 4.06Å; L528-I530 HydrophobicContact CG-CG1 4.15Å; L528-I530 PolarHBondContact O-N 2.93Å
531	S	33.6	Very low	31.8	Very low	45 Å²	45	108.6 Å²	108.6	32%	0.315	60%	0.604	S	S	.	*	S	Bend	trans	-168.1	167.7	160.4	47.6	0	0	0	0	111.5
532	Q	30.5	Very low	31	Very low	165 Å²	165	110 Å²	110	77%	0.771	61%	0.611	S	S	*	*			trans	68.5	60.8	171.4	-54.4	-174.8	10.8	0	0	117.8
533	W	26.9	Very low	30.5	Very low	163 Å²	163	103.8 Å²	103.8	62%	0.617	60%	0.602	S	S	*	*			trans	-108.3	-6.6	155.5	-88.3	96	0	0	0	114	E535	W533-E535 PolarHBondContact O-N 3.32Å
534	T	35.8	Very low	29.7	Very low	68 Å²	68	105.8 Å²	105.8	42%	0.417	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-74.4	-26.5	-167.2	-0.2	0	0	0	0	115.5	V536	T534-V536 PolarHBondContact O-N 3.4Å
535	E	30.6	Very low	29.5	Very low	180 Å²	180	103.1 Å²	103.1	84%	0.841	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-81.3	-10.4	-172.7	-63.4	-168.4	147.1	0	0	114.6	W533	W533-E535 PolarHBondContact O-N 3.32Å
536	V	30.7	Very low	29.1	Very low	65 Å²	65	106 Å²	106	39%	0.394	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-92.9	-9	-166.6	178.7	0	0	0	0	113.8	T534 R616	T534-V536 PolarHBondContact O-N 3.4Å; V536-R616 VanDerWaalsContact CG1-CZ 3.4Å
537	L	32.7	Very low	28.8	Very low	149 Å²	149	109.1 Å²	109.1	78%	0.78	65%	0.647	S	S	*	*	S	Bend	trans	-107.7	-14.2	-172.5	-63.3	177.4	0	0	0	115.1	S539	L537-S539 PolarHBondContact O-N 3.24Å
538	G	31.3	Very low	28.6	Very low	73 Å²	73	109.9 Å²	109.9	75%	0.753	66%	0.656	S	S	*	*	S	Bend	trans	-76	32	-178	0	0	0	0	0	115.9
539	S	31.6	Very low	28.1	Very low	115 Å²	115	112.3 Å²	112.3	80%	0.804	68%	0.676	S	S	*	*			trans	-153.8	54	-175.1	-77.9	0	0	0	0	114.8	L537	L537-S539 PolarHBondContact O-N 3.24Å
540	V	27	Very low	27.6	Very low	148 Å²	148	115.3 Å²	115.3	90%	0.897	69%	0.685	S	S	*	*			trans	-130.7	125.1	144.6	-176.2	0	0	0	0	105.7
541	G	24.1	Very low	27.1	Very low	71 Å²	71	124.2 Å²	124.2	73%	0.732	72%	0.717	S	S	*	*			trans	-121.6	164.7	-167.8	0	0	0	0	0	114.3
542	V	22.6	Very low	26.8	Very low	145 Å²	145	128 Å²	128	88%	0.879	74%	0.74	S	S	*	*			trans	-133.7	137.5	169	-178.2	0	0	0	0	107.9
543	P	28.9	Very low	26.5	Very low	112 Å²	112	124.6 Å²	124.6	73%	0.727	74%	0.735	S	S	*	*			trans	-109.7	150.5	-170.7	39.1	-33	0	0	0	115.4
544	T	23	Very low	26.4	Very low	146 Å²	146	125.1 Å²	125.1	90%	0.896	75%	0.746	S	S	*	*			trans	-156.6	163.6	161.3	22.5	0	0	0	0	110.3
545	P	26.6	Very low	26	Very low	107 Å²	107	126.4 Å²	126.4	70%	0.695	76%	0.764	S	S	*	*			trans	-128.7	157.1	-138.4	42.9	-30.9	0	0	0	119.7
546	L	22.3	Very low	25.8	Very low	166 Å²	166	121.5 Å²	121.5	87%	0.869	76%	0.761	S	S	*	*			trans	56.6	162.4	137.6	-72.2	172.1	0	0	0	124.3
547	V	23.1	Very low	25.6	Very low	127 Å²	127	125.8 Å²	125.8	77%	0.77	78%	0.782	S	S	*	*			trans	96.5	96.1	172.5	-176	0	0	0	0	113.1
548	S	21.7	Very low	25.2	Very low	102 Å²	102	126.8 Å²	126.8	71%	0.713	78%	0.783	S	S	*	*				76.7	142.8	76.4	-70.7	0	0	0	0	114.4
549	C	22.5	Very low	25.1	Very low	106 Å²	106	129.3 Å²	129.3	72%	0.716	78%	0.783	S	S	*	*			cis	-165.9	-172.9	-8.6	-104.3	0	0	0	0	107.8
550	E	19.9	Very low	25.3	Very low	142 Å²	142	129.2 Å²	129.2	66%	0.664	78%	0.78	S	S	*	*			cis	-146.3	-94.8	12.5	-173.3	39.7	48.3	0	0	113.6
551	R	22.8	Very low	25.2	Very low	213 Å²	213	127.7 Å²	127.7	80%	0.804	77%	0.771	S	S	*	*			trans	-169.8	178.9	-160.6	-112.9	175.6	-173.7	143.7	-0.7	111.6
552	P	28.1	Very low	25.4	Very low	124 Å²	124	130.5 Å²	130.5	81%	0.805	77%	0.774	S	S	*	*			cis	-130.2	-114.5	34.2	40.4	-19.8	0	0	0	118.8
553	S	24.9	Very low	26	Very low	94 Å²	94	129 Å²	129	66%	0.657	77%	0.767	S	S	*	*			trans	-170.1	178.6	-143.5	-171.6	0	0	0	0	114.9
554	M	25.2	Very low	25.9	Very low	175 Å²	175	128 Å²	128	86%	0.862	77%	0.769	S	S	*	*			trans	90.5	145.3	166.4	-51.3	-45.1	-156.9	0	0	117.3
555	A	26.6	Very low	26.5	Very low	95 Å²	95	127.1 Å²	127.1	79%	0.785	77%	0.766	S	S	*	*			cis	-168.7	159.8	-17	0	0	0	0	0	112.9
556	G	25.8	Very low	26.5	Very low	76 Å²	76	130.1 Å²	130.1	78%	0.784	78%	0.775	S	S	*	*			trans	77.6	158.3	161.7	0	0	0	0	0	118.9
557	D	25.9	Very low	26.7	Very low	156 Å²	156	130.4 Å²	130.4	83%	0.834	78%	0.776	S	S	*	*			cis	-163.9	164.5	-20.8	-144.7	-19.8	0	0	0	111.7
558	E	24.8	Very low	26.8	Very low	169 Å²	169	130.5 Å²	130.5	79%	0.79	78%	0.777	S	S	*	*			trans	46.9	133.3	170.5	-54	-157.3	117.6	0	0	120.8
559	V	29.1	Very low	27.2	Very low	126 Å²	126	137.6 Å²	137.6	76%	0.764	79%	0.788	S	S	*	*			cis	90.2	140.4	33.9	174.6	0	0	0	0	113.4
560	P	36.8	Very low	27.4	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	80%	0.798	S	S	*	*			cis	-108.4	-144.8	-0.5	17.1	8.9	0	0	0	112.8
561	T	24.2	Very low	27.8	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	80%	0.804	S	S	*	*			cis	-154.8	145.9	19.5	40.3	0	0	0	0	115.8
562	T	29.1	Very low	28.1	Very low	129 Å²	129	137.4 Å²	137.4	79%	0.791	81%	0.807	S	S	*	*			trans	18.9	161.4	136	15.8	0	0	0	0	125.6
563	P	35.3	Very low	28.3	Very low	113 Å²	113	140 Å²	140	73%	0.734	81%	0.808	S	S	*	*				-143.3	-177.5	-108.9	46.2	-26.9	0	0	0	119.7
564	A	26.7	Very low	28.3	Very low	92 Å²	92	143.4 Å²	143.4	76%	0.76	82%	0.816	S	S	*	*			trans	76.4	163.8	150.2	0	0	0	0	0	118.6
565	P	35.6	Very low	28.3	Very low	128 Å²	128	143.3 Å²	143.3	83%	0.831	81%	0.811	S	S	*	*			cis	-123.1	-176.6	3.3	42.1	-27.5	0	0	0	116.3
566	L	26.3	Very low	28.3	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	79%	0.792	S	S	*	*			trans	-103.3	139.6	-172.8	-67	157.8	0	0	0	113.4
567	L	25.7	Very low	28.4	Very low	172 Å²	172	143.2 Å²	143.2	90%	0.901	77%	0.774	S	S	*	*			trans	-150.1	167.7	148.6	-88.7	-170.2	0	0	0	111.5
568	T	25.9	Very low	28.4	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	75%	0.753	S	S	*	*			trans	73.3	70.7	169.8	-40.7	0	0	0	0	117.3
569	R	30.2	Very low	28.7	Very low	251 Å²	251	132.5 Å²	132.5	95%	0.947	73%	0.728	S	S	*	*			trans	-116.7	80.7	153.5	-92.8	-165	175.6	-168.1	1.3	110.8
570	L	27.6	Very low	28.6	Very low	175 Å²	175	130.6 Å²	130.6	92%	0.916	72%	0.72	S	S	*	*			trans	-160.5	49.7	171	-119.9	164.1	0	0	0	113.1
571	A	26.9	Very low	28.1	Very low	95 Å²	95	130.1 Å²	130.1	79%	0.785	72%	0.72	S	S	*	*			trans	-146.5	60	-179.3	0	0	0	0	0	112.4
572	Q	29.9	Very low	28.4	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	73%	0.726	S	S	*	*			trans	-135.4	149.5	172.6	-69.6	-174.7	-24.4	0	0	110.1
573	H	33	Very low	28.3	Very low	178 Å²	178	133.9 Å²	133.9	82%	0.824	73%	0.73	S	S	*	*	S	Bend	trans	70.4	55	-173.3	-75.6	-92.2	0	0	0	118
574	M	24.2	Very low	28	Very low	166 Å²	166	132.8 Å²	132.8	82%	0.818	73%	0.725	S	S	*	*			trans	-135.5	113.9	140.4	-73.9	-62.3	159	0	0	110	R525	R525-M574 PolarHBondContact NH2-SD 3.47Å
575	K	24.7	Very low	28.2	Very low	174 Å²	174	132.6 Å²	132.6	76%	0.757	72%	0.723	S	S	*	*			trans	-125.9	145	161.4	-88.8	-165.6	171.2	-167.6	0	109.3	R525	R525-K575 PolarHBondContact NH1-O 3.03Å
576	W	26.7	Very low	27.7	Very low	107 Å²	107	134.4 Å²	134.4	41%	0.405	73%	0.725	S	S	.	*			trans	-93.3	163.8	155.9	-69.2	83.4	0	0	0	109.2	E500 R525 S578	E500-W576 WeakPolarHBondContact OE2-CB 3.38Å; R525-W576 HydrophobicContact CG-CH2 4.5Å; W576-S578 VanDerWaalsContact C-N 3.28Å; W576-S578 PolarHBondContact O-N 3.35Å; W576-S578 VanDerWaalsContact O-N 3.11Å
577	P	27.7	Very low	27.7	Very low	61 Å²	61	135.9 Å²	135.9	40%	0.396	73%	0.727	S	S	.	*			trans	-82.3	71.9	172.2	34.5	-34.1	0	0	0	110.7
578	S	25.8	Very low	27.7	Very low	55 Å²	55	133.1 Å²	133.1	39%	0.385	72%	0.723	S	S	.	*			trans	-66.5	130	167.7	-20.8	0	0	0	0	108.7	E500 W576 S580	E500-S578 PolarHBondContact OE1-OG 3.17Å; W576-S578 VanDerWaalsContact C-N 3.28Å; W576-S578 PolarHBondContact O-N 3.35Å; W576-S578 VanDerWaalsContact O-N 3.11Å; S578-S580 PolarHBondContact O-N 3.22Å
579	V	31.7	Very low	27.7	Very low	45 Å²	45	132.7 Å²	132.7	27%	0.273	73%	0.725	S	S	.	*	S	Bend	trans	-80.6	-2.9	174.5	-152.8	0	0	0	0	111.6	V291	V291-V579 HydrophobicContact CG1-CB 4.36Å; V291-V579 HydrophobicContact CG1-CG2 4.42Å
580	S	27.7	Very low	27.6	Very low	86 Å²	86	127.1 Å²	127.1	60%	0.601	72%	0.721	S	S	*	*			trans	-90.6	121	172	44.9	0	0	0	0	111.2	S578	S578-S580 PolarHBondContact O-N 3.22Å
581	S	25.3	Very low	27.6	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	72%	0.718	S	S	*	*			trans	-156	116	161.1	-77.7	0	0	0	0	107.7
582	L	29.8	Very low	27.6	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	72%	0.719	S	S	*	*			trans	71.8	86.8	-175.2	-52.9	169.9	0	0	0	115.4
583	D	27.5	Very low	27.5	Very low	162 Å²	162	127.2 Å²	127.2	87%	0.866	72%	0.718	S	S	*	*			trans	-144.3	46.3	157	-95.2	-37.8	0	0	0	110.3
584	S	29.8	Very low	27	Very low	91 Å²	91	124.2 Å²	124.2	64%	0.636	72%	0.716	S	S	*	*	S	Bend	trans	-136.6	44.3	176.2	-60.6	0	0	0	0	111.7	E313	E313-S584 WeakPolarHBondContact OE1-CB 3.21Å; E313-S584 PolarHBondContact OE1-OG 2.85Å
585	A	30.4	Very low	27.5	Very low	87 Å²	87	122.1 Å²	122.1	72%	0.719	72%	0.715	S	S	*	*			trans	-154.6	22.4	-171.9	0	0	0	0	0	118.3
586	L	25.5	Very low	27.6	Very low	167 Å²	167	118.5 Å²	118.5	87%	0.874	72%	0.718	S	S	*	*			trans	-142.8	81.3	174	-77.3	-179	0	0	0	113.9
587	E	25.9	Very low	27.5	Very low	200 Å²	200	121 Å²	121	94%	0.935	74%	0.739	S	S	*	*			trans	-131.7	100.2	151.9	-79.7	-162	159.9	0	0	109.9
588	S	25.8	Very low	27.8	Very low	115 Å²	115	123.2 Å²	123.2	80%	0.804	75%	0.754	S	S	*	*			trans	-157.6	120.9	160.9	52.1	0	0	0	0	111.3
589	S	26.1	Very low	27.8	Very low	119 Å²	119	126 Å²	126	83%	0.832	77%	0.773	S	S	*	*			trans	-85.7	156	175.2	-68.8	0	0	0	0	111.2
590	P	28.3	Very low	27.5	Very low	133 Å²	133	131.9 Å²	131.9	86%	0.864	80%	0.798	S	S	*	*			trans	-82.2	151	-165.4	32.2	-36.8	0	0	0	114.5
591	S	26.3	Very low	27.3	Very low	121 Å²	121	134.9 Å²	134.9	85%	0.846	81%	0.806	S	S	*	*			trans	-139.3	142.8	165.1	58.5	0	0	0	0	110.7
592	L	27.2	Very low	27.4	Very low	155 Å²	155	134.9 Å²	134.9	81%	0.812	81%	0.806	S	S	*	*			trans	-90.2	150.5	-175.2	-77	137.2	0	0	0	113.4
593	H	27.6	Very low	28.2	Very low	184 Å²	184	133 Å²	133	85%	0.852	80%	0.803	S	S	*	*			trans	130.4	133.1	144.7	-69.5	-71.2	0	0	0	115.9
594	S	23.8	Very low	28.6	Very low	114 Å²	114	131 Å²	131	80%	0.797	80%	0.799	S	S	*	*			trans	-100.2	-170	-178.1	-19	0	0	0	0	111
595	P	33.9	Very low	28.5	Very low	122 Å²	122	131.4 Å²	131.4	79%	0.792	81%	0.808	S	S	*	*			cis	-132.9	163.8	-20.2	37	-21.3	0	0	0	114.5
596	A	26.8	Very low	28.2	Very low	99 Å²	99	133.1 Å²	133.1	82%	0.818	82%	0.815	S	S	*	*			trans	-166.1	141.2	154.8	0	0	0	0	0	113.2
597	D	25.3	Very low	28.3	Very low	158 Å²	158	130.6 Å²	130.6	85%	0.845	81%	0.811	S	S	*	*			trans	-102.9	-176.8	170.4	-70.8	-62.3	0	0	0	110.7
598	P	33.8	Very low	28.3	Very low	108 Å²	108	126.9 Å²	126.9	70%	0.701	80%	0.804	S	S	*	*				-133.2	163.7	-61.4	38.9	-24.9	0	0	0	113
599	S	25	Very low	28.4	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	81%	0.81	S	S	*	*			trans	-160.5	118.1	161.9	-61.5	0	0	0	0	115.2
600	H	25.6	Very low	28.5	Very low	169 Å²	169	133.4 Å²	133.4	78%	0.782	81%	0.81	S	S	*	*				11.6	140.3	126.7	-64.6	-76	0	0	0	119.2
601	L	24.1	Very low	28.3	Very low	149 Å²	149	132.8 Å²	132.8	78%	0.78	81%	0.808	S	S	*	*			cis	-162.4	179.2	15.2	-113.5	162.2	0	0	0	112.6
602	S	27.7	Very low	28.4	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	81%	0.814	S	S	*	*			trans	-159.5	173	172.2	-65.6	0	0	0	0	109.7
603	P	45.8	Very low	28.3	Very low	122 Å²	122	135.2 Å²	135.2	79%	0.792	81%	0.81	S	S	*	*			cis	-110.2	-126.3	-29.9	25	-1.1	0	0	0	108.9
604	P	37.1	Very low	28.3	Very low	121 Å²	121	135 Å²	135	79%	0.786	81%	0.808	S	S	*	*			cis	-137.4	-174.9	43.5	40.8	-20.9	0	0	0	115.2
605	A	26.8	Very low	28.6	Very low	99 Å²	99	140.2 Å²	140.2	82%	0.818	81%	0.811	S	S	*	*			trans	-104.1	163.3	177.3	0	0	0	0	0	113.3
606	S	24.3	Very low	28.2	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	80%	0.803	S	S	*	*			trans	-134.1	146.6	155.5	67.5	0	0	0	0	109.8
607	S	26.6	Very low	28.1	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	80%	0.798	S	S	*	*			trans	-145.4	135.7	-174.2	58.6	0	0	0	0	112.5
608	P	26	Very low	28.2	Very low	121 Å²	121	139.5 Å²	139.5	79%	0.786	80%	0.796	S	S	*	*			trans	-100.8	140.9	166	34.5	-28.1	0	0	0	111.8
609	R	29.3	Very low	27.9	Very low	246 Å²	246	139.8 Å²	139.8	93%	0.928	80%	0.8	S	S	*	*			trans	-64.7	149.6	169.1	-81.2	174.9	163.4	169.4	-5.4	112
610	P	27.5	Very low	28	Very low	126 Å²	126	140.2 Å²	140.2	82%	0.818	80%	0.802	S	S	*	*			trans	-112.8	173.5	140	11.1	8.9	0	0	0	112.4
611	S	24.8	Very low	28.1	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	80%	0.796	S	S	*	*			trans	-91.6	163.6	-171.3	45.7	0	0	0	0	114.5
612	R	27.1	Very low	28.2	Very low	258 Å²	258	132.7 Å²	132.7	97%	0.974	79%	0.791	S	S	*	*			trans	-68.5	129.1	174.7	-76.2	174.6	164.9	162.6	-6.9	111.8
613	G	26.2	Very low	28.3	Very low	70 Å²	70	134 Å²	134	72%	0.722	80%	0.797	S	S	*	*			trans	-123.9	158.2	156.1	0	0	0	0	0	109.5
614	H	27.3	Very low	27.5	Very low	178 Å²	178	136 Å²	136	82%	0.824	80%	0.8	S	S	*	*			trans	-148.4	155.6	-167.7	-143.9	63.6	0	0	0	114.7
615	R	29.1	Very low	27	Very low	224 Å²	224	136.2 Å²	136.2	85%	0.845	81%	0.805	S	S	*	*			trans	74.3	132.7	-174.2	-58.2	-176.6	177.5	-124.5	-0.9	114.3
616	R	26	Very low	27	Very low	165 Å²	165	135.4 Å²	135.4	62%	0.623	81%	0.805	S	S	*	*			cis	97	100.9	30	-75.2	-174.1	179	-120.3	6.9	114.5	V536	V536-R616 VanDerWaalsContact CG1-CZ 3.4Å
617	S	25.7	Very low	27.1	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	81%	0.806	S	S	*	*			trans	74.9	144.6	132	-49.1	0	0	0	0	120
618	A	27.4	Very low	27.2	Very low	98 Å²	98	133.1 Å²	133.1	81%	0.81	81%	0.809	S	S	*	*			trans	-101.9	169.9	-175.6	0	0	0	0	0	113.3
619	S	26.9	Very low	27.3	Very low	113 Å²	113	137 Å²	137	79%	0.79	82%	0.817	S	S	*	*			trans	-157.6	157.7	149.9	-154.9	0	0	0	0	111
620	C	27.1	Very low	27.2	Very low	124 Å²	124	129.2 Å²	129.2	84%	0.838	81%	0.813	S	S	*	*			trans	-119.8	167.6	-166.8	-48.7	0	0	0	0	111.7
621	G	26.6	Very low	27.3	Very low	63 Å²	63	127.9 Å²	127.9	65%	0.649	81%	0.813	S	S	*	*			trans	151.6	107.2	160	0	0	0	0	0	116.5
622	S	26.5	Very low	27.5	Very low	96 Å²	96	128 Å²	128	67%	0.671	81%	0.813	S	S	*	*			trans	-129.8	132.5	167.9	-62.4	0	0	0	0	109.4	L669	S622-L669 WeakPolarHBondContact OG-CD2 3.34Å
623	P	30.1	Very low	27.6	Very low	131 Å²	131	119.8 Å²	119.8	85%	0.851	81%	0.809	S	S	*	*			trans	-98.7	164.3	178.4	37.6	-33.8	0	0	0	113.6
624	L	28.1	Very low	27.7	Very low	164 Å²	164	120.5 Å²	120.5	86%	0.859	82%	0.817	S	S	*	*			trans	-88	159.4	-179.8	-65.4	165.9	0	0	0	114.1
625	S	28.6	Very low	27.9	Very low	126 Å²	126	119.4 Å²	119.4	88%	0.881	82%	0.822	S	S	*	*			trans	-160.5	149.5	151.5	-72.2	0	0	0	0	106.5
626	G	25.1	Very low	27.9	Very low	81 Å²	81	112.4 Å²	112.4	84%	0.835	82%	0.82	S	S	*	*			cis	122.7	100	17.1	0	0	0	0	0	107.6
627	G	27.9	Very low	28	Very low	85 Å²	85	116.2 Å²	116.2	88%	0.876	84%	0.836	S	S	*	*			trans	-102.4	178.4	-162.3	0	0	0	0	0	116.3
628	A	28.2	Very low	28.2	Very low	105 Å²	105	115.3 Å²	115.3	87%	0.868	84%	0.843	S	S	*	*			trans	-155.6	167.5	171.2	0	0	0	0	0	110.8
629	E	28.6	Very low	28.2	Very low	204 Å²	204	114.5 Å²	114.5	95%	0.953	84%	0.844	S	S	*	*			trans	-97.7	169.7	-169.9	-54	169.2	113.6	0	0	113.5
630	G	27.2	Very low	28.7	Very low	81 Å²	81	113.6 Å²	113.6	84%	0.835	85%	0.853	S	S	*	*			trans	165.7	113.9	169	0	0	0	0	0	115.3
631	A	29.9	Very low	28.7	Very low	99 Å²	99	111.2 Å²	111.2	82%	0.818	85%	0.849	S	S	*	*			trans	-80.8	164.5	-169.8	0	0	0	0	0	116.7
632	S	28.6	Very low	28.9	Very low	121 Å²	121	114.3 Å²	114.3	85%	0.846	86%	0.861	S	S	*	*			trans	116.4	126.8	138.5	77	0	0	0	0	120.2
633	G	28.9	Very low	29.1	Very low	86 Å²	86	112.6 Å²	112.6	89%	0.887	86%	0.858	S	S	*	*			trans	79.3	119.2	136.1	0	0	0	0	0	120.9
634	G	27.6	Very low	29.3	Very low	85 Å²	85	112.9 Å²	112.9	88%	0.876	86%	0.86	S	S	*	*			trans	141.5	120.6	153	0	0	0	0	0	116.5
635	T	32.8	Very low	29.6	Very low	154 Å²	154	108 Å²	108	95%	0.945	85%	0.85	S	S	*	*			trans	-95	137.2	168.7	50.1	0	0	0	0	111.2
636	G	28.1	Very low	30.2	Very low	78 Å²	78	106.9 Å²	106.9	80%	0.804	85%	0.848	S	S	*	*			trans	-165.6	146.7	174.2	0	0	0	0	0	113.8
637	Y	28.9	Very low	31.3	Very low	244 Å²	244	107 Å²	107	96%	0.957	84%	0.836	S	S	*	*			trans	-90.2	145.3	179.5	-95.3	-110.3	0	0	0	112.6
638	G	29.6	Very low	33.3	Very low	83 Å²	83	107.7 Å²	107.7	86%	0.856	82%	0.82	S	S	*	*			trans	49.9	101.8	139.6	0	0	0	0	0	119.9
639	G	27.2	Very low	35.8	Very low	81 Å²	81	105.8 Å²	105.8	84%	0.835	80%	0.799	S	S	*	*			trans	-165.1	126.7	162.2	0	0	0	0	0	111.1	G641	G639-G641 PolarHBondContact O-N 3.2Å
640	G	38.1	Very low	38.4	Very low	95 Å²	95	100.3 Å²	100.3	98%	0.979	77%	0.77	S	S	*	*			trans	-76.4	118.6	179.4	0	0	0	0	0	111.6
641	G	26	Very low	41.3	Very low	73 Å²	73	100.8 Å²	100.8	75%	0.753	75%	0.752	S	S	*	*			trans	-133.2	129.1	173.8	0	0	0	0	0	110.7	G639 G643	G639-G641 PolarHBondContact O-N 3.2Å; G641-G643 PolarHBondContact O-N 3.33Å
642	S	31.9	Very low	44.1	Very low	129 Å²	129	96 Å²	96	90%	0.902	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-65	129	-177.7	-54.8	0	0	0	0	111.7
643	G	29.8	Very low	47	Very low	59 Å²	59	96.3 Å²	96.3	61%	0.608	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-62.1	155.7	167.7	0	0	0	0	0	111.7	G641 G645	G641-G643 PolarHBondContact O-N 3.33Å; G643-G645 PolarHBondContact O-N 2.85Å
644	P	35.3	Very low	49.9	Very low	137 Å²	137	92.2 Å²	92.2	89%	0.89	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-62.7	125.6	-177.5	26	-33.9	0	0	0	110.9
645	G	33.6	Very low	52.7	Low	62 Å²	62	89.8 Å²	89.8	64%	0.639	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-63	164.2	172.1	0	0	0	0	0	112.1	G643 S647	G643-G645 PolarHBondContact O-N 2.85Å; G645-S647 PolarHBondContact O-N 3.04Å
646	A	41.7	Very low	55	Low	103 Å²	103	82.5 Å²	82.5	85%	0.851	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-49	129.1	179.4	0	0	0	0	0	111.2	D648	A646-D648 PolarHBondContact O-N 3.05Å
647	S	46.8	Very low	56.7	Low	82 Å²	82	84.1 Å²	84.1	57%	0.573	56%	0.561	S	S	*	*			trans	-66.4	97.9	-171.3	-53.9	0	0	0	0	111.8	G645 C649	G645-S647 PolarHBondContact O-N 3.04Å; S647-C649 PolarHBondContact O-N 2.97Å; S647-C649 VanDerWaalsContact O-N 3.13Å; S647-C649 PolarHBondContact O-SG 3.07Å; S647-C649 VanDerWaalsContact O-SG 3.37Å
648	D	70.8	Confident	58	Low	101 Å²	101	75 Å²	75	54%	0.54	53%	0.529	S	S	.	.			trans	-48.2	116.1	173.9	-115.4	-21.9	0	0	0	110.2	A646 T671 S672 F718	A646-D648 PolarHBondContact O-N 3.05Å; D648-T671 CarbonylContact O-C 3.1Å; D648-S672 PolarHBondContact O-N 3.07Å; D648-F718 HydrophobicContact CB-CE1 3.93Å; D648-F718 HydrophobicContact CB-CE2 4.1Å; D648-F718 HydrophobicContact CB-CZ 3.51Å
649	C	80.4	Confident	59.3	Low	64 Å²	64	74.2 Å²	74.2	43%	0.432	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	148.1	-175.1	61.1	0	0	0	0	112.3	S647 L669 V670 T671	S647-C649 PolarHBondContact O-N 2.97Å; S647-C649 VanDerWaalsContact O-N 3.13Å; S647-C649 PolarHBondContact O-SG 3.07Å; S647-C649 VanDerWaalsContact O-SG 3.37Å; C649-L669 HydrophobicContact CB-CD1 3.97Å; C649-L669 HydrophobicContact CB-CG 4.39Å; C649-V670 CarbonylContact C-O 3.54Å; C649-V670 VanDerWaalsContact CA-O 3.23Å; C649-V670 WeakPolarHBondContact CA-O 3.29Å; C649-T671 HydrophobicContact CB-CG2 4.18Å
650	R	83	Confident	60.4	Low	90 Å²	90	80.4 Å²	80.4	34%	0.34	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.5	-177.9	-73.9	170.4	-172.7	-179.3	2.8	109.6	V670 F718 M721	R650-V670 PolarHBondContact N-O 2.88Å; R650-V670 PolarHBondContact O-N 2.63Å; R650-F718 HydrophobicContact CB-CE2 4.34Å; R650-F718 HydrophobicContact CG-CD2 4.33Å; R650-F718 HydrophobicContact CG-CE2 3.75Å; R650-M721 HydrophobicContact CB-SD 4.48Å
651	I	87.5	Confident	60.8	Low	90 Å²	90	81.8 Å²	81.8	46%	0.462	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.4	171.1	-59.9	176.3	0	0	0	108.2	I668 L669	I651-I668 WeakPolarHBondContact CA-O 3.47Å; I651-L669 HydrophobicContact CG1-CD1 3.81Å
652	I	89.9	Confident	62	Low	0 Å²	0	81.4 Å²	81.4	0%	0	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	151.1	173	68.7	168.4	0	0	0	110.2	V654 S667 I668 V670 V679 M721 H726 F728	I652-V654 HydrophobicContact CD1-CG2 3.67Å; I652-V654 HydrophobicContact CG1-CG2 3.87Å; I652-S667 CarbonylContact O-C 3.6Å; I652-S667 WeakPolarHBondContact O-CA 3.4Å; I652-I668 HydrophobicContact CG1-CB 4.04Å; I652-I668 PolarHBondContact N-O 2.77Å; I652-I668 PolarHBondContact O-N 2.85Å; I652-V670 HydrophobicContact CD1-CG2 3.7Å; I652-V670 HydrophobicContact CG1-CG2 3.83Å; I652-V670 HydrophobicContact CG2-CG2 4.33Å; I652-V679 HydrophobicContact CD1-CG1 4.11Å; I652-M721 HydrophobicContact CG2-CE 3.94Å; I652-M721 HydrophobicContact CG2-SD 4.22Å; I652-H726 CarbonylContact C-O 3.58Å; I652-H726 WeakPolarHBondContact CA-O 3.48Å; I652-F728 HydrophobicContact CB-CD2 3.67Å; I652-F728 HydrophobicContact CB-CE2 3.63Å; I652-F728 HydrophobicContact CD1-CD1 4.41Å; I652-F728 HydrophobicContact CD1-CD2 3.82Å; I652-F728 HydrophobicContact CD1-CE1 4.5Å; I652-F728 HydrophobicContact CD1-CE2 3.96Å; I652-F728 HydrophobicContact CD1-CG 4.07Å; I652-F728 HydrophobicContact CD1-CZ 4.28Å; I652-F728 HydrophobicContact CG1-CD2 4.25Å; I652-F728 HydrophobicContact CG1-CE2 4.4Å; I652-F728 HydrophobicContact CG2-CD2 4.07Å; I652-F728 HydrophobicContact CG2-CE2 3.46Å; I652-F728 VanDerWaalsContact CG2-CE2 3.46Å; I652-F728 HydrophobicContact CG2-CZ 4.15Å
653	R	89.6	Confident	63.2	Low	127 Å²	127	77.6 Å²	77.6	48%	0.479	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	112.2	174.7	-60.1	-172.1	-63.6	-147.6	1.7	108.3	H726 D727 F728	R653-H726 PolarHBondContact N-O 3.47Å; R653-D727 IonicContact CZ-OD1 3.22Å; R653-D727 IonicContact CZ-OD2 2.97Å; R653-D727 IonicContact NE-OD1 3.7Å; R653-D727 PolarHBondContact NE-OD1 2.6Å; R653-D727 IonicContact NE-OD2 2.7Å; R653-D727 IonicContact NH2-OD1 3.12Å; R653-D727 PolarHBondContact NH2-OD1 3.18Å; R653-D727 IonicContact NH2-OD2 3.88Å; R653-D727 PolarHBondContact NH2-OD2 3.34Å; R653-F728 PolarHBondContact O-N 3.41Å
654	V	89.7	Confident	64.7	Low	0 Å²	0	77.8 Å²	77.8	0%	0	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	113	179.3	-164.2	0	0	0	0	109.9	I652 K666 I668 V683 L699 F728 L730	I652-V654 HydrophobicContact CD1-CG2 3.67Å; I652-V654 HydrophobicContact CG1-CG2 3.87Å; V654-K666 PolarHBondContact N-O 3.43Å; V654-K666 PolarHBondContact O-N 3.13Å; V654-I668 HydrophobicContact CG2-CB 4.46Å; V654-I668 HydrophobicContact CG2-CG1 3.8Å; V654-V683 HydrophobicContact CB-CG1 4.25Å; V654-V683 HydrophobicContact CB-CG2 3.87Å; V654-V683 HydrophobicContact CG1-CG1 3.91Å; V654-V683 HydrophobicContact CG1-CG2 3.86Å; V654-V683 HydrophobicContact CG2-CG2 3.8Å; V654-L699 HydrophobicContact CG1-CD1 3.9Å; V654-L699 HydrophobicContact CG2-CD1 4.34Å; V654-F728 CarbonylContact C-O 3.52Å; V654-F728 WeakPolarHBondContact CA-O 3.49Å; V654-F728 HydrophobicContact CB-CB 4.49Å; V654-F728 HydrophobicContact CG1-CB 4.28Å; V654-F728 HydrophobicContact CG2-CB 4.18Å; V654-L730 HydrophobicContact CG1-CB 3.94Å
655	Q	85.5	Confident	66.5	Low	34 Å²	34	77.3 Å²	77.3	16%	0.159	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	146.2	165.3	-167.5	179.1	-2.8	0	0	109	S663 Y665 F728 L729 L730	Q655-S663 PolarHBondContact NE2-OG 3.45Å; Q655-Y665 HydrophobicContact CB-CD1 3.74Å; Q655-Y665 HydrophobicContact CB-CE1 3.71Å; Q655-Y665 HydrophobicContact CB-CG 4.38Å; Q655-Y665 HydrophobicContact CG-CD1 4.15Å; Q655-Y665 HydrophobicContact CG-CE1 3.87Å; Q655-Y665 HydrophobicContact CG-CE2 4.29Å; Q655-Y665 PolarHBondContact OE1-OH 2.84Å; Q655-F728 PolarHBondContact N-O 2.96Å; Q655-L729 HydrophobicContact CB-CD1 4.17Å; Q655-L729 HydrophobicContact CG-CD1 4.26Å; Q655-L729 CarbonylContact O-C 3.48Å; Q655-L730 PolarHBondContact O-N 3.17Å
656	M	80.8	Confident	68.7	Low	0 Å²	0	77.6 Å²	77.6	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.3	167.3	-169.2	174.2	75.2	0	0	108.9	L658 V664 L684 N687 L730	M656-L658 HydrophobicContact CE-CD1 4Å; M656-L658 HydrophobicContact CE-CD2 3.96Å; M656-L658 HydrophobicContact CE-CG 3.83Å; M656-L658 PolarHBondContact O-N 3.49Å; M656-L658 VanDerWaalsContact O-N 3.17Å; M656-V664 PolarHBondContact N-O 3.23Å; M656-L684 HydrophobicContact SD-CD2 4.25Å; M656-N687 HydrophobicContact CE-CB 3.64Å; M656-N687 HydrophobicContact SD-CB 4.22Å; M656-L730 HydrophobicContact CG-CB 4.35Å; M656-L730 HydrophobicContact CG-CD2 4.28Å; M656-L730 HydrophobicContact SD-CD2 4.04Å
657	E	64.7	Low	70.8	Confident	113 Å²	113	76 Å²	76	53%	0.528	42%	0.419	S	S	.	.			trans	-70.9	106.1	168.1	-87.2	165.9	-179	0	0	108.9	L729	E657-L729 HydrophobicContact CG-CD1 4.06Å
658	L	57.2	Low	72.9	Confident	52 Å²	52	72.1 Å²	72.1	27%	0.272	39%	0.392	S	S	.	.			trans	-93.7	141.5	159.5	-65.4	116	0	0	0	107.2	M656 D661	M656-L658 HydrophobicContact CE-CD1 4Å; M656-L658 HydrophobicContact CE-CD2 3.96Å; M656-L658 HydrophobicContact CE-CG 3.83Å; M656-L658 PolarHBondContact O-N 3.49Å; M656-L658 VanDerWaalsContact O-N 3.17Å; L658-D661 HydrophobicContact CB-CB 4.31Å
659	G	55.2	Low	73.7	Confident	67 Å²	67	69.4 Å²	69.4	69%	0.691	38%	0.377	S	S	*	.	S	Bend	trans	-76.7	130	176.9	0	0	0	0	0	110.1	D661	G659-D661 PolarHBondContact O-N 3.41Å
660	E	50.3	Low	74.2	Confident	211 Å²	211	66.4 Å²	66.4	99%	0.986	36%	0.356	S	S	*	.	S	Bend	trans	60.1	-31.1	-179.7	-56.3	-166	147.5	0	0	116.7
661	D	46.9	Very low	74.4	Confident	123 Å²	123	63.9 Å²	63.9	66%	0.658	35%	0.351	S	S	*	.	S	Bend	trans	-78.7	133.4	168.7	-78.1	-39.8	0	0	0	112.4	L658 G659	L658-D661 HydrophobicContact CB-CB 4.31Å; G659-D661 PolarHBondContact O-N 3.41Å
662	G	52.2	Low	74.5	Confident	65 Å²	65	61 Å²	61	67%	0.67	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-57.3	134.8	-174.4	0	0	0	0	0	114.7	V664	G662-V664 PolarHBondContact O-N 2.89Å
663	S	56.4	Low	74.3	Confident	50 Å²	50	68.6 Å²	68.6	35%	0.35	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.9	119.9	-169.9	65.2	0	0	0	0	113.9	Q655	Q655-S663 PolarHBondContact NE2-OG 3.45Å
664	V	60.8	Low	74.3	Confident	62 Å²	62	63.4 Å²	63.4	38%	0.376	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-93.9	126.2	180	-175.6	0	0	0	0	110.9	M656 G662 K666	M656-V664 PolarHBondContact N-O 3.23Å; G662-V664 PolarHBondContact O-N 2.89Å; V664-K666 HydrophobicContact CG1-CD 4.19Å
665	Y	72.7	Confident	74.4	Confident	128 Å²	128	69.2 Å²	69.2	50%	0.502	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	136.5	172.7	-61.9	-101.5	0	0	0	110.8	Q655	Q655-Y665 HydrophobicContact CB-CD1 3.74Å; Q655-Y665 HydrophobicContact CB-CE1 3.71Å; Q655-Y665 HydrophobicContact CB-CG 4.38Å; Q655-Y665 HydrophobicContact CG-CD1 4.15Å; Q655-Y665 HydrophobicContact CG-CE1 3.87Å; Q655-Y665 HydrophobicContact CG-CE2 4.29Å; Q655-Y665 PolarHBondContact OE1-OH 2.84Å
666	K	79.9	Confident	74.6	Confident	68 Å²	68	67.7 Å²	67.7	30%	0.296	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.5	174.2	-57	-64.9	-175.4	175	0	110.7	V654 V664 K686 N687	V654-K666 PolarHBondContact N-O 3.43Å; V654-K666 PolarHBondContact O-N 3.13Å; V664-K666 HydrophobicContact CG1-CD 4.19Å; K666-K686 WeakPolarHBondContact CE-O 3.37Å; K666-K686 HydrophobicContact CG-CB 4.4Å; K666-K686 PolarHBondContact NZ-O 3.42Å; K666-N687 WeakPolarHBondContact CE-OD1 3.33Å; K666-N687 WeakPolarHBondContact CG-OD1 3.15Å
667	S	87.4	Confident	75	Confident	69 Å²	69	70 Å²	70	48%	0.483	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.5	172.8	-53.5	0	0	0	0	111.5	I652 K686	I652-S667 CarbonylContact O-C 3.6Å; I652-S667 WeakPolarHBondContact O-CA 3.4Å; S667-K686 PolarHBondContact O-NZ 3.16Å
668	I	90	Very high	76.1	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.8	177.9	-52.9	-67.5	0	0	0	109.3	I651 I652 V654 V670 V679 V683 K686	I651-I668 WeakPolarHBondContact CA-O 3.47Å; I652-I668 HydrophobicContact CG1-CB 4.04Å; I652-I668 PolarHBondContact N-O 2.77Å; I652-I668 PolarHBondContact O-N 2.85Å; V654-I668 HydrophobicContact CG2-CB 4.46Å; V654-I668 HydrophobicContact CG2-CG1 3.8Å; I668-V670 HydrophobicContact CG2-CG2 4.37Å; I668-V679 HydrophobicContact CG2-CG1 4.19Å; I668-V683 HydrophobicContact CD1-CG2 3.85Å; I668-V683 HydrophobicContact CG1-CG2 3.67Å; I668-K686 HydrophobicContact CD1-CD 3.79Å; I668-K686 HydrophobicContact CD1-CG 4.5Å
669	L	88.3	Confident	77.7	Confident	44 Å²	44	65 Å²	65	23%	0.23	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.4	168.5	-174.1	70.9	0	0	0	109.2	S622 C649 I651 R682	S622-L669 WeakPolarHBondContact OG-CD2 3.34Å; C649-L669 HydrophobicContact CB-CD1 3.97Å; C649-L669 HydrophobicContact CB-CG 4.39Å; I651-L669 HydrophobicContact CG1-CD1 3.81Å; L669-R682 PolarHBondContact O-NH1 3.15Å; L669-R682 PolarHBondContact O-NH2 3.01Å
670	V	89.4	Confident	79.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.3	175.5	175.7	0	0	0	0	108.1	C649 R650 I652 I668 D674 V679 V717 F718	C649-V670 CarbonylContact C-O 3.54Å; C649-V670 VanDerWaalsContact CA-O 3.23Å; C649-V670 WeakPolarHBondContact CA-O 3.29Å; R650-V670 PolarHBondContact N-O 2.88Å; R650-V670 PolarHBondContact O-N 2.63Å; I652-V670 HydrophobicContact CD1-CG2 3.7Å; I652-V670 HydrophobicContact CG1-CG2 3.83Å; I652-V670 HydrophobicContact CG2-CG2 4.33Å; I668-V670 HydrophobicContact CG2-CG2 4.37Å; V670-D674 HydrophobicContact CG1-CB 3.99Å; V670-V679 HydrophobicContact CG2-CG1 4.22Å; V670-V679 HydrophobicContact CG2-CG2 3.98Å; V670-V717 HydrophobicContact CG1-CB 3.83Å; V670-V717 HydrophobicContact CG1-CG1 4.11Å; V670-V717 HydrophobicContact CG2-CG1 4.4Å; V670-F718 HydrophobicContact CG1-CB 4.08Å
671	T	89.1	Confident	81	Confident	37 Å²	37	53.8 Å²	53.8	23%	0.227	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	163.8	177.6	63.2	0	0	0	0	111.1	D648 C649 Q673 D674 F718	D648-T671 CarbonylContact O-C 3.1Å; C649-T671 HydrophobicContact CB-CG2 4.18Å; T671-Q673 PolarHBondContact O-N 3.48Å; T671-Q673 PolarHBondContact OG1-N 3.15Å; T671-D674 PolarHBondContact N-OD2 3.09Å; T671-D674 WeakPolarHBondContact O-CB 3.48Å; T671-D674 PolarHBondContact O-N 2.95Å; T671-D674 PolarHBondContact OG1-OD2 3.5Å; T671-F718 WeakPolarHBondContact O-CB 3.34Å
672	S	88	Confident	83	Confident	29 Å²	29	52 Å²	52	20%	0.203	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-6.7	169.9	58.5	0	0	0	0	115.1	D648 N716	D648-S672 PolarHBondContact O-N 3.07Å; S672-N716 PolarHBondContact O-ND2 2.73Å
673	Q	86.1	Confident	84.7	Confident	160 Å²	160	48.9 Å²	48.9	75%	0.748	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-9.9	175.1	-58.2	-176.8	7.7	0	0	113.5	T671 K675	T671-Q673 PolarHBondContact O-N 3.48Å; T671-Q673 PolarHBondContact OG1-N 3.15Å; Q673-K675 PolarHBondContact O-N 3.02Å
674	D	90.2	Very high	86	Confident	18 Å²	18	46.5 Å²	46.5	10%	0.096	24%	0.24	C	C	.	.			trans	-81	115.5	-169.3	-89.3	-63	0	0	0	114.3	V670 T671 V679 R682 N716 V717	V670-D674 HydrophobicContact CG1-CB 3.99Å; T671-D674 PolarHBondContact N-OD2 3.09Å; T671-D674 WeakPolarHBondContact O-CB 3.48Å; T671-D674 PolarHBondContact O-N 2.95Å; T671-D674 PolarHBondContact OG1-OD2 3.5Å; D674-V679 HydrophobicContact CB-CG2 3.94Å; D674-R682 IonicContact OD1-CZ 2.93Å; D674-R682 IonicContact OD1-NE 3.45Å; D674-R682 IonicContact OD1-NH2 2.7Å; D674-R682 PolarHBondContact OD1-NH2 3.18Å; D674-R682 IonicContact OD2-CZ 3.22Å; D674-R682 IonicContact OD2-NH2 3.36Å; D674-R682 PolarHBondContact OD2-NH2 3.33Å; D674-N716 CarbonylContact O-C 3.39Å; D674-N716 WeakPolarHBondContact O-CA 3.31Å; D674-N716 PolarHBondContact O-OD1 3.34Å; D674-V717 PolarHBondContact O-N 2.99Å
675	K	90.9	Very high	87.1	Confident	123 Å²	123	51 Å²	51	54%	0.535	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-84.9	154	167.8	-64	-176.6	-177.9	177.9	0	111.8	Q673 P677 S678 V679 A715	Q673-K675 PolarHBondContact O-N 3.02Å; K675-P677 VanDerWaalsContact C-CD 3.42Å; K675-P677 VanDerWaalsContact C-N 3.35Å; K675-S678 WeakPolarHBondContact O-CB 3.46Å; K675-S678 PolarHBondContact O-N 2.82Å; K675-V679 PolarHBondContact O-N 3.29Å; K675-A715 CarbonylContact C-O 3.53Å; K675-A715 VanDerWaalsContact CA-O 3.29Å; K675-A715 WeakPolarHBondContact CA-O 3.49Å
676	A	89.7	Confident	87.5	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-48.4	-43.7	-177.5	0	0	0	0	0	114.8	S678 V679 I680 I711 A715 V717	A676-S678 VanDerWaalsContact C-N 3.33Å; A676-S678 PolarHBondContact O-N 2.88Å; A676-V679 PolarHBondContact O-N 3.28Å; A676-V679 VanDerWaalsContact O-N 3.15Å; A676-I680 WeakPolarHBondContact O-CB 3.46Å; A676-I680 WeakPolarHBondContact O-CG1 3.22Å; A676-I680 PolarHBondContact O-N 3.04Å; A676-I711 HydrophobicContact CB-CG2 4.22Å; A676-A715 PolarHBondContact N-O 3.28Å; A676-V717 VanDerWaalsContact CA-CG2 3.5Å; A676-V717 HydrophobicContact CB-CG2 4.02Å
677	P	89.6	Confident	87.4	Confident	50 Å²	50	47.8 Å²	47.8	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-35.6	178.9	-22.4	35.8	0	0	0	113.2	K675 V679 I680 S681 V694 A713	K675-P677 VanDerWaalsContact C-CD 3.42Å; K675-P677 VanDerWaalsContact C-N 3.35Å; P677-V679 VanDerWaalsContact C-N 3.31Å; P677-V679 PolarHBondContact O-N 3.45Å; P677-I680 PolarHBondContact O-N 3.05Å; P677-S681 WeakPolarHBondContact O-CB 3.25Å; P677-S681 PolarHBondContact O-N 3.26Å; P677-V694 HydrophobicContact CB-CG1 3.94Å; P677-A713 VanDerWaalsContact CD-O 3.23Å; P677-A713 WeakPolarHBondContact CD-O 3.48Å; P677-A713 VanDerWaalsContact CG-O 3.23Å; P677-A713 WeakPolarHBondContact CG-O 3.31Å
678	S	88.5	Confident	87	Confident	60 Å²	60	52.1 Å²	52.1	42%	0.42	26%	0.263	S	S	.	.	H	α-helix	trans	-69.7	-28.2	176.8	-49.7	0	0	0	0	112.5	K675 A676 R682	K675-S678 WeakPolarHBondContact O-CB 3.46Å; K675-S678 PolarHBondContact O-N 2.82Å; A676-S678 VanDerWaalsContact C-N 3.33Å; A676-S678 PolarHBondContact O-N 2.88Å; S678-R682 VanDerWaalsContact O-CG 3.31Å; S678-R682 WeakPolarHBondContact O-CG 3.47Å; S678-R682 PolarHBondContact O-NE 3.27Å
679	V	89.5	Confident	86.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-77	-47.7	171.7	180	0	0	0	0	110	I652 I668 V670 D674 K675 A676 P677 S681 R682 V683 L699 V717	I652-V679 HydrophobicContact CD1-CG1 4.11Å; I668-V679 HydrophobicContact CG2-CG1 4.19Å; V670-V679 HydrophobicContact CG2-CG1 4.22Å; V670-V679 HydrophobicContact CG2-CG2 3.98Å; D674-V679 HydrophobicContact CB-CG2 3.94Å; K675-V679 PolarHBondContact O-N 3.29Å; A676-V679 PolarHBondContact O-N 3.28Å; A676-V679 VanDerWaalsContact O-N 3.15Å; P677-V679 VanDerWaalsContact C-N 3.31Å; P677-V679 PolarHBondContact O-N 3.45Å; V679-S681 PolarHBondContact O-N 3.18Å; V679-R682 PolarHBondContact O-N 3.46Å; V679-R682 VanDerWaalsContact O-N 3.13Å; V679-V683 WeakPolarHBondContact O-CG2 3.45Å; V679-V683 PolarHBondContact O-N 2.85Å; V679-L699 HydrophobicContact CB-CD2 4.26Å; V679-L699 HydrophobicContact CG1-CD2 3.76Å; V679-V717 HydrophobicContact CB-CG2 4.2Å; V679-V717 HydrophobicContact CG2-CB 4.15Å; V679-V717 HydrophobicContact CG2-CG2 3.66Å
680	I	89.3	Confident	85.6	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-58.3	-47.2	179.2	-67.3	165	0	0	0	111.4	A676 P677 R682 V683 L684 V694 L699 L730	A676-I680 WeakPolarHBondContact O-CB 3.46Å; A676-I680 WeakPolarHBondContact O-CG1 3.22Å; A676-I680 PolarHBondContact O-N 3.04Å; P677-I680 PolarHBondContact O-N 3.05Å; I680-R682 VanDerWaalsContact C-N 3.31Å; I680-R682 PolarHBondContact O-N 2.88Å; I680-V683 WeakPolarHBondContact O-CB 3.49Å; I680-V683 PolarHBondContact O-N 3.42Å; I680-V683 VanDerWaalsContact O-N 3.11Å; I680-L684 HydrophobicContact CG2-CD1 4Å; I680-L684 HydrophobicContact CG2-CG 4.5Å; I680-L684 WeakPolarHBondContact O-CG 3.33Å; I680-L684 PolarHBondContact O-N 2.9Å; I680-V694 HydrophobicContact CB-CG1 4.32Å; I680-V694 HydrophobicContact CG2-CB 4.36Å; I680-V694 HydrophobicContact CG2-CG1 4Å; I680-V694 HydrophobicContact CG2-CG2 4.21Å; I680-L699 HydrophobicContact CD1-CB 4.21Å; I680-L699 HydrophobicContact CG1-CB 4.06Å; I680-L730 HydrophobicContact CB-CD1 4.19Å; I680-L730 HydrophobicContact CG1-CD1 3.72Å; I680-L730 HydrophobicContact CG2-CD1 3.86Å
681	S	86.9	Confident	84.8	Confident	35 Å²	35	61.2 Å²	61.2	25%	0.245	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-42.4	175.4	172	0	0	0	0	112.1	P677 V679 V683 L684 K685 S691	P677-S681 WeakPolarHBondContact O-CB 3.25Å; P677-S681 PolarHBondContact O-N 3.26Å; V679-S681 PolarHBondContact O-N 3.18Å; S681-V683 VanDerWaalsContact C-N 3.34Å; S681-V683 PolarHBondContact O-N 2.67Å; S681-L684 PolarHBondContact O-N 2.97Å; S681-K685 WeakPolarHBondContact O-CB 3.29Å; S681-K685 PolarHBondContact O-N 3.01Å; S681-S691 PolarHBondContact OG-OG 2.92Å
682	R	88.1	Confident	84	Confident	84 Å²	84	63.2 Å²	63.2	32%	0.317	33%	0.328	S	S	.	.	H	α-helix	trans	-69.6	-28.8	177.7	-70.1	-175.4	-65.1	142.1	0.2	112.7	L669 D674 S678 V679 I680 K686	L669-R682 PolarHBondContact O-NH1 3.15Å; L669-R682 PolarHBondContact O-NH2 3.01Å; D674-R682 IonicContact OD1-CZ 2.93Å; D674-R682 IonicContact OD1-NE 3.45Å; D674-R682 IonicContact OD1-NH2 2.7Å; D674-R682 PolarHBondContact OD1-NH2 3.18Å; D674-R682 IonicContact OD2-CZ 3.22Å; D674-R682 IonicContact OD2-NH2 3.36Å; D674-R682 PolarHBondContact OD2-NH2 3.33Å; S678-R682 VanDerWaalsContact O-CG 3.31Å; S678-R682 WeakPolarHBondContact O-CG 3.47Å; S678-R682 PolarHBondContact O-NE 3.27Å; V679-R682 PolarHBondContact O-N 3.46Å; V679-R682 VanDerWaalsContact O-N 3.13Å; I680-R682 VanDerWaalsContact C-N 3.31Å; I680-R682 PolarHBondContact O-N 2.88Å; R682-K686 WeakPolarHBondContact O-CB 3.44Å; R682-K686 WeakPolarHBondContact O-CG 3.28Å; R682-K686 PolarHBondContact O-N 3.07Å; R682-K686 VanDerWaalsContact O-N 3.13Å
683	V	87.2	Confident	83.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-69.9	-47.6	170.5	178.9	0	0	0	0	111	V654 I668 V679 I680 S681 K686 N687 L730	V654-V683 HydrophobicContact CB-CG1 4.25Å; V654-V683 HydrophobicContact CB-CG2 3.87Å; V654-V683 HydrophobicContact CG1-CG1 3.91Å; V654-V683 HydrophobicContact CG1-CG2 3.86Å; V654-V683 HydrophobicContact CG2-CG2 3.8Å; I668-V683 HydrophobicContact CD1-CG2 3.85Å; I668-V683 HydrophobicContact CG1-CG2 3.67Å; V679-V683 WeakPolarHBondContact O-CG2 3.45Å; V679-V683 PolarHBondContact O-N 2.85Å; I680-V683 WeakPolarHBondContact O-CB 3.49Å; I680-V683 PolarHBondContact O-N 3.42Å; I680-V683 VanDerWaalsContact O-N 3.11Å; S681-V683 VanDerWaalsContact C-N 3.34Å; S681-V683 PolarHBondContact O-N 2.67Å; V683-K686 PolarHBondContact O-N 2.9Å; V683-N687 PolarHBondContact O-N 3.11Å; V683-N687 VanDerWaalsContact O-N 3.17Å; V683-N687 PolarHBondContact O-ND2 3.23Å; V683-L730 HydrophobicContact CB-CD2 4.24Å; V683-L730 HydrophobicContact CG1-CB 4.23Å; V683-L730 HydrophobicContact CG1-CD2 3.76Å; V683-L730 HydrophobicContact CG1-CG 4.46Å
684	L	85.5	Confident	83.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-47.4	178.4	-70.3	168.5	0	0	0	111.1	M656 I680 S681 K686 N687 N688 R689 V693 V694 Y697 L730	M656-L684 HydrophobicContact SD-CD2 4.25Å; I680-L684 HydrophobicContact CG2-CD1 4Å; I680-L684 HydrophobicContact CG2-CG 4.5Å; I680-L684 WeakPolarHBondContact O-CG 3.33Å; I680-L684 PolarHBondContact O-N 2.9Å; S681-L684 PolarHBondContact O-N 2.97Å; L684-K686 VanDerWaalsContact C-N 3.34Å; L684-K686 PolarHBondContact O-N 3.19Å; L684-N687 CarbonylContact O-C 3.59Å; L684-N687 WeakPolarHBondContact O-CA 3.45Å; L684-N687 PolarHBondContact O-N 3.31Å; L684-N688 PolarHBondContact O-N 2.9Å; L684-R689 CarbonylContact C-O 3.51Å; L684-R689 HydrophobicContact CB-CB 4.27Å; L684-R689 HydrophobicContact CD2-CB 3.98Å; L684-R689 PolarHBondContact O-N 3.38Å; L684-V693 HydrophobicContact CD1-CG2 4.22Å; L684-V694 HydrophobicContact CD1-CG2 3.77Å; L684-Y697 HydrophobicContact CD1-CD2 4.29Å; L684-Y697 HydrophobicContact CD2-CD2 4.26Å; L684-Y697 HydrophobicContact CD2-CE1 4.49Å; L684-Y697 HydrophobicContact CD2-CE2 4.11Å; L684-L730 HydrophobicContact CD2-CD2 3.88Å; L684-L730 HydrophobicContact CG-CD2 4.08Å
685	K	81.9	Confident	82.7	Confident	156 Å²	156	61.3 Å²	61.3	68%	0.678	33%	0.331	S	S	*	.	H	α-helix	trans	-62.2	-34.9	176.7	-168.9	170.2	-176.2	172.8	0	113.1	S681 N687 N688	S681-K685 WeakPolarHBondContact O-CB 3.29Å; S681-K685 PolarHBondContact O-N 3.01Å; K685-N687 PolarHBondContact O-N 2.68Å; K685-N688 PolarHBondContact O-N 2.86Å
686	K	82.4	Confident	82.3	Confident	105 Å²	105	58 Å²	58	46%	0.457	32%	0.318	S	S	.	.	H	α-helix	trans	-75.1	-8.2	172.6	-78	-162	-170.2	-170.9	0	114.5	K666 S667 I668 R682 V683 L684	K666-K686 WeakPolarHBondContact CE-O 3.37Å; K666-K686 HydrophobicContact CG-CB 4.4Å; K666-K686 PolarHBondContact NZ-O 3.42Å; S667-K686 PolarHBondContact O-NZ 3.16Å; I668-K686 HydrophobicContact CD1-CD 3.79Å; I668-K686 HydrophobicContact CD1-CG 4.5Å; R682-K686 WeakPolarHBondContact O-CB 3.44Å; R682-K686 WeakPolarHBondContact O-CG 3.28Å; R682-K686 PolarHBondContact O-N 3.07Å; R682-K686 VanDerWaalsContact O-N 3.13Å; V683-K686 PolarHBondContact O-N 2.9Å; L684-K686 VanDerWaalsContact C-N 3.34Å; L684-K686 PolarHBondContact O-N 3.19Å
687	N	77.9	Confident	82.1	Confident	25 Å²	25	59 Å²	59	13%	0.134	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	20.7	175.1	-70.5	-63	0	0	0	112.2	M656 K666 V683 L684 K685 R689	M656-N687 HydrophobicContact CE-CB 3.64Å; M656-N687 HydrophobicContact SD-CB 4.22Å; K666-N687 WeakPolarHBondContact CE-OD1 3.33Å; K666-N687 WeakPolarHBondContact CG-OD1 3.15Å; V683-N687 PolarHBondContact O-N 3.11Å; V683-N687 VanDerWaalsContact O-N 3.17Å; V683-N687 PolarHBondContact O-ND2 3.23Å; L684-N687 CarbonylContact O-C 3.59Å; L684-N687 WeakPolarHBondContact O-CA 3.45Å; L684-N687 PolarHBondContact O-N 3.31Å; K685-N687 PolarHBondContact O-N 2.68Å; N687-R689 PolarHBondContact O-N 3.1Å; N687-R689 VanDerWaalsContact O-N 3.14Å
688	N	77.4	Confident	82.1	Confident	160 Å²	160	58.6 Å²	58.6	86%	0.856	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	29.2	178.3	-56.7	-6.4	0	0	0	114.3	L684 K685	L684-N688 PolarHBondContact O-N 2.9Å; K685-N688 PolarHBondContact O-N 2.86Å
689	R	75.4	Confident	82.3	Confident	85 Å²	85	55.8 Å²	55.8	32%	0.321	30%	0.295	S	S	.	.			trans	-102.7	150.1	171.9	-70.7	-170.8	174.9	179.3	1.3	110.8	L684 N687 Y697	L684-R689 CarbonylContact C-O 3.51Å; L684-R689 HydrophobicContact CB-CB 4.27Å; L684-R689 HydrophobicContact CD2-CB 3.98Å; L684-R689 PolarHBondContact O-N 3.38Å; N687-R689 PolarHBondContact O-N 3.1Å; N687-R689 VanDerWaalsContact O-N 3.14Å; R689-Y697 PolarHBondContact NH1-OH 2.89Å
690	D	74.5	Confident	82.3	Confident	109 Å²	109	55.8 Å²	55.8	58%	0.583	30%	0.295	S	S	*	.			trans	-58.2	145.1	175.4	-171.2	-0.3	0	0	0	111.2	A692 V693	D690-A692 PolarHBondContact OD1-N 3.28Å; D690-A692 VanDerWaalsContact OD2-CB 3.27Å; D690-A692 WeakPolarHBondContact OD2-CB 3.4Å; D690-V693 WeakPolarHBondContact O-CG2 3.47Å
691	S	73.6	Confident	82.5	Confident	42 Å²	42	55.4 Å²	55.4	29%	0.294	29%	0.294	S	S	.	.	S	Bend	trans	-84.8	-10.2	172	-68.7	0	0	0	0	113.4	S681 V693 V694	S681-S691 PolarHBondContact OG-OG 2.92Å; S691-V693 PolarHBondContact O-N 3.22Å; S691-V694 WeakPolarHBondContact O-CG2 3.29Å; S691-V694 PolarHBondContact O-N 3Å
692	A	72.3	Confident	82.6	Confident	78 Å²	78	56.2 Å²	56.2	65%	0.645	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-60.4	-29.6	173.6	0	0	0	0	0	112.9	D690 V694	D690-A692 PolarHBondContact OD1-N 3.28Å; D690-A692 VanDerWaalsContact OD2-CB 3.27Å; D690-A692 WeakPolarHBondContact OD2-CB 3.4Å; A692-V694 VanDerWaalsContact C-N 3.33Å; A692-V694 PolarHBondContact O-N 3.12Å
693	V	78.8	Confident	82.6	Confident	49 Å²	49	53.5 Å²	53.5	30%	0.297	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-85.6	8.8	-178.3	-61.4	0	0	0	0	114.8	L684 D690 S691 S695 E696 Y697	L684-V693 HydrophobicContact CD1-CG2 4.22Å; D690-V693 WeakPolarHBondContact O-CG2 3.47Å; S691-V693 PolarHBondContact O-N 3.22Å; V693-S695 PolarHBondContact O-N 3.46Å; V693-E696 WeakPolarHBondContact O-CB 3.1Å; V693-E696 PolarHBondContact O-N 3.01Å; V693-Y697 HydrophobicContact CB-CE2 4.26Å; V693-Y697 HydrophobicContact CG2-CD2 4.4Å; V693-Y697 HydrophobicContact CG2-CE2 3.81Å; V693-Y697 WeakPolarHBondContact O-CD2 3.43Å
694	V	77.9	Confident	82.2	Confident	22 Å²	22	57.1 Å²	57.1	13%	0.133	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-50.3	-37	-178.8	163.5	0	0	0	0	113.3	P677 I680 L684 S691 A692 E696 Y697	P677-V694 HydrophobicContact CB-CG1 3.94Å; I680-V694 HydrophobicContact CB-CG1 4.32Å; I680-V694 HydrophobicContact CG2-CB 4.36Å; I680-V694 HydrophobicContact CG2-CG1 4Å; I680-V694 HydrophobicContact CG2-CG2 4.21Å; L684-V694 HydrophobicContact CD1-CG2 3.77Å; S691-V694 WeakPolarHBondContact O-CG2 3.29Å; S691-V694 PolarHBondContact O-N 3Å; A692-V694 VanDerWaalsContact C-N 3.33Å; A692-V694 PolarHBondContact O-N 3.12Å; V694-E696 PolarHBondContact O-N 3.48Å; V694-Y697 PolarHBondContact O-N 3.35Å
695	S	79.4	Confident	81.8	Confident	97 Å²	97	60.2 Å²	60.2	68%	0.678	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-65.7	-20.7	179.2	-56.8	0	0	0	0	114.5	V693 R733	V693-S695 PolarHBondContact O-N 3.46Å; S695-R733 WeakPolarHBondContact O-CD 3.43Å; S695-R733 PolarHBondContact O-NH1 3.04Å; S695-R733 VanDerWaalsContact O-NH1 3.12Å
696	E	82.6	Confident	81.3	Confident	53 Å²	53	62.5 Å²	62.5	25%	0.248	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-86.1	-0.9	177.6	-60.3	-151.5	138.3	0	0	113.8	V693 V694 Q732 R733 R735	V693-E696 WeakPolarHBondContact O-CB 3.1Å; V693-E696 PolarHBondContact O-N 3.01Å; V694-E696 PolarHBondContact O-N 3.48Å; E696-Q732 CarbonylContact O-C 3.49Å; E696-Q732 WeakPolarHBondContact O-CG 3.39Å; E696-Q732 PolarHBondContact OE2-NE2 2.92Å; E696-R733 WeakPolarHBondContact O-CB 3.45Å; E696-R733 PolarHBondContact O-N 2.99Å; E696-R735 IonicContact OE1-CZ 3.33Å; E696-R735 IonicContact OE1-NE 3.13Å; E696-R735 PolarHBondContact OE1-NE 3.09Å; E696-R735 VanDerWaalsContact OE1-NE 3.13Å; E696-R735 IonicContact OE1-NH2 2.68Å; E696-R735 PolarHBondContact OE1-NH2 2.85Å
697	Y	85.5	Confident	81.2	Confident	21 Å²	21	65 Å²	65	8%	0.082	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.2	-179	-67.8	-98.4	0	0	0	112.3	L684 R689 V693 V694 L730 R731 Q732 R733	L684-Y697 HydrophobicContact CD1-CD2 4.29Å; L684-Y697 HydrophobicContact CD2-CD2 4.26Å; L684-Y697 HydrophobicContact CD2-CE1 4.49Å; L684-Y697 HydrophobicContact CD2-CE2 4.11Å; R689-Y697 PolarHBondContact NH1-OH 2.89Å; V693-Y697 HydrophobicContact CB-CE2 4.26Å; V693-Y697 HydrophobicContact CG2-CD2 4.4Å; V693-Y697 HydrophobicContact CG2-CE2 3.81Å; V693-Y697 WeakPolarHBondContact O-CD2 3.43Å; V694-Y697 PolarHBondContact O-N 3.35Å; Y697-L730 HydrophobicContact CD1-CD2 3.89Å; Y697-L730 HydrophobicContact CD1-CG 3.93Å; Y697-L730 HydrophobicContact CG-CD2 4.23Å; Y697-L730 HydrophobicContact CG-CG 4.35Å; Y697-R731 WeakPolarHBondContact CA-O 3.27Å; Y697-Q732 HydrophobicContact CD1-CB 4.15Å; Y697-Q732 HydrophobicContact CD1-CG 4.48Å; Y697-Q732 HydrophobicContact CE1-CB 3.93Å; Y697-Q732 HydrophobicContact CE1-CG 4.19Å; Y697-R733 WeakPolarHBondContact O-CD 3.27Å
698	E	90	Very high	81.8	Confident	43 Å²	43	68.6 Å²	68.6	20%	0.201	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.5	173.2	59.8	-175.3	-150.5	0	0	110.4	V700 T710 R731 R733	E698-V700 HydrophobicContact CG-CG2 4.23Å; E698-T710 HydrophobicContact CB-CG2 4.34Å; E698-R731 HydrophobicContact CG-CB 4.1Å; E698-R731 PolarHBondContact N-O 3.24Å; E698-R731 PolarHBondContact O-N 3.13Å; E698-R731 IonicContact OE1-CZ 3.92Å; E698-R731 VanDerWaalsContact OE1-CZ 3.3Å; E698-R731 IonicContact OE1-NE 3.79Å; E698-R731 PolarHBondContact OE1-NE 2.77Å; E698-R731 IonicContact OE1-NH2 3.73Å; E698-R731 PolarHBondContact OE1-NH2 3.32Å; E698-R733 HydrophobicContact CB-CG 3.78Å; E698-R733 HydrophobicContact CG-CG 3.88Å
699	L	91.6	Very high	82.3	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.4	178.9	-177.7	66	0	0	0	108.5	V654 V679 I680 I711 V717 F728	V654-L699 HydrophobicContact CG1-CD1 3.9Å; V654-L699 HydrophobicContact CG2-CD1 4.34Å; V679-L699 HydrophobicContact CB-CD2 4.26Å; V679-L699 HydrophobicContact CG1-CD2 3.76Å; I680-L699 HydrophobicContact CD1-CB 4.21Å; I680-L699 HydrophobicContact CG1-CB 4.06Å; L699-I711 WeakPolarHBondContact O-CB 3.45Å; L699-I711 WeakPolarHBondContact O-CG1 3.37Å; L699-I711 PolarHBondContact O-N 2.73Å; L699-V717 HydrophobicContact CD2-CG1 3.96Å; L699-V717 HydrophobicContact CD2-CG2 4.11Å; L699-F728 HydrophobicContact CD1-CB 3.96Å; L699-F728 HydrophobicContact CD1-CD1 3.92Å; L699-F728 HydrophobicContact CD1-CG 4.29Å; L699-F728 HydrophobicContact CD2-CD1 4.24Å; L699-F728 HydrophobicContact CD2-CE1 4.46Å; L699-F728 HydrophobicContact CG-CD1 3.81Å; L699-F728 HydrophobicContact CG-CE1 4.4Å
700	V	91.1	Very high	83	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.4	-176.5	-174.4	0	0	0	0	108.7	E698 E708 L709 T710 F728 L729 R731	E698-V700 HydrophobicContact CG-CG2 4.23Å; V700-E708 HydrophobicContact CG1-CB 3.68Å; V700-E708 HydrophobicContact CG1-CG 3.89Å; V700-L709 CarbonylContact C-O 3.32Å; V700-T710 HydrophobicContact CG2-CG2 4.37Å; V700-F728 CarbonylContact O-C 3.57Å; V700-F728 WeakPolarHBondContact O-CA 3.43Å; V700-F728 VanDerWaalsContact O-CB 3.31Å; V700-F728 WeakPolarHBondContact O-CB 3.17Å; V700-F728 WeakPolarHBondContact O-CD1 3.18Å; V700-L729 HydrophobicContact CB-CB 4.46Å; V700-L729 PolarHBondContact N-O 3.43Å; V700-L729 PolarHBondContact O-N 2.99Å; V700-R731 HydrophobicContact CG2-CB 4.45Å
701	Q	92.4	Very high	83.8	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.9	172.3	-164.9	177	7.8	0	0	109.9	L703 E708 L709 M721 D722 S725 D727 F728	Q701-L703 HydrophobicContact CB-CD2 4.48Å; Q701-L703 HydrophobicContact CG-CD2 3.89Å; Q701-E708 WeakPolarHBondContact O-CA 3.42Å; Q701-L709 HydrophobicContact CB-CB 4.26Å; Q701-L709 PolarHBondContact N-O 2.93Å; Q701-L709 PolarHBondContact O-N 3.2Å; Q701-M721 VanDerWaalsContact OE1-CA 3.31Å; Q701-D722 PolarHBondContact NE2-O 2.77Å; Q701-S725 PolarHBondContact NE2-O 3.03Å; Q701-D727 WeakPolarHBondContact CG-O 3.3Å; Q701-F728 HydrophobicContact CB-CD1 3.73Å; Q701-F728 HydrophobicContact CB-CE1 3.51Å; Q701-F728 HydrophobicContact CB-CG 4.37Å; Q701-F728 HydrophobicContact CB-CZ 3.94Å; Q701-F728 HydrophobicContact CG-CD1 4.08Å; Q701-F728 HydrophobicContact CG-CD2 4.23Å; Q701-F728 HydrophobicContact CG-CE1 3.7Å; Q701-F728 HydrophobicContact CG-CE2 3.83Å; Q701-F728 HydrophobicContact CG-CG 4.35Å; Q701-F728 HydrophobicContact CG-CZ 3.57Å
702	L	89.6	Confident	84.5	Confident	52 Å²	52	59.5 Å²	59.5	27%	0.272	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	109.4	179.8	-56.3	179.7	0	0	0	109	E708 S725 D727 L729	L702-E708 HydrophobicContact CD2-CG 4.25Å; L702-S725 WeakPolarHBondContact O-CB 3.47Å; L702-S725 PolarHBondContact O-OG 3.03Å; L702-D727 HydrophobicContact CB-CB 4.26Å; L702-D727 PolarHBondContact N-O 3.15Å; L702-L729 HydrophobicContact CD1-CB 4.45Å; L702-L729 HydrophobicContact CD2-CB 4.23Å; L702-L729 HydrophobicContact CG-CB 4.45Å
703	L	87.1	Confident	84.9	Confident	27 Å²	27	58.8 Å²	58.8	14%	0.141	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	157	-174.5	-54.8	-178.6	0	0	0	112.1	Q701 G705 R707 L709 D722	Q701-L703 HydrophobicContact CB-CD2 4.48Å; Q701-L703 HydrophobicContact CG-CD2 3.89Å; L703-G705 PolarHBondContact O-N 2.87Å; L703-R707 WeakPolarHBondContact CA-O 3.34Å; L703-R707 HydrophobicContact CB-CB 4.16Å; L703-R707 VanDerWaalsContact CB-O 3.32Å; L703-R707 WeakPolarHBondContact CB-O 3.32Å; L703-R707 PolarHBondContact N-O 3.47Å; L703-L709 HydrophobicContact CD1-CB 3.98Å; L703-L709 HydrophobicContact CG-CB 4.4Å; L703-D722 HydrophobicContact CD2-CB 3.66Å
704	P	79.1	Confident	85	Confident	75 Å²	75	61.3 Å²	61.3	49%	0.487	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	131.1	178.6	-25.8	35.5	0	0	0	113.1	R707	P704-R707 PolarHBondContact O-NE 3Å; P704-R707 PolarHBondContact O-NH2 3.06Å
705	G	78.1	Confident	85.5	Confident	66 Å²	66	61.4 Å²	61.4	68%	0.68	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	46	-177.4	0	0	0	0	0	114	L703 R707	L703-G705 PolarHBondContact O-N 2.87Å; G705-R707 PolarHBondContact O-N 2.91Å; G705-R707 VanDerWaalsContact O-N 3.09Å
706	E	70.6	Confident	86	Confident	204 Å²	204	58.5 Å²	58.5	95%	0.953	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	29.2	173.3	-58.3	-173.6	163.6	0	0	115.1
707	R	80.3	Confident	86.3	Confident	158 Å²	158	56 Å²	56	60%	0.596	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.1	178.4	-73.9	175	-64.6	160.5	4.5	110.7	L703 P704 G705	L703-R707 WeakPolarHBondContact CA-O 3.34Å; L703-R707 HydrophobicContact CB-CB 4.16Å; L703-R707 VanDerWaalsContact CB-O 3.32Å; L703-R707 WeakPolarHBondContact CB-O 3.32Å; L703-R707 PolarHBondContact N-O 3.47Å; P704-R707 PolarHBondContact O-NE 3Å; P704-R707 PolarHBondContact O-NH2 3.06Å; G705-R707 PolarHBondContact O-N 2.91Å; G705-R707 VanDerWaalsContact O-N 3.09Å
708	E	89.8	Confident	86.5	Confident	99 Å²	99	55.5 Å²	55.5	46%	0.463	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	141.1	175.1	-70.4	-169.9	171.4	0	0	111.8	V700 Q701 L702 R731	V700-E708 HydrophobicContact CG1-CB 3.68Å; V700-E708 HydrophobicContact CG1-CG 3.89Å; Q701-E708 WeakPolarHBondContact O-CA 3.42Å; L702-E708 HydrophobicContact CD2-CG 4.25Å; E708-R731 VanDerWaalsContact CD-NH1 3.28Å; E708-R731 IonicContact OE1-NH1 2.86Å; E708-R731 PolarHBondContact OE1-NH1 3.47Å; E708-R731 VanDerWaalsContact OE1-NH1 3.07Å; E708-R731 IonicContact OE2-CZ 2.81Å; E708-R731 IonicContact OE2-NH1 3.3Å; E708-R731 PolarHBondContact OE2-NH1 3.47Å; E708-R731 IonicContact OE2-NH2 2.89Å; E708-R731 PolarHBondContact OE2-NH2 2.77Å
709	L	88.2	Confident	86.4	Confident	64 Å²	64	61.2 Å²	61.2	34%	0.335	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	105.8	169	172.6	62.6	0	0	0	109.5	V700 Q701 L703 I711	V700-L709 CarbonylContact C-O 3.32Å; Q701-L709 HydrophobicContact CB-CB 4.26Å; Q701-L709 PolarHBondContact N-O 2.93Å; Q701-L709 PolarHBondContact O-N 3.2Å; L703-L709 HydrophobicContact CD1-CB 3.98Å; L703-L709 HydrophobicContact CG-CB 4.4Å; L709-I711 HydrophobicContact CD2-CD1 4.49Å; L709-I711 HydrophobicContact CG-CD1 4.35Å; L709-I711 PolarHBondContact O-N 3.03Å
710	T	90.2	Very high	86.1	Confident	61 Å²	61	62.8 Å²	62.8	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.1	178.2	-58	0	0	0	0	110.3	E698 V700 P712	E698-T710 HydrophobicContact CB-CG2 4.34Å; V700-T710 HydrophobicContact CG2-CG2 4.37Å; T710-P712 WeakPolarHBondContact O-CD 3.26Å
711	I	91	Very high	85.9	Confident	6 Å²	6	63.4 Å²	63.4	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.8	-179.7	-52.7	-60.2	0	0	0	109.5	A676 L699 L709 A715 V717 A720 F728	A676-I711 HydrophobicContact CB-CG2 4.22Å; L699-I711 WeakPolarHBondContact O-CB 3.45Å; L699-I711 WeakPolarHBondContact O-CG1 3.37Å; L699-I711 PolarHBondContact O-N 2.73Å; L709-I711 HydrophobicContact CD2-CD1 4.49Å; L709-I711 HydrophobicContact CG-CD1 4.35Å; L709-I711 PolarHBondContact O-N 3.03Å; I711-A715 HydrophobicContact CG2-CB 4.25Å; I711-V717 HydrophobicContact CG2-CG2 4.29Å; I711-A720 HydrophobicContact CD1-CB 4.23Å; I711-A720 HydrophobicContact CG2-CB 4.12Å; I711-F728 HydrophobicContact CD1-CE1 4.34Å; I711-F728 HydrophobicContact CG1-CE1 4.04Å
712	P	88	Confident	85.5	Confident	74 Å²	74	66.8 Å²	66.8	48%	0.481	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.1	142.7	-179	-23.6	33.6	0	0	0	113.1	T710 S714 A715	T710-P712 WeakPolarHBondContact O-CD 3.26Å; P712-S714 PolarHBondContact O-N 2.87Å; P712-A715 HydrophobicContact CB-CB 4.05Å; P712-A715 HydrophobicContact CG-CB 4.28Å; P712-A715 WeakPolarHBondContact O-CB 3.03Å; P712-A715 PolarHBondContact O-N 2.85Å
713	A	80.9	Confident	85	Confident	63 Å²	63	66.6 Å²	66.6	52%	0.521	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15	-175.8	0	0	0	0	0	115.2	P677	P677-A713 VanDerWaalsContact CD-O 3.23Å; P677-A713 WeakPolarHBondContact CD-O 3.48Å; P677-A713 VanDerWaalsContact CG-O 3.23Å; P677-A713 WeakPolarHBondContact CG-O 3.31Å
714	S	82.3	Confident	84.4	Confident	103 Å²	103	68.6 Å²	68.6	72%	0.72	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-11.5	173.5	53.9	0	0	0	0	114	P712	P712-S714 PolarHBondContact O-N 2.87Å
715	A	87.3	Confident	84.6	Confident	23 Å²	23	65.6 Å²	65.6	19%	0.19	39%	0.386	C	S	.	.	S	Bend	trans	-77.5	155.1	-171.6	0	0	0	0	0	113	K675 A676 I711 P712 A720	K675-A715 CarbonylContact C-O 3.53Å; K675-A715 VanDerWaalsContact CA-O 3.29Å; K675-A715 WeakPolarHBondContact CA-O 3.49Å; A676-A715 PolarHBondContact N-O 3.28Å; I711-A715 HydrophobicContact CG2-CB 4.25Å; P712-A715 HydrophobicContact CB-CB 4.05Å; P712-A715 HydrophobicContact CG-CB 4.28Å; P712-A715 WeakPolarHBondContact O-CB 3.03Å; P712-A715 PolarHBondContact O-N 2.85Å; A715-A720 HydrophobicContact CB-CB 4.14Å
716	N	90.9	Very high	85.1	Confident	37 Å²	37	65.9 Å²	65.9	20%	0.198	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-83.7	122	167.7	-176.9	-51.9	0	0	0	109.1	S672 D674 F718 Y719 A720	S672-N716 PolarHBondContact O-ND2 2.73Å; D674-N716 CarbonylContact O-C 3.39Å; D674-N716 WeakPolarHBondContact O-CA 3.31Å; D674-N716 PolarHBondContact O-OD1 3.34Å; N716-F718 VanDerWaalsContact C-N 3.32Å; N716-F718 PolarHBondContact O-N 2.99Å; N716-F718 WeakPolarHBondContact OD1-CB 3.26Å; N716-F718 PolarHBondContact OD1-N 2.81Å; N716-Y719 HydrophobicContact CB-CD2 4.09Å; N716-Y719 PolarHBondContact O-N 2.94Å; N716-A720 WeakPolarHBondContact O-CB 3.49Å; N716-A720 PolarHBondContact O-N 2.83Å
717	V	88.9	Confident	86	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-69.1	-31.9	-171	-173.7	0	0	0	0	111.5	V670 D674 A676 V679 L699 I711 Y719 M721 F728	V670-V717 HydrophobicContact CG1-CB 3.83Å; V670-V717 HydrophobicContact CG1-CG1 4.11Å; V670-V717 HydrophobicContact CG2-CG1 4.4Å; D674-V717 PolarHBondContact O-N 2.99Å; A676-V717 VanDerWaalsContact CA-CG2 3.5Å; A676-V717 HydrophobicContact CB-CG2 4.02Å; V679-V717 HydrophobicContact CB-CG2 4.2Å; V679-V717 HydrophobicContact CG2-CB 4.15Å; V679-V717 HydrophobicContact CG2-CG2 3.66Å; L699-V717 HydrophobicContact CD2-CG1 3.96Å; L699-V717 HydrophobicContact CD2-CG2 4.11Å; I711-V717 HydrophobicContact CG2-CG2 4.29Å; V717-Y719 VanDerWaalsContact C-N 3.33Å; V717-Y719 PolarHBondContact O-N 2.99Å; V717-M721 WeakPolarHBondContact O-CB 3.41Å; V717-M721 WeakPolarHBondContact O-CG 3.44Å; V717-M721 PolarHBondContact O-N 3.47Å; V717-M721 VanDerWaalsContact O-N 3.13Å; V717-F728 HydrophobicContact CG1-CE1 4.44Å
718	F	89	Confident	86.6	Confident	11 Å²	11	50.7 Å²	50.7	5%	0.048	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-37.5	179.9	-173.1	-87.8	0	0	0	112.7	D648 R650 V670 T671 N716	D648-F718 HydrophobicContact CB-CE1 3.93Å; D648-F718 HydrophobicContact CB-CE2 4.1Å; D648-F718 HydrophobicContact CB-CZ 3.51Å; R650-F718 HydrophobicContact CB-CE2 4.34Å; R650-F718 HydrophobicContact CG-CD2 4.33Å; R650-F718 HydrophobicContact CG-CE2 3.75Å; V670-F718 HydrophobicContact CG1-CB 4.08Å; T671-F718 WeakPolarHBondContact O-CB 3.34Å; N716-F718 VanDerWaalsContact C-N 3.32Å; N716-F718 PolarHBondContact O-N 2.99Å; N716-F718 WeakPolarHBondContact OD1-CB 3.26Å; N716-F718 PolarHBondContact OD1-N 2.81Å
719	Y	87.6	Confident	86.6	Confident	162 Å²	162	46.5 Å²	46.5	64%	0.635	29%	0.287	S	S	*	.	H	α-helix	trans	-92.6	-22.8	179.4	-60.7	-67.9	0	0	0	113.7	N716 V717	N716-Y719 HydrophobicContact CB-CD2 4.09Å; N716-Y719 PolarHBondContact O-N 2.94Å; V717-Y719 VanDerWaalsContact C-N 3.33Å; V717-Y719 PolarHBondContact O-N 2.99Å
720	A	86.7	Confident	86.6	Confident	34 Å²	34	43.5 Å²	43.5	28%	0.281	27%	0.271	S	S	.	.	H	α-helix	trans	-87.3	-12.9	179.4	0	0	0	0	0	114	I711 A715 N716	I711-A720 HydrophobicContact CD1-CB 4.23Å; I711-A720 HydrophobicContact CG2-CB 4.12Å; A715-A720 HydrophobicContact CB-CB 4.14Å; N716-A720 WeakPolarHBondContact O-CB 3.49Å; N716-A720 PolarHBondContact O-N 2.83Å
721	M	86.9	Confident	86.5	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.064	26%	0.264	C	S	.	.	S	Bend	trans	-80.5	138.6	178	68.6	177.8	-64.9	0	0	112.8	R650 I652 Q701 V717 F728	R650-M721 HydrophobicContact CB-SD 4.48Å; I652-M721 HydrophobicContact CG2-CE 3.94Å; I652-M721 HydrophobicContact CG2-SD 4.22Å; Q701-M721 VanDerWaalsContact OE1-CA 3.31Å; V717-M721 WeakPolarHBondContact O-CB 3.41Å; V717-M721 WeakPolarHBondContact O-CG 3.44Å; V717-M721 PolarHBondContact O-N 3.47Å; V717-M721 VanDerWaalsContact O-N 3.13Å; M721-F728 HydrophobicContact CB-CZ 3.87Å; M721-F728 HydrophobicContact CE-CE2 4.26Å; M721-F728 HydrophobicContact CE-CZ 4.33Å
722	D	83.9	Confident	86.2	Confident	71 Å²	71	48 Å²	48	38%	0.38	29%	0.285	S	S	.	.			trans	-65.5	146.1	164.7	-163.7	-46.4	0	0	0	109.7	Q701 L703 A724	Q701-D722 PolarHBondContact NE2-O 2.77Å; L703-D722 HydrophobicContact CD2-CB 3.66Å; D722-A724 VanDerWaalsContact OD1-CB 3.27Å; D722-A724 WeakPolarHBondContact OD1-CB 3.31Å; D722-A724 PolarHBondContact OD1-N 2.69Å
723	G	78	Confident	85.8	Confident	48 Å²	48	50.3 Å²	50.3	50%	0.495	28%	0.284	S	S	.	.	S	Bend	trans	-78.7	-18.4	175.4	0	0	0	0	0	114.2	S725	G723-S725 VanDerWaalsContact C-N 3.29Å; G723-S725 PolarHBondContact O-N 3.02Å
724	A	75.8	Confident	84.9	Confident	68 Å²	68	58.5 Å²	58.5	56%	0.562	30%	0.302	S	S	*	.	S	Bend	trans	-74.1	-13.7	-174.5	0	0	0	0	0	114.5	D722	D722-A724 VanDerWaalsContact OD1-CB 3.27Å; D722-A724 WeakPolarHBondContact OD1-CB 3.31Å; D722-A724 PolarHBondContact OD1-N 2.69Å
725	S	82.4	Confident	83.1	Confident	13 Å²	13	63.5 Å²	63.5	9%	0.091	31%	0.305	C	S	.	.			trans	-144.4	149.4	176.1	-178.9	0	0	0	0	111.5	Q701 L702 G723 D727	Q701-S725 PolarHBondContact NE2-O 3.03Å; L702-S725 WeakPolarHBondContact O-CB 3.47Å; L702-S725 PolarHBondContact O-OG 3.03Å; G723-S725 VanDerWaalsContact C-N 3.29Å; G723-S725 PolarHBondContact O-N 3.02Å; S725-D727 PolarHBondContact OG-N 2.69Å; S725-D727 VanDerWaalsContact OG-N 3.14Å
726	H	88.8	Confident	80.7	Confident	72 Å²	72	68.1 Å²	68.1	33%	0.333	34%	0.336	S	S	.	.			trans	-118	12.5	173	-67	65.6	0	0	0	111.4	I652 R653	I652-H726 CarbonylContact C-O 3.58Å; I652-H726 WeakPolarHBondContact CA-O 3.48Å; R653-H726 PolarHBondContact N-O 3.47Å
727	D	88.8	Confident	78	Confident	42 Å²	42	71.7 Å²	71.7	23%	0.225	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	136.1	178.9	-66.8	-57.6	0	0	0	111.5	R653 Q701 L702 S725	R653-D727 IonicContact CZ-OD1 3.22Å; R653-D727 IonicContact CZ-OD2 2.97Å; R653-D727 IonicContact NE-OD1 3.7Å; R653-D727 PolarHBondContact NE-OD1 2.6Å; R653-D727 IonicContact NE-OD2 2.7Å; R653-D727 IonicContact NH2-OD1 3.12Å; R653-D727 PolarHBondContact NH2-OD1 3.18Å; R653-D727 IonicContact NH2-OD2 3.88Å; R653-D727 PolarHBondContact NH2-OD2 3.34Å; Q701-D727 WeakPolarHBondContact CG-O 3.3Å; L702-D727 HydrophobicContact CB-CB 4.26Å; L702-D727 PolarHBondContact N-O 3.15Å; S725-D727 PolarHBondContact OG-N 2.69Å; S725-D727 VanDerWaalsContact OG-N 3.14Å
728	F	92.6	Very high	75.3	Confident	1 Å²	1	76.2 Å²	76.2	0%	0.004	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.9	-177.4	-70.3	-105.6	0	0	0	110.7	I652 R653 V654 Q655 L699 V700 Q701 I711 V717 M721	I652-F728 HydrophobicContact CB-CD2 3.67Å; I652-F728 HydrophobicContact CB-CE2 3.63Å; I652-F728 HydrophobicContact CD1-CD1 4.41Å; I652-F728 HydrophobicContact CD1-CD2 3.82Å; I652-F728 HydrophobicContact CD1-CE1 4.5Å; I652-F728 HydrophobicContact CD1-CE2 3.96Å; I652-F728 HydrophobicContact CD1-CG 4.07Å; I652-F728 HydrophobicContact CD1-CZ 4.28Å; I652-F728 HydrophobicContact CG1-CD2 4.25Å; I652-F728 HydrophobicContact CG1-CE2 4.4Å; I652-F728 HydrophobicContact CG2-CD2 4.07Å; I652-F728 HydrophobicContact CG2-CE2 3.46Å; I652-F728 VanDerWaalsContact CG2-CE2 3.46Å; I652-F728 HydrophobicContact CG2-CZ 4.15Å; R653-F728 PolarHBondContact O-N 3.41Å; V654-F728 CarbonylContact C-O 3.52Å; V654-F728 WeakPolarHBondContact CA-O 3.49Å; V654-F728 HydrophobicContact CB-CB 4.49Å; V654-F728 HydrophobicContact CG1-CB 4.28Å; V654-F728 HydrophobicContact CG2-CB 4.18Å; Q655-F728 PolarHBondContact N-O 2.96Å; L699-F728 HydrophobicContact CD1-CB 3.96Å; L699-F728 HydrophobicContact CD1-CD1 3.92Å; L699-F728 HydrophobicContact CD1-CG 4.29Å; L699-F728 HydrophobicContact CD2-CD1 4.24Å; L699-F728 HydrophobicContact CD2-CE1 4.46Å; L699-F728 HydrophobicContact CG-CD1 3.81Å; L699-F728 HydrophobicContact CG-CE1 4.4Å; V700-F728 CarbonylContact O-C 3.57Å; V700-F728 WeakPolarHBondContact O-CA 3.43Å; V700-F728 VanDerWaalsContact O-CB 3.31Å; V700-F728 WeakPolarHBondContact O-CB 3.17Å; V700-F728 WeakPolarHBondContact O-CD1 3.18Å; Q701-F728 HydrophobicContact CB-CD1 3.73Å; Q701-F728 HydrophobicContact CB-CE1 3.51Å; Q701-F728 HydrophobicContact CB-CG 4.37Å; Q701-F728 HydrophobicContact CB-CZ 3.94Å; Q701-F728 HydrophobicContact CG-CD1 4.08Å; Q701-F728 HydrophobicContact CG-CD2 4.23Å; Q701-F728 HydrophobicContact CG-CE1 3.7Å; Q701-F728 HydrophobicContact CG-CE2 3.83Å; Q701-F728 HydrophobicContact CG-CG 4.35Å; Q701-F728 HydrophobicContact CG-CZ 3.57Å; I711-F728 HydrophobicContact CD1-CE1 4.34Å; I711-F728 HydrophobicContact CG1-CE1 4.04Å; V717-F728 HydrophobicContact CG1-CE1 4.44Å; M721-F728 HydrophobicContact CB-CZ 3.87Å; M721-F728 HydrophobicContact CE-CE2 4.26Å; M721-F728 HydrophobicContact CE-CZ 4.33Å
729	L	89.8	Confident	72.5	Confident	10 Å²	10	80.4 Å²	80.4	5%	0.052	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.6	171.8	177.9	62.7	0	0	0	109.1	Q655 E657 V700 L702 R731	Q655-L729 HydrophobicContact CB-CD1 4.17Å; Q655-L729 HydrophobicContact CG-CD1 4.26Å; Q655-L729 CarbonylContact O-C 3.48Å; E657-L729 HydrophobicContact CG-CD1 4.06Å; V700-L729 HydrophobicContact CB-CB 4.46Å; V700-L729 PolarHBondContact N-O 3.43Å; V700-L729 PolarHBondContact O-N 2.99Å; L702-L729 HydrophobicContact CD1-CB 4.45Å; L702-L729 HydrophobicContact CD2-CB 4.23Å; L702-L729 HydrophobicContact CG-CB 4.45Å; L729-R731 HydrophobicContact CG-CB 4.45Å
730	L	89.8	Confident	69.6	Low	1 Å²	1	79.2 Å²	79.2	1%	0.005	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	102.9	165.6	-168.4	76.8	0	0	0	108.7	V654 Q655 M656 I680 V683 L684 Y697	V654-L730 HydrophobicContact CG1-CB 3.94Å; Q655-L730 PolarHBondContact O-N 3.17Å; M656-L730 HydrophobicContact CG-CB 4.35Å; M656-L730 HydrophobicContact CG-CD2 4.28Å; M656-L730 HydrophobicContact SD-CD2 4.04Å; I680-L730 HydrophobicContact CB-CD1 4.19Å; I680-L730 HydrophobicContact CG1-CD1 3.72Å; I680-L730 HydrophobicContact CG2-CD1 3.86Å; V683-L730 HydrophobicContact CB-CD2 4.24Å; V683-L730 HydrophobicContact CG1-CB 4.23Å; V683-L730 HydrophobicContact CG1-CD2 3.76Å; V683-L730 HydrophobicContact CG1-CG 4.46Å; L684-L730 HydrophobicContact CD2-CD2 3.88Å; L684-L730 HydrophobicContact CG-CD2 4.08Å; Y697-L730 HydrophobicContact CD1-CD2 3.89Å; Y697-L730 HydrophobicContact CD1-CG 3.93Å; Y697-L730 HydrophobicContact CG-CD2 4.23Å; Y697-L730 HydrophobicContact CG-CG 4.35Å
731	R	87.1	Confident	67.2	Low	60 Å²	60	83.5 Å²	83.5	23%	0.226	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.5	-177.3	-179.4	163.7	62.9	-150.4	0.8	110.4	Y697 E698 V700 E708 L729	Y697-R731 WeakPolarHBondContact CA-O 3.27Å; E698-R731 HydrophobicContact CG-CB 4.1Å; E698-R731 PolarHBondContact N-O 3.24Å; E698-R731 PolarHBondContact O-N 3.13Å; E698-R731 IonicContact OE1-CZ 3.92Å; E698-R731 VanDerWaalsContact OE1-CZ 3.3Å; E698-R731 IonicContact OE1-NE 3.79Å; E698-R731 PolarHBondContact OE1-NE 2.77Å; E698-R731 IonicContact OE1-NH2 3.73Å; E698-R731 PolarHBondContact OE1-NH2 3.32Å; V700-R731 HydrophobicContact CG2-CB 4.45Å; E708-R731 VanDerWaalsContact CD-NH1 3.28Å; E708-R731 IonicContact OE1-NH1 2.86Å; E708-R731 PolarHBondContact OE1-NH1 3.47Å; E708-R731 VanDerWaalsContact OE1-NH1 3.07Å; E708-R731 IonicContact OE2-CZ 2.81Å; E708-R731 IonicContact OE2-NH1 3.3Å; E708-R731 PolarHBondContact OE2-NH1 3.47Å; E708-R731 IonicContact OE2-NH2 2.89Å; E708-R731 PolarHBondContact OE2-NH2 2.77Å; L729-R731 HydrophobicContact CG-CB 4.45Å
732	Q	84.6	Confident	64.4	Low	103 Å²	103	86.1 Å²	86.1	48%	0.481	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.8	171.3	-163	179.7	12.7	0	0	109.4	E696 Y697 R734	E696-Q732 CarbonylContact O-C 3.49Å; E696-Q732 WeakPolarHBondContact O-CG 3.39Å; E696-Q732 PolarHBondContact OE2-NE2 2.92Å; Y697-Q732 HydrophobicContact CD1-CB 4.15Å; Y697-Q732 HydrophobicContact CD1-CG 4.48Å; Y697-Q732 HydrophobicContact CE1-CB 3.93Å; Y697-Q732 HydrophobicContact CE1-CG 4.19Å; Q732-R734 PolarHBondContact O-N 3.45Å
733	R	79.4	Confident	61.8	Low	121 Å²	121	89 Å²	89	46%	0.457	52%	0.523	S	S	.	.			trans	-67.5	114.6	178.6	-59.9	175.6	80.8	-160.4	4.9	108	S695 E696 Y697 E698 R735	S695-R733 WeakPolarHBondContact O-CD 3.43Å; S695-R733 PolarHBondContact O-NH1 3.04Å; S695-R733 VanDerWaalsContact O-NH1 3.12Å; E696-R733 WeakPolarHBondContact O-CB 3.45Å; E696-R733 PolarHBondContact O-N 2.99Å; Y697-R733 WeakPolarHBondContact O-CD 3.27Å; E698-R733 HydrophobicContact CB-CG 3.78Å; E698-R733 HydrophobicContact CG-CG 3.88Å; R733-R735 PolarHBondContact O-N 3.11Å; R733-R735 VanDerWaalsContact O-N 3.1Å
734	R	62.5	Low	59.4	Low	236 Å²	236	92.5 Å²	92.5	89%	0.891	53%	0.534	S	S	*	.			trans	-58.4	118.2	177.2	-66	-175.4	178.6	-168.9	-0.1	108.8	Q732 S736	Q732-R734 PolarHBondContact O-N 3.45Å; R734-S736 PolarHBondContact O-N 3.43Å; R734-S736 VanDerWaalsContact O-N 3.09Å
735	R	43.8	Very low	57.2	Low	207 Å²	207	94.9 Å²	94.9	78%	0.781	55%	0.547	S	S	*	.			trans	-58.4	116.2	173.2	-71.2	-175.3	179	-177.7	1.2	108.2	E696 R733 S737	E696-R735 IonicContact OE1-CZ 3.33Å; E696-R735 IonicContact OE1-NE 3.13Å; E696-R735 PolarHBondContact OE1-NE 3.09Å; E696-R735 VanDerWaalsContact OE1-NE 3.13Å; E696-R735 IonicContact OE1-NH2 2.68Å; E696-R735 PolarHBondContact OE1-NH2 2.85Å; R733-R735 PolarHBondContact O-N 3.11Å; R733-R735 VanDerWaalsContact O-N 3.1Å; R735-S737 PolarHBondContact O-N 3.48Å; R735-S737 VanDerWaalsContact O-N 3.09Å
736	S	37.3	Very low	54.6	Low	120 Å²	120	97.6 Å²	97.6	84%	0.839	58%	0.577	S	S	*	*			trans	-60.2	113.2	170.4	-48.7	0	0	0	0	108.1	R734 A738	R734-S736 PolarHBondContact O-N 3.43Å; R734-S736 VanDerWaalsContact O-N 3.09Å; S736-A738 PolarHBondContact O-N 2.8Å
737	S	34.4	Very low	52.3	Low	113 Å²	113	100.1 Å²	100.1	79%	0.79	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.7	170.2	52.1	0	0	0	0	108.9	R735	R735-S737 PolarHBondContact O-N 3.48Å; R735-S737 VanDerWaalsContact O-N 3.09Å
738	A	31.9	Very low	49.4	Very low	95 Å²	95	103.2 Å²	103.2	79%	0.785	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-54.3	143.6	177.9	0	0	0	0	0	110.7	S736 T740	S736-A738 PolarHBondContact O-N 2.8Å; A738-T740 PolarHBondContact O-N 3.12Å
739	A	30.2	Very low	46.3	Very low	99 Å²	99	107.3 Å²	107.3	82%	0.818	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-68.5	127.6	-169.7	0	0	0	0	0	112.6
740	T	27.9	Very low	43.4	Very low	137 Å²	137	113 Å²	113	84%	0.84	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-96.4	116.8	155.6	-49.7	0	0	0	0	107.3	A738	A738-T740 PolarHBondContact O-N 3.12Å
741	P	36	Very low	40.5	Very low	124 Å²	124	116.7 Å²	116.7	81%	0.805	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.7	134.3	-172.9	30	-34.1	0	0	0	112.3
742	G	26.7	Very low	37.7	Very low	67 Å²	67	120.6 Å²	120.6	69%	0.691	77%	0.768	S	S	*	*			trans	-165.1	91	-176.8	0	0	0	0	0	117.2
743	V	30.2	Very low	35.8	Very low	132 Å²	132	121.1 Å²	121.1	80%	0.8	78%	0.781	S	S	*	*			trans	56.9	87.2	137.5	-171.2	0	0	0	0	119.8
744	T	28	Very low	34.3	Very low	121 Å²	121	121.2 Å²	121.2	74%	0.742	80%	0.797	S	S	*	*			trans	60.7	152.2	131.8	62.4	0	0	0	0	124.7
745	S	29.5	Very low	32.6	Very low	118 Å²	118	115.1 Å²	115.1	83%	0.825	79%	0.791	S	S	*	*			trans	70.3	120.4	158.8	54.8	0	0	0	0	120.2
746	G	26.6	Very low	31.9	Very low	71 Å²	71	114.2 Å²	114.2	73%	0.732	80%	0.796	S	S	*	*			trans	-109.8	-146.5	152.1	0	0	0	0	0	109.6
747	P	41.8	Very low	31.3	Very low	124 Å²	124	112.5 Å²	112.5	81%	0.805	80%	0.797	S	S	*	*			cis	-133.5	-160.2	-0.2	39.3	-19.2	0	0	0	113.3
748	S	26.8	Very low	30.9	Very low	107 Å²	107	110.9 Å²	110.9	75%	0.748	80%	0.797	S	S	*	*			trans	108.1	104.7	152.7	-54	0	0	0	0	120.2
749	A	28.9	Very low	30.6	Very low	87 Å²	87	110.4 Å²	110.4	72%	0.719	80%	0.802	S	S	*	*				61.8	125.6	122.6	0	0	0	0	0	124
750	S	27.7	Very low	30.3	Very low	131 Å²	131	109.6 Å²	109.6	92%	0.916	80%	0.804	S	S	*	*			trans	73.5	145.2	139	71.2	0	0	0	0	120.9
751	G	28.2	Very low	30.4	Very low	78 Å²	78	108.8 Å²	108.8	80%	0.804	80%	0.803	S	S	*	*			trans	144.9	106.9	171.5	0	0	0	0	0	113.5
752	T	28.7	Very low	29.7	Very low	141 Å²	141	112.4 Å²	112.4	87%	0.865	81%	0.807	S	S	*	*			trans	-88.2	167.4	174.3	13.5	0	0	0	0	112
753	P	46.3	Very low	30.4	Very low	115 Å²	115	113.9 Å²	113.9	75%	0.747	80%	0.804	S	S	*	*			trans	-88.9	-160.1	-163.5	43.1	-42.8	0	0	0	111.7
754	P	47.1	Very low	30.2	Very low	122 Å²	122	119.6 Å²	119.6	79%	0.792	81%	0.811	S	S	*	*			cis	-137.6	-173.6	-0.9	43.7	-25.9	0	0	0	115.6
755	S	27.4	Very low	30.2	Very low	109 Å²	109	120.9 Å²	120.9	76%	0.762	81%	0.812	S	S	*	*				-173.3	176.4	125.2	-150.5	0	0	0	0	114
756	E	27.6	Very low	30.2	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	82%	0.817	S	S	*	*			trans	-72.2	169	-167.9	-54.3	168.8	118.7	0	0	117.7
757	G	26.3	Very low	30.4	Very low	84 Å²	84	126.4 Å²	126.4	87%	0.866	82%	0.818	S	S	*	*			trans	106.5	147.2	160.2	0	0	0	0	0	115.6
758	G	25	Very low	29.7	Very low	78 Å²	78	127.8 Å²	127.8	80%	0.804	83%	0.825	S	S	*	*			cis	158.7	120.4	-5.8	0	0	0	0	0	112.5
759	G	26.3	Very low	29.6	Very low	85 Å²	85	125.9 Å²	125.9	88%	0.876	82%	0.821	S	S	*	*			trans	78.1	157.1	-179.5	0	0	0	0	0	114.7
760	G	24.1	Very low	29.7	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	83%	0.831	S	S	*	*			cis	128.6	95.1	-7.9	0	0	0	0	0	114.1
761	S	28.4	Very low	29.6	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	83%	0.829	S	S	*	*			trans	-160.8	121.5	159.7	-164.6	0	0	0	0	113.6
762	F	23.1	Very low	29.6	Very low	200 Å²	200	140.1 Å²	140.1	88%	0.877	83%	0.827	S	S	*	*			trans	-123.8	171.1	150.3	-91	-80.3	0	0	0	105.5
763	P	41.3	Very low	29.5	Very low	99 Å²	99	138.3 Å²	138.3	64%	0.643	83%	0.827	S	S	*	*			cis	-129.5	-177.1	-7	40.4	-26.2	0	0	0	113.1
764	R	25.8	Very low	28.8	Very low	251 Å²	251	142 Å²	142	95%	0.947	83%	0.826	S	S	*	*				-159.3	149.4	122.7	-118.5	170.5	177	144.9	1.4	114.7
765	I	28.3	Very low	28	Very low	149 Å²	149	140.2 Å²	140.2	76%	0.764	82%	0.822	S	S	*	*			trans	-103.6	144.2	-174.8	-61.9	157.3	0	0	0	109.8
766	K	28.7	Very low	28	Very low	214 Å²	214	142.9 Å²	142.9	93%	0.93	83%	0.826	S	S	*	*			trans	-152.7	146.7	143.6	-113.2	175.2	-176.3	-176.9	0	109.9
767	A	30.2	Very low	28.3	Very low	90 Å²	90	146.5 Å²	146.5	74%	0.744	84%	0.84	S	S	*	*			trans	-124.1	128.6	-163.2	0	0	0	0	0	113.6
768	T	28.5	Very low	28.4	Very low	154 Å²	154	149.6 Å²	149.6	95%	0.945	84%	0.838	S	S	*	*			trans	-168.8	137.6	158.5	-8.9	0	0	0	0	107.1
769	G	24.3	Very low	28.6	Very low	66 Å²	66	153.4 Å²	153.4	68%	0.68	84%	0.84	S	S	*	*			cis	174.7	132.5	-10.7	0	0	0	0	0	110.7
770	R	30.6	Very low	28.7	Very low	245 Å²	245	157.2 Å²	157.2	93%	0.925	84%	0.838	S	S	*	*			trans	32	104	168.3	-60.8	-179.3	-175.5	173.4	1	117.8
771	K	26	Very low	29	Very low	202 Å²	202	161.5 Å²	161.5	88%	0.878	84%	0.837	S	S	*	*			trans	-161	134.6	137.9	-112.1	165.6	-174.3	-180	0	112.8
772	I	27.7	Very low	29	Very low	148 Å²	148	164.2 Å²	164.2	76%	0.759	84%	0.837	S	S	*	*			trans	58.4	82.4	157.3	-47.7	165.3	0	0	0	115.7	R774	I772-R774 HydrophobicContact CG2-CB 4.26Å
773	A	26.9	Very low	29.4	Very low	104 Å²	104	161.8 Å²	161.8	86%	0.86	84%	0.835	S	S	*	*			trans	-88.6	116.7	132.3	0	0	0	0	0	107
774	R	31.9	Very low	28.6	Very low	192 Å²	192	166.3 Å²	166.3	73%	0.725	85%	0.848	S	S	*	*			trans	-166.2	64.8	169.1	-124.3	179.9	-171.5	-167.4	-0.1	113.1	S56 I772	S56-R774 PolarHBondContact OG-NH2 2.92Å; I772-R774 HydrophobicContact CG2-CB 4.26Å
775	A	29.8	Very low	28.8	Very low	85 Å²	85	159.8 Å²	159.8	70%	0.702	84%	0.841	S	S	*	*	S	Bend	trans	-168.4	149.4	158.8	0	0	0	0	0	109
776	L	27.9	Very low	28.8	Very low	165 Å²	165	160.7 Å²	160.7	86%	0.864	85%	0.847	S	S	*	*			trans	82.7	2.1	172.3	-56.7	172.5	0	0	0	119.9
777	F	33.5	Very low	28.9	Very low	263 Å²	263	155.8 Å²	155.8	100%	1.154	84%	0.84	S	S	*	*			trans	-139.6	0	162.6	-62.2	-71.3	0	0	0	110

Retrieved 777 of 777 residues in 178.3 ms (Link to these results)

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