A0A061IHJ4_CRIGR Loading...

Anion exchange transporter

AlphaFold DB , UniProt , Accession A0A061IHJ4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Slc26a7, Length 656 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	32.8	Very low	229 Å²	229	165.4 Å²	165.4	100%	1.128	87%	0.871	S	S	*	*				0	112.9	0	-79.5	161.8	84.7	0	0	108.8
2	T	31.1	Very low	32.8	Very low	140 Å²	140	165.5 Å²	165.5	86%	0.859	87%	0.871	S	S	*	*			trans	49	125.6	139.9	60.8	0	0	0	0	119.5
3	G	29.3	Very low	32.7	Very low	74 Å²	74	173.1 Å²	173.1	76%	0.763	88%	0.881	S	S	*	*			cis	175.8	134.1	2.3	0	0	0	0	0	110
4	A	37	Very low	32.7	Very low	106 Å²	106	165.9 Å²	165.9	88%	0.876	87%	0.871	S	S	*	*			trans	-78.9	122.9	163.1	0	0	0	0	0	108.9
5	K	33.8	Very low	32.9	Very low	203 Å²	203	167.3 Å²	167.3	88%	0.883	87%	0.867	S	S	*	*			trans	-133.9	103.9	168.5	-88.8	-174.8	178.8	175.3	0	111.8
6	R	31.9	Very low	33.2	Very low	213 Å²	213	168.9 Å²	168.9	80%	0.804	87%	0.872	S	S	*	*				59.1	80.8	129.2	-105.3	177.4	-179.1	168.4	3.6	117.7
7	K	33.7	Very low	34	Very low	212 Å²	212	168.4 Å²	168.4	92%	0.922	87%	0.865	S	S	*	*	S	Bend	trans	-101.3	90.5	146.6	-91.2	-175.4	176.7	177.5	0	109.3
8	K	34.4	Very low	35	Very low	195 Å²	195	165.7 Å²	165.7	85%	0.848	86%	0.857	S	S	*	*			trans	166.9	87.8	159.5	-102	176.1	179	178.3	0	107.9
9	K	31.3	Very low	35.9	Very low	188 Å²	188	161.6 Å²	161.6	82%	0.817	84%	0.843	S	S	*	*			trans	174.3	81.1	158	-101.2	177.8	-175	-166.5	0	108.6
10	S	31.2	Very low	37.5	Very low	116 Å²	116	159.7 Å²	159.7	81%	0.811	83%	0.829	S	S	*	*	S	Bend	trans	-159.8	8	157.8	68.8	0	0	0	0	115.4
11	V	34.8	Very low	39	Very low	143 Å²	143	161.7 Å²	161.7	87%	0.867	83%	0.826	S	S	*	*	S	Bend	trans	-102.3	7.2	-176.4	-175.3	0	0	0	0	113.5
12	L	33.6	Very low	41	Very low	167 Å²	167	157 Å²	157	87%	0.874	80%	0.801	S	S	*	*	S	Bend	trans	-117.2	8.7	-171.7	-107.7	154.3	0	0	0	116.1
13	W	30.9	Very low	43.2	Very low	264 Å²	264	154.4 Å²	154.4	100%	1	78%	0.782	S	S	*	*	S	Bend	trans	-134	64	-178.8	-113	49.7	0	0	0	111.3
14	G	32.6	Very low	45.4	Very low	72 Å²	72	154.2 Å²	154.2	74%	0.742	76%	0.763	S	S	*	*			trans	-166.2	37.2	-176.3	0	0	0	0	0	115
15	K	35.8	Very low	47.3	Very low	188 Å²	188	156 Å²	156	82%	0.817	75%	0.751	S	S	*	*			trans	-146	69.9	161.3	-77.4	-167.6	178.3	177	0	109.5	H17	K15-H17 VanDerWaalsContact C-N 3.3Å; K15-H17 PolarHBondContact O-N 3.4Å; K15-H17 VanDerWaalsContact O-N 3.15Å
16	M	38.6	Very low	49.3	Very low	192 Å²	192	151.4 Å²	151.4	95%	0.946	73%	0.732	S	S	*	*			trans	-66	104	147	-95.1	168.3	106.3	0	0	105	T18	M16-T18 PolarHBondContact O-N 2.79Å
17	H	46.2	Very low	51.5	Low	160 Å²	160	148.3 Å²	148.3	74%	0.741	72%	0.721	S	S	*	*			trans	-52.7	111.9	170.3	-94.6	-61.1	0	0	0	107.9	K15 P19	K15-H17 VanDerWaalsContact C-N 3.3Å; K15-H17 PolarHBondContact O-N 3.4Å; K15-H17 VanDerWaalsContact O-N 3.15Å; H17-P19 WeakPolarHBondContact O-CD 3.48Å
18	T	52.4	Low	53.6	Low	120 Å²	120	140.4 Å²	140.4	74%	0.736	69%	0.692	S	S	*	*			trans	-56.4	117.1	157.7	45.7	0	0	0	0	106	M16 H20	M16-T18 PolarHBondContact O-N 2.79Å; T18-H20 PolarHBondContact O-N 2.9Å
19	P	52.1	Low	55.6	Low	89 Å²	89	137.5 Å²	137.5	58%	0.578	68%	0.679	S	S	*	*			trans	-62.4	114	-177.6	24.8	-31.8	0	0	0	107.7	H17 I24	H17-P19 WeakPolarHBondContact O-CD 3.48Å; P19-I24 HydrophobicContact CB-CD1 4.13Å; P19-I24 HydrophobicContact CB-CG1 4.04Å; P19-I24 HydrophobicContact CG-CD1 4.33Å
20	H	67	Low	58	Low	123 Å²	123	137.3 Å²	137.3	57%	0.569	67%	0.674	S	S	*	*			trans	-65.2	145.1	176.2	-155.7	-92.3	0	0	0	107.4	T18 E22 D23 I24	T18-H20 PolarHBondContact O-N 2.9Å; H20-E22 PolarHBondContact O-N 3.36Å; H20-D23 WeakPolarHBondContact CB-OD2 3.22Å; H20-D23 PolarHBondContact N-OD2 3.26Å; H20-D23 WeakPolarHBondContact O-CB 3.39Å; H20-D23 PolarHBondContact O-N 3.48Å; H20-I24 PolarHBondContact O-N 3.47Å
21	W	68.9	Low	60.6	Low	201 Å²	201	134.3 Å²	134.3	76%	0.761	64%	0.644	S	S	*	*	H	α-helix	trans	-52.9	-30.1	178.6	177.2	-106	0	0	0	112.5	K25	W21-K25 WeakPolarHBondContact O-CB 3.36Å; W21-K25 PolarHBondContact O-N 3.21Å
22	E	74.8	Confident	63.2	Low	132 Å²	132	129.6 Å²	129.6	62%	0.617	61%	0.614	S	S	*	*	H	α-helix	trans	-69.2	-37.1	174.6	-61.2	-143.4	148.5	0	0	113.8	H20 I24 K25 Q26	H20-E22 PolarHBondContact O-N 3.36Å; E22-I24 VanDerWaalsContact C-N 3.33Å; E22-K25 PolarHBondContact O-N 3.44Å; E22-Q26 WeakPolarHBondContact O-CB 3.4Å; E22-Q26 PolarHBondContact O-N 3.3Å
23	D	77.9	Confident	65.8	Low	84 Å²	84	122.1 Å²	122.1	45%	0.449	58%	0.576	S	S	.	*	H	α-helix	trans	-66.1	-39.8	175.7	-62.5	-41.2	0	0	0	110.6	H20 Q26 W27	H20-D23 WeakPolarHBondContact CB-OD2 3.22Å; H20-D23 PolarHBondContact N-OD2 3.26Å; H20-D23 WeakPolarHBondContact O-CB 3.39Å; H20-D23 PolarHBondContact O-N 3.48Å; D23-Q26 PolarHBondContact O-N 3.01Å; D23-W27 WeakPolarHBondContact O-CB 3.44Å; D23-W27 PolarHBondContact O-N 3.15Å
24	I	73.9	Confident	68.5	Low	70 Å²	70	111.6 Å²	111.6	36%	0.359	54%	0.538	S	S	.	.	H	α-helix	trans	-65.4	-44.1	175	-60.6	174.5	0	0	0	110	P19 H20 E22 Q26 W27 C28	P19-I24 HydrophobicContact CB-CD1 4.13Å; P19-I24 HydrophobicContact CB-CG1 4.04Å; P19-I24 HydrophobicContact CG-CD1 4.33Å; H20-I24 PolarHBondContact O-N 3.47Å; E22-I24 VanDerWaalsContact C-N 3.33Å; I24-Q26 PolarHBondContact O-N 3Å; I24-W27 PolarHBondContact O-N 3.35Å; I24-C28 WeakPolarHBondContact O-CB 3.48Å; I24-C28 PolarHBondContact O-N 3.22Å; I24-C28 PolarHBondContact O-SG 3.11Å
25	K	76.8	Confident	71.1	Confident	144 Å²	144	112.5 Å²	112.5	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-62.2	-43.3	177.1	-172.6	178.2	-179.9	-178.6	0	111.6	W21 E22 C28 K29	W21-K25 WeakPolarHBondContact O-CB 3.36Å; W21-K25 PolarHBondContact O-N 3.21Å; E22-K25 PolarHBondContact O-N 3.44Å; K25-C28 PolarHBondContact O-N 3.44Å; K25-K29 WeakPolarHBondContact O-CB 3.38Å; K25-K29 PolarHBondContact O-N 2.9Å
26	Q	77.1	Confident	73.4	Confident	106 Å²	106	108.9 Å²	108.9	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-34.9	178.6	-164.4	165.7	14.3	0	0	111.8	E22 D23 I24 K29 R30	E22-Q26 WeakPolarHBondContact O-CB 3.4Å; E22-Q26 PolarHBondContact O-N 3.3Å; D23-Q26 PolarHBondContact O-N 3.01Å; I24-Q26 PolarHBondContact O-N 3Å; Q26-K29 PolarHBondContact O-N 2.8Å; Q26-R30 WeakPolarHBondContact O-CG 3.14Å; Q26-R30 PolarHBondContact O-N 3.47Å
27	W	78.4	Confident	75.7	Confident	148 Å²	148	101.1 Å²	101.1	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-63.4	-49.4	171.5	-176.2	94.3	0	0	0	111.4	D23 I24 K29 R30 R31	D23-W27 WeakPolarHBondContact O-CB 3.44Å; D23-W27 PolarHBondContact O-N 3.15Å; I24-W27 PolarHBondContact O-N 3.35Å; W27-K29 VanDerWaalsContact C-N 3.32Å; W27-K29 PolarHBondContact O-N 3.19Å; W27-R30 PolarHBondContact O-N 3.42Å; W27-R30 VanDerWaalsContact O-N 3.13Å; W27-R31 HydrophobicContact CD2-CG 4.11Å; W27-R31 HydrophobicContact CE3-CG 4.37Å; W27-R31 HydrophobicContact CH2-CG 4.31Å; W27-R31 HydrophobicContact CZ2-CG 4.06Å; W27-R31 HydrophobicContact CZ3-CG 4.46Å; W27-R31 WeakPolarHBondContact O-CG 2.88Å; W27-R31 PolarHBondContact O-N 3.22Å
28	C	77.4	Confident	77.6	Confident	47 Å²	47	95.6 Å²	95.6	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-58.9	-42.8	175.2	-78.5	0	0	0	0	111.7	I24 K25 R30 R31 L32	I24-C28 WeakPolarHBondContact O-CB 3.48Å; I24-C28 PolarHBondContact O-N 3.22Å; I24-C28 PolarHBondContact O-SG 3.11Å; K25-C28 PolarHBondContact O-N 3.44Å; C28-R30 VanDerWaalsContact C-N 3.3Å; C28-R30 PolarHBondContact O-N 3.12Å; C28-R31 PolarHBondContact O-N 3.33Å; C28-R31 VanDerWaalsContact O-N 3.13Å; C28-L32 WeakPolarHBondContact O-CB 3.08Å; C28-L32 PolarHBondContact O-N 3.41Å
29	K	76.4	Confident	79.3	Confident	134 Å²	134	94.7 Å²	94.7	58%	0.583	45%	0.45	S	S	*	.	H	α-helix	trans	-62.5	-35.5	177.2	-165.5	177.8	-178.6	-177.9	0	112.5	K25 Q26 W27	K25-K29 WeakPolarHBondContact O-CB 3.38Å; K25-K29 PolarHBondContact O-N 2.9Å; Q26-K29 PolarHBondContact O-N 2.8Å; W27-K29 VanDerWaalsContact C-N 3.32Å; W27-K29 PolarHBondContact O-N 3.19Å
30	R	80.9	Confident	81	Confident	184 Å²	184	96.7 Å²	96.7	69%	0.694	45%	0.452	S	S	*	.	H	α-helix	trans	-73.7	-25.7	175.1	-73.5	176.2	-179.2	-177.8	3.7	113.4	Q26 W27 C28	Q26-R30 WeakPolarHBondContact O-CG 3.14Å; Q26-R30 PolarHBondContact O-N 3.47Å; W27-R30 PolarHBondContact O-N 3.42Å; W27-R30 VanDerWaalsContact O-N 3.13Å; C28-R30 VanDerWaalsContact C-N 3.3Å; C28-R30 PolarHBondContact O-N 3.12Å
31	R	86.6	Confident	82	Confident	53 Å²	53	92.4 Å²	92.4	20%	0.2	43%	0.431	C	S	.	.	H	α-helix	trans	-96.8	-11.1	-177.2	-63.8	-55.2	-179.3	-168.9	0.3	114.6	W27 C28 P33 F163 Q342 L345	W27-R31 HydrophobicContact CD2-CG 4.11Å; W27-R31 HydrophobicContact CE3-CG 4.37Å; W27-R31 HydrophobicContact CH2-CG 4.31Å; W27-R31 HydrophobicContact CZ2-CG 4.06Å; W27-R31 HydrophobicContact CZ3-CG 4.46Å; W27-R31 WeakPolarHBondContact O-CG 2.88Å; W27-R31 PolarHBondContact O-N 3.22Å; C28-R31 PolarHBondContact O-N 3.33Å; C28-R31 VanDerWaalsContact O-N 3.13Å; R31-P33 WeakPolarHBondContact O-CD 3.38Å; R31-F163 VanDerWaalsContact CZ-CZ 3.47Å; R31-Q342 PolarHBondContact O-NE2 3.24Å; R31-L345 HydrophobicContact CB-CD2 4.28Å; R31-L345 HydrophobicContact CG-CD2 4.44Å
32	L	89.3	Confident	83	Confident	44 Å²	44	87.1 Å²	87.1	23%	0.23	42%	0.417	C	S	.	.			trans	-115.9	83.1	176.5	-67.5	169.1	0	0	0	110	C28 I34 L35 I92 F93	C28-L32 WeakPolarHBondContact O-CB 3.08Å; C28-L32 PolarHBondContact O-N 3.41Å; L32-I34 HydrophobicContact CB-CG2 4.29Å; L32-I34 PolarHBondContact O-N 3.13Å; L32-L35 HydrophobicContact CB-CD1 3.89Å; L32-L35 HydrophobicContact CB-CG 3.99Å; L32-L35 HydrophobicContact CD1-CD1 3.9Å; L32-L35 WeakPolarHBondContact O-CB 3.4Å; L32-L35 PolarHBondContact O-N 3.26Å; L32-I92 HydrophobicContact CD2-CG2 3.81Å; L32-F93 HydrophobicContact CD2-CD1 3.84Å; L32-F93 HydrophobicContact CD2-CE1 3.43Å; L32-F93 VanDerWaalsContact CD2-CE1 3.43Å; L32-F93 HydrophobicContact CD2-CZ 3.96Å
33	P	87.3	Confident	83.6	Confident	10 Å²	10	86.4 Å²	86.4	7%	0.065	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.1	177.2	-27.8	36.6	0	0	0	113.7	R31 L35 E36 W37 F93 G94 M95 Q342	R31-P33 WeakPolarHBondContact O-CD 3.38Å; P33-L35 PolarHBondContact O-N 3.42Å; P33-E36 WeakPolarHBondContact O-CB 3.49Å; P33-E36 PolarHBondContact O-N 3.31Å; P33-W37 VanDerWaalsContact C-CD1 3.49Å; P33-W37 PolarHBondContact O-N 3.34Å; P33-W37 VanDerWaalsContact O-N 3.12Å; P33-F93 WeakPolarHBondContact CD-O 3.36Å; P33-F93 WeakPolarHBondContact CG-O 3.39Å; P33-G94 WeakPolarHBondContact CB-O 3.41Å; P33-M95 HydrophobicContact CB-CG 4.46Å; P33-M95 HydrophobicContact CG-CG 3.83Å; P33-Q342 HydrophobicContact CG-CG 4.5Å
34	I	88.2	Confident	84	Confident	43 Å²	43	94.3 Å²	94.3	22%	0.221	44%	0.441	C	S	.	.	H	α-helix	trans	-54.7	-33	174.5	-166.1	163.9	0	0	0	113.9	L32 E36 W37 A38 I92	L32-I34 HydrophobicContact CB-CG2 4.29Å; L32-I34 PolarHBondContact O-N 3.13Å; I34-E36 PolarHBondContact O-N 3.28Å; I34-W37 VanDerWaalsContact CA-NE1 3.33Å; I34-W37 HydrophobicContact CB-CZ2 4.46Å; I34-W37 HydrophobicContact CD1-CZ2 4.13Å; I34-W37 HydrophobicContact CG1-CZ2 3.79Å; I34-A38 HydrophobicContact CG1-CB 4.1Å; I34-A38 WeakPolarHBondContact O-CB 3.18Å; I34-A38 PolarHBondContact O-N 3.05Å; I34-I92 HydrophobicContact CD1-CG1 4.11Å; I34-I92 HydrophobicContact CG2-CG2 4.09Å; I34-I92 PolarHBondContact N-O 3.41Å
35	L	86.3	Confident	84.8	Confident	91 Å²	91	97.3 Å²	97.3	48%	0.476	45%	0.453	S	S	.	.	H	α-helix	trans	-72.9	-15.8	178.1	-61.9	178.6	0	0	0	112.9	L32 P33 P39	L32-L35 HydrophobicContact CB-CD1 3.89Å; L32-L35 HydrophobicContact CB-CG 3.99Å; L32-L35 HydrophobicContact CD1-CD1 3.9Å; L32-L35 WeakPolarHBondContact O-CB 3.4Å; L32-L35 PolarHBondContact O-N 3.26Å; P33-L35 PolarHBondContact O-N 3.42Å; L35-P39 WeakPolarHBondContact O-CD 3.4Å; L35-P39 WeakPolarHBondContact O-CG 3.36Å
36	E	85	Confident	85.4	Confident	111 Å²	111	91.8 Å²	91.8	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-93.1	-47.5	177	-171	177.2	-178.9	0	0	111.2	P33 I34 Q40	P33-E36 WeakPolarHBondContact O-CB 3.49Å; P33-E36 PolarHBondContact O-N 3.31Å; I34-E36 PolarHBondContact O-N 3.28Å; E36-Q40 WeakPolarHBondContact O-CG 3.45Å
37	W	86.8	Confident	86.1	Confident	30 Å²	30	90.5 Å²	90.5	11%	0.114	43%	0.426	C	S	.	.	H	α-helix	trans	-84.8	-34.2	-174.4	72.5	-106.2	0	0	0	113.9	P33 I34 Q40 Y41 Q380 V381	P33-W37 VanDerWaalsContact C-CD1 3.49Å; P33-W37 PolarHBondContact O-N 3.34Å; P33-W37 VanDerWaalsContact O-N 3.12Å; I34-W37 VanDerWaalsContact CA-NE1 3.33Å; I34-W37 HydrophobicContact CB-CZ2 4.46Å; I34-W37 HydrophobicContact CD1-CZ2 4.13Å; I34-W37 HydrophobicContact CG1-CZ2 3.79Å; W37-Q40 PolarHBondContact O-N 2.77Å; W37-Y41 PolarHBondContact O-N 3.19Å; W37-Q380 HydrophobicContact CZ2-CB 4.12Å; W37-V381 HydrophobicContact CH2-CG2 3.91Å; W37-V381 HydrophobicContact CZ3-CG2 3.62Å
38	A	87.1	Confident	86.7	Confident	43 Å²	43	89.4 Å²	89.4	36%	0.355	43%	0.431	S	S	.	.	S	Bend	trans	-64.6	-41.1	-176.2	0	0	0	0	0	113.4	I34 Q40 Y41	I34-A38 HydrophobicContact CG1-CB 4.1Å; I34-A38 WeakPolarHBondContact O-CB 3.18Å; I34-A38 PolarHBondContact O-N 3.05Å; A38-Q40 VanDerWaalsContact C-N 3.25Å; A38-Q40 PolarHBondContact O-N 2.87Å; A38-Y41 VanDerWaalsContact O-CB 3.3Å; A38-Y41 WeakPolarHBondContact O-CB 3.36Å; A38-Y41 PolarHBondContact O-N 2.82Å
39	P	86.8	Confident	87.2	Confident	102 Å²	102	88.6 Å²	88.6	66%	0.662	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.7	176.2	-21.1	34.4	0	0	0	113.9	L35 Y41	L35-P39 WeakPolarHBondContact O-CD 3.4Å; L35-P39 WeakPolarHBondContact O-CG 3.36Å; P39-Y41 VanDerWaalsContact C-N 3.27Å
40	Q	87.6	Confident	88	Confident	131 Å²	131	82.2 Å²	82.2	61%	0.612	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	7.6	179.6	-64	178.9	-5.9	0	0	112.4	E36 W37 A38 N42	E36-Q40 WeakPolarHBondContact O-CG 3.45Å; W37-Q40 PolarHBondContact O-N 2.77Å; A38-Q40 VanDerWaalsContact C-N 3.25Å; A38-Q40 PolarHBondContact O-N 2.87Å; Q40-N42 PolarHBondContact O-N 3.01Å
41	Y	88.7	Confident	88.6	Confident	33 Å²	33	75.6 Å²	75.6	13%	0.129	38%	0.378	C	S	.	.			trans	-80.8	111.4	-174.4	-170.5	-107.4	0	0	0	112.9	W37 A38 P39 L43 N46 L47 D50 T379 V381	W37-Y41 PolarHBondContact O-N 3.19Å; A38-Y41 VanDerWaalsContact O-CB 3.3Å; A38-Y41 WeakPolarHBondContact O-CB 3.36Å; A38-Y41 PolarHBondContact O-N 2.82Å; P39-Y41 VanDerWaalsContact C-N 3.27Å; Y41-L43 HydrophobicContact CD1-CD2 3.88Å; Y41-L43 HydrophobicContact CD1-CG 4.21Å; Y41-L43 HydrophobicContact CE1-CD2 3.87Å; Y41-L43 HydrophobicContact CE1-CG 4.5Å; Y41-L43 PolarHBondContact O-N 2.97Å; Y41-L43 VanDerWaalsContact O-N 3.15Å; Y41-N46 HydrophobicContact CD2-CB 4.24Å; Y41-N46 HydrophobicContact CE1-CB 4.41Å; Y41-N46 HydrophobicContact CE2-CB 3.4Å; Y41-N46 WeakPolarHBondContact OH-CB 3.39Å; Y41-N46 PolarHBondContact OH-O 3.46Å; Y41-L47 WeakPolarHBondContact OH-CA 3.24Å; Y41-L47 PolarHBondContact OH-N 2.88Å; Y41-D50 VanDerWaalsContact CE2-OD2 3.27Å; Y41-D50 WeakPolarHBondContact CE2-OD2 3.4Å; Y41-D50 PolarHBondContact OH-OD2 3.15Å; Y41-T379 HydrophobicContact CD2-CG2 3.69Å; Y41-T379 HydrophobicContact CE2-CG2 3.63Å; Y41-T379 VanDerWaalsContact CE2-OG1 3.22Å; Y41-T379 WeakPolarHBondContact CE2-OG1 3.36Å; Y41-V381 HydrophobicContact CD2-CG2 4.29Å; Y41-V381 HydrophobicContact CE1-CG2 4.31Å; Y41-V381 HydrophobicContact CE2-CB 4.39Å; Y41-V381 HydrophobicContact CE2-CG2 3.92Å
42	N	89.1	Confident	88.7	Confident	89 Å²	89	76.4 Å²	76.4	48%	0.476	39%	0.388	S	S	.	.			trans	-76.7	98	172.6	-71.8	-15.9	0	0	0	111.4	Q40 R44 E45 N46	Q40-N42 PolarHBondContact O-N 3.01Å; N42-R44 VanDerWaalsContact C-N 3.32Å; N42-R44 PolarHBondContact O-N 3.11Å; N42-E45 HydrophobicContact CB-CB 4.38Å; N42-E45 PolarHBondContact ND2-OE2 2.91Å; N42-E45 PolarHBondContact O-N 3.49Å; N42-N46 WeakPolarHBondContact O-CB 3.49Å; N42-N46 PolarHBondContact O-N 3.21Å
43	L	88.8	Confident	88.8	Confident	117 Å²	117	74.4 Å²	74.4	61%	0.613	38%	0.378	S	S	*	.	H	α-helix	trans	-55	-41.9	179.4	-73.3	166.6	0	0	0	113.4	Y41 E45 L47	Y41-L43 HydrophobicContact CD1-CD2 3.88Å; Y41-L43 HydrophobicContact CD1-CG 4.21Å; Y41-L43 HydrophobicContact CE1-CD2 3.87Å; Y41-L43 HydrophobicContact CE1-CG 4.5Å; Y41-L43 PolarHBondContact O-N 2.97Å; Y41-L43 VanDerWaalsContact O-N 3.15Å; L43-E45 PolarHBondContact O-N 2.87Å; L43-L47 WeakPolarHBondContact O-CB 3.49Å; L43-L47 PolarHBondContact O-N 3.06Å
44	R	86.6	Confident	89.1	Confident	250 Å²	250	73.9 Å²	73.9	94%	0.943	38%	0.375	S	S	*	.	H	α-helix	trans	-68.5	-32.8	-175	-70.4	-174.1	-179.7	-177.3	0.6	113.7	N42	N42-R44 VanDerWaalsContact C-N 3.32Å; N42-R44 PolarHBondContact O-N 3.11Å
45	E	89.3	Confident	89.2	Confident	133 Å²	133	74.5 Å²	74.5	62%	0.621	38%	0.378	S	S	*	.	H	α-helix	trans	-96	-38.7	-174.2	-65.4	179.1	160.4	0	0	112.2	N42 L43 P49	N42-E45 HydrophobicContact CB-CB 4.38Å; N42-E45 PolarHBondContact ND2-OE2 2.91Å; N42-E45 PolarHBondContact O-N 3.49Å; L43-E45 PolarHBondContact O-N 2.87Å; E45-P49 VanDerWaalsContact O-CD 3.3Å; E45-P49 WeakPolarHBondContact O-CD 3.22Å; E45-P49 WeakPolarHBondContact O-CG 3.42Å
46	N	90.3	Very high	89.3	Confident	29 Å²	29	72 Å²	72	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-97.9	-20.9	-169.1	-62.3	-31.6	0	0	0	113.6	Y41 N42 L48 P49 D50 K378	Y41-N46 HydrophobicContact CD2-CB 4.24Å; Y41-N46 HydrophobicContact CE1-CB 4.41Å; Y41-N46 HydrophobicContact CE2-CB 3.4Å; Y41-N46 WeakPolarHBondContact OH-CB 3.39Å; Y41-N46 PolarHBondContact OH-O 3.46Å; N42-N46 WeakPolarHBondContact O-CB 3.49Å; N42-N46 PolarHBondContact O-N 3.21Å; N46-L48 PolarHBondContact O-N 3.4Å; N46-P49 VanDerWaalsContact O-CD 3.28Å; N46-P49 WeakPolarHBondContact O-CD 3.48Å; N46-P49 VanDerWaalsContact O-CG 3.3Å; N46-P49 WeakPolarHBondContact O-CG 3.43Å; N46-D50 VanDerWaalsContact O-CB 3.24Å; N46-D50 WeakPolarHBondContact O-CB 3.39Å; N46-D50 PolarHBondContact O-N 3.04Å; N46-K378 HydrophobicContact CB-CB 4.27Å; N46-K378 HydrophobicContact CB-CG 4.42Å
47	L	91.1	Very high	89.6	Confident	78 Å²	78	66.9 Å²	66.9	41%	0.408	34%	0.34	S	S	.	.	H	α-helix	trans	-64.9	-43.4	-174.6	-175.8	66.9	0	0	0	112.4	Y41 L43 T51	Y41-L47 WeakPolarHBondContact OH-CA 3.24Å; Y41-L47 PolarHBondContact OH-N 2.88Å; L43-L47 WeakPolarHBondContact O-CB 3.49Å; L43-L47 PolarHBondContact O-N 3.06Å; L47-T51 VanDerWaalsContact O-CB 3.22Å; L47-T51 WeakPolarHBondContact O-CB 3.41Å; L47-T51 PolarHBondContact O-N 2.91Å; L47-T51 PolarHBondContact O-OG1 2.83Å
48	L	90.4	Very high	89.9	Confident	126 Å²	126	65.7 Å²	65.7	66%	0.66	34%	0.337	S	S	*	.	H	α-helix	trans	-62.8	-54.3	179.3	-167.7	160.9	0	0	0	112.2	N46 D50 T51 V52	N46-L48 PolarHBondContact O-N 3.4Å; L48-D50 PolarHBondContact O-N 3.47Å; L48-T51 PolarHBondContact O-N 3.25Å; L48-V52 HydrophobicContact CD2-CG2 4.17Å; L48-V52 WeakPolarHBondContact O-CG2 3.35Å; L48-V52 PolarHBondContact O-N 3.17Å
49	P	89.6	Confident	89.9	Confident	29 Å²	29	64.5 Å²	64.5	19%	0.188	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-42	178	22.4	-31.3	0	0	0	112	E45 N46 T51 V52 S53 K378	E45-P49 VanDerWaalsContact O-CD 3.3Å; E45-P49 WeakPolarHBondContact O-CD 3.22Å; E45-P49 WeakPolarHBondContact O-CG 3.42Å; N46-P49 VanDerWaalsContact O-CD 3.28Å; N46-P49 WeakPolarHBondContact O-CD 3.48Å; N46-P49 VanDerWaalsContact O-CG 3.3Å; N46-P49 WeakPolarHBondContact O-CG 3.43Å; P49-T51 VanDerWaalsContact C-N 3.3Å; P49-T51 PolarHBondContact O-N 2.97Å; P49-V52 PolarHBondContact O-N 3.18Å; P49-S53 VanDerWaalsContact O-CB 3.26Å; P49-S53 WeakPolarHBondContact O-CB 3.39Å; P49-S53 PolarHBondContact O-N 2.89Å; P49-S53 PolarHBondContact O-OG 3.01Å; P49-S53 VanDerWaalsContact O-OG 3.09Å; P49-K378 HydrophobicContact CG-CG 4.26Å
50	D	92.8	Very high	90	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-33.7	177.9	-74.4	-23.1	0	0	0	112.1	Y41 N46 L48 G54 K378 T379 V381 A382	Y41-D50 VanDerWaalsContact CE2-OD2 3.27Å; Y41-D50 WeakPolarHBondContact CE2-OD2 3.4Å; Y41-D50 PolarHBondContact OH-OD2 3.15Å; N46-D50 VanDerWaalsContact O-CB 3.24Å; N46-D50 WeakPolarHBondContact O-CB 3.39Å; N46-D50 PolarHBondContact O-N 3.04Å; L48-D50 PolarHBondContact O-N 3.47Å; D50-G54 WeakPolarHBondContact O-CA 3.24Å; D50-G54 PolarHBondContact O-N 2.84Å; D50-K378 PolarHBondContact OD1-N 3.06Å; D50-T379 PolarHBondContact OD1-N 3.45Å; D50-T379 PolarHBondContact OD2-OG1 3.08Å; D50-V381 HydrophobicContact CB-CB 4.34Å; D50-V381 HydrophobicContact CB-CG1 4.37Å; D50-A382 HydrophobicContact CB-CB 4.15Å; D50-A382 WeakPolarHBondContact O-CA 3.48Å; D50-A382 WeakPolarHBondContact O-CB 3.43Å
51	T	92.2	Very high	90.2	Very high	46 Å²	46	55.6 Å²	55.6	28%	0.282	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-48.3	175.7	-57.7	0	0	0	0	111.4	L47 L48 P49 S53 G54 I55 I385	L47-T51 VanDerWaalsContact O-CB 3.22Å; L47-T51 WeakPolarHBondContact O-CB 3.41Å; L47-T51 PolarHBondContact O-N 2.91Å; L47-T51 PolarHBondContact O-OG1 2.83Å; L48-T51 PolarHBondContact O-N 3.25Å; P49-T51 VanDerWaalsContact C-N 3.3Å; P49-T51 PolarHBondContact O-N 2.97Å; T51-S53 PolarHBondContact O-N 3.35Å; T51-G54 PolarHBondContact O-N 3.12Å; T51-I55 HydrophobicContact CG2-CD1 4.06Å; T51-I55 VanDerWaalsContact O-CG1 3.28Å; T51-I55 WeakPolarHBondContact O-CG1 3.39Å; T51-I55 PolarHBondContact O-N 3.18Å; T51-I385 WeakPolarHBondContact OG1-CD1 3.2Å
52	V	89.6	Confident	90.2	Very high	70 Å²	70	54.7 Å²	54.7	42%	0.424	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-46.8	177.8	174.3	0	0	0	0	110.3	L48 P49 G54 I55 M56	L48-V52 HydrophobicContact CD2-CG2 4.17Å; L48-V52 WeakPolarHBondContact O-CG2 3.35Å; L48-V52 PolarHBondContact O-N 3.17Å; P49-V52 PolarHBondContact O-N 3.18Å; V52-G54 VanDerWaalsContact C-N 3.34Å; V52-G54 PolarHBondContact O-N 3.35Å; V52-I55 PolarHBondContact O-N 3.11Å; V52-M56 WeakPolarHBondContact O-CG 3.43Å; V52-M56 PolarHBondContact O-N 3.05Å; V52-M56 VanDerWaalsContact O-N 3.11Å
53	S	90.9	Very high	90	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.007	25%	0.25	C	S	.	.	H	α-helix	trans	-59.6	-42	174.6	-70.8	0	0	0	0	112.6	P49 T51 M56 L57 T375 A377	P49-S53 VanDerWaalsContact O-CB 3.26Å; P49-S53 WeakPolarHBondContact O-CB 3.39Å; P49-S53 PolarHBondContact O-N 2.89Å; P49-S53 PolarHBondContact O-OG 3.01Å; P49-S53 VanDerWaalsContact O-OG 3.09Å; T51-S53 PolarHBondContact O-N 3.35Å; S53-M56 PolarHBondContact O-N 3.06Å; S53-L57 VanDerWaalsContact O-CB 3.26Å; S53-L57 WeakPolarHBondContact O-CB 3.32Å; S53-L57 PolarHBondContact O-N 2.97Å; S53-T375 WeakPolarHBondContact CB-OG1 3.43Å; S53-T375 WeakPolarHBondContact OG-CB 3.16Å; S53-T375 PolarHBondContact OG-OG1 2.73Å; S53-A377 WeakPolarHBondContact OG-CA 3.41Å; S53-A377 PolarHBondContact OG-N 3.3Å
54	G	93.2	Very high	90	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-39.5	179.6	0	0	0	0	0	113.4	D50 T51 V52 L57 A58 A382 S386	D50-G54 WeakPolarHBondContact O-CA 3.24Å; D50-G54 PolarHBondContact O-N 2.84Å; T51-G54 PolarHBondContact O-N 3.12Å; V52-G54 VanDerWaalsContact C-N 3.34Å; V52-G54 PolarHBondContact O-N 3.35Å; G54-L57 PolarHBondContact O-N 3.03Å; G54-A58 WeakPolarHBondContact O-CB 3.41Å; G54-A58 PolarHBondContact O-N 3.32Å; G54-A382 WeakPolarHBondContact CA-O 3.47Å; G54-S386 WeakPolarHBondContact O-CA 3.42Å; G54-S386 VanDerWaalsContact O-CB 3.23Å; G54-S386 WeakPolarHBondContact O-CB 3.2Å
55	I	90.9	Very high	90.2	Very high	55 Å²	55	33.8 Å²	33.8	28%	0.282	18%	0.18	S	C	.	.	H	α-helix	trans	-65.2	-45.8	174.3	-62.4	167.4	0	0	0	110.2	T51 V52 L57 A58 V59 F389	T51-I55 HydrophobicContact CG2-CD1 4.06Å; T51-I55 VanDerWaalsContact O-CG1 3.28Å; T51-I55 WeakPolarHBondContact O-CG1 3.39Å; T51-I55 PolarHBondContact O-N 3.18Å; V52-I55 PolarHBondContact O-N 3.11Å; I55-L57 VanDerWaalsContact C-N 3.31Å; I55-L57 PolarHBondContact O-N 3.32Å; I55-A58 WeakPolarHBondContact O-CB 3.35Å; I55-A58 PolarHBondContact O-N 3.37Å; I55-V59 PolarHBondContact O-N 2.92Å; I55-V59 VanDerWaalsContact O-N 3.12Å; I55-F389 HydrophobicContact CD1-CE2 4.15Å; I55-F389 HydrophobicContact CD1-CZ 3.88Å; I55-F389 HydrophobicContact CG1-CD2 4.03Å; I55-F389 HydrophobicContact CG1-CE1 4.19Å; I55-F389 HydrophobicContact CG1-CE2 3.43Å; I55-F389 VanDerWaalsContact CG1-CE2 3.43Å; I55-F389 HydrophobicContact CG1-CZ 3.52Å
56	M	88.4	Confident	90.3	Very high	38 Å²	38	27.5 Å²	27.5	19%	0.187	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-38.5	178.2	-65.9	-51.1	91.2	0	0	111.7	V52 S53 Q60 P260 T375	V52-M56 WeakPolarHBondContact O-CG 3.43Å; V52-M56 PolarHBondContact O-N 3.05Å; V52-M56 VanDerWaalsContact O-N 3.11Å; S53-M56 PolarHBondContact O-N 3.06Å; M56-Q60 PolarHBondContact O-N 3.42Å; M56-P260 HydrophobicContact CE-CG 4.49Å; M56-P260 HydrophobicContact SD-CB 3.97Å; M56-P260 HydrophobicContact SD-CG 4.15Å; M56-T375 HydrophobicContact CB-CG2 4.2Å; M56-T375 HydrophobicContact CG-CG2 4.12Å
57	L	91.6	Very high	90.2	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-44.2	173.7	177.6	61.6	0	0	0	111.2	S53 G54 I55 V59 Q60 Q61 A100 R368 L372 C383	S53-L57 VanDerWaalsContact O-CB 3.26Å; S53-L57 WeakPolarHBondContact O-CB 3.32Å; S53-L57 PolarHBondContact O-N 2.97Å; G54-L57 PolarHBondContact O-N 3.03Å; I55-L57 VanDerWaalsContact C-N 3.31Å; I55-L57 PolarHBondContact O-N 3.32Å; L57-V59 VanDerWaalsContact C-N 3.3Å; L57-V59 PolarHBondContact O-N 3.41Å; L57-Q60 PolarHBondContact O-N 3.05Å; L57-Q60 VanDerWaalsContact O-N 3.15Å; L57-Q61 VanDerWaalsContact O-CB 3.22Å; L57-Q61 WeakPolarHBondContact O-CB 3.33Å; L57-Q61 PolarHBondContact O-N 3.3Å; L57-A100 HydrophobicContact CD1-CB 3.95Å; L57-A100 HydrophobicContact CD2-CB 4.29Å; L57-R368 HydrophobicContact CD1-CB 3.72Å; L57-R368 HydrophobicContact CD1-CG 4.08Å; L57-L372 HydrophobicContact CB-CD2 4.3Å; L57-L372 HydrophobicContact CD2-CD1 4.22Å; L57-L372 HydrophobicContact CD2-CD2 4.04Å; L57-L372 HydrophobicContact CD2-CG 4.34Å; L57-C383 HydrophobicContact CD2-CB 4.4Å
58	A	92.5	Very high	90.2	Very high	5 Å²	5	23.1 Å²	23.1	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-43.1	179.5	0	0	0	0	0	112	G54 I55 Q61 V62 F389	G54-A58 WeakPolarHBondContact O-CB 3.41Å; G54-A58 PolarHBondContact O-N 3.32Å; I55-A58 WeakPolarHBondContact O-CB 3.35Å; I55-A58 PolarHBondContact O-N 3.37Å; A58-Q61 WeakPolarHBondContact O-CB 3.4Å; A58-Q61 PolarHBondContact O-N 3.08Å; A58-V62 VanDerWaalsContact O-CG2 3.31Å; A58-V62 WeakPolarHBondContact O-CG2 3.48Å; A58-V62 PolarHBondContact O-N 3.48Å; A58-F389 HydrophobicContact CB-CB 3.42Å; A58-F389 VanDerWaalsContact CB-CB 3.42Å; A58-F389 HydrophobicContact CB-CG 4.24Å
59	V	88.4	Confident	90.3	Very high	19 Å²	19	17.1 Å²	17.1	12%	0.115	10%	0.096	C	C	.	.	H	α-helix	trans	-55.4	-55.6	173.7	165.8	0	0	0	0	110.4	I55 L57 Q61 V62 T63 P260 L263	I55-V59 PolarHBondContact O-N 2.92Å; I55-V59 VanDerWaalsContact O-N 3.12Å; L57-V59 VanDerWaalsContact C-N 3.3Å; L57-V59 PolarHBondContact O-N 3.41Å; V59-Q61 PolarHBondContact O-N 3.41Å; V59-V62 PolarHBondContact O-N 3.39Å; V59-T63 WeakPolarHBondContact O-CG2 3.47Å; V59-T63 PolarHBondContact O-N 3.17Å; V59-T63 VanDerWaalsContact O-N 3.14Å; V59-P260 HydrophobicContact CG1-CB 4.2Å; V59-L263 HydrophobicContact CG1-CB 3.62Å; V59-L263 HydrophobicContact CG1-CD1 4.47Å; V59-L263 HydrophobicContact CG1-CG 4.47Å; V59-L263 HydrophobicContact CG2-CB 4.38Å; V59-L263 HydrophobicContact CG2-CD1 4.47Å; V59-L263 HydrophobicContact CG2-CD2 3.95Å
60	Q	88.1	Confident	90.2	Very high	43 Å²	43	16.6 Å²	16.6	20%	0.201	9%	0.091	C	C	.	.	H	α-helix	trans	-59.8	-35.1	179.6	-68.5	-177.6	-26.7	0	0	112.2	M56 L57 T63 Q64 R368	M56-Q60 PolarHBondContact O-N 3.42Å; L57-Q60 PolarHBondContact O-N 3.05Å; L57-Q60 VanDerWaalsContact O-N 3.15Å; Q60-T63 PolarHBondContact O-OG1 3.24Å; Q60-T63 VanDerWaalsContact O-OG1 3.08Å; Q60-Q64 VanDerWaalsContact O-CB 3.27Å; Q60-Q64 WeakPolarHBondContact O-CB 3.35Å; Q60-Q64 VanDerWaalsContact O-CG 3.31Å; Q60-Q64 WeakPolarHBondContact O-CG 3.4Å; Q60-Q64 PolarHBondContact O-N 3.28Å; Q60-R368 HydrophobicContact CB-CG 4.49Å
61	Q	90.9	Very high	90	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.009	9%	0.094	C	C	.	.	H	α-helix	trans	-68.9	-41.8	-179	-165.5	72.1	46.6	0	0	111.9	L57 A58 V59 G65 S83 R368 V390	L57-Q61 VanDerWaalsContact O-CB 3.22Å; L57-Q61 WeakPolarHBondContact O-CB 3.33Å; L57-Q61 PolarHBondContact O-N 3.3Å; A58-Q61 WeakPolarHBondContact O-CB 3.4Å; A58-Q61 PolarHBondContact O-N 3.08Å; V59-Q61 PolarHBondContact O-N 3.41Å; Q61-G65 WeakPolarHBondContact O-CA 3.36Å; Q61-G65 PolarHBondContact O-N 2.9Å; Q61-S83 WeakPolarHBondContact CG-OG 3.33Å; Q61-S83 PolarHBondContact NE2-OG 3.44Å; Q61-R368 VanDerWaalsContact CD-NH1 3.35Å; Q61-V390 HydrophobicContact CB-CG2 4.28Å; Q61-V390 HydrophobicContact CG-CG2 4.17Å
62	V	89.7	Confident	90	Very high	15 Å²	15	15 Å²	15	9%	0.091	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-49.2	175.4	171.4	0	0	0	0	110	A58 V59 L66 L80 V390 V393 L401	A58-V62 VanDerWaalsContact O-CG2 3.31Å; A58-V62 WeakPolarHBondContact O-CG2 3.48Å; A58-V62 PolarHBondContact O-N 3.48Å; V59-V62 PolarHBondContact O-N 3.39Å; V62-L66 HydrophobicContact CG1-CD1 4.25Å; V62-L66 WeakPolarHBondContact O-CD1 3.39Å; V62-L66 VanDerWaalsContact O-CG 3.27Å; V62-L66 WeakPolarHBondContact O-CG 3.45Å; V62-L66 PolarHBondContact O-N 3.3Å; V62-L80 HydrophobicContact CB-CD2 4.34Å; V62-L80 HydrophobicContact CG1-CD2 4.11Å; V62-L80 HydrophobicContact CG2-CD2 4.32Å; V62-V390 HydrophobicContact CG2-CG2 4.25Å; V62-V393 HydrophobicContact CG1-CG1 4.03Å; V62-V393 HydrophobicContact CG2-CB 4.17Å; V62-V393 HydrophobicContact CG2-CG1 3.96Å; V62-V393 HydrophobicContact CG2-CG2 3.89Å; V62-L401 HydrophobicContact CG1-CD1 4.27Å
63	T	85.6	Confident	90	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-63.5	-53.9	-176.4	69.8	0	0	0	0	111.4	V59 Q60 S67 D262 I266	V59-T63 WeakPolarHBondContact O-CG2 3.47Å; V59-T63 PolarHBondContact O-N 3.17Å; V59-T63 VanDerWaalsContact O-N 3.14Å; Q60-T63 PolarHBondContact O-OG1 3.24Å; Q60-T63 VanDerWaalsContact O-OG1 3.08Å; T63-S67 PolarHBondContact O-N 3.48Å; T63-S67 PolarHBondContact O-OG 2.98Å; T63-D262 HydrophobicContact CG2-CB 4.26Å; T63-I266 HydrophobicContact CG2-CD1 3.07Å; T63-I266 HydrophobicContact CG2-CG1 4.36Å
64	Q	88.3	Confident	90.1	Very high	16 Å²	16	12.9 Å²	12.9	8%	0.075	7%	0.069	C	C	.	.	H	α-helix	trans	-72.9	-32.1	-177.5	-64.6	176.7	5.5	0	0	111.9	Q60 S67 F68	Q60-Q64 VanDerWaalsContact O-CB 3.27Å; Q60-Q64 WeakPolarHBondContact O-CB 3.35Å; Q60-Q64 VanDerWaalsContact O-CG 3.31Å; Q60-Q64 WeakPolarHBondContact O-CG 3.4Å; Q60-Q64 PolarHBondContact O-N 3.28Å; Q64-S67 PolarHBondContact O-N 3.33Å; Q64-F68 HydrophobicContact CB-CD2 4.19Å; Q64-F68 HydrophobicContact CB-CE2 3.81Å; Q64-F68 HydrophobicContact CB-CZ 4.22Å; Q64-F68 VanDerWaalsContact O-CB 3.31Å; Q64-F68 WeakPolarHBondContact O-CB 3.38Å; Q64-F68 VanDerWaalsContact O-CD2 3.26Å; Q64-F68 WeakPolarHBondContact O-CD2 3.43Å; Q64-F68 WeakPolarHBondContact O-CG 3.36Å; Q64-F68 PolarHBondContact O-N 2.83Å
65	G	90.8	Very high	90	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-54	-57.2	174.8	0	0	0	0	0	111.6	Q61 S67 F68 A69 G79 T103	Q61-G65 WeakPolarHBondContact O-CA 3.36Å; Q61-G65 PolarHBondContact O-N 2.9Å; G65-S67 PolarHBondContact O-N 3.45Å; G65-F68 PolarHBondContact O-N 3.28Å; G65-A69 PolarHBondContact O-N 3.08Å; G65-A69 VanDerWaalsContact O-N 3.09Å; G65-G79 WeakPolarHBondContact O-CA 3.37Å; G65-T103 WeakPolarHBondContact CA-OG1 3.42Å
66	L	90.5	Very high	90	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-56.1	-49.4	178.6	-65.1	166.1	0	0	0	111.2	V62 F68 A69 I70 P76 L80 I290 L401 L404	V62-L66 HydrophobicContact CG1-CD1 4.25Å; V62-L66 WeakPolarHBondContact O-CD1 3.39Å; V62-L66 VanDerWaalsContact O-CG 3.27Å; V62-L66 WeakPolarHBondContact O-CG 3.45Å; V62-L66 PolarHBondContact O-N 3.3Å; L66-F68 VanDerWaalsContact C-N 3.35Å; L66-F68 PolarHBondContact O-N 3.49Å; L66-A69 PolarHBondContact O-N 2.83Å; L66-I70 WeakPolarHBondContact O-CD1 3.48Å; L66-I70 WeakPolarHBondContact O-CG1 3.38Å; L66-I70 PolarHBondContact O-N 3.46Å; L66-P76 HydrophobicContact CB-CB 4.42Å; L66-P76 HydrophobicContact CD2-CB 3.78Å; L66-L80 HydrophobicContact CD2-CD1 4.21Å; L66-L80 HydrophobicContact CD2-CD2 4.07Å; L66-L80 HydrophobicContact CD2-CG 3.96Å; L66-L80 HydrophobicContact CG-CD2 4.08Å; L66-I290 HydrophobicContact CD2-CD1 4.21Å; L66-L401 HydrophobicContact CD1-CD1 4.12Å; L66-L404 HydrophobicContact CD1-CD2 4.45Å
67	S	88.1	Confident	90.1	Very high	4 Å²	4	9.9 Å²	9.9	3%	0.028	5%	0.054	C	C	.	.	H	α-helix	trans	-64.7	-37	-178.1	-39.4	0	0	0	0	113.3	T63 Q64 G65 I70 L71 L409	T63-S67 PolarHBondContact O-N 3.48Å; T63-S67 PolarHBondContact O-OG 2.98Å; Q64-S67 PolarHBondContact O-N 3.33Å; G65-S67 PolarHBondContact O-N 3.45Å; S67-I70 WeakPolarHBondContact O-CB 3.12Å; S67-I70 PolarHBondContact O-N 2.85Å; S67-L71 WeakPolarHBondContact O-CB 3.22Å; S67-L71 PolarHBondContact O-N 3.09Å; S67-L409 WeakPolarHBondContact OG-CB 3.26Å; S67-L409 WeakPolarHBondContact OG-CD2 3.35Å
68	F	90.8	Very high	90.1	Very high	11 Å²	11	9.9 Å²	9.9	5%	0.048	5%	0.053	C	C	.	.	H	α-helix	trans	-76.7	-22	179.5	-66.1	-22.6	0	0	0	113.5	Q64 G65 L66 L71 S72 A105 S108 I413	Q64-F68 HydrophobicContact CB-CD2 4.19Å; Q64-F68 HydrophobicContact CB-CE2 3.81Å; Q64-F68 HydrophobicContact CB-CZ 4.22Å; Q64-F68 VanDerWaalsContact O-CB 3.31Å; Q64-F68 WeakPolarHBondContact O-CB 3.38Å; Q64-F68 VanDerWaalsContact O-CD2 3.26Å; Q64-F68 WeakPolarHBondContact O-CD2 3.43Å; Q64-F68 WeakPolarHBondContact O-CG 3.36Å; Q64-F68 PolarHBondContact O-N 2.83Å; G65-F68 PolarHBondContact O-N 3.28Å; L66-F68 VanDerWaalsContact C-N 3.35Å; L66-F68 PolarHBondContact O-N 3.49Å; F68-L71 HydrophobicContact CD1-CD2 4.29Å; F68-S72 PolarHBondContact O-N 3.14Å; F68-A105 HydrophobicContact CD1-CB 3.91Å; F68-A105 HydrophobicContact CE1-CB 3.46Å; F68-A105 VanDerWaalsContact CE1-CB 3.46Å; F68-A105 HydrophobicContact CZ-CB 3.82Å; F68-S108 WeakPolarHBondContact O-CB 3.12Å; F68-S108 PolarHBondContact O-OG 3.38Å; F68-I413 HydrophobicContact CD1-CD1 4.23Å; F68-I413 HydrophobicContact CD1-CG1 4.48Å; F68-I413 HydrophobicContact CE1-CD1 4.14Å; F68-I413 HydrophobicContact CE1-CG1 3.96Å; F68-I413 HydrophobicContact CE1-CG2 4.29Å
69	A	92.6	Very high	90.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-69.1	-44.6	166.9	0	0	0	0	0	111.5	G65 L66 L71 S72 S73 V74 I360	G65-A69 PolarHBondContact O-N 3.08Å; G65-A69 VanDerWaalsContact O-N 3.09Å; L66-A69 PolarHBondContact O-N 2.83Å; A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3Å; A69-S72 CarbonylContact O-C 3.44Å; A69-S72 WeakPolarHBondContact O-CA 3.41Å; A69-S72 WeakPolarHBondContact O-CB 3.4Å; A69-S72 PolarHBondContact O-N 2.93Å; A69-S73 PolarHBondContact O-N 3.47Å; A69-V74 CarbonylContact C-O 3.6Å; A69-V74 HydrophobicContact CB-CG2 3.98Å; A69-V74 VanDerWaalsContact O-CG2 3.29Å; A69-V74 WeakPolarHBondContact O-CG2 3.36Å; A69-V74 PolarHBondContact O-N 2.82Å; A69-V74 VanDerWaalsContact O-N 3.14Å; A69-I360 HydrophobicContact CB-CD1 4.3Å
70	I	88.8	Confident	90.3	Very high	19 Å²	19	8.7 Å²	8.7	10%	0.097	5%	0.046	C	C	.	.	H	α-helix	trans	-59.5	-41.1	173	-65	154.6	0	0	0	110.7	L66 S67 S72 S73 P76 Y197 M406 L409	L66-I70 WeakPolarHBondContact O-CD1 3.48Å; L66-I70 WeakPolarHBondContact O-CG1 3.38Å; L66-I70 PolarHBondContact O-N 3.46Å; S67-I70 WeakPolarHBondContact O-CB 3.12Å; S67-I70 PolarHBondContact O-N 2.85Å; I70-S72 PolarHBondContact O-N 3.03Å; I70-S73 PolarHBondContact O-N 3.37Å; I70-P76 HydrophobicContact CD1-CB 4.41Å; I70-P76 HydrophobicContact CD1-CG 3.99Å; I70-P76 HydrophobicContact CG1-CB 4.34Å; I70-P76 HydrophobicContact CG1-CG 3.74Å; I70-Y197 HydrophobicContact CG2-CE1 4.34Å; I70-Y197 HydrophobicContact CG2-CE2 3.85Å; I70-Y197 WeakPolarHBondContact CG2-OH 2.96Å; I70-M406 HydrophobicContact CD1-CE 3.55Å; I70-M406 HydrophobicContact CD1-SD 3.31Å; I70-M406 WeakPolarHBondContact CD1-SD 3.26Å; I70-M406 HydrophobicContact CG1-CE 4.01Å; I70-M406 HydrophobicContact CG1-SD 4.31Å; I70-L409 HydrophobicContact CD1-CD1 3.9Å
71	L	88.6	Confident	90.6	Very high	11 Å²	11	6.7 Å²	6.7	6%	0.058	4%	0.037	C	C	.	.	H	α-helix	trans	-65.2	-27.3	175.1	-172.4	58.4	0	0	0	112.9	S67 F68 A69 S73 A105 L109 A112 V190	S67-L71 WeakPolarHBondContact O-CB 3.22Å; S67-L71 PolarHBondContact O-N 3.09Å; F68-L71 HydrophobicContact CD1-CD2 4.29Å; A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3Å; L71-S73 PolarHBondContact O-N 2.81Å; L71-A105 HydrophobicContact CD2-CB 4.02Å; L71-A105 WeakPolarHBondContact CD2-O 3.42Å; L71-L109 HydrophobicContact CD1-CD1 4.13Å; L71-A112 VanDerWaalsContact O-CB 3.28Å; L71-A112 WeakPolarHBondContact O-CB 3.26Å; L71-V190 HydrophobicContact CD2-CG1 3.88Å; L71-V190 HydrophobicContact CD2-CG2 4.35Å
72	S	91.3	Very high	90.7	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	8.7	172.4	-174.9	0	0	0	0	113	F68 A69 I70 V74 S108 S111	F68-S72 PolarHBondContact O-N 3.14Å; A69-S72 CarbonylContact O-C 3.44Å; A69-S72 WeakPolarHBondContact O-CA 3.41Å; A69-S72 WeakPolarHBondContact O-CB 3.4Å; A69-S72 PolarHBondContact O-N 2.93Å; I70-S72 PolarHBondContact O-N 3.03Å; S72-V74 PolarHBondContact O-N 3.33Å; S72-S108 WeakPolarHBondContact CA-O 3.49Å; S72-S111 VanDerWaalsContact OG-CB 3.31Å; S72-S111 WeakPolarHBondContact OG-CB 3.48Å; S72-S111 PolarHBondContact OG-OG 3.47Å
73	S	90.6	Very high	90.8	Very high	18 Å²	18	5.9 Å²	5.9	13%	0.126	3%	0.032	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	27.4	-178.1	-76.8	0	0	0	0	114.3	A69 I70 L71 E116 R144	A69-S73 PolarHBondContact O-N 3.47Å; I70-S73 PolarHBondContact O-N 3.37Å; L71-S73 PolarHBondContact O-N 2.81Å; S73-E116 WeakPolarHBondContact CB-OE1 3.18Å; S73-E116 WeakPolarHBondContact OG-CG 3.31Å; S73-E116 PolarHBondContact OG-OE1 3.32Å; S73-R144 WeakPolarHBondContact O-CD 3.23Å; S73-R144 PolarHBondContact O-NH1 3.33Å
74	V	92.8	Very high	91.3	Very high	9 Å²	9	6.3 Å²	6.3	6%	0.055	3%	0.034	C	C	.	.	S	Bend	trans	-120.2	167.4	177.1	-59	0	0	0	0	111.4	A69 S72 F78 V115 R144 I145 A148 I360	A69-V74 CarbonylContact C-O 3.6Å; A69-V74 HydrophobicContact CB-CG2 3.98Å; A69-V74 VanDerWaalsContact O-CG2 3.29Å; A69-V74 WeakPolarHBondContact O-CG2 3.36Å; A69-V74 PolarHBondContact O-N 2.82Å; A69-V74 VanDerWaalsContact O-N 3.14Å; S72-V74 PolarHBondContact O-N 3.33Å; V74-F78 HydrophobicContact CB-CD2 4.28Å; V74-F78 HydrophobicContact CG2-CB 4.29Å; V74-F78 HydrophobicContact CG2-CD2 4.37Å; V74-V115 HydrophobicContact CG1-CG2 4.36Å; V74-R144 HydrophobicContact CG1-CB 4.33Å; V74-I145 HydrophobicContact CB-CD1 4.19Å; V74-I145 HydrophobicContact CG1-CB 4.49Å; V74-I145 HydrophobicContact CG1-CD1 4.05Å; V74-I145 HydrophobicContact CG2-CD1 4.11Å; V74-A148 HydrophobicContact CG1-CB 4.04Å; V74-I360 HydrophobicContact CG2-CG2 3.67Å
75	H	91.2	Very high	91.6	Very high	23 Å²	23	7 Å²	7	11%	0.106	4%	0.037	C	C	.	.			trans	-58.9	138.6	178.3	-167.8	-90.5	0	0	0	111.9	V77 F78 L137 E141 H289	H75-V77 VanDerWaalsContact ND1-CG1 3.32Å; H75-V77 WeakPolarHBondContact ND1-CG1 3.43Å; H75-V77 PolarHBondContact ND1-N 2.88Å; H75-V77 PolarHBondContact O-N 3.31Å; H75-V77 VanDerWaalsContact O-N 3.08Å; H75-F78 HydrophobicContact CB-CD2 3.82Å; H75-F78 HydrophobicContact CB-CE2 3.74Å; H75-F78 VanDerWaalsContact O-CD2 3.32Å; H75-F78 WeakPolarHBondContact O-CD2 3.42Å; H75-F78 PolarHBondContact O-N 3.02Å; H75-L137 HydrophobicContact CB-CD2 4.41Å; H75-E141 IonicContact CD2-OE1 2.75Å; H75-E141 PolarHBondContact CD2-OE1 3.06Å; H75-H289 PolarHBondContact CE1-O 2.88Å; H75-H289 PolarHBondContact NE2-O 3.19Å
76	P	89.8	Confident	91.9	Very high	8 Å²	8	7.1 Å²	7.1	5%	0.052	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-34	-173.6	-28.2	33.4	0	0	0	115.2	L66 I70 F78 G79 V287 M406	L66-P76 HydrophobicContact CB-CB 4.42Å; L66-P76 HydrophobicContact CD2-CB 3.78Å; I70-P76 HydrophobicContact CD1-CB 4.41Å; I70-P76 HydrophobicContact CD1-CG 3.99Å; I70-P76 HydrophobicContact CG1-CB 4.34Å; I70-P76 HydrophobicContact CG1-CG 3.74Å; P76-F78 PolarHBondContact O-N 2.77Å; P76-G79 WeakPolarHBondContact O-CA 3.43Å; P76-G79 PolarHBondContact O-N 3.3Å; P76-V287 HydrophobicContact CB-CG1 4.02Å; P76-V287 HydrophobicContact CG-CG1 4.01Å; P76-M406 HydrophobicContact CG-CE 4.36Å
77	V	90.7	Very high	92.1	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-55.9	-35.2	-177.9	73.1	0	0	0	0	113.5	H75 G79 L80 Y81 I290 P291	H75-V77 VanDerWaalsContact ND1-CG1 3.32Å; H75-V77 WeakPolarHBondContact ND1-CG1 3.43Å; H75-V77 PolarHBondContact ND1-N 2.88Å; H75-V77 PolarHBondContact O-N 3.31Å; H75-V77 VanDerWaalsContact O-N 3.08Å; V77-G79 PolarHBondContact O-N 2.85Å; V77-G79 VanDerWaalsContact O-N 3.12Å; V77-L80 WeakPolarHBondContact O-CB 3.3Å; V77-L80 PolarHBondContact O-N 2.8Å; V77-Y81 HydrophobicContact CG1-CE2 4.28Å; V77-Y81 HydrophobicContact CG2-CE1 4.25Å; V77-Y81 HydrophobicContact CG2-CE2 4.04Å; V77-Y81 PolarHBondContact O-N 3.12Å; V77-I290 HydrophobicContact CB-CG2 4.11Å; V77-I290 HydrophobicContact CG2-CG2 3.74Å; V77-P291 HydrophobicContact CB-CG 4.31Å; V77-P291 HydrophobicContact CG1-CG 4.04Å; V77-P291 HydrophobicContact CG2-CG 4.07Å
78	F	92.4	Very high	92.4	Very high	3 Å²	3	9.8 Å²	9.8	1%	0.013	5%	0.051	C	C	.	.	H	α-helix	trans	-66	-18.6	-179.9	-61.4	-63	0	0	0	112.6	V74 H75 P76 Y81 G82 L137 I145 F358 I360	V74-F78 HydrophobicContact CB-CD2 4.28Å; V74-F78 HydrophobicContact CG2-CB 4.29Å; V74-F78 HydrophobicContact CG2-CD2 4.37Å; H75-F78 HydrophobicContact CB-CD2 3.82Å; H75-F78 HydrophobicContact CB-CE2 3.74Å; H75-F78 VanDerWaalsContact O-CD2 3.32Å; H75-F78 WeakPolarHBondContact O-CD2 3.42Å; H75-F78 PolarHBondContact O-N 3.02Å; P76-F78 PolarHBondContact O-N 2.77Å; F78-Y81 AromaticContact CD1-CD2 3.74Å; F78-Y81 HydrophobicContact CD1-CD2 3.74Å; F78-Y81 AromaticContact CD1-CE2 3.92Å; F78-Y81 HydrophobicContact CD1-CE2 3.92Å; F78-Y81 HydrophobicContact CE1-CD2 4.37Å; F78-Y81 HydrophobicContact CE1-CE2 4.18Å; F78-Y81 PolarHBondContact O-N 3.23Å; F78-G82 PolarHBondContact O-N 3.05Å; F78-L137 HydrophobicContact CE1-CD1 4.46Å; F78-L137 HydrophobicContact CE2-CD1 4.38Å; F78-L137 HydrophobicContact CZ-CD1 3.7Å; F78-I145 HydrophobicContact CB-CD1 3.64Å; F78-I145 HydrophobicContact CB-CG1 4.29Å; F78-I145 HydrophobicContact CD1-CB 4.42Å; F78-I145 HydrophobicContact CD1-CD1 3.92Å; F78-I145 HydrophobicContact CD1-CG1 3.58Å; F78-I145 HydrophobicContact CD2-CB 3.92Å; F78-I145 HydrophobicContact CD2-CD1 3.74Å; F78-I145 HydrophobicContact CD2-CG1 3.74Å; F78-I145 HydrophobicContact CE1-CB 4.22Å; F78-I145 HydrophobicContact CE1-CG1 3.74Å; F78-I145 HydrophobicContact CE1-CG2 4.04Å; F78-I145 HydrophobicContact CE2-CB 3.66Å; F78-I145 HydrophobicContact CE2-CD1 4.37Å; F78-I145 HydrophobicContact CE2-CG1 3.87Å; F78-I145 HydrophobicContact CE2-CG2 3.86Å; F78-I145 HydrophobicContact CG-CB 4.3Å; F78-I145 HydrophobicContact CG-CD1 3.49Å; F78-I145 VanDerWaalsContact CG-CD1 3.49Å; F78-I145 HydrophobicContact CG-CG1 3.59Å; F78-I145 HydrophobicContact CZ-CB 3.83Å; F78-I145 HydrophobicContact CZ-CG1 3.88Å; F78-I145 HydrophobicContact CZ-CG2 3.57Å; F78-F358 HydrophobicContact CD1-CB 3.87Å; F78-F358 WeakPolarHBondContact CD1-O 3.23Å; F78-F358 HydrophobicContact CE1-CB 3.76Å; F78-F358 HydrophobicContact CE1-CG 4.43Å; F78-I360 HydrophobicContact CB-CG2 4.5Å
79	G	92.8	Very high	92.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-68.4	-33.7	171.2	0	0	0	0	0	113.1	G65 P76 V77 S83 T103	G65-G79 WeakPolarHBondContact O-CA 3.37Å; P76-G79 WeakPolarHBondContact O-CA 3.43Å; P76-G79 PolarHBondContact O-N 3.3Å; V77-G79 PolarHBondContact O-N 2.85Å; V77-G79 VanDerWaalsContact O-N 3.12Å; G79-S83 WeakPolarHBondContact O-CB 3.35Å; G79-S83 PolarHBondContact O-N 3.3Å; G79-S83 VanDerWaalsContact O-N 3.16Å; G79-S83 PolarHBondContact O-OG 3.36Å; G79-T103 WeakPolarHBondContact O-CG2 3.41Å
80	L	92.4	Very high	92.8	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-71.5	-37.8	174.5	-57.3	179.3	0	0	0	110.9	V62 L66 V77 S83 L84 V390 I394	V62-L80 HydrophobicContact CB-CD2 4.34Å; V62-L80 HydrophobicContact CG1-CD2 4.11Å; V62-L80 HydrophobicContact CG2-CD2 4.32Å; L66-L80 HydrophobicContact CD2-CD1 4.21Å; L66-L80 HydrophobicContact CD2-CD2 4.07Å; L66-L80 HydrophobicContact CD2-CG 3.96Å; L66-L80 HydrophobicContact CG-CD2 4.08Å; V77-L80 WeakPolarHBondContact O-CB 3.3Å; V77-L80 PolarHBondContact O-N 2.8Å; L80-S83 VanDerWaalsContact O-CB 3.28Å; L80-S83 WeakPolarHBondContact O-CB 3.43Å; L80-S83 PolarHBondContact O-N 3.24Å; L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 2.91Å; L80-L84 VanDerWaalsContact O-N 3.15Å; L80-V390 HydrophobicContact CB-CG1 4.49Å; L80-I394 HydrophobicContact CB-CD1 4.07Å; L80-I394 HydrophobicContact CB-CG1 3.93Å; L80-I394 HydrophobicContact CD1-CG1 3.98Å
81	Y	93.8	Very high	93.1	Very high	1 Å²	1	9.4 Å²	9.4	0%	0.004	5%	0.049	C	C	.	.	H	α-helix	trans	-69.3	-44.6	174.8	-51.8	-32.9	0	0	0	112	V77 F78 S83 L84 F85 G293 P295 C359 I394	V77-Y81 HydrophobicContact CG1-CE2 4.28Å; V77-Y81 HydrophobicContact CG2-CE1 4.25Å; V77-Y81 HydrophobicContact CG2-CE2 4.04Å; V77-Y81 PolarHBondContact O-N 3.12Å; F78-Y81 AromaticContact CD1-CD2 3.74Å; F78-Y81 HydrophobicContact CD1-CD2 3.74Å; F78-Y81 AromaticContact CD1-CE2 3.92Å; F78-Y81 HydrophobicContact CD1-CE2 3.92Å; F78-Y81 HydrophobicContact CE1-CD2 4.37Å; F78-Y81 HydrophobicContact CE1-CE2 4.18Å; F78-Y81 PolarHBondContact O-N 3.23Å; Y81-S83 PolarHBondContact O-N 2.74Å; Y81-S83 VanDerWaalsContact O-N 3.07Å; Y81-L84 PolarHBondContact O-N 3.44Å; Y81-F85 PolarHBondContact O-N 3.21Å; Y81-F85 VanDerWaalsContact O-N 3.08Å; Y81-G293 PolarHBondContact OH-O 3.39Å; Y81-P295 HydrophobicContact CD2-CG 4.04Å; Y81-P295 VanDerWaalsContact CE2-CD 3.41Å; Y81-P295 HydrophobicContact CE2-CG 3.78Å; Y81-C359 PolarHBondContact O-SG 2.87Å; Y81-C359 VanDerWaalsContact O-SG 3.37Å; Y81-I394 HydrophobicContact CD1-CD1 3.87Å; Y81-I394 HydrophobicContact CE1-CD1 3.97Å; Y81-I394 HydrophobicContact CE1-CG1 4.42Å; Y81-I394 HydrophobicContact CE1-CG2 4.19Å
82	G	93.1	Very high	93.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-65	-9.6	174.5	0	0	0	0	0	114.1	F78 P86 G102 T103	F78-G82 PolarHBondContact O-N 3.05Å; G82-P86 WeakPolarHBondContact O-CD 3.4Å; G82-P86 VanDerWaalsContact O-CG 3.29Å; G82-P86 WeakPolarHBondContact O-CG 3.39Å; G82-G102 CarbonylContact O-C 3.59Å; G82-G102 WeakPolarHBondContact O-CA 3.41Å; G82-T103 PolarHBondContact O-N 3.44Å
83	S	92.9	Very high	93.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-96.1	-23.8	173.7	-73.3	0	0	0	0	113.6	Q61 G79 L80 Y81	Q61-S83 WeakPolarHBondContact CG-OG 3.33Å; Q61-S83 PolarHBondContact NE2-OG 3.44Å; G79-S83 WeakPolarHBondContact O-CB 3.35Å; G79-S83 PolarHBondContact O-N 3.3Å; G79-S83 VanDerWaalsContact O-N 3.16Å; G79-S83 PolarHBondContact O-OG 3.36Å; L80-S83 VanDerWaalsContact O-CB 3.28Å; L80-S83 WeakPolarHBondContact O-CB 3.43Å; L80-S83 PolarHBondContact O-N 3.24Å; Y81-S83 PolarHBondContact O-N 2.74Å; Y81-S83 VanDerWaalsContact O-N 3.07Å
84	L	94.8	Very high	93.6	Very high	9 Å²	9	12.5 Å²	12.5	5%	0.047	6%	0.062	C	C	.	.	H	α-helix	trans	-90.6	-62	-175.9	178.2	67.5	0	0	0	111.1	L80 Y81 I88 I294 C387 V390 L391 I394	L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 2.91Å; L80-L84 VanDerWaalsContact O-N 3.15Å; Y81-L84 PolarHBondContact O-N 3.44Å; L84-I88 HydrophobicContact CD1-CD1 4.29Å; L84-I88 HydrophobicContact CG-CD1 4.36Å; L84-I88 WeakPolarHBondContact O-CG1 3.14Å; L84-I88 PolarHBondContact O-N 3.43Å; L84-I294 HydrophobicContact CD2-CD1 4.23Å; L84-C387 HydrophobicContact CD1-CB 3.58Å; L84-C387 WeakPolarHBondContact CD1-O 3.5Å; L84-V390 HydrophobicContact CB-CG1 4.22Å; L84-L391 HydrophobicContact CD2-CD1 4.28Å; L84-I394 HydrophobicContact CD2-CD1 4.28Å
85	F	95.5	Very high	93.5	Very high	32 Å²	32	14.3 Å²	14.3	14%	0.14	7%	0.071	C	C	.	.	H	α-helix	trans	-69.1	-46.7	-169.5	-68.9	-77.5	0	0	0	113.5	Y81 A87 I88 I89 I294 P354 F357	Y81-F85 PolarHBondContact O-N 3.21Å; Y81-F85 VanDerWaalsContact O-N 3.08Å; F85-A87 VanDerWaalsContact C-N 3.25Å; F85-A87 PolarHBondContact O-N 2.86Å; F85-I88 PolarHBondContact O-N 3.33Å; F85-I89 WeakPolarHBondContact O-CG1 3.37Å; F85-I89 PolarHBondContact O-N 3Å; F85-I89 VanDerWaalsContact O-N 3.13Å; F85-I294 HydrophobicContact CE2-CG2 4.16Å; F85-I294 HydrophobicContact CZ-CG2 3.79Å; F85-P354 HydrophobicContact CB-CB 3.73Å; F85-P354 HydrophobicContact CB-CG 3.79Å; F85-F357 HydrophobicContact CD1-CD2 4.11Å; F85-F357 HydrophobicContact CD1-CE2 4.38Å; F85-F357 HydrophobicContact CD1-CG 4.29Å; F85-F357 HydrophobicContact CD2-CB 3.85Å; F85-F357 HydrophobicContact CD2-CG 4.23Å; F85-F357 AromaticContact CE1-CD1 3.94Å; F85-F357 HydrophobicContact CE1-CD1 3.94Å; F85-F357 HydrophobicContact CE1-CD2 4.04Å; F85-F357 HydrophobicContact CE1-CE1 4.08Å; F85-F357 HydrophobicContact CE1-CE2 4.19Å; F85-F357 AromaticContact CE1-CG 3.91Å; F85-F357 HydrophobicContact CE1-CG 3.91Å; F85-F357 HydrophobicContact CE1-CZ 4.2Å; F85-F357 HydrophobicContact CE2-CB 3.59Å; F85-F357 HydrophobicContact CE2-CD1 4.08Å; F85-F357 AromaticContact CE2-CG 3.84Å; F85-F357 HydrophobicContact CE2-CG 3.84Å; F85-F357 HydrophobicContact CG-CB 4.43Å; F85-F357 HydrophobicContact CG-CD2 4.39Å; F85-F357 HydrophobicContact CG-CG 4.44Å; F85-F357 HydrophobicContact CZ-CB 3.96Å; F85-F357 AromaticContact CZ-CD1 3.55Å; F85-F357 HydrophobicContact CZ-CD1 3.55Å; F85-F357 HydrophobicContact CZ-CD2 4.27Å; F85-F357 HydrophobicContact CZ-CE1 4.06Å; F85-F357 AromaticContact CZ-CG 3.66Å; F85-F357 HydrophobicContact CZ-CG 3.66Å
86	P	95.6	Very high	93.5	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-60.5	-33.7	179.1	-26.2	37.4	0	0	0	113.8	G82 I89 Y90 T101 S350 P354 S362	G82-P86 WeakPolarHBondContact O-CD 3.4Å; G82-P86 VanDerWaalsContact O-CG 3.29Å; G82-P86 WeakPolarHBondContact O-CG 3.39Å; P86-I89 PolarHBondContact O-N 2.97Å; P86-Y90 VanDerWaalsContact O-CB 3.3Å; P86-Y90 WeakPolarHBondContact O-CB 3.27Å; P86-Y90 PolarHBondContact O-N 2.98Å; P86-T101 PolarHBondContact O-OG1 3.04Å; P86-S350 WeakPolarHBondContact CB-O 3.22Å; P86-P354 HydrophobicContact CB-CG 4.39Å; P86-P354 HydrophobicContact CG-CB 3.94Å; P86-P354 HydrophobicContact CG-CG 3.88Å; P86-S362 WeakPolarHBondContact CB-OG 3.43Å
87	A	94.8	Very high	93.4	Very high	2 Å²	2	17.6 Å²	17.6	2%	0.017	8%	0.082	C	C	.	.	H	α-helix	trans	-66.4	-40.7	177.4	0	0	0	0	0	112.1	F85 Y90 A91 T101	F85-A87 VanDerWaalsContact C-N 3.25Å; F85-A87 PolarHBondContact O-N 2.86Å; A87-Y90 PolarHBondContact O-N 3.44Å; A87-A91 WeakPolarHBondContact O-CB 3.27Å; A87-A91 PolarHBondContact O-N 2.94Å; A87-T101 WeakPolarHBondContact CA-OG1 3.44Å
88	I	95.8	Very high	93.4	Very high	59 Å²	59	18.1 Å²	18.1	30%	0.303	8%	0.084	S	C	.	.	H	α-helix	trans	-62.9	-47.8	175.4	-63.8	168	0	0	0	110.5	L84 F85 Y90 A91 I92 C387	L84-I88 HydrophobicContact CD1-CD1 4.29Å; L84-I88 HydrophobicContact CG-CD1 4.36Å; L84-I88 WeakPolarHBondContact O-CG1 3.14Å; L84-I88 PolarHBondContact O-N 3.43Å; F85-I88 PolarHBondContact O-N 3.33Å; I88-Y90 VanDerWaalsContact C-N 3.35Å; I88-Y90 PolarHBondContact O-N 3.43Å; I88-A91 PolarHBondContact O-N 3.16Å; I88-I92 HydrophobicContact CG2-CD1 4.41Å; I88-I92 WeakPolarHBondContact O-CG1 3.49Å; I88-I92 PolarHBondContact O-N 3.47Å; I88-C387 HydrophobicContact CD1-CB 4.41Å; I88-C387 HydrophobicContact CG1-CB 4.15Å
89	I	96.3	Very high	93.4	Very high	21 Å²	21	18 Å²	18	11%	0.108	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-42.7	-179.5	-57.5	-54.6	0	0	0	110.7	F85 P86 A91 I92 F93 L349 I353 P354	F85-I89 WeakPolarHBondContact O-CG1 3.37Å; F85-I89 PolarHBondContact O-N 3Å; F85-I89 VanDerWaalsContact O-N 3.13Å; P86-I89 PolarHBondContact O-N 2.97Å; I89-A91 VanDerWaalsContact C-N 3.35Å; I89-A91 PolarHBondContact O-N 2.95Å; I89-I92 WeakPolarHBondContact O-CB 3.39Å; I89-I92 PolarHBondContact O-N 2.88Å; I89-I92 VanDerWaalsContact O-N 3.13Å; I89-F93 HydrophobicContact CG2-CD2 3.83Å; I89-F93 HydrophobicContact CG2-CE2 4.23Å; I89-F93 WeakPolarHBondContact O-CD2 3.47Å; I89-F93 PolarHBondContact O-N 2.83Å; I89-F93 VanDerWaalsContact O-N 3.1Å; I89-L349 HydrophobicContact CG2-CB 3.87Å; I89-I353 HydrophobicContact CD1-CB 4.31Å; I89-I353 HydrophobicContact CD1-CD1 3.94Å; I89-I353 HydrophobicContact CD1-CG2 4.02Å; I89-I353 HydrophobicContact CG1-CB 4.32Å; I89-I353 HydrophobicContact CG1-CD1 4.44Å; I89-I353 HydrophobicContact CG1-CG2 4.41Å; I89-I353 HydrophobicContact CG2-CD1 4.23Å; I89-P354 HydrophobicContact CG1-CG 4.24Å
90	Y	95.8	Very high	93.4	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65.6	-35.7	177.8	-173.7	-95.4	0	0	0	112.9	P86 A87 I88 I92 F93 G94 G96 V99 T101 E343 A346 H347 S350	P86-Y90 VanDerWaalsContact O-CB 3.3Å; P86-Y90 WeakPolarHBondContact O-CB 3.27Å; P86-Y90 PolarHBondContact O-N 2.98Å; A87-Y90 PolarHBondContact O-N 3.44Å; I88-Y90 VanDerWaalsContact C-N 3.35Å; I88-Y90 PolarHBondContact O-N 3.43Å; Y90-I92 PolarHBondContact O-N 3.24Å; Y90-F93 PolarHBondContact O-N 3.47Å; Y90-G94 VanDerWaalsContact O-CA 3.31Å; Y90-G94 WeakPolarHBondContact O-CA 3.3Å; Y90-G94 PolarHBondContact O-N 3.44Å; Y90-G96 PolarHBondContact OH-N 3.36Å; Y90-V99 HydrophobicContact CE1-CB 3.89Å; Y90-V99 HydrophobicContact CE1-CG1 4.15Å; Y90-V99 WeakPolarHBondContact OH-CB 3.41Å; Y90-T101 WeakPolarHBondContact CB-OG1 3.33Å; Y90-T101 HydrophobicContact CD1-CG2 3.61Å; Y90-T101 HydrophobicContact CD2-CG2 3.4Å; Y90-T101 VanDerWaalsContact CD2-CG2 3.4Å; Y90-T101 HydrophobicContact CE1-CG2 3.96Å; Y90-T101 HydrophobicContact CE2-CG2 3.76Å; Y90-T101 HydrophobicContact CG-CG2 3.31Å; Y90-E343 WeakPolarHBondContact CE2-OE2 3.47Å; Y90-E343 PolarHBondContact OH-OE2 3.16Å; Y90-A346 HydrophobicContact CD2-CB 4.03Å; Y90-A346 HydrophobicContact CE2-CB 4.13Å; Y90-H347 AromaticContact CD2-NE2 4Å; Y90-H347 AromaticContact CE2-CE1 3.8Å; Y90-H347 AromaticContact CE2-NE2 3.4Å; Y90-H347 WeakPolarHBondContact CE2-NE2 3.47Å; Y90-S350 PolarHBondContact N-OG 3.19Å
91	A	94.1	Very high	93.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-27	174.7	0	0	0	0	0	113	A87 I88 I89 Q380 L384	A87-A91 WeakPolarHBondContact O-CB 3.27Å; A87-A91 PolarHBondContact O-N 2.94Å; I88-A91 PolarHBondContact O-N 3.16Å; I89-A91 VanDerWaalsContact C-N 3.35Å; I89-A91 PolarHBondContact O-N 2.95Å; A91-Q380 HydrophobicContact CB-CB 4.22Å; A91-L384 HydrophobicContact CB-CD1 4.36Å; A91-L384 HydrophobicContact CB-CD2 3.71Å; A91-L384 HydrophobicContact CB-CG 3.95Å
92	I	94.3	Very high	93.3	Very high	50 Å²	50	18 Å²	18	26%	0.256	8%	0.084	S	C	.	.	H	α-helix	trans	-82.2	-47.6	178.5	-62.7	167.4	0	0	0	111.5	L32 I34 I88 I89 Y90	L32-I92 HydrophobicContact CD2-CG2 3.81Å; I34-I92 HydrophobicContact CD1-CG1 4.11Å; I34-I92 HydrophobicContact CG2-CG2 4.09Å; I34-I92 PolarHBondContact N-O 3.41Å; I88-I92 HydrophobicContact CG2-CD1 4.41Å; I88-I92 WeakPolarHBondContact O-CG1 3.49Å; I88-I92 PolarHBondContact O-N 3.47Å; I89-I92 WeakPolarHBondContact O-CB 3.39Å; I89-I92 PolarHBondContact O-N 2.88Å; I89-I92 VanDerWaalsContact O-N 3.13Å; Y90-I92 PolarHBondContact O-N 3.24Å
93	F	94.3	Very high	93.3	Very high	42 Å²	42	18 Å²	18	18%	0.184	8%	0.084	C	C	.	.	H	α-helix	trans	-104.7	-20.1	-168	-67.2	-80.7	0	0	0	115.3	L32 P33 I89 Y90 Q342 A346 L349	L32-F93 HydrophobicContact CD2-CD1 3.84Å; L32-F93 HydrophobicContact CD2-CE1 3.43Å; L32-F93 VanDerWaalsContact CD2-CE1 3.43Å; L32-F93 HydrophobicContact CD2-CZ 3.96Å; P33-F93 WeakPolarHBondContact CD-O 3.36Å; P33-F93 WeakPolarHBondContact CG-O 3.39Å; I89-F93 HydrophobicContact CG2-CD2 3.83Å; I89-F93 HydrophobicContact CG2-CE2 4.23Å; I89-F93 WeakPolarHBondContact O-CD2 3.47Å; I89-F93 PolarHBondContact O-N 2.83Å; I89-F93 VanDerWaalsContact O-N 3.1Å; Y90-F93 PolarHBondContact O-N 3.47Å; F93-Q342 PolarHBondContact O-NE2 3.24Å; F93-A346 HydrophobicContact CB-CB 4.08Å; F93-L349 HydrophobicContact CD1-CD1 3.69Å; F93-L349 HydrophobicContact CD2-CD1 3.86Å; F93-L349 HydrophobicContact CE1-CD1 3.64Å; F93-L349 HydrophobicContact CE2-CD1 3.83Å; F93-L349 HydrophobicContact CG-CD1 3.8Å; F93-L349 HydrophobicContact CZ-CD1 3.72Å
94	G	92.9	Very high	93.2	Very high	2 Å²	2	18.7 Å²	18.7	2%	0.021	9%	0.087	C	C	.	.			trans	-81.1	147.7	-174.9	0	0	0	0	0	113.6	P33 Y90	P33-G94 WeakPolarHBondContact CB-O 3.41Å; Y90-G94 VanDerWaalsContact O-CA 3.31Å; Y90-G94 WeakPolarHBondContact O-CA 3.3Å; Y90-G94 PolarHBondContact O-N 3.44Å
95	M	91.3	Very high	92.9	Very high	48 Å²	48	18.4 Å²	18.4	24%	0.236	9%	0.086	C	C	.	.			trans	-95.5	-25.3	177.2	-64.1	-172.5	76	0	0	112.4	P33 R97 V338 N339 Q342 E343	P33-M95 HydrophobicContact CB-CG 4.46Å; P33-M95 HydrophobicContact CG-CG 3.83Å; M95-R97 PolarHBondContact O-N 2.72Å; M95-V338 HydrophobicContact CB-CG1 4.42Å; M95-V338 HydrophobicContact CB-CG2 4.4Å; M95-N339 HydrophobicContact CE-CB 4.37Å; M95-N339 HydrophobicContact SD-CB 3.51Å; M95-N339 VanDerWaalsContact SD-CB 3.51Å; M95-N339 PolarHBondContact SD-N 3.46Å; M95-Q342 HydrophobicContact CG-CB 4.28Å; M95-Q342 HydrophobicContact CG-CG 3.75Å; M95-Q342 HydrophobicContact SD-CB 3.77Å; M95-Q342 HydrophobicContact SD-CG 3.8Å; M95-E343 WeakPolarHBondContact CB-OE1 3.44Å; M95-E343 PolarHBondContact N-OE1 3.3Å
96	G	89.6	Confident	92.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.081	C	C	.	.			trans	-67.9	102	-179.4	0	0	0	0	0	112.4	Y90 H98 V99 Y336 E343 Q380	Y90-G96 PolarHBondContact OH-N 3.36Å; G96-H98 VanDerWaalsContact C-N 3.27Å; G96-H98 PolarHBondContact O-N 3.18Å; G96-V99 PolarHBondContact O-N 3.22Å; G96-Y336 WeakPolarHBondContact CA-OH 3.08Å; G96-E343 PolarHBondContact N-OE1 3.07Å; G96-Q380 PolarHBondContact O-NE2 2.9Å
97	R	88.5	Confident	92.4	Very high	100 Å²	100	17.2 Å²	17.2	38%	0.377	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.7	-175.6	-66.2	-178.2	-176.6	174.8	-0.5	115.9	M95 Y336 T379 Q380	M95-R97 PolarHBondContact O-N 2.72Å; R97-Y336 PolarHBondContact N-OH 3.23Å; R97-T379 CarbonylContact O-C 3.42Å; R97-T379 VanDerWaalsContact O-C 3.26Å; R97-Q380 PolarHBondContact O-N 3.24Å; R97-Q380 PolarHBondContact O-NE2 3.35Å
98	H	90.2	Very high	92.3	Very high	10 Å²	10	17.1 Å²	17.1	5%	0.046	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	11.2	-174.7	-55.7	84.5	0	0	0	112.6	G96 F334 Y336 T369 L372 Y373 A377 K378	G96-H98 VanDerWaalsContact C-N 3.27Å; G96-H98 PolarHBondContact O-N 3.18Å; H98-F334 HydrophobicContact CB-CE2 4.29Å; H98-F334 AromaticContact CD2-CE2 3.99Å; H98-F334 AromaticContact CD2-CZ 3.98Å; H98-F334 AromaticContact CE1-CD1 3.9Å; H98-F334 AromaticContact CE1-CD2 3.78Å; H98-F334 AromaticContact CE1-CG 3.62Å; H98-F334 AromaticContact CG-CD2 3.96Å; H98-F334 AromaticContact CG-CE2 3.84Å; H98-F334 AromaticContact ND1-CD2 3.6Å; H98-F334 AromaticContact ND1-CE2 3.97Å; H98-F334 AromaticContact ND1-CG 3.9Å; H98-F334 AromaticContact NE2-CD1 3.96Å; H98-F334 AromaticContact NE2-CE1 3.94Å; H98-Y336 AromaticContact ND1-CE1 3.91Å; H98-T369 WeakPolarHBondContact O-CG2 3.37Å; H98-L372 WeakPolarHBondContact O-CD1 3.48Å; H98-Y373 HydrophobicContact CB-CD1 3.98Å; H98-Y373 HydrophobicContact CB-CE1 3.62Å; H98-A377 PolarHBondContact CD2-O 3.47Å; H98-A377 PolarHBondContact NE2-O 3.04Å; H98-A377 VanDerWaalsContact NE2-O 3.09Å; H98-K378 PolarHBondContact NE2-O 3.3Å
99	V	92.4	Very high	92	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.072	C	C	.	.			trans	-87.6	124.8	-177.2	178.4	0	0	0	0	109.1	Y90 G96 T101 A327 A364 Q380	Y90-V99 HydrophobicContact CE1-CB 3.89Å; Y90-V99 HydrophobicContact CE1-CG1 4.15Å; Y90-V99 WeakPolarHBondContact OH-CB 3.41Å; G96-V99 PolarHBondContact O-N 3.22Å; V99-T101 HydrophobicContact CG1-CG2 4.23Å; V99-A327 HydrophobicContact CG2-CB 4.04Å; V99-A364 HydrophobicContact CG1-CB 3.39Å; V99-Q380 PolarHBondContact O-NE2 3.06Å
100	A	92.4	Very high	91.8	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.008	7%	0.069	C	C	.	.			trans	-96.4	109.3	175	0	0	0	0	0	110.5	L57 A364 A365 R368 T369 L372	L57-A100 HydrophobicContact CD1-CB 3.95Å; L57-A100 HydrophobicContact CD2-CB 4.29Å; A100-A364 WeakPolarHBondContact O-CA 3.42Å; A100-A365 PolarHBondContact O-N 3.39Å; A100-A365 VanDerWaalsContact O-N 3.15Å; A100-R368 HydrophobicContact CB-CB 3.64Å; A100-T369 PolarHBondContact N-OG1 3.13Å; A100-T369 VanDerWaalsContact N-OG1 3.08Å; A100-L372 HydrophobicContact CB-CD1 3.87Å
101	T	92.6	Very high	91.7	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.012	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	152.5	175.5	59.3	0	0	0	0	111.8	P86 A87 Y90 V99 A364 R368	P86-T101 PolarHBondContact O-OG1 3.04Å; A87-T101 WeakPolarHBondContact CA-OG1 3.44Å; Y90-T101 WeakPolarHBondContact CB-OG1 3.33Å; Y90-T101 HydrophobicContact CD1-CG2 3.61Å; Y90-T101 HydrophobicContact CD2-CG2 3.4Å; Y90-T101 VanDerWaalsContact CD2-CG2 3.4Å; Y90-T101 HydrophobicContact CE1-CG2 3.96Å; Y90-T101 HydrophobicContact CE2-CG2 3.76Å; Y90-T101 HydrophobicContact CG-CG2 3.31Å; V99-T101 HydrophobicContact CG1-CG2 4.23Å; T101-A364 HydrophobicContact CG2-CB 4.28Å; T101-R368 PolarHBondContact O-NH1 3.15Å
102	G	91.9	Very high	91.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-151.4	180	0	0	0	0	0	110.6	G82 S362 A363	G82-G102 CarbonylContact O-C 3.59Å; G82-G102 WeakPolarHBondContact O-CA 3.41Å; G102-S362 CarbonylContact O-C 3.26Å; G102-S362 WeakPolarHBondContact O-CA 3.09Å; G102-S362 VanDerWaalsContact O-CB 3.26Å; G102-S362 WeakPolarHBondContact O-CB 3.33Å; G102-A363 PolarHBondContact N-O 3Å; G102-A363 PolarHBondContact O-N 3.1Å
103	T	92.8	Very high	91.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	139.9	176.5	57	0	0	0	0	112.1	G65 G79 G82 I360 R368	G65-T103 WeakPolarHBondContact CA-OG1 3.42Å; G79-T103 WeakPolarHBondContact O-CG2 3.41Å; G82-T103 PolarHBondContact O-N 3.44Å; T103-I360 HydrophobicContact CG2-CD1 3.68Å; T103-I360 HydrophobicContact CG2-CG1 3.86Å; T103-R368 PolarHBondContact O-NH2 3.42Å
104	F	91.7	Very high	91.3	Very high	13 Å²	13	12.7 Å²	12.7	6%	0.057	6%	0.059	C	C	.	.			trans	-138.6	133.1	-178.9	176.7	-123.2	0	0	0	110.6	L106 T107 S108 A322 A363 A365	F104-L106 HydrophobicContact CD1-CB 3.86Å; F104-L106 HydrophobicContact CE1-CB 3.37Å; F104-L106 HydrophobicContact CE1-CD2 4.18Å; F104-L106 HydrophobicContact CE1-CG 4.4Å; F104-L106 HydrophobicContact CZ-CB 3.89Å; F104-L106 PolarHBondContact O-N 2.95Å; F104-L106 VanDerWaalsContact O-N 3.14Å; F104-T107 HydrophobicContact CD1-CG2 4.02Å; F104-T107 PolarHBondContact O-N 3.14Å; F104-T107 PolarHBondContact O-OG1 3.45Å; F104-S108 WeakPolarHBondContact O-CB 3.43Å; F104-S108 PolarHBondContact O-N 3.16Å; F104-S108 PolarHBondContact O-OG 2.96Å; F104-A322 HydrophobicContact CE1-CB 4.14Å; F104-A322 HydrophobicContact CZ-CB 4.26Å; F104-A363 HydrophobicContact CB-CB 3.82Å; F104-A363 HydrophobicContact CD1-CB 3.77Å; F104-A363 HydrophobicContact CG-CB 4.01Å; F104-A365 HydrophobicContact CD2-CB 4.36Å
105	A	88.8	Confident	91.3	Very high	4 Å²	4	12.6 Å²	12.6	3%	0.033	6%	0.058	C	C	.	.	H	α-helix	trans	-54.6	-40	-170.1	0	0	0	0	0	113.6	F68 L71 S108 L109 V190	F68-A105 HydrophobicContact CD1-CB 3.91Å; F68-A105 HydrophobicContact CE1-CB 3.46Å; F68-A105 VanDerWaalsContact CE1-CB 3.46Å; F68-A105 HydrophobicContact CZ-CB 3.82Å; L71-A105 HydrophobicContact CD2-CB 4.02Å; L71-A105 WeakPolarHBondContact CD2-O 3.42Å; A105-S108 WeakPolarHBondContact O-CB 3.3Å; A105-L109 WeakPolarHBondContact O-CB 3.4Å; A105-L109 PolarHBondContact O-N 3.13Å; A105-V190 HydrophobicContact CB-CB 4.38Å; A105-V190 HydrophobicContact CB-CG1 3.9Å; A105-V190 HydrophobicContact CB-CG2 3.61Å
106	L	87.4	Confident	91.3	Very high	7 Å²	7	11.1 Å²	11.1	4%	0.037	5%	0.051	C	C	.	.	H	α-helix	trans	-75.7	-42.2	-174.4	-164.2	53.4	0	0	0	112.8	F104 S108 L109 I110 A186 V318 A453	F104-L106 HydrophobicContact CD1-CB 3.86Å; F104-L106 HydrophobicContact CE1-CB 3.37Å; F104-L106 HydrophobicContact CE1-CD2 4.18Å; F104-L106 HydrophobicContact CE1-CG 4.4Å; F104-L106 HydrophobicContact CZ-CB 3.89Å; F104-L106 PolarHBondContact O-N 2.95Å; F104-L106 VanDerWaalsContact O-N 3.14Å; L106-S108 VanDerWaalsContact C-N 3.28Å; L106-L109 PolarHBondContact O-N 2.9Å; L106-I110 VanDerWaalsContact O-CG1 3.3Å; L106-I110 WeakPolarHBondContact O-CG1 3.49Å; L106-I110 PolarHBondContact O-N 3.02Å; L106-A186 HydrophobicContact CD1-CB 3.51Å; L106-A186 HydrophobicContact CD2-CB 3.41Å; L106-A186 VanDerWaalsContact CD2-CB 3.41Å; L106-A186 HydrophobicContact CG-CB 4.02Å; L106-V318 HydrophobicContact CD2-CG1 3.19Å; L106-V318 HydrophobicContact CG-CG1 3.84Å; L106-A453 HydrophobicContact CD1-CB 3.52Å; L106-A453 HydrophobicContact CD2-CB 3.87Å; L106-A453 HydrophobicContact CG-CB 4.07Å
107	T	92.7	Very high	91.4	Very high	0 Å²	0	17 Å²	17	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-68	-33.6	175.6	52.3	0	0	0	0	110.6	F104 S111 V315 P361 A363	F104-T107 HydrophobicContact CD1-CG2 4.02Å; F104-T107 PolarHBondContact O-N 3.14Å; F104-T107 PolarHBondContact O-OG1 3.45Å; T107-S111 VanDerWaalsContact O-CB 3.31Å; T107-S111 WeakPolarHBondContact O-CB 3.34Å; T107-S111 PolarHBondContact O-N 3.06Å; T107-V315 HydrophobicContact CG2-CG1 4.19Å; T107-V315 HydrophobicContact CG2-CG2 4.39Å; T107-P361 PolarHBondContact OG1-O 3.11Å; T107-P361 VanDerWaalsContact OG1-O 3.11Å; T107-A363 HydrophobicContact CG2-CB 4.28Å
108	S	93.2	Very high	91.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.7	-46.4	169	-72.1	0	0	0	0	112.6	F68 S72 F104 A105 L106 I110 S111 A112	F68-S108 WeakPolarHBondContact O-CB 3.12Å; F68-S108 PolarHBondContact O-OG 3.38Å; S72-S108 WeakPolarHBondContact CA-O 3.49Å; F104-S108 WeakPolarHBondContact O-CB 3.43Å; F104-S108 PolarHBondContact O-N 3.16Å; F104-S108 PolarHBondContact O-OG 2.96Å; A105-S108 WeakPolarHBondContact O-CB 3.3Å; L106-S108 VanDerWaalsContact C-N 3.28Å; S108-I110 VanDerWaalsContact C-N 3.35Å; S108-I110 PolarHBondContact O-N 3.45Å; S108-S111 WeakPolarHBondContact O-CB 3.36Å; S108-S111 PolarHBondContact O-N 3.23Å; S108-A112 PolarHBondContact O-N 3.03Å
109	L	89.8	Confident	91.4	Very high	25 Å²	25	15.5 Å²	15.5	13%	0.131	7%	0.073	C	C	.	.	H	α-helix	trans	-64.5	-39	178.9	-174.8	63.5	0	0	0	112.1	L71 A105 L106 S111 A112 N113 H189	L71-L109 HydrophobicContact CD1-CD1 4.13Å; A105-L109 WeakPolarHBondContact O-CB 3.4Å; A105-L109 PolarHBondContact O-N 3.13Å; L106-L109 PolarHBondContact O-N 2.9Å; L109-S111 VanDerWaalsContact C-N 3.35Å; L109-A112 WeakPolarHBondContact O-CB 3.5Å; L109-A112 PolarHBondContact O-N 3.24Å; L109-N113 PolarHBondContact O-N 3.15Å; L109-N113 PolarHBondContact O-ND2 2.87Å; L109-H189 HydrophobicContact CD2-CB 3.99Å
110	I	91.1	Very high	91	Very high	9 Å²	9	18.2 Å²	18.2	5%	0.046	9%	0.09	C	C	.	.	H	α-helix	trans	-63.8	-43	173.9	-65.4	165.5	0	0	0	110.4	L106 S108 A112 N113 E311 V315 V318 N454	L106-I110 VanDerWaalsContact O-CG1 3.3Å; L106-I110 WeakPolarHBondContact O-CG1 3.49Å; L106-I110 PolarHBondContact O-N 3.02Å; S108-I110 VanDerWaalsContact C-N 3.35Å; S108-I110 PolarHBondContact O-N 3.45Å; I110-A112 PolarHBondContact O-N 3.18Å; I110-N113 WeakPolarHBondContact O-CB 3.31Å; I110-N113 PolarHBondContact O-N 3.34Å; I110-E311 HydrophobicContact CG2-CB 3.86Å; I110-E311 HydrophobicContact CG2-CG 4.19Å; I110-E311 WeakPolarHBondContact CG2-O 3.22Å; I110-V315 HydrophobicContact CB-CG2 4.13Å; I110-V315 HydrophobicContact CG2-CG2 3.83Å; I110-V318 HydrophobicContact CD1-CB 4.4Å; I110-V318 HydrophobicContact CD1-CG2 4.38Å; I110-N454 HydrophobicContact CD1-CB 4.36Å
111	S	94.3	Very high	89.9	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-41	175.5	-177.6	0	0	0	0	112.3	S72 T107 S108 L109 N113 A114 V115 A148	S72-S111 VanDerWaalsContact OG-CB 3.31Å; S72-S111 WeakPolarHBondContact OG-CB 3.48Å; S72-S111 PolarHBondContact OG-OG 3.47Å; T107-S111 VanDerWaalsContact O-CB 3.31Å; T107-S111 WeakPolarHBondContact O-CB 3.34Å; T107-S111 PolarHBondContact O-N 3.06Å; S108-S111 WeakPolarHBondContact O-CB 3.36Å; S108-S111 PolarHBondContact O-N 3.23Å; L109-S111 VanDerWaalsContact C-N 3.35Å; S111-N113 VanDerWaalsContact C-N 3.25Å; S111-N113 PolarHBondContact O-N 2.9Å; S111-A114 PolarHBondContact O-N 2.85Å; S111-A114 VanDerWaalsContact O-N 3.09Å; S111-V115 WeakPolarHBondContact O-CG2 3.32Å; S111-V115 PolarHBondContact O-N 3.03Å; S111-A148 VanDerWaalsContact OG-CB 3.31Å; S111-A148 WeakPolarHBondContact OG-CB 3.32Å
112	A	91.8	Very high	88.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.5	-38.4	177.6	0	0	0	0	0	112.8	L71 S108 L109 I110 A114 V115 E116 Y205	L71-A112 VanDerWaalsContact O-CB 3.28Å; L71-A112 WeakPolarHBondContact O-CB 3.26Å; S108-A112 PolarHBondContact O-N 3.03Å; L109-A112 WeakPolarHBondContact O-CB 3.5Å; L109-A112 PolarHBondContact O-N 3.24Å; I110-A112 PolarHBondContact O-N 3.18Å; A112-A114 VanDerWaalsContact C-N 3.3Å; A112-A114 PolarHBondContact O-N 2.87Å; A112-V115 PolarHBondContact O-N 2.7Å; A112-E116 WeakPolarHBondContact O-CB 3.31Å; A112-E116 WeakPolarHBondContact O-CG 3.37Å; A112-E116 PolarHBondContact O-N 3.48Å; A112-Y205 HydrophobicContact CB-CE2 4.32Å
113	N	89.5	Confident	86.8	Confident	45 Å²	45	30.4 Å²	30.4	24%	0.241	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-41.3	178.1	-74.2	-51.1	0	0	0	111.8	L109 I110 S111 R117 Y205 S207	L109-N113 PolarHBondContact O-N 3.15Å; L109-N113 PolarHBondContact O-ND2 2.87Å; I110-N113 WeakPolarHBondContact O-CB 3.31Å; I110-N113 PolarHBondContact O-N 3.34Å; S111-N113 VanDerWaalsContact C-N 3.25Å; S111-N113 PolarHBondContact O-N 2.9Å; N113-R117 WeakPolarHBondContact O-CB 3.4Å; N113-R117 PolarHBondContact O-N 3.49Å; N113-Y205 VanDerWaalsContact CA-OH 3.3Å; N113-Y205 WeakPolarHBondContact CA-OH 3.36Å; N113-Y205 PolarHBondContact N-OH 3.31Å; N113-Y205 VanDerWaalsContact N-OH 3.12Å; N113-Y205 PolarHBondContact OD1-OH 2.97Å; N113-S207 WeakPolarHBondContact OD1-CB 3.42Å; N113-S207 PolarHBondContact OD1-OG 3.1Å
114	A	92.1	Very high	85	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-70.1	-43.8	175.9	0	0	0	0	0	111.8	S111 A112 R117 L118 V147 V151 V308 E311	S111-A114 PolarHBondContact O-N 2.85Å; S111-A114 VanDerWaalsContact O-N 3.09Å; A112-A114 VanDerWaalsContact C-N 3.3Å; A112-A114 PolarHBondContact O-N 2.87Å; A114-R117 PolarHBondContact O-N 2.8Å; A114-L118 WeakPolarHBondContact O-CB 3.38Å; A114-L118 WeakPolarHBondContact O-CG 3.42Å; A114-L118 PolarHBondContact O-N 2.71Å; A114-V147 HydrophobicContact CB-CG1 3.97Å; A114-V151 HydrophobicContact CB-CG2 3.77Å; A114-V308 HydrophobicContact CB-CG1 4.06Å; A114-E311 HydrophobicContact CB-CB 4.25Å; A114-E311 HydrophobicContact CB-CG 3.85Å
115	V	93.9	Very high	83	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-49.3	-179.3	174.4	0	0	0	0	111.1	V74 S111 A112 V119 R144 V147 A148	V74-V115 HydrophobicContact CG1-CG2 4.36Å; S111-V115 WeakPolarHBondContact O-CG2 3.32Å; S111-V115 PolarHBondContact O-N 3.03Å; A112-V115 PolarHBondContact O-N 2.7Å; V115-V119 CarbonylContact O-C 3.5Å; V115-V119 WeakPolarHBondContact O-CA 3.34Å; V115-V119 PolarHBondContact O-N 3.17Å; V115-R144 HydrophobicContact CG1-CB 3.81Å; V115-R144 HydrophobicContact CG1-CG 3.78Å; V115-V147 HydrophobicContact CG2-CB 4.17Å; V115-V147 HydrophobicContact CG2-CG1 4.08Å; V115-A148 HydrophobicContact CG2-CB 3.93Å
116	E	90.9	Very high	81.2	Confident	18 Å²	18	52 Å²	52	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-72.7	-29.4	-178.3	-66.9	-70.6	168.6	0	0	112.5	S73 A112 P120 R144 Y205	S73-E116 WeakPolarHBondContact CB-OE1 3.18Å; S73-E116 WeakPolarHBondContact OG-CG 3.31Å; S73-E116 PolarHBondContact OG-OE1 3.32Å; A112-E116 WeakPolarHBondContact O-CB 3.31Å; A112-E116 WeakPolarHBondContact O-CG 3.37Å; A112-E116 PolarHBondContact O-N 3.48Å; E116-P120 WeakPolarHBondContact O-CA 3.45Å; E116-P120 WeakPolarHBondContact O-CG 3.19Å; E116-R144 IonicContact OE1-CZ 3.53Å; E116-R144 IonicContact OE1-NH1 3.58Å; E116-R144 PolarHBondContact OE1-NH1 2.94Å; E116-R144 IonicContact OE1-NH2 2.79Å; E116-R144 PolarHBondContact OE1-NH2 3.12Å; E116-R144 IonicContact OE2-CZ 2.85Å; E116-R144 IonicContact OE2-NH1 2.54Å; E116-R144 IonicContact OE2-NH2 3.9Å; E116-R144 PolarHBondContact OE2-NH2 3.23Å; E116-Y205 HydrophobicContact CB-CD1 3.33Å; E116-Y205 HydrophobicContact CB-CD2 4.42Å; E116-Y205 HydrophobicContact CB-CE1 3.46Å; E116-Y205 VanDerWaalsContact CB-CE1 3.46Å; E116-Y205 HydrophobicContact CB-CG 3.83Å; E116-Y205 HydrophobicContact CG-CD1 3.62Å; E116-Y205 HydrophobicContact CG-CD2 3.75Å; E116-Y205 HydrophobicContact CG-CE1 3.76Å; E116-Y205 HydrophobicContact CG-CE2 3.95Å; E116-Y205 HydrophobicContact CG-CG 3.58Å
117	R	90.5	Very high	79.4	Confident	124 Å²	124	55.1 Å²	55.1	47%	0.468	28%	0.284	S	S	.	.	H	α-helix	trans	-70.1	-45.2	174.4	-179.6	177.8	67	-136.3	0.8	112.4	N113 A114 A307 E311	N113-R117 WeakPolarHBondContact O-CB 3.4Å; N113-R117 PolarHBondContact O-N 3.49Å; A114-R117 PolarHBondContact O-N 2.8Å; R117-A307 PolarHBondContact NH2-O 3.03Å; R117-E311 IonicContact CZ-OE1 3.19Å; R117-E311 VanDerWaalsContact CZ-OE1 3.3Å; R117-E311 IonicContact CZ-OE2 3.86Å; R117-E311 IonicContact NH1-OE1 3.54Å; R117-E311 PolarHBondContact NH1-OE1 3.49Å; R117-E311 IonicContact NH1-OE2 3.72Å; R117-E311 IonicContact NH2-OE1 2.8Å; R117-E311 PolarHBondContact NH2-OE1 2.62Å; R117-E311 VanDerWaalsContact NH2-OE1 3.11Å; R117-E311 IonicContact NH2-OE2 3.51Å; R117-E311 PolarHBondContact NH2-OE2 3.14Å
118	L	89.9	Confident	77.2	Confident	65 Å²	65	60.9 Å²	60.9	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-87.7	-28.7	-174.5	-65.7	178.5	0	0	0	112.9	A114 V147 I304 A307 V308	A114-L118 WeakPolarHBondContact O-CB 3.38Å; A114-L118 WeakPolarHBondContact O-CG 3.42Å; A114-L118 PolarHBondContact O-N 2.71Å; L118-V147 HydrophobicContact CB-CG2 4.21Å; L118-V147 HydrophobicContact CD1-CG1 3.9Å; L118-V147 HydrophobicContact CD1-CG2 4.32Å; L118-I304 HydrophobicContact CD1-CD1 4.4Å; L118-A307 HydrophobicContact CD1-CB 4.38Å; L118-A307 HydrophobicContact CD2-CB 4.26Å; L118-V308 HydrophobicContact CD1-CG1 3.57Å
119	V	90.3	Very high	74.9	Confident	13 Å²	13	69.5 Å²	69.5	8%	0.079	36%	0.359	C	S	.	.	S	Bend	trans	-134.5	73.4	-179.9	-169.4	0	0	0	0	110.2	V115 F140 Q143 R144 V147	V115-V119 CarbonylContact O-C 3.5Å; V115-V119 WeakPolarHBondContact O-CA 3.34Å; V115-V119 PolarHBondContact O-N 3.17Å; V119-F140 HydrophobicContact CG1-CD2 3.97Å; V119-F140 HydrophobicContact CG1-CE2 3.73Å; V119-Q143 HydrophobicContact CG1-CB 4.43Å; V119-Q143 HydrophobicContact CG2-CB 4.35Å; V119-R144 HydrophobicContact CB-CG 4.06Å; V119-R144 HydrophobicContact CG1-CG 3.81Å; V119-R144 PolarHBondContact O-NE 3.01Å; V119-R144 PolarHBondContact O-NH2 3.05Å; V119-V147 HydrophobicContact CG2-CG2 3.95Å
120	P	82.6	Confident	73	Confident	56 Å²	56	72.7 Å²	72.7	36%	0.364	38%	0.384	S	S	.	.			trans	-65.3	149.8	-179.2	-16.7	29.4	0	0	0	112.1	E116 S122 S123	E116-P120 WeakPolarHBondContact O-CA 3.45Å; E116-P120 WeakPolarHBondContact O-CG 3.19Å; P120-S122 PolarHBondContact O-N 2.8Å; P120-S122 VanDerWaalsContact O-N 3.12Å; P120-S123 WeakPolarHBondContact O-CB 3.46Å; P120-S123 PolarHBondContact O-N 3.48Å; P120-S123 PolarHBondContact O-OG 3.01Å
121	Q	70.5	Confident	70.9	Confident	118 Å²	118	79 Å²	79	55%	0.551	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.6	179.7	-64.3	-171.6	-7.4	0	0	114	S123 R124 R144	Q121-S123 PolarHBondContact O-N 3.46Å; Q121-S123 VanDerWaalsContact O-N 3.15Å; Q121-R124 VanDerWaalsContact O-CB 3.24Å; Q121-R124 WeakPolarHBondContact O-CB 3.25Å; Q121-R124 PolarHBondContact O-N 3.36Å; Q121-R124 VanDerWaalsContact O-N 3.09Å; Q121-R144 VanDerWaalsContact CG-NH2 3.26Å
122	S	59.6	Low	68.7	Low	103 Å²	103	87.3 Å²	87.3	72%	0.72	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-60.6	-21.4	176.1	-43.9	0	0	0	0	113.8	P120 R124	P120-S122 PolarHBondContact O-N 2.8Å; P120-S122 VanDerWaalsContact O-N 3.12Å; S122-R124 PolarHBondContact O-N 3.13Å
123	S	58.6	Low	67.1	Low	38 Å²	38	88.8 Å²	88.8	27%	0.266	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-72.7	-12.5	176.4	64.2	0	0	0	0	113.9	P120 Q121 N125 L126 T127 F140	P120-S123 WeakPolarHBondContact O-CB 3.46Å; P120-S123 PolarHBondContact O-N 3.48Å; P120-S123 PolarHBondContact O-OG 3.01Å; Q121-S123 PolarHBondContact O-N 3.46Å; Q121-S123 VanDerWaalsContact O-N 3.15Å; S123-N125 PolarHBondContact O-N 3.26Å; S123-L126 PolarHBondContact O-N 3.07Å; S123-L126 VanDerWaalsContact O-N 3.14Å; S123-T127 PolarHBondContact O-OG1 3.2Å; S123-F140 WeakPolarHBondContact OG-CE2 3.06Å
124	R	55.7	Low	65.4	Low	176 Å²	176	91.4 Å²	91.4	66%	0.664	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-60.1	-28.7	175.1	-171	173.2	-178.6	155.7	1.9	112.9	Q121 S122 L126	Q121-R124 VanDerWaalsContact O-CB 3.24Å; Q121-R124 WeakPolarHBondContact O-CB 3.25Å; Q121-R124 PolarHBondContact O-N 3.36Å; Q121-R124 VanDerWaalsContact O-N 3.09Å; S122-R124 PolarHBondContact O-N 3.13Å; R124-L126 VanDerWaalsContact C-N 3.34Å
125	N	49.7	Very low	63.8	Low	135 Å²	135	94 Å²	94	72%	0.722	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-78.3	-17.2	179.8	-68.1	-9.4	0	0	0	113.4	S123	S123-N125 PolarHBondContact O-N 3.26Å
126	L	50.5	Low	62.4	Low	160 Å²	160	95.7 Å²	95.7	84%	0.838	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-91.1	-11.5	-175.9	-154.4	73.2	0	0	0	113.1	S123 R124	S123-L126 PolarHBondContact O-N 3.07Å; S123-L126 VanDerWaalsContact O-N 3.14Å; R124-L126 VanDerWaalsContact C-N 3.34Å
127	T	50.2	Low	61.7	Low	72 Å²	72	95.3 Å²	95.3	44%	0.442	51%	0.511	S	S	.	.			trans	-113.2	26.1	-171.1	44.6	0	0	0	0	113.7	S123 Q129	S123-T127 PolarHBondContact O-OG1 3.2Å; T127-Q129 PolarHBondContact O-N 3.25Å
128	T	46.9	Very low	61.2	Low	121 Å²	121	91.9 Å²	91.9	74%	0.742	51%	0.506	S	S	*	.			trans	-64.8	16.5	-179.8	42.1	0	0	0	0	115.9
129	Q	44.8	Very low	60.9	Low	182 Å²	182	92.2 Å²	92.2	85%	0.85	51%	0.508	S	S	*	.			trans	-107.3	80.6	165.7	-73.7	-175.5	-12.1	0	0	109.5	T127 N131	T127-Q129 PolarHBondContact O-N 3.25Å; Q129-N131 PolarHBondContact O-N 2.78Å
130	S	50	Low	60.7	Low	91 Å²	91	92.8 Å²	92.8	64%	0.636	51%	0.51	S	S	*	.			trans	-84.6	104.3	-178.4	56.6	0	0	0	0	112
131	N	46.2	Very low	60.9	Low	142 Å²	142	92.5 Å²	92.5	76%	0.759	50%	0.504	S	S	*	.			trans	-78.7	122.8	149.4	-75.1	-29.5	0	0	0	106.8	Q129 S133	Q129-N131 PolarHBondContact O-N 2.78Å; N131-S133 PolarHBondContact O-N 3.31Å; N131-S133 VanDerWaalsContact O-N 3.13Å
132	F	47.9	Very low	61.7	Low	175 Å²	175	88.8 Å²	88.8	77%	0.768	49%	0.487	S	S	*	.			trans	-59.7	118	173.3	-95.4	-90	0	0	0	109.3
133	S	58.8	Low	63.2	Low	30 Å²	30	89.1 Å²	89.1	21%	0.21	48%	0.477	C	S	.	.			trans	-91.2	174.6	179.5	85.4	0	0	0	0	111.9	N131 L135 G136 L137	N131-S133 PolarHBondContact O-N 3.31Å; N131-S133 VanDerWaalsContact O-N 3.13Å; S133-L135 PolarHBondContact O-N 3.12Å; S133-G136 PolarHBondContact O-N 3.06Å; S133-L137 PolarHBondContact OG-O 2.82Å
134	V	53.4	Low	64.9	Low	101 Å²	101	87.9 Å²	87.9	61%	0.612	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-44	130	-178.7	176.9	0	0	0	0	111.4	G136	V134-G136 PolarHBondContact O-N 2.95Å
135	L	59.5	Low	66.8	Low	54 Å²	54	79.5 Å²	79.5	28%	0.283	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	70.5	9.8	-177.9	-66.7	164.1	0	0	0	116.8	S133 L137 P291 N292 P295	S133-L135 PolarHBondContact O-N 3.12Å; L135-L137 VanDerWaalsContact C-N 3.28Å; L135-L137 PolarHBondContact O-N 2.87Å; L135-P291 HydrophobicContact CB-CB 4.05Å; L135-P291 WeakPolarHBondContact O-CB 3.39Å; L135-N292 VanDerWaalsContact CD2-O 3.26Å; L135-N292 WeakPolarHBondContact CD2-O 3.49Å; L135-P295 HydrophobicContact CD1-CB 3.83Å
136	G	64.1	Low	68.9	Low	35 Å²	35	73.4 Å²	73.4	36%	0.361	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	78.3	12.9	176.3	0	0	0	0	0	114.4	S133 V134	S133-G136 PolarHBondContact O-N 3.06Å; V134-G136 PolarHBondContact O-N 2.95Å
137	L	75.1	Confident	71.1	Confident	11 Å²	11	66.2 Å²	66.2	6%	0.058	37%	0.367	C	S	.	.			trans	-87.8	146.7	175.2	-69.1	164.9	0	0	0	110.8	H75 F78 S133 L135 P291	H75-L137 HydrophobicContact CB-CD2 4.41Å; F78-L137 HydrophobicContact CE1-CD1 4.46Å; F78-L137 HydrophobicContact CE2-CD1 4.38Å; F78-L137 HydrophobicContact CZ-CD1 3.7Å; S133-L137 PolarHBondContact OG-O 2.82Å; L135-L137 VanDerWaalsContact C-N 3.28Å; L135-L137 PolarHBondContact O-N 2.87Å; L137-P291 HydrophobicContact CD1-CG 4.36Å; L137-P291 HydrophobicContact CD2-CG 4.35Å; L137-P291 HydrophobicContact CG-CG 4.29Å
138	S	81.3	Confident	73.3	Confident	52 Å²	52	62.8 Å²	62.8	36%	0.364	35%	0.346	S	S	.	.			trans	-71.2	150.5	175	64.5	0	0	0	0	111.7	F140 E141 L142	S138-F140 PolarHBondContact O-N 3.37Å; S138-F140 VanDerWaalsContact O-N 3.16Å; S138-E141 WeakPolarHBondContact CB-OE2 3.4Å; S138-E141 PolarHBondContact N-OE2 2.93Å; S138-E141 PolarHBondContact O-N 3.03Å; S138-E141 VanDerWaalsContact OG-CG 3.23Å; S138-E141 WeakPolarHBondContact OG-CG 3.41Å; S138-E141 PolarHBondContact OG-N 3.3Å; S138-E141 PolarHBondContact OG-OE2 2.91Å; S138-L142 PolarHBondContact O-N 3Å
139	D	83.2	Confident	75.7	Confident	72 Å²	72	57 Å²	57	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-33.4	176.2	-72.9	-30.1	0	0	0	112.1	L142 Q143	D139-L142 PolarHBondContact O-N 2.9Å; D139-Q143 WeakPolarHBondContact O-CG 3.29Å; D139-Q143 PolarHBondContact O-N 3.42Å
140	F	85.9	Confident	78.2	Confident	24 Å²	24	48.4 Å²	48.4	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-46.5	174.4	175.2	-99.6	0	0	0	112.4	V119 S123 S138 L142 Q143 R144	V119-F140 HydrophobicContact CG1-CD2 3.97Å; V119-F140 HydrophobicContact CG1-CE2 3.73Å; S123-F140 WeakPolarHBondContact OG-CE2 3.06Å; S138-F140 PolarHBondContact O-N 3.37Å; S138-F140 VanDerWaalsContact O-N 3.16Å; F140-L142 VanDerWaalsContact C-N 3.31Å; F140-L142 PolarHBondContact O-N 3Å; F140-Q143 PolarHBondContact O-N 2.96Å; F140-R144 HydrophobicContact CE1-CG 4.38Å; F140-R144 VanDerWaalsContact CE1-NE 3.35Å; F140-R144 HydrophobicContact CZ-CG 4.36Å; F140-R144 WeakPolarHBondContact O-CG 3.21Å; F140-R144 PolarHBondContact O-N 3.03Å
141	E	87.3	Confident	80.4	Confident	51 Å²	51	44 Å²	44	24%	0.238	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-37.6	177	-72.1	161.9	141.7	0	0	111.5	H75 S138 R144 I145	H75-E141 IonicContact CD2-OE1 2.75Å; H75-E141 PolarHBondContact CD2-OE1 3.06Å; S138-E141 WeakPolarHBondContact CB-OE2 3.4Å; S138-E141 PolarHBondContact N-OE2 2.93Å; S138-E141 PolarHBondContact O-N 3.03Å; S138-E141 VanDerWaalsContact OG-CG 3.23Å; S138-E141 WeakPolarHBondContact OG-CG 3.41Å; S138-E141 PolarHBondContact OG-N 3.3Å; S138-E141 PolarHBondContact OG-OE2 2.91Å; E141-R144 PolarHBondContact O-N 3.49Å; E141-I145 WeakPolarHBondContact O-CG2 3.48Å; E141-I145 PolarHBondContact O-N 3.39Å
142	L	88.1	Confident	82.8	Confident	40 Å²	40	37.3 Å²	37.3	21%	0.209	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-39.4	176.9	-166.9	68	0	0	0	112	S138 D139 F140 I145 G146 F358	S138-L142 PolarHBondContact O-N 3Å; D139-L142 PolarHBondContact O-N 2.9Å; F140-L142 VanDerWaalsContact C-N 3.31Å; F140-L142 PolarHBondContact O-N 3Å; L142-I145 HydrophobicContact CD1-CG2 4.34Å; L142-I145 VanDerWaalsContact O-CG2 3.23Å; L142-I145 WeakPolarHBondContact O-CG2 3.39Å; L142-G146 PolarHBondContact O-N 3.35Å; L142-F358 HydrophobicContact CD1-CE1 4.03Å; L142-F358 HydrophobicContact CD1-CZ 4.15Å
143	Q	91.2	Very high	85.2	Confident	109 Å²	109	30.4 Å²	30.4	51%	0.509	17%	0.174	S	C	.	.	H	α-helix	trans	-65.2	-45.2	173.9	-74.6	-179.9	0.2	0	0	111.7	V119 D139 F140 I145 G146 V147	V119-Q143 HydrophobicContact CG1-CB 4.43Å; V119-Q143 HydrophobicContact CG2-CB 4.35Å; D139-Q143 WeakPolarHBondContact O-CG 3.29Å; D139-Q143 PolarHBondContact O-N 3.42Å; F140-Q143 PolarHBondContact O-N 2.96Å; Q143-I145 PolarHBondContact O-N 3.07Å; Q143-G146 PolarHBondContact O-N 3.23Å; Q143-G146 VanDerWaalsContact O-N 3.16Å; Q143-V147 PolarHBondContact O-N 2.96Å; Q143-V147 VanDerWaalsContact O-N 3.1Å
144	R	93.5	Very high	87.1	Confident	13 Å²	13	30.1 Å²	30.1	5%	0.049	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-47.3	178	-76.2	-171.6	155.9	-132.5	-8.8	112.3	S73 V74 V115 E116 V119 Q121 F140 E141 G146 V147 A148	S73-R144 WeakPolarHBondContact O-CD 3.23Å; S73-R144 PolarHBondContact O-NH1 3.33Å; V74-R144 HydrophobicContact CG1-CB 4.33Å; V115-R144 HydrophobicContact CG1-CB 3.81Å; V115-R144 HydrophobicContact CG1-CG 3.78Å; E116-R144 IonicContact OE1-CZ 3.53Å; E116-R144 IonicContact OE1-NH1 3.58Å; E116-R144 PolarHBondContact OE1-NH1 2.94Å; E116-R144 IonicContact OE1-NH2 2.79Å; E116-R144 PolarHBondContact OE1-NH2 3.12Å; E116-R144 IonicContact OE2-CZ 2.85Å; E116-R144 IonicContact OE2-NH1 2.54Å; E116-R144 IonicContact OE2-NH2 3.9Å; E116-R144 PolarHBondContact OE2-NH2 3.23Å; V119-R144 HydrophobicContact CB-CG 4.06Å; V119-R144 HydrophobicContact CG1-CG 3.81Å; V119-R144 PolarHBondContact O-NE 3.01Å; V119-R144 PolarHBondContact O-NH2 3.05Å; Q121-R144 VanDerWaalsContact CG-NH2 3.26Å; F140-R144 HydrophobicContact CE1-CG 4.38Å; F140-R144 VanDerWaalsContact CE1-NE 3.35Å; F140-R144 HydrophobicContact CZ-CG 4.36Å; F140-R144 WeakPolarHBondContact O-CG 3.21Å; F140-R144 PolarHBondContact O-N 3.03Å; E141-R144 PolarHBondContact O-N 3.49Å; R144-G146 VanDerWaalsContact C-N 3.3Å; R144-G146 PolarHBondContact O-N 3.28Å; R144-V147 PolarHBondContact O-N 3.17Å; R144-A148 PolarHBondContact O-N 3.2Å
145	I	94.4	Very high	89.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.8	-31.8	177.2	-168.4	60.4	0	0	0	112.2	V74 F78 E141 L142 Q143 V147 A148 A149 F358 I360	V74-I145 HydrophobicContact CB-CD1 4.19Å; V74-I145 HydrophobicContact CG1-CB 4.49Å; V74-I145 HydrophobicContact CG1-CD1 4.05Å; V74-I145 HydrophobicContact CG2-CD1 4.11Å; F78-I145 HydrophobicContact CB-CD1 3.64Å; F78-I145 HydrophobicContact CB-CG1 4.29Å; F78-I145 HydrophobicContact CD1-CB 4.42Å; F78-I145 HydrophobicContact CD1-CD1 3.92Å; F78-I145 HydrophobicContact CD1-CG1 3.58Å; F78-I145 HydrophobicContact CD2-CB 3.92Å; F78-I145 HydrophobicContact CD2-CD1 3.74Å; F78-I145 HydrophobicContact CD2-CG1 3.74Å; F78-I145 HydrophobicContact CE1-CB 4.22Å; F78-I145 HydrophobicContact CE1-CG1 3.74Å; F78-I145 HydrophobicContact CE1-CG2 4.04Å; F78-I145 HydrophobicContact CE2-CB 3.66Å; F78-I145 HydrophobicContact CE2-CD1 4.37Å; F78-I145 HydrophobicContact CE2-CG1 3.87Å; F78-I145 HydrophobicContact CE2-CG2 3.86Å; F78-I145 HydrophobicContact CG-CB 4.3Å; F78-I145 HydrophobicContact CG-CD1 3.49Å; F78-I145 VanDerWaalsContact CG-CD1 3.49Å; F78-I145 HydrophobicContact CG-CG1 3.59Å; F78-I145 HydrophobicContact CZ-CB 3.83Å; F78-I145 HydrophobicContact CZ-CG1 3.88Å; F78-I145 HydrophobicContact CZ-CG2 3.57Å; E141-I145 WeakPolarHBondContact O-CG2 3.48Å; E141-I145 PolarHBondContact O-N 3.39Å; L142-I145 HydrophobicContact CD1-CG2 4.34Å; L142-I145 VanDerWaalsContact O-CG2 3.23Å; L142-I145 WeakPolarHBondContact O-CG2 3.39Å; Q143-I145 PolarHBondContact O-N 3.07Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.08Å; I145-A148 HydrophobicContact CD1-CB 4.19Å; I145-A148 PolarHBondContact O-N 3.39Å; I145-A149 VanDerWaalsContact O-CB 3.26Å; I145-A149 WeakPolarHBondContact O-CB 3.41Å; I145-A149 PolarHBondContact O-N 2.66Å; I145-F358 WeakPolarHBondContact CD1-O 3.31Å; I145-F358 HydrophobicContact CG1-CB 3.73Å; I145-F358 HydrophobicContact CG1-CD1 4.34Å; I145-F358 HydrophobicContact CG1-CG 4.5Å; I145-F358 WeakPolarHBondContact CG1-O 3.45Å; I145-F358 HydrophobicContact CG2-CD1 3.86Å; I145-F358 HydrophobicContact CG2-CG 4.49Å; I145-I360 HydrophobicContact CD1-CG2 3.79Å
146	G	94.5	Very high	91	Very high	7 Å²	7	22.7 Å²	22.7	7%	0.072	13%	0.127	C	C	.	.	H	α-helix	trans	-56.7	-42.4	172.6	0	0	0	0	0	112.2	L142 Q143 R144 A150 P301	L142-G146 PolarHBondContact O-N 3.35Å; Q143-G146 PolarHBondContact O-N 3.23Å; Q143-G146 VanDerWaalsContact O-N 3.16Å; R144-G146 VanDerWaalsContact C-N 3.3Å; R144-G146 PolarHBondContact O-N 3.28Å; G146-A150 WeakPolarHBondContact O-CB 3.44Å; G146-A150 PolarHBondContact O-N 3.46Å; G146-P301 VanDerWaalsContact O-CD 3.22Å; G146-P301 WeakPolarHBondContact O-CD 3.45Å; G146-P301 WeakPolarHBondContact O-CG 3.22Å
147	V	96.4	Very high	92.6	Very high	8 Å²	8	23.4 Å²	23.4	5%	0.048	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-49.4	174.9	177.9	0	0	0	0	111.5	A114 V115 L118 V119 Q143 R144 I145 A149 A150 V151 I304 V308	A114-V147 HydrophobicContact CB-CG1 3.97Å; V115-V147 HydrophobicContact CG2-CB 4.17Å; V115-V147 HydrophobicContact CG2-CG1 4.08Å; L118-V147 HydrophobicContact CB-CG2 4.21Å; L118-V147 HydrophobicContact CD1-CG1 3.9Å; L118-V147 HydrophobicContact CD1-CG2 4.32Å; V119-V147 HydrophobicContact CG2-CG2 3.95Å; Q143-V147 PolarHBondContact O-N 2.96Å; Q143-V147 VanDerWaalsContact O-N 3.1Å; R144-V147 PolarHBondContact O-N 3.17Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.08Å; V147-A149 VanDerWaalsContact C-N 3.32Å; V147-A149 PolarHBondContact O-N 2.78Å; V147-A150 WeakPolarHBondContact O-CB 3.23Å; V147-A150 PolarHBondContact O-N 3.15Å; V147-A150 VanDerWaalsContact O-N 3.14Å; V147-V151 WeakPolarHBondContact O-CG2 3.48Å; V147-V151 PolarHBondContact O-N 3.36Å; V147-I304 HydrophobicContact CB-CD1 4.19Å; V147-I304 HydrophobicContact CG1-CD1 4.41Å; V147-I304 HydrophobicContact CG2-CD1 3.74Å; V147-V308 HydrophobicContact CG1-CG1 4.17Å
148	A	96.6	Very high	93.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-38.5	179	0	0	0	0	0	112.5	V74 S111 V115 R144 I145 V151 S152 I360	V74-A148 HydrophobicContact CG1-CB 4.04Å; S111-A148 VanDerWaalsContact OG-CB 3.31Å; S111-A148 WeakPolarHBondContact OG-CB 3.32Å; V115-A148 HydrophobicContact CG2-CB 3.93Å; R144-A148 PolarHBondContact O-N 3.2Å; I145-A148 HydrophobicContact CD1-CB 4.19Å; I145-A148 PolarHBondContact O-N 3.39Å; A148-V151 PolarHBondContact O-N 3.34Å; A148-S152 PolarHBondContact O-N 3.36Å; A148-I360 HydrophobicContact CB-CG2 4.2Å
149	A	96.6	Very high	94.3	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-65.2	-38.2	174.2	0	0	0	0	0	111.7	I145 V147 S152 F153 P300 S355	I145-A149 VanDerWaalsContact O-CB 3.26Å; I145-A149 WeakPolarHBondContact O-CB 3.41Å; I145-A149 PolarHBondContact O-N 2.66Å; V147-A149 VanDerWaalsContact C-N 3.32Å; V147-A149 PolarHBondContact O-N 2.78Å; A149-S152 PolarHBondContact O-N 3.18Å; A149-F153 WeakPolarHBondContact O-CB 3.3Å; A149-F153 PolarHBondContact O-N 3.12Å; A149-P300 HydrophobicContact CB-CB 4.38Å; A149-P300 HydrophobicContact CB-CG 4.35Å; A149-S355 WeakPolarHBondContact O-CB 3.38Å
150	A	97.3	Very high	95	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.4	-40	174.5	0	0	0	0	0	112.3	G146 V147 F153 L154 P300 P301 I304 L305 V308	G146-A150 WeakPolarHBondContact O-CB 3.44Å; G146-A150 PolarHBondContact O-N 3.46Å; V147-A150 WeakPolarHBondContact O-CB 3.23Å; V147-A150 PolarHBondContact O-N 3.15Å; V147-A150 VanDerWaalsContact O-N 3.14Å; A150-F153 PolarHBondContact O-N 3.45Å; A150-L154 WeakPolarHBondContact O-CB 3.22Å; A150-L154 PolarHBondContact O-N 2.59Å; A150-P300 HydrophobicContact CB-CB 4.31Å; A150-P301 HydrophobicContact CB-CG 4.21Å; A150-I304 HydrophobicContact CB-CD1 3.97Å; A150-I304 HydrophobicContact CB-CG1 4.11Å; A150-L305 HydrophobicContact CB-CD2 4.33Å; A150-V308 HydrophobicContact CB-CG2 4.42Å
151	V	97.3	Very high	95.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-45.7	172.2	175.3	0	0	0	0	110.6	A114 V147 A148 G155 V308 E311 V315 P361	A114-V151 HydrophobicContact CB-CG2 3.77Å; V147-V151 WeakPolarHBondContact O-CG2 3.48Å; V147-V151 PolarHBondContact O-N 3.36Å; A148-V151 PolarHBondContact O-N 3.34Å; V151-G155 PolarHBondContact O-N 3.36Å; V151-V308 HydrophobicContact CG2-CB 3.84Å; V151-V308 HydrophobicContact CG2-CG1 4.06Å; V151-V308 HydrophobicContact CG2-CG2 4.31Å; V151-E311 HydrophobicContact CG1-CB 4.18Å; V151-E311 HydrophobicContact CG2-CB 4.34Å; V151-V315 HydrophobicContact CG1-CG2 3.84Å; V151-P361 HydrophobicContact CB-CG 4.35Å; V151-P361 HydrophobicContact CG1-CG 3.96Å
152	S	97.1	Very high	95.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-46.9	178.7	-166.1	0	0	0	0	111.6	A148 A149 G155 G156 N351 P361	A148-S152 PolarHBondContact O-N 3.36Å; A149-S152 PolarHBondContact O-N 3.18Å; S152-G155 PolarHBondContact O-N 2.95Å; S152-G156 PolarHBondContact O-N 3.18Å; S152-N351 PolarHBondContact OG-O 3.15Å; S152-N351 PolarHBondContact OG-OD1 3.38Å; S152-P361 WeakPolarHBondContact OG-CA 3.31Å
153	F	98	Very high	96.1	Very high	31 Å²	31	20.4 Å²	20.4	14%	0.136	11%	0.107	C	C	.	.	H	α-helix	trans	-57.3	-55.1	176.8	178.2	-101.7	0	0	0	111.8	A149 A150 G155 G156 V157 P300 M302 L305 V352 S355 F356	A149-F153 WeakPolarHBondContact O-CB 3.3Å; A149-F153 PolarHBondContact O-N 3.12Å; A150-F153 PolarHBondContact O-N 3.45Å; F153-G155 PolarHBondContact O-N 2.9Å; F153-G156 PolarHBondContact O-N 2.92Å; F153-V157 HydrophobicContact CD1-CG2 4.39Å; F153-V157 HydrophobicContact CE1-CG2 4.04Å; F153-V157 HydrophobicContact CE2-CG2 4.34Å; F153-V157 HydrophobicContact CZ-CG2 4.02Å; F153-V157 WeakPolarHBondContact O-CG2 3.45Å; F153-V157 PolarHBondContact O-N 3.25Å; F153-P300 HydrophobicContact CB-CB 4.39Å; F153-P300 HydrophobicContact CB-CG 3.97Å; F153-P300 HydrophobicContact CD2-CG 4.45Å; F153-P300 HydrophobicContact CG-CG 4.26Å; F153-M302 HydrophobicContact CD1-CE 4.34Å; F153-M302 HydrophobicContact CD1-SD 4.48Å; F153-M302 HydrophobicContact CE1-CE 3.92Å; F153-M302 HydrophobicContact CE1-SD 3.97Å; F153-M302 HydrophobicContact CE2-CE 4.43Å; F153-M302 HydrophobicContact CZ-CE 3.97Å; F153-M302 HydrophobicContact CZ-SD 4.48Å; F153-L305 HydrophobicContact CD1-CD2 4.02Å; F153-L305 HydrophobicContact CE1-CD1 4.5Å; F153-V352 HydrophobicContact CD2-CG1 4.08Å; F153-V352 HydrophobicContact CE2-CG1 3.96Å; F153-S355 WeakPolarHBondContact CB-OG 3.49Å; F153-S355 WeakPolarHBondContact CD2-OG 3.16Å; F153-F356 HydrophobicContact CD2-CE2 4.14Å; F153-F356 HydrophobicContact CD2-CZ 4.38Å; F153-F356 AromaticContact CE2-CE2 3.99Å; F153-F356 HydrophobicContact CE2-CE2 3.99Å; F153-F356 AromaticContact CE2-CZ 3.93Å; F153-F356 HydrophobicContact CE2-CZ 3.93Å
154	L	97.8	Very high	96.3	Very high	23 Å²	23	20.4 Å²	20.4	12%	0.12	11%	0.114	C	C	.	.	H	α-helix	trans	-66.2	-38.7	-177.7	-173.3	58	0	0	0	111.7	A150 G156 V157 I158 L305 V308 L309 A312	A150-L154 WeakPolarHBondContact O-CB 3.22Å; A150-L154 PolarHBondContact O-N 2.59Å; L154-G156 VanDerWaalsContact C-N 3.32Å; L154-G156 PolarHBondContact O-N 2.95Å; L154-V157 PolarHBondContact O-N 3.35Å; L154-I158 HydrophobicContact CG-CD1 4.21Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.27Å; L154-I158 PolarHBondContact O-N 3.36Å; L154-L305 HydrophobicContact CB-CD2 3.99Å; L154-L305 HydrophobicContact CD2-CB 4.42Å; L154-L305 HydrophobicContact CD2-CD2 4.35Å; L154-L305 VanDerWaalsContact CD2-O 3.28Å; L154-L305 WeakPolarHBondContact CD2-O 3.26Å; L154-V308 HydrophobicContact CD2-CG2 4.23Å; L154-L309 HydrophobicContact CD2-CB 4.4Å; L154-L309 HydrophobicContact CD2-CD1 3.93Å; L154-A312 HydrophobicContact CB-CB 3.61Å; L154-A312 HydrophobicContact CD2-CB 3.65Å; L154-A312 HydrophobicContact CG-CB 3.56Å
155	G	97.2	Very high	96.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-41.3	174.6	0	0	0	0	0	112	V151 S152 F153 I158 Q159 A312 A316	V151-G155 PolarHBondContact O-N 3.36Å; S152-G155 PolarHBondContact O-N 2.95Å; F153-G155 PolarHBondContact O-N 2.9Å; G155-I158 PolarHBondContact O-N 2.91Å; G155-Q159 WeakPolarHBondContact O-CG 3.44Å; G155-Q159 PolarHBondContact O-N 3.04Å; G155-A312 WeakPolarHBondContact CA-O 3.41Å; G155-A316 WeakPolarHBondContact O-CB 3.25Å
156	G	97.6	Very high	96.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.4	-38.7	174.4	0	0	0	0	0	113.4	S152 F153 L154 Q159 M160 G348 V352	S152-G156 PolarHBondContact O-N 3.18Å; F153-G156 PolarHBondContact O-N 2.92Å; L154-G156 VanDerWaalsContact C-N 3.32Å; L154-G156 PolarHBondContact O-N 2.95Å; G156-Q159 WeakPolarHBondContact O-CB 3.37Å; G156-Q159 PolarHBondContact O-N 2.9Å; G156-M160 WeakPolarHBondContact O-CG 3.36Å; G156-M160 PolarHBondContact O-N 3.45Å; G156-G348 WeakPolarHBondContact CA-O 3.48Å; G156-V352 VanDerWaalsContact C-CG2 3.43Å
157	V	97.8	Very high	95.9	Very high	49 Å²	49	34.3 Å²	34.3	30%	0.297	18%	0.183	S	C	.	.	H	α-helix	trans	-62.7	-43.5	173	170.4	0	0	0	0	110.7	F153 L154 Q159 M160 V161 V352	F153-V157 HydrophobicContact CD1-CG2 4.39Å; F153-V157 HydrophobicContact CE1-CG2 4.04Å; F153-V157 HydrophobicContact CE2-CG2 4.34Å; F153-V157 HydrophobicContact CZ-CG2 4.02Å; F153-V157 WeakPolarHBondContact O-CG2 3.45Å; F153-V157 PolarHBondContact O-N 3.25Å; L154-V157 PolarHBondContact O-N 3.35Å; V157-Q159 VanDerWaalsContact C-N 3.31Å; V157-Q159 PolarHBondContact O-N 3.11Å; V157-M160 WeakPolarHBondContact O-CB 3.32Å; V157-M160 PolarHBondContact O-N 3Å; V157-M160 VanDerWaalsContact O-N 3.14Å; V157-V161 WeakPolarHBondContact O-CG2 3.5Å; V157-V161 PolarHBondContact O-N 3.19Å; V157-V352 HydrophobicContact CG2-CG2 3.97Å
158	I	97.2	Very high	95.4	Very high	27 Å²	27	34.2 Å²	34.2	14%	0.138	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-44.4	175.2	-68.3	164.6	0	0	0	110	L154 G155 M160 V161 M162 L309 A312 F313 A316	L154-I158 HydrophobicContact CG-CD1 4.21Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.27Å; L154-I158 PolarHBondContact O-N 3.36Å; G155-I158 PolarHBondContact O-N 2.91Å; I158-M160 VanDerWaalsContact C-N 3.34Å; I158-M160 PolarHBondContact O-N 3.35Å; I158-V161 WeakPolarHBondContact O-CB 3.32Å; I158-V161 PolarHBondContact O-N 3.49Å; I158-V161 VanDerWaalsContact O-N 3.12Å; I158-M162 HydrophobicContact CG2-CE 3.82Å; I158-M162 HydrophobicContact CG2-CG 4.42Å; I158-M162 HydrophobicContact CG2-SD 4.46Å; I158-M162 VanDerWaalsContact O-CG 3.29Å; I158-M162 WeakPolarHBondContact O-CG 3.44Å; I158-M162 PolarHBondContact O-N 3.16Å; I158-L309 HydrophobicContact CD1-CD1 4.42Å; I158-A312 HydrophobicContact CD1-CB 4.11Å; I158-F313 HydrophobicContact CD1-CB 4.28Å; I158-F313 HydrophobicContact CG2-CD2 4.34Å; I158-A316 HydrophobicContact CB-CB 3.88Å; I158-A316 HydrophobicContact CG2-CB 3.62Å
159	Q	96.3	Very high	94.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-38.3	175	-72.6	172.5	-21.2	0	0	112.7	G155 G156 V157 M162 F163 A316 F344 H347 N351	G155-Q159 WeakPolarHBondContact O-CG 3.44Å; G155-Q159 PolarHBondContact O-N 3.04Å; G156-Q159 WeakPolarHBondContact O-CB 3.37Å; G156-Q159 PolarHBondContact O-N 2.9Å; V157-Q159 VanDerWaalsContact C-N 3.31Å; V157-Q159 PolarHBondContact O-N 3.11Å; Q159-M162 PolarHBondContact O-N 2.7Å; Q159-F163 PolarHBondContact O-N 3.17Å; Q159-A316 HydrophobicContact CG-CB 3.89Å; Q159-A316 PolarHBondContact NE2-O 2.7Å; Q159-F344 HydrophobicContact CB-CD1 4.42Å; Q159-H347 VanDerWaalsContact OE1-C 3.27Å; Q159-H347 PolarHBondContact OE1-O 3.48Å; Q159-N351 PolarHBondContact OE1-ND2 3.47Å
160	M	96.5	Very high	94.2	Very high	37 Å²	37	40.2 Å²	40.2	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-42.6	171.2	-71.2	-58.8	97.6	0	0	112.4	G156 V157 I158 M162 F163 V164 F344 L345 G348 L349	G156-M160 WeakPolarHBondContact O-CG 3.36Å; G156-M160 PolarHBondContact O-N 3.45Å; V157-M160 WeakPolarHBondContact O-CB 3.32Å; V157-M160 PolarHBondContact O-N 3Å; V157-M160 VanDerWaalsContact O-N 3.14Å; I158-M160 VanDerWaalsContact C-N 3.34Å; I158-M160 PolarHBondContact O-N 3.35Å; M160-M162 VanDerWaalsContact C-N 3.34Å; M160-F163 WeakPolarHBondContact O-CB 3.4Å; M160-F163 PolarHBondContact O-N 2.83Å; M160-V164 WeakPolarHBondContact O-CG2 3.33Å; M160-V164 PolarHBondContact O-N 3.4Å; M160-F344 WeakPolarHBondContact CE-O 3.26Å; M160-L345 VanDerWaalsContact CE-CA 3.49Å; M160-L345 HydrophobicContact CE-CD1 3.88Å; M160-L345 VanDerWaalsContact CE-O 3.26Å; M160-L345 WeakPolarHBondContact CE-O 3.29Å; M160-L345 HydrophobicContact SD-CD1 3.5Å; M160-L345 VanDerWaalsContact SD-CD1 3.5Å; M160-G348 VanDerWaalsContact CE-C 3.47Å; M160-L349 HydrophobicContact CE-CG 4.04Å; M160-L349 VanDerWaalsContact CE-N 3.31Å; M160-L349 HydrophobicContact SD-CD2 4.01Å; M160-L349 HydrophobicContact SD-CG 3.99Å
161	V	96.5	Very high	93.5	Very high	77 Å²	77	41 Å²	41	47%	0.467	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-43.6	176.9	172.6	0	0	0	0	110	V157 I158 F163 V164 L165	V157-V161 WeakPolarHBondContact O-CG2 3.5Å; V157-V161 PolarHBondContact O-N 3.19Å; I158-V161 WeakPolarHBondContact O-CB 3.32Å; I158-V161 PolarHBondContact O-N 3.49Å; I158-V161 VanDerWaalsContact O-N 3.12Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 3.49Å; V161-V164 PolarHBondContact O-N 3.38Å; V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 HydrophobicContact CG1-CG 4.36Å; V161-L165 WeakPolarHBondContact O-CB 3.43Å; V161-L165 VanDerWaalsContact O-CG 3.31Å; V161-L165 WeakPolarHBondContact O-CG 3.49Å; V161-L165 PolarHBondContact O-N 3.43Å
162	M	94.1	Very high	92.7	Very high	22 Å²	22	48.5 Å²	48.5	11%	0.108	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-37.5	175.2	-65.3	-171.5	171.2	0	0	112.3	I158 Q159 M160 L165 Q166 L167 F313 F344	I158-M162 HydrophobicContact CG2-CE 3.82Å; I158-M162 HydrophobicContact CG2-CG 4.42Å; I158-M162 HydrophobicContact CG2-SD 4.46Å; I158-M162 VanDerWaalsContact O-CG 3.29Å; I158-M162 WeakPolarHBondContact O-CG 3.44Å; I158-M162 PolarHBondContact O-N 3.16Å; Q159-M162 PolarHBondContact O-N 2.7Å; M160-M162 VanDerWaalsContact C-N 3.34Å; M162-L165 PolarHBondContact O-N 3.11Å; M162-Q166 PolarHBondContact O-N 2.86Å; M162-L167 HydrophobicContact CB-CB 4.31Å; M162-L167 HydrophobicContact CB-CD1 3.93Å; M162-L167 HydrophobicContact CG-CD1 3.76Å; M162-L167 PolarHBondContact O-N 2.9Å; M162-L167 HydrophobicContact SD-CD1 4.49Å; M162-F313 HydrophobicContact CE-CE2 3.99Å; M162-F344 HydrophobicContact CB-CD1 3.86Å; M162-F344 HydrophobicContact CB-CE1 3.71Å; M162-F344 HydrophobicContact CB-CG 4.34Å; M162-F344 HydrophobicContact CB-CZ 4.06Å; M162-F344 HydrophobicContact CG-CE1 4.28Å; M162-F344 HydrophobicContact SD-CD1 4.43Å; M162-F344 HydrophobicContact SD-CE1 3.57Å; M162-F344 VanDerWaalsContact SD-CE1 3.57Å; M162-F344 HydrophobicContact SD-CZ 4.05Å
163	F	94.7	Very high	92	Very high	23 Å²	23	51.2 Å²	51.2	10%	0.101	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-47.1	172.8	165	-109.9	0	0	0	112.9	R31 Q159 M160 V161 L165 Q166 N341 F344 L345	R31-F163 VanDerWaalsContact CZ-CZ 3.47Å; Q159-F163 PolarHBondContact O-N 3.17Å; M160-F163 WeakPolarHBondContact O-CB 3.4Å; M160-F163 PolarHBondContact O-N 2.83Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 3.49Å; F163-L165 VanDerWaalsContact C-N 3.3Å; F163-L165 PolarHBondContact O-N 2.9Å; F163-Q166 PolarHBondContact O-N 3.33Å; F163-N341 VanDerWaalsContact CD2-ND2 3.27Å; F163-N341 WeakPolarHBondContact CD2-ND2 3.45Å; F163-N341 WeakPolarHBondContact CD2-O 3.41Å; F163-N341 WeakPolarHBondContact CE2-ND2 3.37Å; F163-N341 PolarHBondContact O-ND2 3.39Å; F163-N341 VanDerWaalsContact O-ND2 3.13Å; F163-N341 PolarHBondContact O-OD1 2.9Å; F163-F344 HydrophobicContact CB-CB 3.76Å; F163-L345 HydrophobicContact CD1-CB 4.25Å; F163-L345 HydrophobicContact CD1-CD1 4.08Å; F163-L345 HydrophobicContact CD2-CB 3.87Å; F163-L345 HydrophobicContact CE1-CB 4.33Å; F163-L345 HydrophobicContact CE1-CD1 4.03Å; F163-L345 HydrophobicContact CE1-CD2 4.14Å; F163-L345 HydrophobicContact CE1-CG 4.4Å; F163-L345 HydrophobicContact CE2-CB 3.93Å; F163-L345 HydrophobicContact CE2-CD2 4.31Å; F163-L345 HydrophobicContact CG-CB 4Å; F163-L345 HydrophobicContact CZ-CB 4.17Å; F163-L345 HydrophobicContact CZ-CD2 3.85Å; F163-L345 HydrophobicContact CZ-CG 4.41Å
164	V	94.4	Very high	91.5	Very high	110 Å²	110	51 Å²	51	67%	0.667	28%	0.28	S	S	*	.	H	α-helix	trans	-63.4	-39.2	178.6	172.2	0	0	0	0	110.8	M160 V161 Q166	M160-V164 WeakPolarHBondContact O-CG2 3.33Å; M160-V164 PolarHBondContact O-N 3.4Å; V161-V164 PolarHBondContact O-N 3.38Å; V164-Q166 PolarHBondContact O-N 2.75Å
165	L	94.3	Very high	91	Very high	114 Å²	114	51.7 Å²	51.7	60%	0.597	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-1.6	175.4	-65.4	176.6	0	0	0	113.8	V161 M162 F163 L167	V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 HydrophobicContact CG1-CG 4.36Å; V161-L165 WeakPolarHBondContact O-CB 3.43Å; V161-L165 VanDerWaalsContact O-CG 3.31Å; V161-L165 WeakPolarHBondContact O-CG 3.49Å; V161-L165 PolarHBondContact O-N 3.43Å; M162-L165 PolarHBondContact O-N 3.11Å; F163-L165 VanDerWaalsContact C-N 3.3Å; F163-L165 PolarHBondContact O-N 2.9Å; L165-L167 HydrophobicContact CB-CD1 4.45Å; L165-L167 HydrophobicContact CB-CG 4Å; L165-L167 HydrophobicContact CD1-CD1 4.47Å; L165-L167 PolarHBondContact O-N 3.33Å
166	Q	90.8	Very high	90.6	Very high	129 Å²	129	57.5 Å²	57.5	60%	0.603	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-178.2	-56.5	-174.2	-4.2	0	0	113.8	M162 F163 V164 G168 S169	M162-Q166 PolarHBondContact O-N 2.86Å; F163-Q166 PolarHBondContact O-N 3.33Å; V164-Q166 PolarHBondContact O-N 2.75Å; Q166-G168 PolarHBondContact O-N 3.33Å; Q166-S169 PolarHBondContact O-N 3.29Å; Q166-S169 VanDerWaalsContact O-N 3.12Å; Q166-S169 PolarHBondContact O-OG 3.42Å
167	L	89	Confident	90.3	Very high	69 Å²	69	57.8 Å²	57.8	36%	0.361	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-65.6	-9.1	178.3	-69	179.1	0	0	0	113.2	M162 L165 S169 A170 F344	M162-L167 HydrophobicContact CB-CB 4.31Å; M162-L167 HydrophobicContact CB-CD1 3.93Å; M162-L167 HydrophobicContact CG-CD1 3.76Å; M162-L167 PolarHBondContact O-N 2.9Å; M162-L167 HydrophobicContact SD-CD1 4.49Å; L165-L167 HydrophobicContact CB-CD1 4.45Å; L165-L167 HydrophobicContact CB-CG 4Å; L165-L167 HydrophobicContact CD1-CD1 4.47Å; L165-L167 PolarHBondContact O-N 3.33Å; L167-S169 PolarHBondContact O-N 3.33Å; L167-S169 VanDerWaalsContact O-N 3.17Å; L167-A170 WeakPolarHBondContact O-CB 3.26Å; L167-A170 PolarHBondContact O-N 2.96Å; L167-F344 HydrophobicContact CB-CE2 4.27Å; L167-F344 HydrophobicContact CB-CZ 4.48Å
168	G	86.4	Confident	90	Very high	5 Å²	5	55.5 Å²	55.5	5%	0.052	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-53.6	-31.4	168	0	0	0	0	0	112.9	Q166 A170 T171 N341	Q166-G168 PolarHBondContact O-N 3.33Å; G168-A170 VanDerWaalsContact C-N 3.27Å; G168-A170 PolarHBondContact O-N 3.41Å; G168-T171 PolarHBondContact O-N 3.38Å; G168-T171 PolarHBondContact O-OG1 2.88Å; G168-N341 PolarHBondContact N-OD1 2.79Å
169	S	83.3	Confident	89.6	Confident	93 Å²	93	55.6 Å²	55.6	65%	0.65	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23.2	174.4	62.6	0	0	0	0	114.2	Q166 L167 T171 F172	Q166-S169 PolarHBondContact O-N 3.29Å; Q166-S169 VanDerWaalsContact O-N 3.12Å; Q166-S169 PolarHBondContact O-OG 3.42Å; L167-S169 PolarHBondContact O-N 3.33Å; L167-S169 VanDerWaalsContact O-N 3.17Å; S169-T171 VanDerWaalsContact C-N 3.35Å; S169-F172 WeakPolarHBondContact O-CD1 3.47Å; S169-F172 VanDerWaalsContact O-CE1 3.25Å; S169-F172 WeakPolarHBondContact O-CE1 3.44Å
170	A	84.5	Confident	89.3	Confident	34 Å²	34	55.8 Å²	55.8	28%	0.281	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-89.6	-1.9	179.9	0	0	0	0	0	112.6	L167 G168 F172 L173	L167-A170 WeakPolarHBondContact O-CB 3.26Å; L167-A170 PolarHBondContact O-N 2.96Å; G168-A170 VanDerWaalsContact C-N 3.27Å; G168-A170 PolarHBondContact O-N 3.41Å; A170-F172 PolarHBondContact O-N 2.86Å; A170-F172 VanDerWaalsContact O-N 3.16Å; A170-L173 HydrophobicContact CB-CD1 4.34Å; A170-L173 WeakPolarHBondContact O-CB 3.3Å; A170-L173 VanDerWaalsContact O-CG 3.29Å; A170-L173 WeakPolarHBondContact O-CG 3.42Å; A170-L173 PolarHBondContact O-N 3.41Å; A170-L173 VanDerWaalsContact O-N 3.1Å
171	T	82.1	Confident	89.1	Confident	17 Å²	17	54 Å²	54	10%	0.104	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-68.8	-17.1	-173.3	-39.7	0	0	0	0	113.8	G168 S169 L173 V174 Y320 L324	G168-T171 PolarHBondContact O-N 3.38Å; G168-T171 PolarHBondContact O-OG1 2.88Å; S169-T171 VanDerWaalsContact C-N 3.35Å; T171-L173 PolarHBondContact O-N 3.41Å; T171-L173 VanDerWaalsContact O-N 3.07Å; T171-V174 HydrophobicContact CG2-CG2 4.47Å; T171-V174 PolarHBondContact O-N 3.13Å; T171-Y320 HydrophobicContact CG2-CE1 4.13Å; T171-L324 HydrophobicContact CG2-CD2 3.11Å
172	F	81.5	Confident	88.7	Confident	158 Å²	158	50.4 Å²	50.4	69%	0.693	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-59.1	-19	171.6	72.6	-91.3	0	0	0	113.3	S169 A170 V174	S169-F172 WeakPolarHBondContact O-CD1 3.47Å; S169-F172 VanDerWaalsContact O-CE1 3.25Å; S169-F172 WeakPolarHBondContact O-CE1 3.44Å; A170-F172 PolarHBondContact O-N 2.86Å; A170-F172 VanDerWaalsContact O-N 3.16Å; F172-V174 PolarHBondContact O-N 2.78Å
173	L	82.7	Confident	88.4	Confident	56 Å²	56	49.9 Å²	49.9	29%	0.293	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-69.5	-19.4	175.1	-62.9	174.3	0	0	0	112.7	A170 T171 T175 I465	A170-L173 HydrophobicContact CB-CD1 4.34Å; A170-L173 WeakPolarHBondContact O-CB 3.3Å; A170-L173 VanDerWaalsContact O-CG 3.29Å; A170-L173 WeakPolarHBondContact O-CG 3.42Å; A170-L173 PolarHBondContact O-N 3.41Å; A170-L173 VanDerWaalsContact O-N 3.1Å; T171-L173 PolarHBondContact O-N 3.41Å; T171-L173 VanDerWaalsContact O-N 3.07Å; L173-T175 PolarHBondContact O-N 3.2Å; L173-I465 HydrophobicContact CD1-CD1 4.25Å; L173-I465 HydrophobicContact CD2-CG1 4.1Å
174	V	86.1	Confident	88.3	Confident	26 Å²	26	48.9 Å²	48.9	16%	0.158	27%	0.266	C	S	.	.	S	Bend	trans	-92.9	92.8	179.2	-170.7	0	0	0	0	108.8	T171 F172 I179 V321 L457 V461	T171-V174 HydrophobicContact CG2-CG2 4.47Å; T171-V174 PolarHBondContact O-N 3.13Å; F172-V174 PolarHBondContact O-N 2.78Å; V174-I179 HydrophobicContact CG1-CD1 3.98Å; V174-I179 HydrophobicContact CG1-CG1 3.61Å; V174-V321 HydrophobicContact CG1-CG1 3.61Å; V174-V321 HydrophobicContact CG1-CG2 4.18Å; V174-V321 HydrophobicContact CG2-CG2 4.23Å; V174-L457 HydrophobicContact CG1-CD1 4.42Å; V174-V461 HydrophobicContact CG2-CG2 4.06Å
175	T	88.6	Confident	88.2	Confident	39 Å²	39	43.6 Å²	43.6	24%	0.239	23%	0.234	C	C	.	.			trans	-79.1	157.6	-174	59.4	0	0	0	0	112.7	L173 P177 V178 I179 T464	L173-T175 PolarHBondContact O-N 3.2Å; T175-P177 VanDerWaalsContact C-CD 3.47Å; T175-P177 VanDerWaalsContact C-N 3.35Å; T175-V178 PolarHBondContact O-N 3.39Å; T175-V178 VanDerWaalsContact O-N 3.07Å; T175-V178 WeakPolarHBondContact OG1-CG2 3.33Å; T175-I179 WeakPolarHBondContact O-CG1 3.26Å; T175-I179 PolarHBondContact O-N 3.1Å; T175-T464 HydrophobicContact CG2-CG2 3.66Å
176	E	87.6	Confident	87.9	Confident	121 Å²	121	38.3 Å²	38.3	57%	0.565	21%	0.206	S	C	*	.	H	α-helix	trans	-53.3	-41.5	177.4	-171	-177.8	159.2	0	0	113.3	V178 I179 S180 K429	E176-V178 PolarHBondContact O-N 3.39Å; E176-I179 PolarHBondContact O-N 3.15Å; E176-S180 VanDerWaalsContact O-CB 3.3Å; E176-S180 WeakPolarHBondContact O-CB 3.35Å; E176-S180 PolarHBondContact O-N 2.93Å; E176-K429 IonicContact OE1-NZ 3.41Å
177	P	91.5	Very high	87.8	Confident	7 Å²	7	32.2 Å²	32.2	5%	0.045	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-39.8	174.6	-23.2	34.8	0	0	0	113.6	T175 S180 A181 Y430 D437 W441	T175-P177 VanDerWaalsContact C-CD 3.47Å; T175-P177 VanDerWaalsContact C-N 3.35Å; P177-S180 PolarHBondContact O-N 3.36Å; P177-A181 VanDerWaalsContact O-CB 3.27Å; P177-A181 WeakPolarHBondContact O-CB 3.29Å; P177-A181 PolarHBondContact O-N 3.42Å; P177-Y430 HydrophobicContact CG-CD1 4.44Å; P177-Y430 HydrophobicContact CG-CE1 4.1Å; P177-D437 HydrophobicContact CG-CB 4.02Å; P177-W441 HydrophobicContact CB-CB 4.34Å
178	V	91.9	Very high	88	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.1	-44.4	178	173.3	0	0	0	0	110.6	T175 E176 M182 I440 T444 L457 V461 T464	T175-V178 PolarHBondContact O-N 3.39Å; T175-V178 VanDerWaalsContact O-N 3.07Å; T175-V178 WeakPolarHBondContact OG1-CG2 3.33Å; E176-V178 PolarHBondContact O-N 3.39Å; V178-M182 VanDerWaalsContact O-CB 3.25Å; V178-M182 WeakPolarHBondContact O-CB 3.46Å; V178-M182 PolarHBondContact O-N 2.91Å; V178-I440 HydrophobicContact CG2-CG2 3.59Å; V178-T444 HydrophobicContact CG1-CG2 4.49Å; V178-L457 HydrophobicContact CG1-CD1 3.85Å; V178-V461 HydrophobicContact CG1-CG2 4.44Å; V178-T464 WeakPolarHBondContact CG2-OG1 3.24Å
179	I	88.7	Confident	88.2	Confident	30 Å²	30	30.7 Å²	30.7	15%	0.154	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-50.6	177.2	-62	169.5	0	0	0	109.8	V174 T175 E176 M182 T183 V321 A325	V174-I179 HydrophobicContact CG1-CD1 3.98Å; V174-I179 HydrophobicContact CG1-CG1 3.61Å; T175-I179 WeakPolarHBondContact O-CG1 3.26Å; T175-I179 PolarHBondContact O-N 3.1Å; E176-I179 PolarHBondContact O-N 3.15Å; I179-M182 PolarHBondContact O-N 3.01Å; I179-T183 HydrophobicContact CG2-CG2 4.37Å; I179-T183 WeakPolarHBondContact O-CG2 3.14Å; I179-T183 PolarHBondContact O-N 3.19Å; I179-T183 PolarHBondContact O-OG1 3.26Å; I179-V321 HydrophobicContact CD1-CG1 4.42Å; I179-V321 HydrophobicContact CG1-CG1 3.92Å; I179-A325 HydrophobicContact CD1-CB 4.15Å; I179-A325 HydrophobicContact CG2-CB 3.88Å
180	S	89.9	Confident	88.5	Confident	5 Å²	5	26.3 Å²	26.3	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-46.3	-179.8	174.8	0	0	0	0	112.5	E176 P177 T183 T184 W441	E176-S180 VanDerWaalsContact O-CB 3.3Å; E176-S180 WeakPolarHBondContact O-CB 3.35Å; E176-S180 PolarHBondContact O-N 2.93Å; P177-S180 PolarHBondContact O-N 3.36Å; S180-T183 WeakPolarHBondContact CA-OG1 3.47Å; S180-T183 PolarHBondContact O-N 3.31Å; S180-T183 PolarHBondContact O-OG1 2.83Å; S180-T183 VanDerWaalsContact O-OG1 3.09Å; S180-T184 WeakPolarHBondContact O-CB 2.93Å; S180-T184 PolarHBondContact O-N 3.05Å; S180-T184 PolarHBondContact O-OG1 3.11Å; S180-W441 PolarHBondContact OG-NE1 2.8Å
181	A	92.8	Very high	88.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-44.7	178.7	0	0	0	0	0	111.9	P177 G185 W441 T444	P177-A181 VanDerWaalsContact O-CB 3.27Å; P177-A181 WeakPolarHBondContact O-CB 3.29Å; P177-A181 PolarHBondContact O-N 3.42Å; A181-G185 PolarHBondContact O-N 3.18Å; A181-W441 HydrophobicContact CB-CB 4.45Å; A181-W441 HydrophobicContact CB-CD2 4Å; A181-W441 HydrophobicContact CB-CG 3.84Å; A181-W441 VanDerWaalsContact CB-O 3.26Å; A181-W441 WeakPolarHBondContact CB-O 2.99Å; A181-T444 HydrophobicContact CB-CG2 3.85Å
182	M	88.4	Confident	89.4	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-63.3	-48.4	177	178.2	-158	12.8	0	0	111.5	V178 I179 T184 G185 A186 V318 V321 L457	V178-M182 VanDerWaalsContact O-CB 3.25Å; V178-M182 WeakPolarHBondContact O-CB 3.46Å; V178-M182 PolarHBondContact O-N 2.91Å; I179-M182 PolarHBondContact O-N 3.01Å; M182-T184 VanDerWaalsContact C-N 3.32Å; M182-T184 PolarHBondContact O-N 2.94Å; M182-G185 PolarHBondContact O-N 3.04Å; M182-A186 WeakPolarHBondContact O-CB 3.07Å; M182-A186 PolarHBondContact O-N 2.98Å; M182-V318 HydrophobicContact SD-CG1 4.17Å; M182-V321 HydrophobicContact CE-CB 4.42Å; M182-V321 HydrophobicContact CE-CG1 3.62Å; M182-L457 HydrophobicContact CE-CD1 3.64Å; M182-L457 HydrophobicContact CE-CD2 4.16Å; M182-L457 HydrophobicContact CE-CG 4.33Å; M182-L457 HydrophobicContact CG-CB 4.26Å; M182-L457 HydrophobicContact SD-CB 3.76Å; M182-L457 HydrophobicContact SD-CD1 3.96Å; M182-L457 HydrophobicContact SD-CD2 3.71Å; M182-L457 HydrophobicContact SD-CG 4.01Å
183	T	87.8	Confident	89.7	Confident	10 Å²	10	19 Å²	19	6%	0.061	11%	0.105	C	C	.	.	H	α-helix	trans	-64.5	-38.8	-179.3	46.8	0	0	0	0	111.4	I179 S180 A187 M420 Q423	I179-T183 HydrophobicContact CG2-CG2 4.37Å; I179-T183 WeakPolarHBondContact O-CG2 3.14Å; I179-T183 PolarHBondContact O-N 3.19Å; I179-T183 PolarHBondContact O-OG1 3.26Å; S180-T183 WeakPolarHBondContact CA-OG1 3.47Å; S180-T183 PolarHBondContact O-N 3.31Å; S180-T183 PolarHBondContact O-OG1 2.83Å; S180-T183 VanDerWaalsContact O-OG1 3.09Å; T183-A187 WeakPolarHBondContact O-CB 3.46Å; T183-A187 PolarHBondContact O-N 3.36Å; T183-M420 HydrophobicContact CG2-CE 4.17Å; T183-M420 WeakPolarHBondContact O-CE 3.3Å; T183-Q423 PolarHBondContact OG1-OE1 3.32Å
184	T	91.9	Very high	90.2	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-50.3	174.3	-50.8	0	0	0	0	110.8	S180 M182 A186 A187 T188 M420 Q423 F424 W441 Y445	S180-T184 WeakPolarHBondContact O-CB 2.93Å; S180-T184 PolarHBondContact O-N 3.05Å; S180-T184 PolarHBondContact O-OG1 3.11Å; M182-T184 VanDerWaalsContact C-N 3.32Å; M182-T184 PolarHBondContact O-N 2.94Å; T184-A186 VanDerWaalsContact C-N 3.35Å; T184-A186 PolarHBondContact O-N 3.03Å; T184-A187 PolarHBondContact O-N 2.79Å; T184-T188 PolarHBondContact O-N 3.12Å; T184-T188 PolarHBondContact O-OG1 3.43Å; T184-M420 PolarHBondContact OG1-O 3.48Å; T184-Q423 WeakPolarHBondContact OG1-CB 3.3Å; T184-F424 HydrophobicContact CG2-CB 4.43Å; T184-F424 HydrophobicContact CG2-CD2 4.22Å; T184-W441 HydrophobicContact CG2-CH2 4.47Å; T184-W441 HydrophobicContact CG2-CZ2 4.31Å; T184-Y445 HydrophobicContact CG2-CD2 4.27Å; T184-Y445 HydrophobicContact CG2-CE2 3.84Å
185	G	92.3	Very high	90.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.1	-37.8	179.6	0	0	0	0	0	113.2	A181 M182 T188 H189	A181-G185 PolarHBondContact O-N 3.18Å; M182-G185 PolarHBondContact O-N 3.04Å; G185-T188 WeakPolarHBondContact O-CB 3.4Å; G185-T188 PolarHBondContact O-N 3.34Å; G185-H189 PolarHBondContact O-CD2 3.3Å; G185-H189 PolarHBondContact O-N 3.34Å
186	A	87.9	Confident	90.7	Very high	2 Å²	2	17 Å²	17	2%	0.017	9%	0.089	C	C	.	.	H	α-helix	trans	-63.4	-43.9	172.7	0	0	0	0	0	112.4	L106 M182 T184 T188 H189 V190 A453	L106-A186 HydrophobicContact CD1-CB 3.51Å; L106-A186 HydrophobicContact CD2-CB 3.41Å; L106-A186 VanDerWaalsContact CD2-CB 3.41Å; L106-A186 HydrophobicContact CG-CB 4.02Å; M182-A186 WeakPolarHBondContact O-CB 3.07Å; M182-A186 PolarHBondContact O-N 2.98Å; T184-A186 VanDerWaalsContact C-N 3.35Å; T184-A186 PolarHBondContact O-N 3.03Å; A186-T188 VanDerWaalsContact C-N 3.27Å; A186-T188 PolarHBondContact O-N 2.85Å; A186-H189 PolarHBondContact O-N 3.12Å; A186-V190 VanDerWaalsContact O-CG2 3.3Å; A186-V190 WeakPolarHBondContact O-CG2 3.5Å; A186-V190 PolarHBondContact O-N 2.61Å; A186-A453 HydrophobicContact CB-CB 4.12Å
187	A	89.9	Confident	90.8	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-60.2	-40.6	175.3	0	0	0	0	0	111	T183 T184 V190 V191 L417 M420 L421	T183-A187 WeakPolarHBondContact O-CB 3.46Å; T183-A187 PolarHBondContact O-N 3.36Å; T184-A187 PolarHBondContact O-N 2.79Å; A187-V190 PolarHBondContact O-N 3.36Å; A187-V191 WeakPolarHBondContact O-CG2 3.45Å; A187-V191 PolarHBondContact O-N 3.46Å; A187-L417 HydrophobicContact CB-CB 4.41Å; A187-L417 HydrophobicContact CB-CD2 4.44Å; A187-M420 HydrophobicContact CB-CB 3.7Å; A187-M420 HydrophobicContact CB-CE 4.36Å; A187-L421 HydrophobicContact CB-CD2 3.79Å; A187-L421 HydrophobicContact CB-CG 4.08Å
188	T	92.9	Very high	91	Very high	23 Å²	23	13.6 Å²	13.6	14%	0.141	7%	0.072	C	C	.	.	H	α-helix	trans	-60.2	-47.3	174.1	-46.4	0	0	0	0	111.7	T184 G185 A186 V190 V191 T192 F212 Y445 I449	T184-T188 PolarHBondContact O-N 3.12Å; T184-T188 PolarHBondContact O-OG1 3.43Å; G185-T188 WeakPolarHBondContact O-CB 3.4Å; G185-T188 PolarHBondContact O-N 3.34Å; A186-T188 VanDerWaalsContact C-N 3.27Å; A186-T188 PolarHBondContact O-N 2.85Å; T188-V190 VanDerWaalsContact C-N 3.33Å; T188-V190 PolarHBondContact O-N 3.23Å; T188-V191 PolarHBondContact O-N 2.89Å; T188-T192 PolarHBondContact O-N 3.4Å; T188-T192 PolarHBondContact O-OG1 3.27Å; T188-T192 VanDerWaalsContact O-OG1 3.07Å; T188-F212 HydrophobicContact CG2-CE2 3.77Å; T188-F212 HydrophobicContact CG2-CZ 4.08Å; T188-Y445 PolarHBondContact OG1-OH 3.43Å; T188-I449 HydrophobicContact CG2-CD1 3.76Å
189	H	90.4	Very high	91	Very high	19 Å²	19	15 Å²	15	9%	0.088	8%	0.08	C	C	.	.	H	α-helix	trans	-58.2	-41.8	175.3	-90.5	-69.6	0	0	0	113.4	L109 G185 A186 T192 S193 T448	L109-H189 HydrophobicContact CD2-CB 3.99Å; G185-H189 PolarHBondContact O-CD2 3.3Å; G185-H189 PolarHBondContact O-N 3.34Å; A186-H189 PolarHBondContact O-N 3.12Å; H189-T192 PolarHBondContact O-N 3.14Å; H189-S193 PolarHBondContact O-N 2.87Å; H189-S193 PolarHBondContact O-OG 3.02Å; H189-T448 PolarHBondContact NE2-O 3Å
190	V	89.4	Confident	91.1	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-66.3	-44.4	178.3	176.7	0	0	0	0	110.4	L71 A105 A186 A187 T188 T192 S193 Q194 I413 L417	L71-V190 HydrophobicContact CD2-CG1 3.88Å; L71-V190 HydrophobicContact CD2-CG2 4.35Å; A105-V190 HydrophobicContact CB-CB 4.38Å; A105-V190 HydrophobicContact CB-CG1 3.9Å; A105-V190 HydrophobicContact CB-CG2 3.61Å; A186-V190 VanDerWaalsContact O-CG2 3.3Å; A186-V190 WeakPolarHBondContact O-CG2 3.5Å; A186-V190 PolarHBondContact O-N 2.61Å; A187-V190 PolarHBondContact O-N 3.36Å; T188-V190 VanDerWaalsContact C-N 3.33Å; T188-V190 PolarHBondContact O-N 3.23Å; V190-T192 VanDerWaalsContact C-N 3.33Å; V190-T192 PolarHBondContact O-N 3.42Å; V190-S193 WeakPolarHBondContact O-CB 3.48Å; V190-S193 PolarHBondContact O-N 3.42Å; V190-S193 VanDerWaalsContact O-N 3.14Å; V190-Q194 WeakPolarHBondContact O-CG 3.43Å; V190-Q194 PolarHBondContact O-N 3.45Å; V190-I413 HydrophobicContact CG1-CG2 3.73Å; V190-L417 HydrophobicContact CB-CD1 3.7Å; V190-L417 HydrophobicContact CG1-CD1 3.5Å
191	V	92.5	Very high	91.1	Very high	30 Å²	30	14.5 Å²	14.5	18%	0.182	8%	0.081	C	C	.	.	H	α-helix	trans	-58.3	-45.9	175.4	170.3	0	0	0	0	110.7	A187 T188 S193 Q194 V195 V414 L417 L421	A187-V191 WeakPolarHBondContact O-CG2 3.45Å; A187-V191 PolarHBondContact O-N 3.46Å; T188-V191 PolarHBondContact O-N 2.89Å; V191-S193 VanDerWaalsContact C-N 3.28Å; V191-S193 PolarHBondContact O-N 3.28Å; V191-Q194 WeakPolarHBondContact O-CA 3.41Å; V191-Q194 WeakPolarHBondContact O-CB 3.27Å; V191-Q194 PolarHBondContact O-N 2.86Å; V191-V195 PolarHBondContact O-N 2.87Å; V191-V414 HydrophobicContact CG1-CG2 4.36Å; V191-V414 HydrophobicContact CG2-CG1 4.46Å; V191-V414 HydrophobicContact CG2-CG2 4.29Å; V191-L417 HydrophobicContact CG2-CD1 4.08Å; V191-L421 HydrophobicContact CG2-CD1 4.2Å
192	T	92.3	Very high	90.7	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-40.5	175.7	-59.5	0	0	0	0	112	T188 H189 V190 Q194 V195 F212 I215 Y216	T188-T192 PolarHBondContact O-N 3.4Å; T188-T192 PolarHBondContact O-OG1 3.27Å; T188-T192 VanDerWaalsContact O-OG1 3.07Å; H189-T192 PolarHBondContact O-N 3.14Å; V190-T192 VanDerWaalsContact C-N 3.33Å; V190-T192 PolarHBondContact O-N 3.42Å; T192-Q194 PolarHBondContact O-N 3.19Å; T192-V195 WeakPolarHBondContact O-CB 3.42Å; T192-V195 PolarHBondContact O-N 3.16Å; T192-F212 HydrophobicContact CG2-CD2 4.02Å; T192-F212 HydrophobicContact CG2-CE2 4.19Å; T192-F212 WeakPolarHBondContact OG1-CE2 3.28Å; T192-I215 HydrophobicContact CG2-CB 4.04Å; T192-I215 HydrophobicContact CG2-CD1 3.98Å; T192-I215 HydrophobicContact CG2-CG2 3.73Å; T192-Y216 HydrophobicContact CG2-CD2 4.11Å; T192-Y216 HydrophobicContact CG2-CE2 3.43Å; T192-Y216 VanDerWaalsContact CG2-CE2 3.43Å; T192-Y216 WeakPolarHBondContact OG1-CE2 3.4Å; T192-Y216 PolarHBondContact OG1-OH 3.46Å
193	S	89.2	Confident	90.5	Very high	23 Å²	23	24.4 Å²	24.4	16%	0.161	13%	0.125	C	C	.	.	H	α-helix	trans	-66.6	-23.5	175.8	-56.2	0	0	0	0	113.3	H189 V190 V191	H189-S193 PolarHBondContact O-N 2.87Å; H189-S193 PolarHBondContact O-OG 3.02Å; V190-S193 WeakPolarHBondContact O-CB 3.48Å; V190-S193 PolarHBondContact O-N 3.42Å; V190-S193 VanDerWaalsContact O-N 3.14Å; V191-S193 VanDerWaalsContact C-N 3.28Å; V191-S193 PolarHBondContact O-N 3.28Å
194	Q	92.3	Very high	90.3	Very high	5 Å²	5	27.4 Å²	27.4	2%	0.023	14%	0.144	C	C	.	.	H	α-helix	trans	-82.6	-19	175.9	-63.6	-39.5	-67.6	0	0	113.6	V190 V191 T192 K196 Y197 L198 A410 I413 V414	V190-Q194 WeakPolarHBondContact O-CG 3.43Å; V190-Q194 PolarHBondContact O-N 3.45Å; V191-Q194 WeakPolarHBondContact O-CA 3.41Å; V191-Q194 WeakPolarHBondContact O-CB 3.27Å; V191-Q194 PolarHBondContact O-N 2.86Å; T192-Q194 PolarHBondContact O-N 3.19Å; Q194-K196 PolarHBondContact O-N 3.14Å; Q194-Y197 PolarHBondContact O-N 3.47Å; Q194-L198 WeakPolarHBondContact O-CG 3.4Å; Q194-L198 PolarHBondContact O-N 3.27Å; Q194-A410 HydrophobicContact CB-CB 4.19Å; Q194-I413 HydrophobicContact CG-CB 4.15Å; Q194-I413 HydrophobicContact CG-CD1 4.24Å; Q194-I413 HydrophobicContact CG-CG2 3.94Å; Q194-V414 HydrophobicContact CB-CG2 3.96Å; Q194-V414 HydrophobicContact CG-CG2 4.18Å
195	V	93	Very high	89.7	Confident	21 Å²	21	30.9 Å²	30.9	13%	0.127	16%	0.158	C	C	.	.	H	α-helix	trans	-54.6	-40.3	-175.3	172.8	0	0	0	0	111.9	V191 T192 Y197 L198 L199 Y216 V219	V191-V195 PolarHBondContact O-N 2.87Å; T192-V195 WeakPolarHBondContact O-CB 3.42Å; T192-V195 PolarHBondContact O-N 3.16Å; V195-Y197 VanDerWaalsContact C-N 3.32Å; V195-Y197 PolarHBondContact O-N 3.33Å; V195-L198 PolarHBondContact O-N 3.02Å; V195-L199 HydrophobicContact CG1-CD1 3.64Å; V195-L199 HydrophobicContact CG1-CG 4.13Å; V195-L199 WeakPolarHBondContact O-CB 3.29Å; V195-L199 WeakPolarHBondContact O-CG 3.33Å; V195-L199 PolarHBondContact O-N 3.12Å; V195-Y216 HydrophobicContact CG2-CE1 4.34Å; V195-V219 HydrophobicContact CG1-CG1 4.43Å; V195-V219 HydrophobicContact CG1-CG2 4.15Å
196	K	91.1	Very high	89.2	Confident	51 Å²	51	33.1 Å²	33.1	22%	0.222	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-39.1	178.4	68.6	179.8	-175.9	171.5	0	113.2	Q194 G200 I201 M203	Q194-K196 PolarHBondContact O-N 3.14Å; K196-G200 CarbonylContact O-C 3.58Å; K196-G200 WeakPolarHBondContact O-CA 3.34Å; K196-G200 PolarHBondContact O-N 3.36Å; K196-I201 PolarHBondContact O-N 3.21Å; K196-M203 HydrophobicContact CB-CB 4.27Å; K196-M203 HydrophobicContact CD-CB 4.28Å
197	Y	91.5	Very high	88.6	Confident	34 Å²	34	35.9 Å²	35.9	13%	0.133	19%	0.188	C	C	.	.	H	α-helix	trans	-78.6	-32.8	178.9	-61.9	-59.4	0	0	0	112	I70 Q194 V195 L199 G200 M406 C407	I70-Y197 HydrophobicContact CG2-CE1 4.34Å; I70-Y197 HydrophobicContact CG2-CE2 3.85Å; I70-Y197 WeakPolarHBondContact CG2-OH 2.96Å; Q194-Y197 PolarHBondContact O-N 3.47Å; V195-Y197 VanDerWaalsContact C-N 3.32Å; V195-Y197 PolarHBondContact O-N 3.33Å; Y197-L199 VanDerWaalsContact C-N 3.33Å; Y197-G200 PolarHBondContact O-N 3.35Å; Y197-M406 HydrophobicContact CD1-CB 4.08Å; Y197-C407 WeakPolarHBondContact O-CA 3.32Å; Y197-C407 WeakPolarHBondContact O-CB 3.22Å
198	L	94	Very high	88.2	Confident	23 Å²	23	37.9 Å²	37.9	12%	0.12	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-37.7	174.4	-66.7	176.6	0	0	0	112.1	Q194 V195 S234 I238 A410 S411 V414	Q194-L198 WeakPolarHBondContact O-CG 3.4Å; Q194-L198 PolarHBondContact O-N 3.27Å; V195-L198 PolarHBondContact O-N 3.02Å; L198-S234 PolarHBondContact O-OG 3.45Å; L198-I238 HydrophobicContact CD2-CD1 4.21Å; L198-A410 HydrophobicContact CD2-CB 3.84Å; L198-A410 HydrophobicContact CG-CB 4.13Å; L198-S411 WeakPolarHBondContact CD2-OG 3.47Å; L198-V414 HydrophobicContact CD1-CG2 4.1Å
199	L	93.2	Very high	87.8	Confident	30 Å²	30	40.9 Å²	40.9	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-90.2	-11.2	179.6	-61.5	-178.3	0	0	0	113.7	V195 Y197 I201 V219 V226 Q227 L231	V195-L199 HydrophobicContact CG1-CD1 3.64Å; V195-L199 HydrophobicContact CG1-CG 4.13Å; V195-L199 WeakPolarHBondContact O-CB 3.29Å; V195-L199 WeakPolarHBondContact O-CG 3.33Å; V195-L199 PolarHBondContact O-N 3.12Å; Y197-L199 VanDerWaalsContact C-N 3.33Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 HydrophobicContact CB-CD1 3.88Å; L199-I201 HydrophobicContact CB-CG1 3.83Å; L199-I201 HydrophobicContact CD1-CD1 3.82Å; L199-I201 PolarHBondContact O-N 2.95Å; L199-V219 HydrophobicContact CD1-CG1 3.58Å; L199-V226 HydrophobicContact CB-CG2 4.35Å; L199-Q227 PolarHBondContact O-N 2.67Å; L199-Q227 VanDerWaalsContact O-N 3.1Å; L199-L231 HydrophobicContact CD2-CD1 3.78Å
200	G	90.1	Very high	87.8	Confident	17 Å²	17	43.7 Å²	43.7	18%	0.175	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	26.9	-174.4	0	0	0	0	0	114.3	K196 Y197 Q227	K196-G200 CarbonylContact O-C 3.58Å; K196-G200 WeakPolarHBondContact O-CA 3.34Å; K196-G200 PolarHBondContact O-N 3.36Å; Y197-G200 PolarHBondContact O-N 3.35Å; G200-Q227 PolarHBondContact O-OE1 3.03Å
201	I	90.3	Very high	87.7	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.041	25%	0.247	C	C	.	.			trans	-90.9	131.1	-178.9	-59.6	173.2	0	0	0	109.9	K196 L199 M203 V219 V226	K196-I201 PolarHBondContact O-N 3.21Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 HydrophobicContact CB-CD1 3.88Å; L199-I201 HydrophobicContact CB-CG1 3.83Å; L199-I201 HydrophobicContact CD1-CD1 3.82Å; L199-I201 PolarHBondContact O-N 2.95Å; I201-M203 PolarHBondContact O-N 2.94Å; I201-V219 HydrophobicContact CD1-CG1 4.46Å; I201-V226 HydrophobicContact CD1-CG2 3.7Å; I201-V226 HydrophobicContact CG1-CG2 4.05Å
202	K	85.2	Confident	87.6	Confident	181 Å²	181	43.8 Å²	43.8	79%	0.787	24%	0.244	S	C	*	.			trans	-76.1	117.6	168.5	-67	-176.2	-179.5	178.3	0	109.8
203	M	83.6	Confident	87.6	Confident	28 Å²	28	48.5 Å²	48.5	14%	0.138	26%	0.264	C	S	.	.			trans	-127.5	134.3	-173	-171.6	-175.4	-174.1	0	0	110.7	K196 I201 I206 I215 Y218	K196-M203 HydrophobicContact CB-CB 4.27Å; K196-M203 HydrophobicContact CD-CB 4.28Å; I201-M203 PolarHBondContact O-N 2.94Å; M203-I206 HydrophobicContact CE-CD1 3.29Å; M203-I206 HydrophobicContact CE-CG1 3.81Å; M203-I215 HydrophobicContact CE-CB 3.94Å; M203-I215 HydrophobicContact CE-CG1 3.8Å; M203-I215 HydrophobicContact CE-CG2 3.86Å; M203-I215 HydrophobicContact SD-CG2 4.1Å; M203-Y218 HydrophobicContact CB-CE1 4.16Å; M203-Y218 HydrophobicContact CE-CD1 3.8Å; M203-Y218 HydrophobicContact CE-CG 3.91Å; M203-Y218 HydrophobicContact CG-CD1 3.7Å; M203-Y218 HydrophobicContact CG-CE1 3.7Å; M203-Y218 HydrophobicContact CG-CG 4.47Å; M203-Y218 HydrophobicContact SD-CD1 4.24Å
204	P	82.5	Confident	87.8	Confident	72 Å²	72	54 Å²	54	47%	0.468	28%	0.282	S	S	.	.			trans	-63	154.2	169.8	29.1	-34.6	0	0	0	110.3	I206 Y218	P204-I206 PolarHBondContact O-N 3.16Å; P204-Y218 WeakPolarHBondContact CD-OH 3.5Å; P204-Y218 HydrophobicContact CG-CE2 4.09Å
205	Y	79.7	Confident	87.8	Confident	76 Å²	76	54.8 Å²	54.8	30%	0.298	29%	0.287	S	S	.	.			trans	-70.7	115.5	175.8	-171.3	-106.6	0	0	0	110.2	A112 N113 E116 S207	A112-Y205 HydrophobicContact CB-CE2 4.32Å; N113-Y205 VanDerWaalsContact CA-OH 3.3Å; N113-Y205 WeakPolarHBondContact CA-OH 3.36Å; N113-Y205 PolarHBondContact N-OH 3.31Å; N113-Y205 VanDerWaalsContact N-OH 3.12Å; N113-Y205 PolarHBondContact OD1-OH 2.97Å; E116-Y205 HydrophobicContact CB-CD1 3.33Å; E116-Y205 HydrophobicContact CB-CD2 4.42Å; E116-Y205 HydrophobicContact CB-CE1 3.46Å; E116-Y205 VanDerWaalsContact CB-CE1 3.46Å; E116-Y205 HydrophobicContact CB-CG 3.83Å; E116-Y205 HydrophobicContact CG-CD1 3.62Å; E116-Y205 HydrophobicContact CG-CD2 3.75Å; E116-Y205 HydrophobicContact CG-CE1 3.76Å; E116-Y205 HydrophobicContact CG-CE2 3.95Å; E116-Y205 HydrophobicContact CG-CG 3.58Å; Y205-S207 WeakPolarHBondContact CE1-OG 3.45Å; Y205-S207 PolarHBondContact OH-OG 3.41Å
206	I	82.4	Confident	87.8	Confident	47 Å²	47	57 Å²	57	24%	0.241	29%	0.293	C	S	.	.			trans	-106.5	117.3	177.5	-55.1	-171.6	0	0	0	108.6	M203 P204 I215	M203-I206 HydrophobicContact CE-CD1 3.29Å; M203-I206 HydrophobicContact CE-CG1 3.81Å; P204-I206 PolarHBondContact O-N 3.16Å; I206-I215 HydrophobicContact CB-CG1 4.2Å
207	S	75.7	Confident	87.9	Confident	59 Å²	59	57.1 Å²	57.1	41%	0.413	30%	0.304	S	S	.	.			trans	-132.6	160.5	175.3	-76.4	0	0	0	0	111.8	N113 Y205	N113-S207 WeakPolarHBondContact OD1-CB 3.42Å; N113-S207 PolarHBondContact OD1-OG 3.1Å; Y205-S207 WeakPolarHBondContact CE1-OG 3.45Å; Y205-S207 PolarHBondContact OH-OG 3.41Å
208	G	81.2	Confident	88	Confident	43 Å²	43	58.3 Å²	58.3	44%	0.443	31%	0.308	S	S	.	.	S	Bend	trans	121	-179.2	177.3	0	0	0	0	0	112.9	L210 G211	G208-L210 PolarHBondContact O-N 3.07Å; G208-G211 PolarHBondContact O-N 3.45Å
209	P	84.9	Confident	87.9	Confident	87 Å²	87	57.7 Å²	57.7	57%	0.565	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	137	173.4	-22.2	33.5	0	0	0	110.6	G211 F451	P209-G211 PolarHBondContact O-N 2.99Å; P209-G211 VanDerWaalsContact O-N 3.1Å; P209-F451 HydrophobicContact CB-CD1 3.87Å; P209-F451 HydrophobicContact CB-CE1 3.9Å; P209-F451 HydrophobicContact CG-CD1 4.21Å; P209-F451 HydrophobicContact CG-CE1 4.3Å
210	L	89.9	Confident	87.9	Confident	77 Å²	77	63.3 Å²	63.3	40%	0.403	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	12.1	-177.4	-52.8	172.8	0	0	0	114.5	G208 F212 F213 Y214 C450	G208-L210 PolarHBondContact O-N 3.07Å; L210-F212 PolarHBondContact O-N 3.49Å; L210-F212 VanDerWaalsContact O-N 3.11Å; L210-F213 HydrophobicContact CB-CD2 4.11Å; L210-F213 HydrophobicContact CD2-CD2 3.84Å; L210-F213 HydrophobicContact CD2-CE2 3.86Å; L210-F213 PolarHBondContact O-N 2.91Å; L210-Y214 HydrophobicContact CB-CD2 4.43Å; L210-Y214 HydrophobicContact CB-CE2 4.13Å; L210-Y214 VanDerWaalsContact O-CD2 3.3Å; L210-Y214 WeakPolarHBondContact O-CD2 3Å; L210-Y214 PolarHBondContact O-N 3.35Å; L210-C450 WeakPolarHBondContact CA-O 3.31Å; L210-C450 HydrophobicContact CD2-CB 4Å; L210-C450 PolarHBondContact N-O 3.37Å
211	G	87.1	Confident	88.1	Confident	6 Å²	6	70 Å²	70	6%	0.062	36%	0.356	C	S	.	.	H	α-helix	trans	-52.2	-35.2	177.5	0	0	0	0	0	113.1	G208 P209 F213 Y214 I215	G208-G211 PolarHBondContact O-N 3.45Å; P209-G211 PolarHBondContact O-N 2.99Å; P209-G211 VanDerWaalsContact O-N 3.1Å; G211-F213 VanDerWaalsContact C-N 3.32Å; G211-F213 PolarHBondContact O-N 3.4Å; G211-Y214 PolarHBondContact O-N 3.47Å; G211-I215 VanDerWaalsContact O-CG1 3.3Å; G211-I215 WeakPolarHBondContact O-CG1 3.42Å; G211-I215 PolarHBondContact O-N 2.96Å
212	F	90.4	Very high	88.2	Confident	29 Å²	29	72.1 Å²	72.1	13%	0.127	37%	0.367	C	S	.	.	H	α-helix	trans	-49.7	-49.8	171.6	178.8	-88.9	0	0	0	112.8	T188 T192 L210 I215 Y216 I449	T188-F212 HydrophobicContact CG2-CE2 3.77Å; T188-F212 HydrophobicContact CG2-CZ 4.08Å; T192-F212 HydrophobicContact CG2-CD2 4.02Å; T192-F212 HydrophobicContact CG2-CE2 4.19Å; T192-F212 WeakPolarHBondContact OG1-CE2 3.28Å; L210-F212 PolarHBondContact O-N 3.49Å; L210-F212 VanDerWaalsContact O-N 3.11Å; F212-I215 PolarHBondContact O-N 3.38Å; F212-Y216 HydrophobicContact CD1-CD2 4.32Å; F212-Y216 HydrophobicContact CD1-CE2 4.34Å; F212-Y216 HydrophobicContact CD2-CE2 4.36Å; F212-Y216 AromaticContact CE1-CD2 3.99Å; F212-Y216 HydrophobicContact CE1-CD2 3.99Å; F212-Y216 AromaticContact CE1-CE2 3.77Å; F212-Y216 HydrophobicContact CE1-CE2 3.77Å; F212-Y216 AromaticContact CE2-CE2 3.83Å; F212-Y216 HydrophobicContact CE2-CE2 3.83Å; F212-Y216 HydrophobicContact CZ-CD2 4.19Å; F212-Y216 AromaticContact CZ-CE2 3.49Å; F212-Y216 HydrophobicContact CZ-CE2 3.49Å; F212-Y216 VanDerWaalsContact CZ-CE2 3.49Å; F212-Y216 VanDerWaalsContact O-CD2 3.29Å; F212-Y216 WeakPolarHBondContact O-CD2 3.24Å; F212-I449 HydrophobicContact CD1-CG2 3.86Å; F212-I449 HydrophobicContact CD2-CG2 4.39Å; F212-I449 HydrophobicContact CE1-CG2 4.09Å; F212-I449 HydrophobicContact CE2-CD1 4.39Å; F212-I449 HydrophobicContact CG-CG2 4.03Å; F212-I449 HydrophobicContact CZ-CG2 4.43Å
213	F	93.4	Very high	88.5	Confident	102 Å²	102	67.8 Å²	67.8	45%	0.447	35%	0.352	S	S	.	.	H	α-helix	trans	-72.9	-38	-177.7	-61.4	-75.6	0	0	0	111.7	L210 G211 I215 Y216 A217 I449	L210-F213 HydrophobicContact CB-CD2 4.11Å; L210-F213 HydrophobicContact CD2-CD2 3.84Å; L210-F213 HydrophobicContact CD2-CE2 3.86Å; L210-F213 PolarHBondContact O-N 2.91Å; G211-F213 VanDerWaalsContact C-N 3.32Å; G211-F213 PolarHBondContact O-N 3.4Å; F213-I215 VanDerWaalsContact C-N 3.27Å; F213-I215 PolarHBondContact O-N 2.97Å; F213-Y216 PolarHBondContact O-N 3.48Å; F213-A217 PolarHBondContact O-N 2.89Å; F213-I449 HydrophobicContact CE2-CG2 4.46Å; F213-I449 HydrophobicContact CZ-CG2 4.21Å
214	Y	92.3	Very high	88.8	Confident	137 Å²	137	76.4 Å²	76.4	54%	0.537	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-34.8	175.3	-71.5	-64.5	0	0	0	112.5	L210 G211 A217 Y218	L210-Y214 HydrophobicContact CB-CD2 4.43Å; L210-Y214 HydrophobicContact CB-CE2 4.13Å; L210-Y214 VanDerWaalsContact O-CD2 3.3Å; L210-Y214 WeakPolarHBondContact O-CD2 3Å; L210-Y214 PolarHBondContact O-N 3.35Å; G211-Y214 PolarHBondContact O-N 3.47Å; Y214-A217 PolarHBondContact O-N 3.31Å; Y214-Y218 WeakPolarHBondContact O-CB 3.3Å; Y214-Y218 PolarHBondContact O-N 3.48Å
215	I	91.7	Very high	89.2	Confident	22 Å²	22	75.8 Å²	75.8	11%	0.113	39%	0.386	C	S	.	.	H	α-helix	trans	-60.2	-49.5	175.5	-69.7	161.9	0	0	0	110.6	T192 M203 I206 G211 F212 F213 Y218 V219	T192-I215 HydrophobicContact CG2-CB 4.04Å; T192-I215 HydrophobicContact CG2-CD1 3.98Å; T192-I215 HydrophobicContact CG2-CG2 3.73Å; M203-I215 HydrophobicContact CE-CB 3.94Å; M203-I215 HydrophobicContact CE-CG1 3.8Å; M203-I215 HydrophobicContact CE-CG2 3.86Å; M203-I215 HydrophobicContact SD-CG2 4.1Å; I206-I215 HydrophobicContact CB-CG1 4.2Å; G211-I215 VanDerWaalsContact O-CG1 3.3Å; G211-I215 WeakPolarHBondContact O-CG1 3.42Å; G211-I215 PolarHBondContact O-N 2.96Å; F212-I215 PolarHBondContact O-N 3.38Å; F213-I215 VanDerWaalsContact C-N 3.27Å; F213-I215 PolarHBondContact O-N 2.97Å; I215-Y218 PolarHBondContact O-N 2.98Å; I215-V219 VanDerWaalsContact O-CG2 3.31Å; I215-V219 WeakPolarHBondContact O-CG2 3.42Å; I215-V219 PolarHBondContact O-N 3.3Å
216	Y	93.4	Very high	89.8	Confident	67 Å²	67	73.9 Å²	73.9	26%	0.263	38%	0.382	S	S	.	.	H	α-helix	trans	-66.7	-39.8	178.4	-74.2	-74	0	0	0	112.5	T192 V195 F212 F213 Y218 V219 F220	T192-Y216 HydrophobicContact CG2-CD2 4.11Å; T192-Y216 HydrophobicContact CG2-CE2 3.43Å; T192-Y216 VanDerWaalsContact CG2-CE2 3.43Å; T192-Y216 WeakPolarHBondContact OG1-CE2 3.4Å; T192-Y216 PolarHBondContact OG1-OH 3.46Å; V195-Y216 HydrophobicContact CG2-CE1 4.34Å; F212-Y216 HydrophobicContact CD1-CD2 4.32Å; F212-Y216 HydrophobicContact CD1-CE2 4.34Å; F212-Y216 HydrophobicContact CD2-CE2 4.36Å; F212-Y216 AromaticContact CE1-CD2 3.99Å; F212-Y216 HydrophobicContact CE1-CD2 3.99Å; F212-Y216 AromaticContact CE1-CE2 3.77Å; F212-Y216 HydrophobicContact CE1-CE2 3.77Å; F212-Y216 AromaticContact CE2-CE2 3.83Å; F212-Y216 HydrophobicContact CE2-CE2 3.83Å; F212-Y216 HydrophobicContact CZ-CD2 4.19Å; F212-Y216 AromaticContact CZ-CE2 3.49Å; F212-Y216 HydrophobicContact CZ-CE2 3.49Å; F212-Y216 VanDerWaalsContact CZ-CE2 3.49Å; F212-Y216 VanDerWaalsContact O-CD2 3.29Å; F212-Y216 WeakPolarHBondContact O-CD2 3.24Å; F213-Y216 PolarHBondContact O-N 3.48Å; Y216-Y218 VanDerWaalsContact C-N 3.32Å; Y216-Y218 PolarHBondContact O-N 3.48Å; Y216-V219 PolarHBondContact O-N 3.13Å; Y216-F220 WeakPolarHBondContact O-CD2 3.3Å; Y216-F220 PolarHBondContact O-N 3.44Å
217	A	93.4	Very high	90.2	Very high	54 Å²	54	74.1 Å²	74.1	45%	0.446	38%	0.382	S	S	.	.	H	α-helix	trans	-56.8	-46.6	174.7	0	0	0	0	0	111.5	F213 Y214 V219 F220 E221	F213-A217 PolarHBondContact O-N 2.89Å; Y214-A217 PolarHBondContact O-N 3.31Å; A217-V219 PolarHBondContact O-N 2.85Å; A217-F220 PolarHBondContact O-N 2.92Å; A217-E221 WeakPolarHBondContact O-CB 3.45Å; A217-E221 PolarHBondContact O-N 3.35Å
218	Y	92.8	Very high	90.9	Very high	59 Å²	59	76.2 Å²	76.2	23%	0.231	39%	0.388	C	S	.	.	H	α-helix	trans	-62.4	-41.1	176.6	-175.6	-85.5	0	0	0	112.5	M203 P204 Y214 I215 Y216 E221 N222	M203-Y218 HydrophobicContact CB-CE1 4.16Å; M203-Y218 HydrophobicContact CE-CD1 3.8Å; M203-Y218 HydrophobicContact CE-CG 3.91Å; M203-Y218 HydrophobicContact CG-CD1 3.7Å; M203-Y218 HydrophobicContact CG-CE1 3.7Å; M203-Y218 HydrophobicContact CG-CG 4.47Å; M203-Y218 HydrophobicContact SD-CD1 4.24Å; P204-Y218 WeakPolarHBondContact CD-OH 3.5Å; P204-Y218 HydrophobicContact CG-CE2 4.09Å; Y214-Y218 WeakPolarHBondContact O-CB 3.3Å; Y214-Y218 PolarHBondContact O-N 3.48Å; I215-Y218 PolarHBondContact O-N 2.98Å; Y216-Y218 VanDerWaalsContact C-N 3.32Å; Y216-Y218 PolarHBondContact O-N 3.48Å; Y218-E221 PolarHBondContact O-N 3.12Å; Y218-N222 HydrophobicContact CE1-CB 4.31Å; Y218-N222 WeakPolarHBondContact O-CB 3.41Å; Y218-N222 PolarHBondContact O-N 3.06Å; Y218-N222 PolarHBondContact O-ND2 3.4Å
219	V	92.9	Very high	91.4	Very high	10 Å²	10	77.6 Å²	77.6	6%	0.061	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-43	176.7	169.2	0	0	0	0	111.2	V195 L199 I201 I215 Y216 A217 N222 I223	V195-V219 HydrophobicContact CG1-CG1 4.43Å; V195-V219 HydrophobicContact CG1-CG2 4.15Å; L199-V219 HydrophobicContact CD1-CG1 3.58Å; I201-V219 HydrophobicContact CD1-CG1 4.46Å; I215-V219 VanDerWaalsContact O-CG2 3.31Å; I215-V219 WeakPolarHBondContact O-CG2 3.42Å; I215-V219 PolarHBondContact O-N 3.3Å; Y216-V219 PolarHBondContact O-N 3.13Å; A217-V219 PolarHBondContact O-N 2.85Å; V219-N222 CarbonylContact O-C 3.48Å; V219-N222 PolarHBondContact O-N 3.31Å; V219-I223 WeakPolarHBondContact O-CA 3.32Å; V219-I223 PolarHBondContact O-N 2.81Å; V219-I223 VanDerWaalsContact O-N 3.08Å
220	F	93.3	Very high	91.8	Very high	148 Å²	148	73.4 Å²	73.4	65%	0.649	36%	0.356	S	S	*	.	H	α-helix	trans	-68.4	-38.8	178.1	-73.5	-60.4	0	0	0	112.6	Y216 A217 N222	Y216-F220 WeakPolarHBondContact O-CD2 3.3Å; Y216-F220 PolarHBondContact O-N 3.44Å; A217-F220 PolarHBondContact O-N 2.92Å; F220-N222 VanDerWaalsContact C-N 3.32Å; F220-N222 PolarHBondContact O-N 2.69Å
221	E	93.7	Very high	92	Very high	159 Å²	159	73 Å²	73	74%	0.743	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-37.8	175.7	-171	175.2	-172.2	0	0	111.8	A217 Y218	A217-E221 WeakPolarHBondContact O-CB 3.45Å; A217-E221 PolarHBondContact O-N 3.35Å; Y218-E221 PolarHBondContact O-N 3.12Å
222	N	92.3	Very high	92.3	Very high	51 Å²	51	77.5 Å²	77.5	27%	0.273	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	23.4	-176.9	-66.8	-83.5	0	0	0	113.6	Y218 V219 F220 K224 S225	Y218-N222 HydrophobicContact CE1-CB 4.31Å; Y218-N222 WeakPolarHBondContact O-CB 3.41Å; Y218-N222 PolarHBondContact O-N 3.06Å; Y218-N222 PolarHBondContact O-ND2 3.4Å; V219-N222 CarbonylContact O-C 3.48Å; V219-N222 PolarHBondContact O-N 3.31Å; F220-N222 VanDerWaalsContact C-N 3.32Å; F220-N222 PolarHBondContact O-N 2.69Å; N222-K224 PolarHBondContact O-N 3.38Å; N222-S225 WeakPolarHBondContact O-CB 3.48Å; N222-S225 PolarHBondContact O-N 3.21Å; N222-S225 PolarHBondContact O-OG 3.12Å
223	I	91.5	Very high	92.5	Very high	90 Å²	90	77.5 Å²	77.5	46%	0.462	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-59.1	-24.5	-174.9	-162.3	66.2	0	0	0	113.5	V219 S225 V226	V219-I223 WeakPolarHBondContact O-CA 3.32Å; V219-I223 PolarHBondContact O-N 2.81Å; V219-I223 VanDerWaalsContact O-N 3.08Å; I223-S225 PolarHBondContact O-N 3.32Å; I223-V226 HydrophobicContact CD1-CG2 4.05Å; I223-V226 WeakPolarHBondContact O-CG2 3.28Å
224	K	90.9	Very high	92.6	Very high	209 Å²	209	72.9 Å²	72.9	91%	0.909	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-72.5	-15	176.1	-63.9	-176.1	-178.6	178.8	0	113.8	N222 V226	N222-K224 PolarHBondContact O-N 3.38Å; K224-V226 VanDerWaalsContact C-N 3.33Å
225	S	89.5	Confident	92.8	Very high	59 Å²	59	71.1 Å²	71.1	41%	0.413	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-89.2	3.2	179.3	70.3	0	0	0	0	113.8	N222 I223 Q227	N222-S225 WeakPolarHBondContact O-CB 3.48Å; N222-S225 PolarHBondContact O-N 3.21Å; N222-S225 PolarHBondContact O-OG 3.12Å; I223-S225 PolarHBondContact O-N 3.32Å; S225-Q227 PolarHBondContact O-N 2.87Å
226	V	92.1	Very high	93	Very high	37 Å²	37	75.1 Å²	75.1	22%	0.224	38%	0.378	C	S	.	.			trans	-62.3	129.1	177.2	173	0	0	0	0	110.2	L199 I201 I223 K224 L231	L199-V226 HydrophobicContact CB-CG2 4.35Å; I201-V226 HydrophobicContact CD1-CG2 3.7Å; I201-V226 HydrophobicContact CG1-CG2 4.05Å; I223-V226 HydrophobicContact CD1-CG2 4.05Å; I223-V226 WeakPolarHBondContact O-CG2 3.28Å; K224-V226 VanDerWaalsContact C-N 3.33Å; V226-L231 HydrophobicContact CG1-CB 4.33Å; V226-L231 HydrophobicContact CG1-CD2 4.25Å
227	Q	91.4	Very high	93.1	Very high	51 Å²	51	72 Å²	72	24%	0.238	37%	0.366	C	S	.	.			trans	-82.8	116.9	170.4	-67.6	-179.1	-28.8	0	0	109	L199 G200 S225 E229 A230 L231 G283	L199-Q227 PolarHBondContact O-N 2.67Å; L199-Q227 VanDerWaalsContact O-N 3.1Å; G200-Q227 PolarHBondContact O-OE1 3.03Å; S225-Q227 PolarHBondContact O-N 2.87Å; Q227-E229 VanDerWaalsContact C-N 3.26Å; Q227-E229 PolarHBondContact O-N 3.28Å; Q227-A230 HydrophobicContact CB-CB 4Å; Q227-A230 PolarHBondContact O-N 3.39Å; Q227-L231 PolarHBondContact O-N 3.26Å; Q227-L231 VanDerWaalsContact O-N 3.08Å; Q227-G283 PolarHBondContact NE2-O 2.93Å
228	L	91.7	Very high	93.1	Very high	104 Å²	104	71.6 Å²	71.6	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-66.2	-32.3	-173.5	-175	141	0	0	0	111.8	L231 L232	L228-L231 PolarHBondContact O-N 2.75Å; L228-L232 HydrophobicContact CD2-CD1 3.46Å; L228-L232 VanDerWaalsContact CD2-CD1 3.46Å; L228-L232 HydrophobicContact CD2-CG 4Å; L228-L232 HydrophobicContact CG-CD1 4.42Å; L228-L232 HydrophobicContact CG-CG 4.47Å; L228-L232 WeakPolarHBondContact O-CB 3.37Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.4Å; L228-L232 PolarHBondContact O-N 3.3Å
229	E	91.3	Very high	93.2	Very high	71 Å²	71	72 Å²	72	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-67.5	-45.9	179.6	-60.5	70.9	-163.5	0	0	110.3	Q227 L233 Y282	Q227-E229 VanDerWaalsContact C-N 3.26Å; Q227-E229 PolarHBondContact O-N 3.28Å; E229-L233 VanDerWaalsContact O-CB 3.23Å; E229-L233 WeakPolarHBondContact O-CB 3.26Å; E229-L233 PolarHBondContact O-N 3.2Å; E229-Y282 HydrophobicContact CG-CD1 3.83Å; E229-Y282 HydrophobicContact CG-CE1 4.5Å; E229-Y282 HydrophobicContact CG-CG 4.12Å
230	A	92.3	Very high	93.3	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.3	-42.9	174.5	0	0	0	0	0	111.1	Q227 S234 L284 C407	Q227-A230 HydrophobicContact CB-CB 4Å; Q227-A230 PolarHBondContact O-N 3.39Å; A230-S234 WeakPolarHBondContact O-CB 3.4Å; A230-S234 PolarHBondContact O-N 3.14Å; A230-S234 PolarHBondContact O-OG 2.91Å; A230-S234 VanDerWaalsContact O-OG 3.09Å; A230-L284 HydrophobicContact CB-CD1 3.62Å; A230-C407 HydrophobicContact CB-CB 4.36Å
231	L	94.3	Very high	93.2	Very high	68 Å²	68	67.1 Å²	67.1	36%	0.356	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-47.7	178	178.7	67.9	0	0	0	112.3	L199 V226 Q227 L228 S234 L235	L199-L231 HydrophobicContact CD2-CD1 3.78Å; V226-L231 HydrophobicContact CG1-CB 4.33Å; V226-L231 HydrophobicContact CG1-CD2 4.25Å; Q227-L231 PolarHBondContact O-N 3.26Å; Q227-L231 VanDerWaalsContact O-N 3.08Å; L228-L231 PolarHBondContact O-N 2.75Å; L231-S234 PolarHBondContact O-N 3.19Å; L231-S234 PolarHBondContact O-OG 2.88Å; L231-L235 VanDerWaalsContact O-CB 3.25Å; L231-L235 WeakPolarHBondContact O-CB 3.27Å; L231-L235 PolarHBondContact O-N 3.49Å
232	L	94.3	Very high	93.1	Very high	101 Å²	101	62 Å²	62	53%	0.529	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-44	178.9	-74.8	-177.8	0	0	0	111.2	L228 L235 L236	L228-L232 HydrophobicContact CD2-CD1 3.46Å; L228-L232 VanDerWaalsContact CD2-CD1 3.46Å; L228-L232 HydrophobicContact CD2-CG 4Å; L228-L232 HydrophobicContact CG-CD1 4.42Å; L228-L232 HydrophobicContact CG-CG 4.47Å; L228-L232 WeakPolarHBondContact O-CB 3.37Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.4Å; L228-L232 PolarHBondContact O-N 3.3Å; L232-L235 PolarHBondContact O-N 3.05Å; L232-L236 VanDerWaalsContact O-CB 3.26Å; L232-L236 WeakPolarHBondContact O-CB 3.47Å; L232-L236 PolarHBondContact O-N 3.28Å
233	L	93.9	Very high	93	Very high	29 Å²	29	64.3 Å²	64.3	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-66.1	-39.6	178.9	-175	59	0	0	0	111.7	E229 S237 L284 P405 V408	E229-L233 VanDerWaalsContact O-CB 3.23Å; E229-L233 WeakPolarHBondContact O-CB 3.26Å; E229-L233 PolarHBondContact O-N 3.2Å; L233-S237 WeakPolarHBondContact O-CB 3.33Å; L233-S237 PolarHBondContact O-N 2.92Å; L233-S237 PolarHBondContact O-OG 3.5Å; L233-L284 HydrophobicContact CD2-CD2 4.14Å; L233-P405 HydrophobicContact CD2-CB 4.17Å; L233-P405 HydrophobicContact CD2-CG 3.99Å; L233-V408 HydrophobicContact CD1-CG2 4.4Å; L233-V408 HydrophobicContact CD2-CG2 3.92Å; L233-V408 HydrophobicContact CG-CG2 3.87Å
234	S	95.3	Very high	92.8	Very high	4 Å²	4	62.3 Å²	62.3	3%	0.028	33%	0.33	C	S	.	.	H	α-helix	trans	-69	-42.1	177.8	71.3	0	0	0	0	111.9	L198 A230 L231 S237 I238 S411	L198-S234 PolarHBondContact O-OG 3.45Å; A230-S234 WeakPolarHBondContact O-CB 3.4Å; A230-S234 PolarHBondContact O-N 3.14Å; A230-S234 PolarHBondContact O-OG 2.91Å; A230-S234 VanDerWaalsContact O-OG 3.09Å; L231-S234 PolarHBondContact O-N 3.19Å; L231-S234 PolarHBondContact O-OG 2.88Å; S234-S237 WeakPolarHBondContact O-CB 3.37Å; S234-S237 PolarHBondContact O-N 3.25Å; S234-I238 VanDerWaalsContact O-CG1 3.29Å; S234-I238 WeakPolarHBondContact O-CG1 3.44Å; S234-I238 PolarHBondContact O-N 3.28Å; S234-S411 WeakPolarHBondContact CA-OG 3.43Å; S234-S411 PolarHBondContact O-OG 3.1Å
235	L	96	Very high	92.5	Very high	100 Å²	100	55.3 Å²	55.3	52%	0.524	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-48.8	175.2	-177.8	65.8	0	0	0	111.4	L231 L232 S237 I238 V239	L231-L235 VanDerWaalsContact O-CB 3.25Å; L231-L235 WeakPolarHBondContact O-CB 3.27Å; L231-L235 PolarHBondContact O-N 3.49Å; L232-L235 PolarHBondContact O-N 3.05Å; L235-S237 VanDerWaalsContact C-N 3.3Å; L235-S237 PolarHBondContact O-N 3.19Å; L235-I238 PolarHBondContact O-N 3.33Å; L235-V239 WeakPolarHBondContact O-CG2 3.48Å; L235-V239 PolarHBondContact O-N 2.75Å
236	L	96	Very high	92.2	Very high	106 Å²	106	56.2 Å²	56.2	56%	0.555	30%	0.297	S	S	*	.	H	α-helix	trans	-57.7	-46	176	179	62.8	0	0	0	110.9	L232 I238 V239 V240	L232-L236 VanDerWaalsContact O-CB 3.26Å; L232-L236 WeakPolarHBondContact O-CB 3.47Å; L232-L236 PolarHBondContact O-N 3.28Å; L236-I238 PolarHBondContact O-N 2.74Å; L236-V239 PolarHBondContact O-N 3.19Å; L236-V240 HydrophobicContact CD1-CG2 4.2Å; L236-V240 WeakPolarHBondContact O-CB 3.31Å; L236-V240 VanDerWaalsContact O-CG2 3.31Å; L236-V240 WeakPolarHBondContact O-CG2 3.47Å; L236-V240 PolarHBondContact O-N 2.98Å
237	S	95.2	Very high	91.8	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-45.5	177.7	-65.7	0	0	0	0	112.2	L233 S234 L235 V240 L241	L233-S237 WeakPolarHBondContact O-CB 3.33Å; L233-S237 PolarHBondContact O-N 2.92Å; L233-S237 PolarHBondContact O-OG 3.5Å; S234-S237 WeakPolarHBondContact O-CB 3.37Å; S234-S237 PolarHBondContact O-N 3.25Å; L235-S237 VanDerWaalsContact C-N 3.3Å; L235-S237 PolarHBondContact O-N 3.19Å; S237-V240 PolarHBondContact O-N 3.46Å; S237-L241 VanDerWaalsContact O-CB 3.32Å; S237-L241 WeakPolarHBondContact O-CB 3.18Å; S237-L241 WeakPolarHBondContact O-CD1 3.45Å; S237-L241 WeakPolarHBondContact O-CG 3.42Å; S237-L241 PolarHBondContact O-N 3.49Å
238	I	94.9	Very high	91.2	Very high	45 Å²	45	57.9 Å²	57.9	23%	0.231	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-47.4	177.4	-71.1	166.9	0	0	0	110.4	L198 S234 L235 L236 L241 V242 V415	L198-I238 HydrophobicContact CD2-CD1 4.21Å; S234-I238 VanDerWaalsContact O-CG1 3.29Å; S234-I238 WeakPolarHBondContact O-CG1 3.44Å; S234-I238 PolarHBondContact O-N 3.28Å; L235-I238 PolarHBondContact O-N 3.33Å; L236-I238 PolarHBondContact O-N 2.74Å; I238-L241 PolarHBondContact O-N 3.09Å; I238-V242 HydrophobicContact CG2-CG2 4.21Å; I238-V242 WeakPolarHBondContact O-CB 3.12Å; I238-V242 VanDerWaalsContact O-CG2 3.28Å; I238-V242 WeakPolarHBondContact O-CG2 3.28Å; I238-V242 PolarHBondContact O-N 3.46Å; I238-V415 HydrophobicContact CB-CG2 4.5Å; I238-V415 HydrophobicContact CG1-CG2 4.34Å; I238-V415 HydrophobicContact CG2-CG2 4.19Å
239	V	95.3	Very high	90.5	Very high	69 Å²	69	58.1 Å²	58.1	42%	0.418	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-49.3	-179.9	170.4	0	0	0	0	110.6	L235 L236 L241 V242 L243	L235-V239 WeakPolarHBondContact O-CG2 3.48Å; L235-V239 PolarHBondContact O-N 2.75Å; L236-V239 PolarHBondContact O-N 3.19Å; V239-L241 PolarHBondContact O-N 3.14Å; V239-V242 PolarHBondContact O-N 3.41Å; V239-L243 HydrophobicContact CG1-CD1 3.58Å; V239-L243 HydrophobicContact CG1-CG 4.21Å; V239-L243 VanDerWaalsContact O-CB 3.27Å; V239-L243 WeakPolarHBondContact O-CB 3.49Å; V239-L243 WeakPolarHBondContact O-CG 3.29Å; V239-L243 PolarHBondContact O-N 3.37Å
240	V	94.1	Very high	90	Very high	54 Å²	54	61.8 Å²	61.8	33%	0.327	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-47.9	177.8	171.3	0	0	0	0	111.2	L236 S237 V242 V244	L236-V240 HydrophobicContact CD1-CG2 4.2Å; L236-V240 WeakPolarHBondContact O-CB 3.31Å; L236-V240 VanDerWaalsContact O-CG2 3.31Å; L236-V240 WeakPolarHBondContact O-CG2 3.47Å; L236-V240 PolarHBondContact O-N 2.98Å; S237-V240 PolarHBondContact O-N 3.46Å; V240-V242 PolarHBondContact O-N 3.3Å; V240-V244 HydrophobicContact CG1-CG2 4.28Å; V240-V244 WeakPolarHBondContact O-CB 3.41Å; V240-V244 WeakPolarHBondContact O-CG2 3.5Å; V240-V244 PolarHBondContact O-N 3.31Å
241	L	91.4	Very high	89.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.6	-45.7	-179.7	-74.1	169.1	0	0	0	112.3	S237 I238 V239 K245 V261 D262 L265 I412 V415	S237-L241 VanDerWaalsContact O-CB 3.32Å; S237-L241 WeakPolarHBondContact O-CB 3.18Å; S237-L241 WeakPolarHBondContact O-CD1 3.45Å; S237-L241 WeakPolarHBondContact O-CG 3.42Å; S237-L241 PolarHBondContact O-N 3.49Å; I238-L241 PolarHBondContact O-N 3.09Å; V239-L241 PolarHBondContact O-N 3.14Å; L241-K245 VanDerWaalsContact O-CB 3.26Å; L241-K245 WeakPolarHBondContact O-CB 3.25Å; L241-K245 VanDerWaalsContact O-CG 3.22Å; L241-K245 WeakPolarHBondContact O-CG 3.43Å; L241-K245 PolarHBondContact O-N 3.02Å; L241-V261 HydrophobicContact CD2-CG1 3.93Å; L241-V261 HydrophobicContact CD2-CG2 4.03Å; L241-D262 WeakPolarHBondContact CD2-OD1 3.18Å; L241-L265 HydrophobicContact CD1-CD2 3.68Å; L241-L265 HydrophobicContact CD2-CD2 3.82Å; L241-L265 HydrophobicContact CG-CD2 3.65Å; L241-I412 HydrophobicContact CD1-CG1 3.89Å; L241-V415 HydrophobicContact CB-CB 4.35Å; L241-V415 HydrophobicContact CB-CG1 4.07Å; L241-V415 HydrophobicContact CB-CG2 4.04Å; L241-V415 HydrophobicContact CD1-CB 4.37Å; L241-V415 HydrophobicContact CD1-CG2 4.15Å
242	V	90.9	Very high	88.2	Confident	52 Å²	52	68.5 Å²	68.5	32%	0.315	35%	0.348	S	S	.	.	H	α-helix	trans	-67.2	-49.1	-179.6	172.1	0	0	0	0	110.3	I238 V239 V240 V244 K245 E246 V415	I238-V242 HydrophobicContact CG2-CG2 4.21Å; I238-V242 WeakPolarHBondContact O-CB 3.12Å; I238-V242 VanDerWaalsContact O-CG2 3.28Å; I238-V242 WeakPolarHBondContact O-CG2 3.28Å; I238-V242 PolarHBondContact O-N 3.46Å; V239-V242 PolarHBondContact O-N 3.41Å; V240-V242 PolarHBondContact O-N 3.3Å; V242-V244 PolarHBondContact O-N 3.47Å; V242-K245 PolarHBondContact O-N 2.91Å; V242-E246 HydrophobicContact CG1-CG 4.28Å; V242-E246 WeakPolarHBondContact O-CB 3.43Å; V242-E246 VanDerWaalsContact O-CG 3.3Å; V242-E246 WeakPolarHBondContact O-CG 3.32Å; V242-E246 PolarHBondContact O-N 2.79Å; V242-V415 HydrophobicContact CG2-CG1 4.1Å; V242-V415 HydrophobicContact CG2-CG2 3.9Å
243	L	90.8	Very high	87.1	Confident	100 Å²	100	75.7 Å²	75.7	52%	0.524	37%	0.368	S	S	.	.	H	α-helix	trans	-58.3	-50.1	179.4	-73.3	174.8	0	0	0	111.2	V239 K245 E246 L247	V239-L243 HydrophobicContact CG1-CD1 3.58Å; V239-L243 HydrophobicContact CG1-CG 4.21Å; V239-L243 VanDerWaalsContact O-CB 3.27Å; V239-L243 WeakPolarHBondContact O-CB 3.49Å; V239-L243 WeakPolarHBondContact O-CG 3.29Å; V239-L243 PolarHBondContact O-N 3.37Å; L243-K245 PolarHBondContact O-N 3.32Å; L243-E246 PolarHBondContact O-N 3.19Å; L243-L247 VanDerWaalsContact O-CB 3.28Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.3Å
244	V	87.1	Confident	85.9	Confident	48 Å²	48	83 Å²	83	29%	0.291	40%	0.398	S	S	.	.	H	α-helix	trans	-66.4	-40.4	-177.8	175.9	0	0	0	0	111.4	V240 V242 L247 N248 V261	V240-V244 HydrophobicContact CG1-CG2 4.28Å; V240-V244 WeakPolarHBondContact O-CB 3.41Å; V240-V244 WeakPolarHBondContact O-CG2 3.5Å; V240-V244 PolarHBondContact O-N 3.31Å; V242-V244 PolarHBondContact O-N 3.47Å; V244-L247 PolarHBondContact O-N 2.94Å; V244-N248 WeakPolarHBondContact O-CB 3.26Å; V244-N248 PolarHBondContact O-N 3.47Å; V244-V261 HydrophobicContact CB-CB 4.35Å; V244-V261 HydrophobicContact CB-CG2 3.83Å; V244-V261 HydrophobicContact CG1-CB 3.79Å; V244-V261 HydrophobicContact CG1-CG1 4.38Å; V244-V261 HydrophobicContact CG1-CG2 3.73Å; V244-V261 HydrophobicContact CG2-CG2 4.15Å
245	K	84.2	Confident	84.4	Confident	61 Å²	61	86.1 Å²	86.1	27%	0.265	41%	0.414	S	S	.	.	H	α-helix	trans	-66.4	-41.9	178.1	-74.1	177.5	-178.5	176.4	0	112	L241 V242 L243 N248 E249 V261 D262 V415	L241-K245 VanDerWaalsContact O-CB 3.26Å; L241-K245 WeakPolarHBondContact O-CB 3.25Å; L241-K245 VanDerWaalsContact O-CG 3.22Å; L241-K245 WeakPolarHBondContact O-CG 3.43Å; L241-K245 PolarHBondContact O-N 3.02Å; V242-K245 PolarHBondContact O-N 2.91Å; L243-K245 PolarHBondContact O-N 3.32Å; K245-N248 PolarHBondContact O-N 2.9Å; K245-E249 PolarHBondContact O-N 3.28Å; K245-E249 VanDerWaalsContact O-N 3.1Å; K245-V261 HydrophobicContact CD-CG1 4.43Å; K245-V261 HydrophobicContact CG-CG1 3.99Å; K245-D262 VanDerWaalsContact CE-OD1 3.3Å; K245-D262 WeakPolarHBondContact CE-OD1 3.18Å; K245-D262 IonicContact NZ-OD1 3.87Å; K245-D262 PolarHBondContact NZ-OD1 2.82Å; K245-D262 IonicContact NZ-OD2 3.17Å; K245-V415 HydrophobicContact CD-CG1 4.02Å
246	E	83.9	Confident	82.5	Confident	79 Å²	79	91.4 Å²	91.4	37%	0.369	43%	0.433	S	S	.	.	H	α-helix	trans	-66.5	-44.1	175.8	-70.9	-57.8	135.5	0	0	111.9	V242 L243 N248 E249 Q250 K418	V242-E246 HydrophobicContact CG1-CG 4.28Å; V242-E246 WeakPolarHBondContact O-CB 3.43Å; V242-E246 VanDerWaalsContact O-CG 3.3Å; V242-E246 WeakPolarHBondContact O-CG 3.32Å; V242-E246 PolarHBondContact O-N 2.79Å; L243-E246 PolarHBondContact O-N 3.19Å; E246-N248 VanDerWaalsContact C-N 3.3Å; E246-N248 PolarHBondContact O-N 3.21Å; E246-E249 PolarHBondContact O-N 2.89Å; E246-Q250 VanDerWaalsContact O-CG 3.27Å; E246-Q250 WeakPolarHBondContact O-CG 3.34Å; E246-Q250 PolarHBondContact O-N 3.01Å; E246-K418 IonicContact OE1-NZ 3.76Å; E246-K418 PolarHBondContact OE1-NZ 3.47Å
247	L	83.7	Confident	80.9	Confident	90 Å²	90	91.1 Å²	91.1	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-40.8	175.3	-70.9	171.1	0	0	0	111.2	L243 V244 E249 Q250 F251	L243-L247 VanDerWaalsContact O-CB 3.28Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.3Å; V244-L247 PolarHBondContact O-N 2.94Å; L247-E249 VanDerWaalsContact C-N 3.33Å; L247-E249 PolarHBondContact O-N 3.43Å; L247-Q250 PolarHBondContact O-N 3.32Å; L247-F251 HydrophobicContact CB-CD2 4.44Å; L247-F251 HydrophobicContact CD2-CD2 4.19Å; L247-F251 HydrophobicContact CD2-CE2 3.79Å; L247-F251 WeakPolarHBondContact O-CB 3.35Å; L247-F251 VanDerWaalsContact O-CD2 3.3Å; L247-F251 WeakPolarHBondContact O-CD2 3.36Å; L247-F251 PolarHBondContact O-N 3.3Å
248	N	79.2	Confident	79.5	Confident	32 Å²	32	94 Å²	94	17%	0.171	45%	0.452	C	S	.	.	H	α-helix	trans	-63.4	-38.3	178	-166.5	30.1	0	0	0	112	V244 K245 E246 K252	V244-N248 WeakPolarHBondContact O-CB 3.26Å; V244-N248 PolarHBondContact O-N 3.47Å; K245-N248 PolarHBondContact O-N 2.9Å; E246-N248 VanDerWaalsContact C-N 3.3Å; E246-N248 PolarHBondContact O-N 3.21Å; N248-K252 WeakPolarHBondContact O-CA 3.48Å; N248-K252 WeakPolarHBondContact O-CB 3.39Å; N248-K252 PolarHBondContact O-N 2.83Å; N248-K252 VanDerWaalsContact O-N 3.11Å
249	E	77	Confident	78.4	Confident	110 Å²	110	96.5 Å²	96.5	51%	0.514	47%	0.466	S	S	.	.	H	α-helix	trans	-70.3	-43	173.6	-76.6	-64.7	159.6	0	0	112.4	K245 E246 L247 F251 K252	K245-E249 PolarHBondContact O-N 3.28Å; K245-E249 VanDerWaalsContact O-N 3.1Å; E246-E249 PolarHBondContact O-N 2.89Å; L247-E249 VanDerWaalsContact C-N 3.33Å; L247-E249 PolarHBondContact O-N 3.43Å; E249-F251 PolarHBondContact O-N 3.31Å; E249-K252 WeakPolarHBondContact O-CB 3.47Å; E249-K252 PolarHBondContact O-N 2.89Å; E249-K252 IonicContact OE1-NZ 2.77Å; E249-K252 IonicContact OE2-NZ 2.66Å
250	Q	80.8	Confident	77.6	Confident	148 Å²	148	94.9 Å²	94.9	69%	0.692	46%	0.457	S	S	*	.	H	α-helix	trans	-64.3	-40.7	178.4	-68.9	-69.4	-22.6	0	0	112.4	E246 L247	E246-Q250 VanDerWaalsContact O-CG 3.27Å; E246-Q250 WeakPolarHBondContact O-CG 3.34Å; E246-Q250 PolarHBondContact O-N 3.01Å; L247-Q250 PolarHBondContact O-N 3.32Å
251	F	78.1	Confident	77.3	Confident	99 Å²	99	93.1 Å²	93.1	43%	0.434	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	15.4	-177.6	-66.5	-74.6	0	0	0	114	L247 E249 R253 K254 I255	L247-F251 HydrophobicContact CB-CD2 4.44Å; L247-F251 HydrophobicContact CD2-CD2 4.19Å; L247-F251 HydrophobicContact CD2-CE2 3.79Å; L247-F251 WeakPolarHBondContact O-CB 3.35Å; L247-F251 VanDerWaalsContact O-CD2 3.3Å; L247-F251 WeakPolarHBondContact O-CD2 3.36Å; L247-F251 PolarHBondContact O-N 3.3Å; E249-F251 PolarHBondContact O-N 3.31Å; F251-R253 PolarHBondContact O-N 3.4Å; F251-K254 PolarHBondContact O-N 3.48Å; F251-I255 HydrophobicContact CB-CD1 3.94Å; F251-I255 HydrophobicContact CB-CG1 4.2Å; F251-I255 PolarHBondContact O-N 2.87Å
252	K	70.3	Confident	77	Confident	110 Å²	110	93.4 Å²	93.4	48%	0.478	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-26.7	-179.6	-168.5	173.7	-171.8	166.4	0	114.5	N248 E249	N248-K252 WeakPolarHBondContact O-CA 3.48Å; N248-K252 WeakPolarHBondContact O-CB 3.39Å; N248-K252 PolarHBondContact O-N 2.83Å; N248-K252 VanDerWaalsContact O-N 3.11Å; E249-K252 WeakPolarHBondContact O-CB 3.47Å; E249-K252 PolarHBondContact O-N 2.89Å; E249-K252 IonicContact OE1-NZ 2.77Å; E249-K252 IonicContact OE2-NZ 2.66Å
253	R	71.4	Confident	76.8	Confident	252 Å²	252	94 Å²	94	95%	0.951	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-25.1	174.9	-84.2	-177.7	70.7	167.8	1.2	114.2	F251	F251-R253 PolarHBondContact O-N 3.4Å
254	K	69.2	Low	76.7	Confident	181 Å²	181	93.4 Å²	93.4	79%	0.787	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-34.2	-177.7	-73.6	-173.3	178.5	-176.4	0	112.5	F251	F251-K254 PolarHBondContact O-N 3.48Å
255	I	62.3	Low	76.9	Confident	71 Å²	71	92.1 Å²	92.1	36%	0.364	44%	0.44	S	S	.	.			trans	-94.2	108.1	-179.2	-55.8	176.8	0	0	0	108.7	F251 V257	F251-I255 HydrophobicContact CB-CD1 3.94Å; F251-I255 HydrophobicContact CB-CG1 4.2Å; F251-I255 PolarHBondContact O-N 2.87Å; I255-V257 VanDerWaalsContact C-N 3.3Å; I255-V257 WeakPolarHBondContact CG2-O 3.24Å
256	K	57.2	Low	77.2	Confident	210 Å²	210	89.5 Å²	89.5	91%	0.913	43%	0.429	S	S	*	.			trans	-77.9	-14.3	179.9	-157.7	171.3	-177.3	-179.8	0	113.2
257	V	61.4	Low	77.6	Confident	100 Å²	100	90.7 Å²	90.7	61%	0.606	44%	0.437	S	S	*	.	S	Bend	trans	-111.5	117	-176.7	-177.5	0	0	0	0	110.1	I255 L259	I255-V257 VanDerWaalsContact C-N 3.3Å; I255-V257 WeakPolarHBondContact CG2-O 3.24Å; V257-L259 PolarHBondContact O-N 3.21Å; V257-L259 VanDerWaalsContact O-N 3.16Å
258	V	67.4	Low	78	Confident	62 Å²	62	89 Å²	89	38%	0.376	44%	0.436	S	S	.	.			trans	-70.8	108.7	171.9	178.6	0	0	0	0	108.1	P260	V258-P260 WeakPolarHBondContact O-CD 3.3Å
259	L	71.4	Confident	78.6	Confident	99 Å²	99	87.9 Å²	87.9	52%	0.518	43%	0.431	S	S	.	.			trans	-71.2	122.4	177.4	-72.1	168	0	0	0	110.1	V257 V261	V257-L259 PolarHBondContact O-N 3.21Å; V257-L259 VanDerWaalsContact O-N 3.16Å; L259-V261 PolarHBondContact O-N 3.28Å
260	P	78.9	Confident	79.3	Confident	35 Å²	35	83.1 Å²	83.1	23%	0.227	41%	0.41	C	S	.	.			trans	-75.5	75	175.2	31.2	-33.7	0	0	0	110	M56 V59 V258 D262 L263 V264	M56-P260 HydrophobicContact CE-CG 4.49Å; M56-P260 HydrophobicContact SD-CB 3.97Å; M56-P260 HydrophobicContact SD-CG 4.15Å; V59-P260 HydrophobicContact CG1-CB 4.2Å; V258-P260 WeakPolarHBondContact O-CD 3.3Å; P260-D262 PolarHBondContact O-N 3.49Å; P260-D262 VanDerWaalsContact O-N 3.16Å; P260-L263 HydrophobicContact CB-CB 4.17Å; P260-L263 HydrophobicContact CG-CB 4.41Å; P260-L263 HydrophobicContact CG-CD2 4.48Å; P260-L263 WeakPolarHBondContact O-CB 3.45Å; P260-L263 PolarHBondContact O-N 2.72Å; P260-V264 PolarHBondContact O-N 3.35Å
261	V	86.3	Confident	79.8	Confident	16 Å²	16	82.7 Å²	82.7	10%	0.097	41%	0.406	C	S	.	.	H	α-helix	trans	-56.1	-33.8	-177.3	64	0	0	0	0	112.6	L241 V244 K245 L259 L263 V264 L265	L241-V261 HydrophobicContact CD2-CG1 3.93Å; L241-V261 HydrophobicContact CD2-CG2 4.03Å; V244-V261 HydrophobicContact CB-CB 4.35Å; V244-V261 HydrophobicContact CB-CG2 3.83Å; V244-V261 HydrophobicContact CG1-CB 3.79Å; V244-V261 HydrophobicContact CG1-CG1 4.38Å; V244-V261 HydrophobicContact CG1-CG2 3.73Å; V244-V261 HydrophobicContact CG2-CG2 4.15Å; K245-V261 HydrophobicContact CD-CG1 4.43Å; K245-V261 HydrophobicContact CG-CG1 3.99Å; L259-V261 PolarHBondContact O-N 3.28Å; V261-L263 VanDerWaalsContact C-N 3.28Å; V261-L263 PolarHBondContact O-N 3.25Å; V261-V264 PolarHBondContact O-N 3.14Å; V261-L265 WeakPolarHBondContact O-CB 3.47Å; V261-L265 PolarHBondContact O-N 2.95Å
262	D	86.3	Confident	80.5	Confident	7 Å²	7	80 Å²	80	4%	0.037	40%	0.403	C	S	.	.	H	α-helix	trans	-60.7	-38.2	177.5	-56.5	-24	0	0	0	111	T63 L241 K245 P260 I266	T63-D262 HydrophobicContact CG2-CB 4.26Å; L241-D262 WeakPolarHBondContact CD2-OD1 3.18Å; K245-D262 VanDerWaalsContact CE-OD1 3.3Å; K245-D262 WeakPolarHBondContact CE-OD1 3.18Å; K245-D262 IonicContact NZ-OD1 3.87Å; K245-D262 PolarHBondContact NZ-OD1 2.82Å; K245-D262 IonicContact NZ-OD2 3.17Å; P260-D262 PolarHBondContact O-N 3.49Å; P260-D262 VanDerWaalsContact O-N 3.16Å; D262-I266 VanDerWaalsContact O-CG1 3.31Å; D262-I266 WeakPolarHBondContact O-CG1 3.2Å; D262-I266 PolarHBondContact O-N 2.89Å
263	L	86.1	Confident	81.5	Confident	65 Å²	65	74.8 Å²	74.8	34%	0.34	38%	0.38	S	S	.	.	H	α-helix	trans	-70.5	-47.7	176.4	-175.5	63.4	0	0	0	111.8	V59 P260 V261 L265 I266 I267	V59-L263 HydrophobicContact CG1-CB 3.62Å; V59-L263 HydrophobicContact CG1-CD1 4.47Å; V59-L263 HydrophobicContact CG1-CG 4.47Å; V59-L263 HydrophobicContact CG2-CB 4.38Å; V59-L263 HydrophobicContact CG2-CD1 4.47Å; V59-L263 HydrophobicContact CG2-CD2 3.95Å; P260-L263 HydrophobicContact CB-CB 4.17Å; P260-L263 HydrophobicContact CG-CB 4.41Å; P260-L263 HydrophobicContact CG-CD2 4.48Å; P260-L263 WeakPolarHBondContact O-CB 3.45Å; P260-L263 PolarHBondContact O-N 2.72Å; V261-L263 VanDerWaalsContact C-N 3.28Å; V261-L263 PolarHBondContact O-N 3.25Å; L263-L265 PolarHBondContact O-N 3.48Å; L263-I266 PolarHBondContact O-N 3.22Å; L263-I266 VanDerWaalsContact O-N 3.16Å; L263-I267 HydrophobicContact CD1-CD1 4.05Å; L263-I267 HydrophobicContact CD1-CG1 4.34Å; L263-I267 HydrophobicContact CD2-CD1 4.39Å; L263-I267 HydrophobicContact CG-CD1 3.8Å; L263-I267 HydrophobicContact CG-CG1 4.43Å; L263-I267 WeakPolarHBondContact O-CG1 3.44Å; L263-I267 PolarHBondContact O-N 3.28Å
264	V	89.4	Confident	82.4	Confident	86 Å²	86	69.5 Å²	69.5	52%	0.521	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-43.7	-178.7	177	0	0	0	0	109.8	P260 V261 I267 A268	P260-V264 PolarHBondContact O-N 3.35Å; V261-V264 PolarHBondContact O-N 3.14Å; V264-I267 PolarHBondContact O-N 2.99Å; V264-A268 VanDerWaalsContact O-CB 3.26Å; V264-A268 WeakPolarHBondContact O-CB 3.31Å; V264-A268 PolarHBondContact O-N 3.28Å
265	L	91.3	Very high	83.4	Confident	21 Å²	21	64.6 Å²	64.6	11%	0.11	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-43.8	177.4	-175.6	68.3	0	0	0	111.9	L241 V261 L263 A268 A269 V408 I412	L241-L265 HydrophobicContact CD1-CD2 3.68Å; L241-L265 HydrophobicContact CD2-CD2 3.82Å; L241-L265 HydrophobicContact CG-CD2 3.65Å; V261-L265 WeakPolarHBondContact O-CB 3.47Å; V261-L265 PolarHBondContact O-N 2.95Å; L263-L265 PolarHBondContact O-N 3.48Å; L265-A268 PolarHBondContact O-N 3.49Å; L265-A269 WeakPolarHBondContact O-CB 3.45Å; L265-A269 PolarHBondContact O-N 3.32Å; L265-V408 HydrophobicContact CD2-CG1 3.86Å; L265-V408 HydrophobicContact CG-CG1 3.93Å; L265-I412 HydrophobicContact CD2-CG1 4.29Å
266	I	90.3	Very high	84.6	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.036	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-46.9	177.7	-77.6	178.8	0	0	0	111.6	T63 D262 L263 S270 L401 L404 I412	T63-I266 HydrophobicContact CG2-CD1 3.07Å; T63-I266 HydrophobicContact CG2-CG1 4.36Å; D262-I266 VanDerWaalsContact O-CG1 3.31Å; D262-I266 WeakPolarHBondContact O-CG1 3.2Å; D262-I266 PolarHBondContact O-N 2.89Å; L263-I266 PolarHBondContact O-N 3.22Å; L263-I266 VanDerWaalsContact O-N 3.16Å; I266-S270 VanDerWaalsContact O-CB 3.26Å; I266-S270 WeakPolarHBondContact O-CB 3.37Å; I266-S270 PolarHBondContact O-N 2.88Å; I266-S270 PolarHBondContact O-OG 3.08Å; I266-L401 HydrophobicContact CG2-CD2 4.23Å; I266-L404 HydrophobicContact CB-CD1 4.24Å; I266-L404 HydrophobicContact CD1-CD2 4.21Å; I266-L404 HydrophobicContact CG1-CD1 3.97Å; I266-L404 HydrophobicContact CG1-CD2 4.26Å; I266-L404 HydrophobicContact CG2-CD1 4.01Å; I266-L404 HydrophobicContact CG2-CD2 4.09Å; I266-I412 HydrophobicContact CD1-CD1 4.02Å; I266-I412 HydrophobicContact CG1-CD1 3.88Å
267	I	90.8	Very high	86.1	Confident	104 Å²	104	57.5 Å²	57.5	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-48.5	-180	-65.7	170.3	0	0	0	109.7	L263 V264 S270 F271	L263-I267 HydrophobicContact CD1-CD1 4.05Å; L263-I267 HydrophobicContact CD1-CG1 4.34Å; L263-I267 HydrophobicContact CD2-CD1 4.39Å; L263-I267 HydrophobicContact CG-CD1 3.8Å; L263-I267 HydrophobicContact CG-CG1 4.43Å; L263-I267 WeakPolarHBondContact O-CG1 3.44Å; L263-I267 PolarHBondContact O-N 3.28Å; V264-I267 PolarHBondContact O-N 2.99Å; I267-S270 PolarHBondContact O-N 2.87Å; I267-F271 VanDerWaalsContact O-CB 3.26Å; I267-F271 WeakPolarHBondContact O-CB 3.46Å; I267-F271 PolarHBondContact O-N 3.19Å
268	A	92.4	Very high	87.1	Confident	55 Å²	55	54.5 Å²	54.5	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-44.8	-179.4	0	0	0	0	0	112.2	V264 L265 A272	V264-A268 VanDerWaalsContact O-CB 3.26Å; V264-A268 WeakPolarHBondContact O-CB 3.31Å; V264-A268 PolarHBondContact O-N 3.28Å; L265-A268 PolarHBondContact O-N 3.49Å; A268-A272 VanDerWaalsContact O-CB 3.32Å; A268-A272 WeakPolarHBondContact O-CB 3.38Å; A268-A272 PolarHBondContact O-N 3.35Å
269	A	92.3	Very high	88	Confident	7 Å²	7	54.3 Å²	54.3	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-66.6	-44.9	178.6	0	0	0	0	0	111.9	L265 F271 A272 C273 V408	L265-A269 WeakPolarHBondContact O-CB 3.45Å; L265-A269 PolarHBondContact O-N 3.32Å; A269-F271 VanDerWaalsContact C-N 3.32Å; A269-F271 PolarHBondContact O-N 3.45Å; A269-A272 PolarHBondContact O-N 3.48Å; A269-C273 WeakPolarHBondContact O-CB 3.39Å; A269-C273 PolarHBondContact O-N 3.26Å; A269-C273 PolarHBondContact O-SG 3.07Å; A269-V408 HydrophobicContact CB-CG1 4.24Å; A269-V408 HydrophobicContact CB-CG2 3.91Å
270	S	91.5	Very high	88.6	Confident	11 Å²	11	55.2 Å²	55.2	8%	0.077	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.3	-52.1	0	0	0	0	111.1	I266 I267 C273 Y274	I266-S270 VanDerWaalsContact O-CB 3.26Å; I266-S270 WeakPolarHBondContact O-CB 3.37Å; I266-S270 PolarHBondContact O-N 2.88Å; I266-S270 PolarHBondContact O-OG 3.08Å; I267-S270 PolarHBondContact O-N 2.87Å; S270-C273 PolarHBondContact O-N 3.13Å; S270-Y274 WeakPolarHBondContact O-CB 3.44Å; S270-Y274 PolarHBondContact O-N 3.18Å
271	F	92.3	Very high	88.9	Confident	138 Å²	138	57.7 Å²	57.7	61%	0.605	32%	0.319	S	S	*	.	H	α-helix	trans	-64.9	-43.5	175.5	-176.7	-103.9	0	0	0	112.1	I267 A269 C273 Y274 C275	I267-F271 VanDerWaalsContact O-CB 3.26Å; I267-F271 WeakPolarHBondContact O-CB 3.46Å; I267-F271 PolarHBondContact O-N 3.19Å; A269-F271 VanDerWaalsContact C-N 3.32Å; A269-F271 PolarHBondContact O-N 3.45Å; F271-C273 PolarHBondContact O-N 2.96Å; F271-Y274 PolarHBondContact O-N 3.38Å; F271-C275 VanDerWaalsContact CZ-SG 3.53Å; F271-C275 WeakPolarHBondContact O-CB 3.11Å; F271-C275 PolarHBondContact O-N 3.15Å; F271-C275 PolarHBondContact O-SG 2.76Å
272	A	91.7	Very high	88.7	Confident	44 Å²	44	62.5 Å²	62.5	36%	0.364	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-44	175.7	0	0	0	0	0	111.8	A268 A269 C275 T276	A268-A272 VanDerWaalsContact O-CB 3.32Å; A268-A272 WeakPolarHBondContact O-CB 3.38Å; A268-A272 PolarHBondContact O-N 3.35Å; A269-A272 PolarHBondContact O-N 3.48Å; A272-C275 PolarHBondContact O-N 2.65Å; A272-T276 WeakPolarHBondContact O-CB 3.43Å; A272-T276 WeakPolarHBondContact O-CG2 3.4Å; A272-T276 PolarHBondContact O-N 2.95Å; A272-T276 PolarHBondContact O-OG1 3.22Å
273	C	91.4	Very high	88.6	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67	-36.2	178.3	-70.3	0	0	0	0	113.3	A269 S270 F271 N277 M278 W403 P405	A269-C273 WeakPolarHBondContact O-CB 3.39Å; A269-C273 PolarHBondContact O-N 3.26Å; A269-C273 PolarHBondContact O-SG 3.07Å; S270-C273 PolarHBondContact O-N 3.13Å; F271-C273 PolarHBondContact O-N 2.96Å; C273-N277 WeakPolarHBondContact O-CA 3.34Å; C273-N277 PolarHBondContact O-N 2.8Å; C273-M278 HydrophobicContact CB-CB 4.24Å; C273-M278 HydrophobicContact CB-SD 4.29Å; C273-M278 PolarHBondContact O-N 3.39Å; C273-M278 VanDerWaalsContact O-N 3.11Å; C273-M278 PolarHBondContact SG-SD 3.37Å; C273-W403 WeakPolarHBondContact CB-O 3.35Å; C273-P405 HydrophobicContact CB-CG 4.28Å; C273-P405 WeakPolarHBondContact SG-CG 3.26Å
274	Y	90.8	Very high	88.7	Confident	141 Å²	141	61.6 Å²	61.6	55%	0.553	34%	0.342	S	S	*	.	H	α-helix	trans	-63.7	-52	172.5	175.3	-105.4	0	0	0	111.6	S270 F271 T276 N277 W403	S270-Y274 WeakPolarHBondContact O-CB 3.44Å; S270-Y274 PolarHBondContact O-N 3.18Å; F271-Y274 PolarHBondContact O-N 3.38Å; Y274-T276 VanDerWaalsContact C-N 3.29Å; Y274-T276 PolarHBondContact O-N 3.47Å; Y274-N277 PolarHBondContact O-N 3.43Å; Y274-W403 AromaticContact CD2-CD1 3.96Å; Y274-W403 HydrophobicContact CD2-CD2 4.04Å; Y274-W403 AromaticContact CD2-CE2 3.59Å; Y274-W403 HydrophobicContact CD2-CG 4.27Å; Y274-W403 AromaticContact CD2-CZ2 3.97Å; Y274-W403 HydrophobicContact CD2-CZ2 3.97Å; Y274-W403 AromaticContact CD2-NE1 3.54Å; Y274-W403 HydrophobicContact CE2-CZ2 4.4Å
275	C	90.4	Very high	88.6	Confident	78 Å²	78	62.7 Å²	62.7	53%	0.527	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-32.9	-177.4	-71.2	0	0	0	0	113.5	F271 A272	F271-C275 VanDerWaalsContact CZ-SG 3.53Å; F271-C275 WeakPolarHBondContact O-CB 3.11Å; F271-C275 PolarHBondContact O-N 3.15Å; F271-C275 PolarHBondContact O-SG 2.76Å; A272-C275 PolarHBondContact O-N 2.65Å
276	T	87.6	Confident	88.6	Confident	70 Å²	70	62.3 Å²	62.3	43%	0.429	34%	0.34	S	S	.	.	H	α-helix	trans	-97.6	-1.8	-178.6	57	0	0	0	0	113.4	A272 Y274 M278	A272-T276 WeakPolarHBondContact O-CB 3.43Å; A272-T276 WeakPolarHBondContact O-CG2 3.4Å; A272-T276 PolarHBondContact O-N 2.95Å; A272-T276 PolarHBondContact O-OG1 3.22Å; Y274-T276 VanDerWaalsContact C-N 3.29Å; Y274-T276 PolarHBondContact O-N 3.47Å; T276-M278 VanDerWaalsContact C-N 3.28Å; T276-M278 PolarHBondContact O-N 3.27Å; T276-M278 VanDerWaalsContact OG1-CG 3.29Å; T276-M278 WeakPolarHBondContact OG1-CG 3.39Å
277	N	87.3	Confident	88.5	Confident	61 Å²	61	62.4 Å²	62.4	33%	0.326	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.5	53.3	-173.8	-164.2	10.8	0	0	0	112.3	C273 Y274 E279 N280 T281	C273-N277 WeakPolarHBondContact O-CA 3.34Å; C273-N277 PolarHBondContact O-N 2.8Å; Y274-N277 PolarHBondContact O-N 3.43Å; N277-E279 VanDerWaalsContact C-N 3.26Å; N277-E279 PolarHBondContact O-N 2.91Å; N277-N280 PolarHBondContact ND2-ND2 2.88Å; N277-N280 PolarHBondContact O-N 2.92Å; N277-N280 PolarHBondContact OD1-ND2 2.78Å; N277-T281 WeakPolarHBondContact O-CB 3.47Å; N277-T281 PolarHBondContact O-N 3.24Å; N277-T281 PolarHBondContact O-OG1 2.84Å
278	M	83	Confident	88.3	Confident	37 Å²	37	58.1 Å²	58.1	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-29.6	-169.9	-100.7	165.7	153.8	0	0	114	C273 T276 Y282 G283 L284	C273-M278 HydrophobicContact CB-CB 4.24Å; C273-M278 HydrophobicContact CB-SD 4.29Å; C273-M278 PolarHBondContact O-N 3.39Å; C273-M278 VanDerWaalsContact O-N 3.11Å; C273-M278 PolarHBondContact SG-SD 3.37Å; T276-M278 VanDerWaalsContact C-N 3.28Å; T276-M278 PolarHBondContact O-N 3.27Å; T276-M278 VanDerWaalsContact OG1-CG 3.29Å; T276-M278 WeakPolarHBondContact OG1-CG 3.39Å; M278-Y282 HydrophobicContact CB-CD2 4.49Å; M278-Y282 HydrophobicContact CG-CD2 3.86Å; M278-Y282 HydrophobicContact CG-CE2 4.41Å; M278-Y282 PolarHBondContact O-N 3.28Å; M278-Y282 VanDerWaalsContact O-N 3.07Å; M278-G283 PolarHBondContact O-N 3.36Å; M278-L284 HydrophobicContact CB-CB 4.47Å; M278-L284 HydrophobicContact CB-CD2 4.27Å; M278-L284 PolarHBondContact O-N 3.47Å; M278-L284 HydrophobicContact SD-CD2 4.31Å
279	E	86.2	Confident	87.9	Confident	59 Å²	59	61.4 Å²	61.4	28%	0.276	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-52.1	176.4	-178.5	179.6	-167.8	0	0	111.1	N277 G283 V286 Y402 W403	N277-E279 VanDerWaalsContact C-N 3.26Å; N277-E279 PolarHBondContact O-N 2.91Å; E279-G283 WeakPolarHBondContact O-CA 3.42Å; E279-G283 PolarHBondContact O-N 3.36Å; E279-G283 VanDerWaalsContact O-N 3.07Å; E279-V286 HydrophobicContact CB-CG1 4.31Å; E279-V286 HydrophobicContact CB-CG2 4.37Å; E279-V286 HydrophobicContact CG-CG2 4.07Å; E279-Y402 PolarHBondContact OE1-OH 3.29Å; E279-Y402 WeakPolarHBondContact OE2-CE1 3.26Å; E279-Y402 PolarHBondContact OE2-OH 2.85Å; E279-W403 HydrophobicContact CB-CZ3 4.43Å
280	N	85.1	Confident	87.6	Confident	118 Å²	118	61.2 Å²	61.2	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-80.2	-35.1	-175.3	-67	-57.8	0	0	0	112.9	N277	N277-N280 PolarHBondContact ND2-ND2 2.88Å; N277-N280 PolarHBondContact O-N 2.92Å; N277-N280 PolarHBondContact OD1-ND2 2.78Å
281	T	85.4	Confident	87.1	Confident	87 Å²	87	60.9 Å²	60.9	53%	0.534	32%	0.324	S	S	.	.	H	α-helix	trans	-81.3	-41.7	-174.5	-49.7	0	0	0	0	112.2	N277	N277-T281 WeakPolarHBondContact O-CB 3.47Å; N277-T281 PolarHBondContact O-N 3.24Å; N277-T281 PolarHBondContact O-OG1 2.84Å
282	Y	82.1	Confident	86.6	Confident	117 Å²	117	58.5 Å²	58.5	46%	0.459	32%	0.317	S	S	.	.	H	α-helix	trans	-115.7	-1.2	-172.8	-58.7	-78.6	0	0	0	113.2	E229 M278 L284	E229-Y282 HydrophobicContact CG-CD1 3.83Å; E229-Y282 HydrophobicContact CG-CE1 4.5Å; E229-Y282 HydrophobicContact CG-CG 4.12Å; M278-Y282 HydrophobicContact CB-CD2 4.49Å; M278-Y282 HydrophobicContact CG-CD2 3.86Å; M278-Y282 HydrophobicContact CG-CE2 4.41Å; M278-Y282 PolarHBondContact O-N 3.28Å; M278-Y282 VanDerWaalsContact O-N 3.07Å; Y282-L284 PolarHBondContact O-N 3.43Å
283	G	83.8	Confident	86.3	Confident	46 Å²	46	56.8 Å²	56.8	47%	0.474	30%	0.304	S	S	.	.			trans	65.8	26.1	179.7	0	0	0	0	0	113.5	Q227 M278 E279	Q227-G283 PolarHBondContact NE2-O 2.93Å; M278-G283 PolarHBondContact O-N 3.36Å; E279-G283 WeakPolarHBondContact O-CA 3.42Å; E279-G283 PolarHBondContact O-N 3.36Å; E279-G283 VanDerWaalsContact O-N 3.07Å
284	L	88.2	Confident	86.1	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.037	32%	0.316	C	S	.	.			trans	-72.5	132.7	-179.4	-170.1	68.7	0	0	0	110.2	A230 L233 M278 Y282 V286 P405	A230-L284 HydrophobicContact CB-CD1 3.62Å; L233-L284 HydrophobicContact CD2-CD2 4.14Å; M278-L284 HydrophobicContact CB-CB 4.47Å; M278-L284 HydrophobicContact CB-CD2 4.27Å; M278-L284 PolarHBondContact O-N 3.47Å; M278-L284 HydrophobicContact SD-CD2 4.31Å; Y282-L284 PolarHBondContact O-N 3.43Å; L284-V286 PolarHBondContact O-N 2.84Å; L284-P405 HydrophobicContact CD2-CB 3.87Å; L284-P405 HydrophobicContact CD2-CG 4.03Å
285	E	88	Confident	85.7	Confident	108 Å²	108	52.8 Å²	52.8	51%	0.505	29%	0.292	S	S	.	.			trans	-74.3	123	179.7	-158.9	173.3	-154.9	0	0	110.9	M406	E285-M406 HydrophobicContact CB-CB 4.45Å; E285-M406 HydrophobicContact CB-CG 4.17Å; E285-M406 HydrophobicContact CG-CG 3.99Å; E285-M406 WeakPolarHBondContact O-CG 3.33Å; E285-M406 PolarHBondContact O-N 3.25Å
286	V	90.9	Very high	85.6	Confident	14 Å²	14	52.9 Å²	52.9	9%	0.085	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-115.4	164.2	179.7	-61.9	0	0	0	0	111.3	E279 L284 G288 Y402 L404	E279-V286 HydrophobicContact CB-CG1 4.31Å; E279-V286 HydrophobicContact CB-CG2 4.37Å; E279-V286 HydrophobicContact CG-CG2 4.07Å; L284-V286 PolarHBondContact O-N 2.84Å; V286-G288 VanDerWaalsContact C-N 3.29Å; V286-G288 PolarHBondContact O-N 3.21Å; V286-Y402 HydrophobicContact CG2-CE1 4.39Å; V286-L404 WeakPolarHBondContact CA-O 3.2Å
287	V	87.6	Confident	85.7	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.048	30%	0.298	C	S	.	.			trans	-58	-38.1	-179	167.4	0	0	0	0	113.1	P76 I290 L404 M406 L409	P76-V287 HydrophobicContact CB-CG1 4.02Å; P76-V287 HydrophobicContact CG-CG1 4.01Å; V287-I290 HydrophobicContact CG1-CD1 3.91Å; V287-I290 HydrophobicContact CG1-CG1 4.08Å; V287-L404 HydrophobicContact CB-CB 4.45Å; V287-L404 HydrophobicContact CG2-CB 3.9Å; V287-L404 HydrophobicContact CG2-CD2 4.28Å; V287-L404 HydrophobicContact CG2-CG 4.19Å; V287-L404 WeakPolarHBondContact CG2-O 3.48Å; V287-L404 PolarHBondContact N-O 2.89Å; V287-M406 HydrophobicContact CG2-CE 4.29Å; V287-M406 HydrophobicContact CG2-SD 4Å; V287-L409 HydrophobicContact CG2-CD1 3.63Å
288	G	85.8	Confident	85.9	Confident	14 Å²	14	58.2 Å²	58.2	14%	0.144	31%	0.31	C	S	.	.			trans	80.9	-165.1	178.6	0	0	0	0	0	113.9	V286 I290 Y402	V286-G288 VanDerWaalsContact C-N 3.29Å; V286-G288 PolarHBondContact O-N 3.21Å; G288-I290 PolarHBondContact O-N 3.46Å; G288-Y402 PolarHBondContact N-O 3.49Å; G288-Y402 WeakPolarHBondContact O-CA 3.37Å; G288-Y402 WeakPolarHBondContact O-CD2 3.42Å
289	H	85.2	Confident	86.4	Confident	124 Å²	124	59.2 Å²	59.2	57%	0.574	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-68.4	118.5	-170	-174.4	67.9	0	0	0	112.6	H75	H75-H289 PolarHBondContact CE1-O 2.88Å; H75-H289 PolarHBondContact NE2-O 3.19Å
290	I	85.6	Confident	86.7	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-97.6	117.9	174.2	-56.1	-171.7	0	0	0	109	L66 V77 V287 G288 L401	L66-I290 HydrophobicContact CD2-CD1 4.21Å; V77-I290 HydrophobicContact CB-CG2 4.11Å; V77-I290 HydrophobicContact CG2-CG2 3.74Å; V287-I290 HydrophobicContact CG1-CD1 3.91Å; V287-I290 HydrophobicContact CG1-CG1 4.08Å; G288-I290 PolarHBondContact O-N 3.46Å; I290-L401 HydrophobicContact CD1-CB 3.61Å; I290-L401 HydrophobicContact CD1-CD1 4.06Å; I290-L401 HydrophobicContact CD1-CG 4.48Å
291	P	81.8	Confident	87.1	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.026	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.3	141.9	179.7	30.5	-36	0	0	0	111.3	V77 L135 L137	V77-P291 HydrophobicContact CB-CG 4.31Å; V77-P291 HydrophobicContact CG1-CG 4.04Å; V77-P291 HydrophobicContact CG2-CG 4.07Å; L135-P291 HydrophobicContact CB-CB 4.05Å; L135-P291 WeakPolarHBondContact O-CB 3.39Å; L137-P291 HydrophobicContact CD1-CG 4.36Å; L137-P291 HydrophobicContact CD2-CG 4.35Å; L137-P291 HydrophobicContact CG-CG 4.29Å
292	N	80.9	Confident	87.4	Confident	89 Å²	89	53.3 Å²	53.3	48%	0.476	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-81.8	134.3	-179.8	-66.1	-32.6	0	0	0	110.7	L135	L135-N292 VanDerWaalsContact CD2-O 3.26Å; L135-N292 WeakPolarHBondContact CD2-O 3.49Å
293	G	85.3	Confident	88	Confident	7 Å²	7	54 Å²	54	7%	0.072	30%	0.304	C	S	.	.	S	Bend	trans	100.6	-175.8	173.1	0	0	0	0	0	114.7	Y81 I394	Y81-G293 PolarHBondContact OH-O 3.39Å; G293-I394 WeakPolarHBondContact O-CG2 3.19Å
294	I	86.7	Confident	88.5	Confident	52 Å²	52	53.5 Å²	53.5	27%	0.267	29%	0.29	S	S	.	.			trans	-107.8	135.1	-177.3	-64.9	176.1	0	0	0	108.8	L84 F85 L391 Y395	L84-I294 HydrophobicContact CD2-CD1 4.23Å; F85-I294 HydrophobicContact CE2-CG2 4.16Å; F85-I294 HydrophobicContact CZ-CG2 3.79Å; I294-L391 HydrophobicContact CD1-CD1 3.6Å; I294-Y395 HydrophobicContact CD1-CE2 4.23Å; I294-Y395 HydrophobicContact CG1-CE2 4.19Å
295	P	82.6	Confident	88.7	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.039	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-65.7	142.5	176.9	27.7	-35.6	0	0	0	111.2	Y81 L135 F358	Y81-P295 HydrophobicContact CD2-CG 4.04Å; Y81-P295 VanDerWaalsContact CE2-CD 3.41Å; Y81-P295 HydrophobicContact CE2-CG 3.78Å; L135-P295 HydrophobicContact CD1-CB 3.83Å; P295-F358 HydrophobicContact CB-CD2 3.67Å; P295-F358 HydrophobicContact CB-CE2 3.97Å; P295-F358 HydrophobicContact CG-CD2 3.83Å
296	P	87.6	Confident	89.1	Confident	79 Å²	79	54.5 Å²	54.5	51%	0.513	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-61.4	146.2	171.5	28.1	-34.2	0	0	0	109.9	R298	P296-R298 PolarHBondContact O-N 3.36Å
297	P	91.5	Very high	89.2	Confident	89 Å²	89	56 Å²	56	58%	0.578	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-62.7	129	-178.7	25.2	-33	0	0	0	110.7	F356 F357	P297-F356 CarbonylContact C-O 3.49Å; P297-F356 VanDerWaalsContact CA-O 3.26Å; P297-F356 WeakPolarHBondContact CA-O 3.4Å; P297-F357 HydrophobicContact CB-CD1 4.3Å; P297-F357 HydrophobicContact CB-CE1 3.86Å; P297-F357 HydrophobicContact CB-CZ 4.09Å; P297-F357 HydrophobicContact CG-CE1 4.3Å
298	R	90.9	Very high	89.6	Confident	155 Å²	155	55.6 Å²	55.6	59%	0.585	32%	0.318	S	S	*	.			trans	-136.6	138.4	177.4	-169.7	179.3	-178	170.6	-1.3	109.9	P296 F356 F358	P296-R298 PolarHBondContact O-N 3.36Å; R298-F356 PolarHBondContact N-O 2.86Å; R298-F356 CarbonylContact O-C 3.52Å; R298-F356 VanDerWaalsContact O-CA 3.27Å; R298-F356 WeakPolarHBondContact O-CA 3.44Å; R298-F356 VanDerWaalsContact O-O 3.07Å; R298-F358 HydrophobicContact CB-CE2 3.99Å; R298-F358 HydrophobicContact CB-CZ 3.67Å; R298-F358 HydrophobicContact CG-CZ 4.29Å
299	A	92.9	Very high	90	Very high	57 Å²	57	59.4 Å²	59.4	47%	0.471	34%	0.335	S	S	.	.			trans	-62.8	136.1	175.2	0	0	0	0	0	111.2	M302 F356	A299-M302 HydrophobicContact CB-CE 4.32Å; A299-F356 HydrophobicContact CB-CD1 4.37Å; A299-F356 HydrophobicContact CB-CE1 4.13Å
300	P	92.8	Very high	90.4	Very high	7 Å²	7	58.2 Å²	58.2	5%	0.045	34%	0.336	C	S	.	.			trans	-56.3	152.1	168.8	-24.3	33.6	0	0	0	111.6	A149 A150 F153 M302	A149-P300 HydrophobicContact CB-CB 4.38Å; A149-P300 HydrophobicContact CB-CG 4.35Å; A150-P300 HydrophobicContact CB-CB 4.31Å; F153-P300 HydrophobicContact CB-CB 4.39Å; F153-P300 HydrophobicContact CB-CG 3.97Å; F153-P300 HydrophobicContact CD2-CG 4.45Å; F153-P300 HydrophobicContact CG-CG 4.26Å; P300-M302 WeakPolarHBondContact O-CE 3.48Å; P300-M302 PolarHBondContact O-N 3.03Å
301	P	92.8	Very high	90.7	Very high	44 Å²	44	58.9 Å²	58.9	29%	0.286	34%	0.339	S	S	.	.			trans	-63.2	108.4	179.2	26.2	-34.7	0	0	0	111.2	G146 A150 N303 I304	G146-P301 VanDerWaalsContact O-CD 3.22Å; G146-P301 WeakPolarHBondContact O-CD 3.45Å; G146-P301 WeakPolarHBondContact O-CG 3.22Å; A150-P301 HydrophobicContact CB-CG 4.21Å; P301-N303 VanDerWaalsContact C-N 3.32Å; P301-N303 WeakPolarHBondContact CB-OD1 3.13Å; P301-N303 PolarHBondContact O-N 3.07Å; P301-I304 HydrophobicContact CB-CD1 4.26Å; P301-I304 HydrophobicContact CB-CG1 4.06Å; P301-I304 HydrophobicContact CG-CD1 3.6Å; P301-I304 HydrophobicContact CG-CG1 3.84Å; P301-I304 VanDerWaalsContact O-CG1 3.32Å; P301-I304 WeakPolarHBondContact O-CG1 3.39Å
302	M	92.8	Very high	91.4	Very high	89 Å²	89	58.7 Å²	58.7	44%	0.438	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-74.8	-22	-175.3	-61.8	-63.1	161.2	0	0	113.2	F153 A299 P300 I304 L305	F153-M302 HydrophobicContact CD1-CE 4.34Å; F153-M302 HydrophobicContact CD1-SD 4.48Å; F153-M302 HydrophobicContact CE1-CE 3.92Å; F153-M302 HydrophobicContact CE1-SD 3.97Å; F153-M302 HydrophobicContact CE2-CE 4.43Å; F153-M302 HydrophobicContact CZ-CE 3.97Å; F153-M302 HydrophobicContact CZ-SD 4.48Å; A299-M302 HydrophobicContact CB-CE 4.32Å; P300-M302 WeakPolarHBondContact O-CE 3.48Å; P300-M302 PolarHBondContact O-N 3.03Å; M302-I304 VanDerWaalsContact C-N 3.3Å; M302-I304 PolarHBondContact O-N 3.04Å; M302-L305 HydrophobicContact CB-CD1 4.26Å; M302-L305 WeakPolarHBondContact O-CG 3.2Å; M302-L305 HydrophobicContact SD-CD1 3.62Å; M302-L305 HydrophobicContact SD-CG 4.45Å
303	N	93.7	Very high	92	Very high	132 Å²	132	58.9 Å²	58.9	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-68	-25.5	-179.9	60.3	-28.9	0	0	0	113.7	P301	P301-N303 VanDerWaalsContact C-N 3.32Å; P301-N303 WeakPolarHBondContact CB-OD1 3.13Å; P301-N303 PolarHBondContact O-N 3.07Å
304	I	94.2	Very high	92.3	Very high	36 Å²	36	58.7 Å²	58.7	19%	0.185	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-98	2.2	-177.5	64.6	166	0	0	0	113.8	L118 V147 A150 P301 M302 S306 A307 V308	L118-I304 HydrophobicContact CD1-CD1 4.4Å; V147-I304 HydrophobicContact CB-CD1 4.19Å; V147-I304 HydrophobicContact CG1-CD1 4.41Å; V147-I304 HydrophobicContact CG2-CD1 3.74Å; A150-I304 HydrophobicContact CB-CD1 3.97Å; A150-I304 HydrophobicContact CB-CG1 4.11Å; P301-I304 HydrophobicContact CB-CD1 4.26Å; P301-I304 HydrophobicContact CB-CG1 4.06Å; P301-I304 HydrophobicContact CG-CD1 3.6Å; P301-I304 HydrophobicContact CG-CG1 3.84Å; P301-I304 VanDerWaalsContact O-CG1 3.32Å; P301-I304 WeakPolarHBondContact O-CG1 3.39Å; M302-I304 VanDerWaalsContact C-N 3.3Å; M302-I304 PolarHBondContact O-N 3.04Å; I304-S306 VanDerWaalsContact C-N 3.3Å; I304-S306 PolarHBondContact O-N 3.31Å; I304-A307 WeakPolarHBondContact O-CB 3.42Å; I304-A307 PolarHBondContact O-N 3.21Å; I304-V308 PolarHBondContact O-N 3.45Å
305	L	94.3	Very high	92.7	Very high	34 Å²	34	56.2 Å²	56.2	18%	0.178	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-58.2	-40.8	-175.1	-71.9	174	0	0	0	112.8	A150 F153 L154 M302 A307 V308 L309	A150-L305 HydrophobicContact CB-CD2 4.33Å; F153-L305 HydrophobicContact CD1-CD2 4.02Å; F153-L305 HydrophobicContact CE1-CD1 4.5Å; L154-L305 HydrophobicContact CB-CD2 3.99Å; L154-L305 HydrophobicContact CD2-CB 4.42Å; L154-L305 HydrophobicContact CD2-CD2 4.35Å; L154-L305 VanDerWaalsContact CD2-O 3.28Å; L154-L305 WeakPolarHBondContact CD2-O 3.26Å; M302-L305 HydrophobicContact CB-CD1 4.26Å; M302-L305 WeakPolarHBondContact O-CG 3.2Å; M302-L305 HydrophobicContact SD-CD1 3.62Å; M302-L305 HydrophobicContact SD-CG 4.45Å; L305-A307 VanDerWaalsContact C-N 3.25Å; L305-A307 PolarHBondContact O-N 3.1Å; L305-V308 WeakPolarHBondContact O-CG2 3.35Å; L305-V308 PolarHBondContact O-N 3.26Å; L305-L309 PolarHBondContact O-N 3.45Å
306	S	94.6	Very high	93.3	Very high	102 Å²	102	55.9 Å²	55.9	71%	0.713	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-62.9	-33.2	176.3	54.2	0	0	0	0	112.4	I304 V308	I304-S306 VanDerWaalsContact C-N 3.3Å; I304-S306 PolarHBondContact O-N 3.31Å; S306-V308 VanDerWaalsContact C-N 3.34Å
307	A	94.4	Very high	93.4	Very high	44 Å²	44	53.8 Å²	53.8	36%	0.364	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-78.6	-15.8	-178.7	0	0	0	0	0	113.7	R117 L118 I304 L305	R117-A307 PolarHBondContact NH2-O 3.03Å; L118-A307 HydrophobicContact CD1-CB 4.38Å; L118-A307 HydrophobicContact CD2-CB 4.26Å; I304-A307 WeakPolarHBondContact O-CB 3.42Å; I304-A307 PolarHBondContact O-N 3.21Å; L305-A307 VanDerWaalsContact C-N 3.25Å; L305-A307 PolarHBondContact O-N 3.1Å
308	V	95.7	Very high	93.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-111.7	9.9	179.2	-59.1	0	0	0	0	113.3	A114 L118 V147 A150 V151 L154 I304 L305 S306 T310 E311 A312	A114-V308 HydrophobicContact CB-CG1 4.06Å; L118-V308 HydrophobicContact CD1-CG1 3.57Å; V147-V308 HydrophobicContact CG1-CG1 4.17Å; A150-V308 HydrophobicContact CB-CG2 4.42Å; V151-V308 HydrophobicContact CG2-CB 3.84Å; V151-V308 HydrophobicContact CG2-CG1 4.06Å; V151-V308 HydrophobicContact CG2-CG2 4.31Å; L154-V308 HydrophobicContact CD2-CG2 4.23Å; I304-V308 PolarHBondContact O-N 3.45Å; L305-V308 WeakPolarHBondContact O-CG2 3.35Å; L305-V308 PolarHBondContact O-N 3.26Å; S306-V308 VanDerWaalsContact C-N 3.34Å; V308-T310 VanDerWaalsContact C-N 3.3Å; V308-T310 PolarHBondContact O-N 3.46Å; V308-E311 PolarHBondContact O-N 2.99Å; V308-A312 VanDerWaalsContact O-CB 3.29Å; V308-A312 WeakPolarHBondContact O-CB 3.41Å; V308-A312 PolarHBondContact O-N 3.12Å
309	L	95	Very high	93.3	Very high	95 Å²	95	42.2 Å²	42.2	50%	0.497	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-41.1	-174.9	-177.3	64.3	0	0	0	112.6	L154 I158 L305 A312 F313	L154-L309 HydrophobicContact CD2-CB 4.4Å; L154-L309 HydrophobicContact CD2-CD1 3.93Å; I158-L309 HydrophobicContact CD1-CD1 4.42Å; L305-L309 PolarHBondContact O-N 3.45Å; L309-A312 PolarHBondContact O-N 3.19Å; L309-F313 WeakPolarHBondContact O-CB 3.43Å; L309-F313 PolarHBondContact O-N 3.49Å
310	T	91.8	Very high	93.3	Very high	99 Å²	99	39.7 Å²	39.7	61%	0.607	23%	0.226	S	C	*	.	H	α-helix	trans	-65	-45.4	-179.2	-54	0	0	0	0	111.8	V308 G314	V308-T310 VanDerWaalsContact C-N 3.3Å; V308-T310 PolarHBondContact O-N 3.46Å; T310-G314 PolarHBondContact O-N 2.92Å
311	E	93.5	Very high	93.1	Very high	16 Å²	16	39.6 Å²	39.6	8%	0.075	23%	0.225	C	C	.	.	H	α-helix	trans	-68.9	-40.9	177.7	-68.9	75.3	-159.7	0	0	111.3	I110 A114 R117 V151 V308 F313 G314 V315	I110-E311 HydrophobicContact CG2-CB 3.86Å; I110-E311 HydrophobicContact CG2-CG 4.19Å; I110-E311 WeakPolarHBondContact CG2-O 3.22Å; A114-E311 HydrophobicContact CB-CB 4.25Å; A114-E311 HydrophobicContact CB-CG 3.85Å; R117-E311 IonicContact CZ-OE1 3.19Å; R117-E311 VanDerWaalsContact CZ-OE1 3.3Å; R117-E311 IonicContact CZ-OE2 3.86Å; R117-E311 IonicContact NH1-OE1 3.54Å; R117-E311 PolarHBondContact NH1-OE1 3.49Å; R117-E311 IonicContact NH1-OE2 3.72Å; R117-E311 IonicContact NH2-OE1 2.8Å; R117-E311 PolarHBondContact NH2-OE1 2.62Å; R117-E311 VanDerWaalsContact NH2-OE1 3.11Å; R117-E311 IonicContact NH2-OE2 3.51Å; R117-E311 PolarHBondContact NH2-OE2 3.14Å; V151-E311 HydrophobicContact CG1-CB 4.18Å; V151-E311 HydrophobicContact CG2-CB 4.34Å; V308-E311 PolarHBondContact O-N 2.99Å; E311-F313 PolarHBondContact O-N 2.85Å; E311-G314 PolarHBondContact O-N 2.79Å; E311-V315 WeakPolarHBondContact O-CG2 3.37Å; E311-V315 PolarHBondContact O-N 2.84Å
312	A	95.8	Very high	92.9	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-43	175.8	0	0	0	0	0	112	L154 G155 I158 V308 L309 V315 A316	L154-A312 HydrophobicContact CB-CB 3.61Å; L154-A312 HydrophobicContact CD2-CB 3.65Å; L154-A312 HydrophobicContact CG-CB 3.56Å; G155-A312 WeakPolarHBondContact CA-O 3.41Å; I158-A312 HydrophobicContact CD1-CB 4.11Å; V308-A312 VanDerWaalsContact O-CB 3.29Å; V308-A312 WeakPolarHBondContact O-CB 3.41Å; V308-A312 PolarHBondContact O-N 3.12Å; L309-A312 PolarHBondContact O-N 3.19Å; A312-V315 PolarHBondContact O-N 3.35Å; A312-A316 VanDerWaalsContact O-CB 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.45Å; A312-A316 PolarHBondContact O-N 3.08Å
313	F	93.8	Very high	92.9	Very high	94 Å²	94	33.7 Å²	33.7	41%	0.412	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-42	173.6	-175.4	-96	0	0	0	111.8	I158 M162 L309 E311 A316 L317	I158-F313 HydrophobicContact CD1-CB 4.28Å; I158-F313 HydrophobicContact CG2-CD2 4.34Å; M162-F313 HydrophobicContact CE-CE2 3.99Å; L309-F313 WeakPolarHBondContact O-CB 3.43Å; L309-F313 PolarHBondContact O-N 3.49Å; E311-F313 PolarHBondContact O-N 2.85Å; F313-A316 PolarHBondContact O-N 2.73Å; F313-L317 HydrophobicContact CE1-CD2 4.38Å; F313-L317 WeakPolarHBondContact O-CB 3.46Å; F313-L317 PolarHBondContact O-N 3.49Å
314	G	91.8	Very high	92.8	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-59.1	-47.8	174.2	0	0	0	0	0	112.6	T310 E311 V318	T310-G314 PolarHBondContact O-N 2.92Å; E311-G314 PolarHBondContact O-N 2.79Å; G314-V318 WeakPolarHBondContact O-CB 3.39Å; G314-V318 VanDerWaalsContact O-CG2 3.27Å; G314-V318 WeakPolarHBondContact O-CG2 3.42Å; G314-V318 PolarHBondContact O-N 3.36Å
315	V	94.4	Very high	92.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-45.5	175	164.4	0	0	0	0	111.2	T107 I110 V151 E311 A312 L317 G319 P361	T107-V315 HydrophobicContact CG2-CG1 4.19Å; T107-V315 HydrophobicContact CG2-CG2 4.39Å; I110-V315 HydrophobicContact CB-CG2 4.13Å; I110-V315 HydrophobicContact CG2-CG2 3.83Å; V151-V315 HydrophobicContact CG1-CG2 3.84Å; E311-V315 WeakPolarHBondContact O-CG2 3.37Å; E311-V315 PolarHBondContact O-N 2.84Å; A312-V315 PolarHBondContact O-N 3.35Å; V315-L317 PolarHBondContact O-N 3.03Å; V315-G319 VanDerWaalsContact O-CA 3.32Å; V315-G319 WeakPolarHBondContact O-CA 3.29Å; V315-G319 PolarHBondContact O-N 2.79Å; V315-P361 HydrophobicContact CG1-CB 3.76Å; V315-P361 HydrophobicContact CG1-CG 4.39Å; V315-P361 HydrophobicContact CG2-CB 4.06Å; V315-P361 HydrophobicContact CG2-CG 4.21Å
316	A	94.6	Very high	92.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-50.6	-178.9	0	0	0	0	0	111.6	G155 I158 Q159 A312 F313 Y320	G155-A316 WeakPolarHBondContact O-CB 3.25Å; I158-A316 HydrophobicContact CB-CB 3.88Å; I158-A316 HydrophobicContact CG2-CB 3.62Å; Q159-A316 HydrophobicContact CG-CB 3.89Å; Q159-A316 PolarHBondContact NE2-O 2.7Å; A312-A316 VanDerWaalsContact O-CB 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.45Å; A312-A316 PolarHBondContact O-N 3.08Å; F313-A316 PolarHBondContact O-N 2.73Å; A316-Y320 WeakPolarHBondContact O-CB 3.26Å; A316-Y320 PolarHBondContact O-N 3.1Å
317	L	90.2	Very high	92.3	Very high	35 Å²	35	21.8 Å²	21.8	18%	0.183	13%	0.126	C	C	.	.	H	α-helix	trans	-72.2	-53.9	-176.4	-174	68.7	0	0	0	111.7	F313 V315 Y320 V321 L457	F313-L317 HydrophobicContact CE1-CD2 4.38Å; F313-L317 WeakPolarHBondContact O-CB 3.46Å; F313-L317 PolarHBondContact O-N 3.49Å; V315-L317 PolarHBondContact O-N 3.03Å; L317-Y320 PolarHBondContact O-N 3.37Å; L317-V321 WeakPolarHBondContact O-CG2 3.19Å; L317-V321 PolarHBondContact O-N 2.89Å; L317-L457 HydrophobicContact CD2-CD2 3.83Å; L317-L457 HydrophobicContact CD2-CG 4.13Å; L317-L457 HydrophobicContact CG-CD2 3.65Å; L317-L457 HydrophobicContact CG-CG 4.43Å
318	V	89.4	Confident	92	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.6	-43.8	-174.9	174.3	0	0	0	0	111.3	L106 I110 M182 G314 Y320 V321 A322 N454 L457	L106-V318 HydrophobicContact CD2-CG1 3.19Å; L106-V318 HydrophobicContact CG-CG1 3.84Å; I110-V318 HydrophobicContact CD1-CB 4.4Å; I110-V318 HydrophobicContact CD1-CG2 4.38Å; M182-V318 HydrophobicContact SD-CG1 4.17Å; G314-V318 WeakPolarHBondContact O-CB 3.39Å; G314-V318 VanDerWaalsContact O-CG2 3.27Å; G314-V318 WeakPolarHBondContact O-CG2 3.42Å; G314-V318 PolarHBondContact O-N 3.36Å; V318-Y320 VanDerWaalsContact C-N 3.32Å; V318-Y320 PolarHBondContact O-N 3.47Å; V318-V321 PolarHBondContact O-N 3.1Å; V318-A322 WeakPolarHBondContact O-CB 3.44Å; V318-A322 PolarHBondContact O-N 2.63Å; V318-N454 HydrophobicContact CG2-CB 3.93Å; V318-L457 HydrophobicContact CB-CD2 4.44Å; V318-L457 HydrophobicContact CG2-CD2 3.83Å
319	G	91.8	Very high	91.7	Very high	1 Å²	1	25 Å²	25	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-40.3	177.7	0	0	0	0	0	111.9	V315 S323	V315-G319 VanDerWaalsContact O-CA 3.32Å; V315-G319 WeakPolarHBondContact O-CA 3.29Å; V315-G319 PolarHBondContact O-N 2.79Å; G319-S323 WeakPolarHBondContact O-CB 3.4Å; G319-S323 PolarHBondContact O-N 3.26Å; G319-S323 VanDerWaalsContact O-N 3.15Å; G319-S323 PolarHBondContact O-OG 2.84Å
320	Y	91.8	Very high	91.5	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-66.2	-52	175.3	173.7	-103.7	0	0	0	111.9	T171 A316 L317 V318 A322 S323 L324 D340 E343 F344	T171-Y320 HydrophobicContact CG2-CE1 4.13Å; A316-Y320 WeakPolarHBondContact O-CB 3.26Å; A316-Y320 PolarHBondContact O-N 3.1Å; L317-Y320 PolarHBondContact O-N 3.37Å; V318-Y320 VanDerWaalsContact C-N 3.32Å; V318-Y320 PolarHBondContact O-N 3.47Å; Y320-A322 VanDerWaalsContact C-N 3.35Å; Y320-A322 PolarHBondContact O-N 3.09Å; Y320-S323 PolarHBondContact O-N 2.69Å; Y320-S323 VanDerWaalsContact O-N 3.07Å; Y320-L324 HydrophobicContact CE1-CB 4.47Å; Y320-L324 HydrophobicContact CE1-CD2 4.02Å; Y320-L324 HydrophobicContact CE2-CB 4.48Å; Y320-L324 WeakPolarHBondContact O-CB 3.39Å; Y320-L324 PolarHBondContact O-N 3.17Å; Y320-D340 PolarHBondContact OH-O 2.94Å; Y320-E343 HydrophobicContact CE2-CB 4.06Å; Y320-F344 HydrophobicContact CD1-CD1 4.11Å; Y320-F344 AromaticContact CD1-CE1 3.35Å; Y320-F344 HydrophobicContact CD1-CE1 3.35Å; Y320-F344 HydrophobicContact CD1-CE2 4.12Å; Y320-F344 AromaticContact CD1-CZ 3.37Å; Y320-F344 HydrophobicContact CD1-CZ 3.37Å; Y320-F344 AromaticContact CD2-CD1 3.41Å; Y320-F344 HydrophobicContact CD2-CD1 3.41Å; Y320-F344 VanDerWaalsContact CD2-CD1 3.41Å; Y320-F344 HydrophobicContact CD2-CD2 4.34Å; Y320-F344 AromaticContact CD2-CE1 3.57Å; Y320-F344 HydrophobicContact CD2-CE1 3.57Å; Y320-F344 HydrophobicContact CD2-CE2 4.47Å; Y320-F344 AromaticContact CD2-CG 3.83Å; Y320-F344 HydrophobicContact CD2-CG 3.83Å; Y320-F344 HydrophobicContact CD2-CZ 4.12Å; Y320-F344 HydrophobicContact CE1-CD1 4.21Å; Y320-F344 HydrophobicContact CE1-CD2 4.08Å; Y320-F344 AromaticContact CE1-CE1 3.55Å; Y320-F344 HydrophobicContact CE1-CE1 3.55Å; Y320-F344 AromaticContact CE1-CE2 3.39Å; Y320-F344 HydrophobicContact CE1-CE2 3.39Å; Y320-F344 HydrophobicContact CE1-CG 4.44Å; Y320-F344 AromaticContact CE1-CZ 3.09Å; Y320-F344 HydrophobicContact CE1-CZ 3.09Å; Y320-F344 HydrophobicContact CE2-CB 4.14Å; Y320-F344 AromaticContact CE2-CD1 3.53Å; Y320-F344 HydrophobicContact CE2-CD1 3.53Å; Y320-F344 AromaticContact CE2-CD2 3.59Å; Y320-F344 HydrophobicContact CE2-CD2 3.59Å; Y320-F344 AromaticContact CE2-CE1 3.75Å; Y320-F344 HydrophobicContact CE2-CE1 3.75Å; Y320-F344 AromaticContact CE2-CE2 3.81Å; Y320-F344 HydrophobicContact CE2-CE2 3.81Å; Y320-F344 AromaticContact CE2-CG 3.44Å; Y320-F344 HydrophobicContact CE2-CG 3.44Å; Y320-F344 VanDerWaalsContact CE2-CG 3.44Å; Y320-F344 AromaticContact CE2-CZ 3.9Å; Y320-F344 HydrophobicContact CE2-CZ 3.9Å; Y320-F344 AromaticContact CG-CD1 3.7Å; Y320-F344 HydrophobicContact CG-CD1 3.7Å; Y320-F344 AromaticContact CG-CE1 3.35Å; Y320-F344 HydrophobicContact CG-CE1 3.35Å; Y320-F344 HydrophobicContact CG-CG 4.46Å; Y320-F344 AromaticContact CG-CZ 3.87Å; Y320-F344 HydrophobicContact CG-CZ 3.87Å; Y320-F344 AromaticContact CZ-CD1 3.92Å; Y320-F344 AromaticContact CZ-CD2 3.41Å; Y320-F344 VanDerWaalsContact CZ-CD2 3.41Å; Y320-F344 AromaticContact CZ-CE1 3.72Å; Y320-F344 AromaticContact CZ-CE2 3.18Å; Y320-F344 AromaticContact CZ-CG 3.77Å; Y320-F344 AromaticContact CZ-CZ 3.37Å; Y320-F344 WeakPolarHBondContact OH-CD2 3.45Å; Y320-F344 WeakPolarHBondContact OH-CE2 3.48Å
321	V	89.9	Confident	91.4	Very high	5 Å²	5	16.2 Å²	16.2	3%	0.03	9%	0.094	C	C	.	.	H	α-helix	trans	-59.8	-45.2	-177.4	169.3	0	0	0	0	111.5	V174 I179 M182 L317 V318 S323 L324 A325 L457	V174-V321 HydrophobicContact CG1-CG1 3.61Å; V174-V321 HydrophobicContact CG1-CG2 4.18Å; V174-V321 HydrophobicContact CG2-CG2 4.23Å; I179-V321 HydrophobicContact CD1-CG1 4.42Å; I179-V321 HydrophobicContact CG1-CG1 3.92Å; M182-V321 HydrophobicContact CE-CB 4.42Å; M182-V321 HydrophobicContact CE-CG1 3.62Å; L317-V321 WeakPolarHBondContact O-CG2 3.19Å; L317-V321 PolarHBondContact O-N 2.89Å; V318-V321 PolarHBondContact O-N 3.1Å; V321-S323 VanDerWaalsContact C-N 3.27Å; V321-S323 PolarHBondContact O-N 3.29Å; V321-L324 PolarHBondContact O-N 3.26Å; V321-A325 WeakPolarHBondContact O-CB 3.33Å; V321-A325 PolarHBondContact O-N 3.14Å; V321-L457 HydrophobicContact CB-CD2 4.25Å; V321-L457 HydrophobicContact CG1-CD1 4.49Å; V321-L457 HydrophobicContact CG2-CD2 4.05Å
322	A	88.5	Confident	91.3	Very high	9 Å²	9	24 Å²	24	7%	0.074	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-40.4	176.9	0	0	0	0	0	111.6	F104 V318 Y320 L326	F104-A322 HydrophobicContact CE1-CB 4.14Å; F104-A322 HydrophobicContact CZ-CB 4.26Å; V318-A322 WeakPolarHBondContact O-CB 3.44Å; V318-A322 PolarHBondContact O-N 2.63Å; Y320-A322 VanDerWaalsContact C-N 3.35Å; Y320-A322 PolarHBondContact O-N 3.09Å; A322-L326 WeakPolarHBondContact O-CG 3.27Å; A322-L326 PolarHBondContact O-N 3.23Å
323	S	92.4	Very high	91	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-74.4	-40.9	-178.3	-50.5	0	0	0	0	113.3	G319 Y320 V321 A325 L326 A327 H347 A364	G319-S323 WeakPolarHBondContact O-CB 3.4Å; G319-S323 PolarHBondContact O-N 3.26Å; G319-S323 VanDerWaalsContact O-N 3.15Å; G319-S323 PolarHBondContact O-OG 2.84Å; Y320-S323 PolarHBondContact O-N 2.69Å; Y320-S323 VanDerWaalsContact O-N 3.07Å; V321-S323 VanDerWaalsContact C-N 3.27Å; V321-S323 PolarHBondContact O-N 3.29Å; S323-A325 VanDerWaalsContact C-N 3.34Å; S323-A325 PolarHBondContact O-N 3.46Å; S323-L326 PolarHBondContact O-N 2.8Å; S323-A327 PolarHBondContact O-N 2.98Å; S323-H347 WeakPolarHBondContact CB-CE1 3.41Å; S323-H347 WeakPolarHBondContact CB-NE2 3.31Å; S323-H347 PolarHBondContact OG-CE1 3.24Å; S323-A364 PolarHBondContact OG-N 2.85Å
324	L	91.4	Very high	90.8	Very high	4 Å²	4	29 Å²	29	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-42.6	175.8	-176.2	70.6	0	0	0	111.3	T171 Y320 V321 L326 A327 Q328 D340 E343	T171-L324 HydrophobicContact CG2-CD2 3.11Å; Y320-L324 HydrophobicContact CE1-CB 4.47Å; Y320-L324 HydrophobicContact CE1-CD2 4.02Å; Y320-L324 HydrophobicContact CE2-CB 4.48Å; Y320-L324 WeakPolarHBondContact O-CB 3.39Å; Y320-L324 PolarHBondContact O-N 3.17Å; V321-L324 PolarHBondContact O-N 3.26Å; L324-L326 PolarHBondContact O-N 2.97Å; L324-A327 PolarHBondContact O-N 2.98Å; L324-A327 VanDerWaalsContact O-N 3.12Å; L324-Q328 HydrophobicContact CD1-CG 4.11Å; L324-Q328 HydrophobicContact CG-CG 4.13Å; L324-Q328 WeakPolarHBondContact O-CB 3.43Å; L324-Q328 WeakPolarHBondContact O-CG 3.39Å; L324-Q328 PolarHBondContact O-N 3.26Å; L324-D340 HydrophobicContact CD1-CB 4.12Å; L324-D340 HydrophobicContact CD2-CB 4.34Å; L324-E343 HydrophobicContact CD1-CB 4.17Å; L324-E343 HydrophobicContact CD1-CG 4.12Å
325	A	88.6	Confident	90.7	Very high	29 Å²	29	38.5 Å²	38.5	24%	0.24	19%	0.191	C	C	.	.	H	α-helix	trans	-57	-39.8	176.4	0	0	0	0	0	111.8	I179 V321 S323 G329	I179-A325 HydrophobicContact CD1-CB 4.15Å; I179-A325 HydrophobicContact CG2-CB 3.88Å; V321-A325 WeakPolarHBondContact O-CB 3.33Å; V321-A325 PolarHBondContact O-N 3.14Å; S323-A325 VanDerWaalsContact C-N 3.34Å; S323-A325 PolarHBondContact O-N 3.46Å; A325-G329 PolarHBondContact O-N 2.98Å
326	L	90.5	Very high	90.5	Very high	20 Å²	20	40.2 Å²	40.2	11%	0.105	20%	0.197	C	C	.	.	H	α-helix	trans	-72.3	-38.8	175.8	-68.5	172.6	0	0	0	112.4	A322 S323 L324 G329 S330 A364 M366	A322-L326 WeakPolarHBondContact O-CG 3.27Å; A322-L326 PolarHBondContact O-N 3.23Å; S323-L326 PolarHBondContact O-N 2.8Å; L324-L326 PolarHBondContact O-N 2.97Å; L326-G329 PolarHBondContact O-N 3.4Å; L326-S330 WeakPolarHBondContact O-CB 3.39Å; L326-S330 PolarHBondContact O-N 2.9Å; L326-S330 PolarHBondContact O-OG 3.29Å; L326-A364 HydrophobicContact CD1-CB 3.76Å; L326-M366 HydrophobicContact CD1-CB 4.41Å; L326-M366 HydrophobicContact CD2-CB 4.02Å; L326-M366 HydrophobicContact CD2-CE 4.29Å; L326-M366 HydrophobicContact CD2-CG 4.06Å
327	A	92.1	Very high	90.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-47.8	176.6	0	0	0	0	0	111.6	V99 S323 L324 S330 A331 V338 E343	V99-A327 HydrophobicContact CG2-CB 4.04Å; S323-A327 PolarHBondContact O-N 2.98Å; L324-A327 PolarHBondContact O-N 2.98Å; L324-A327 VanDerWaalsContact O-N 3.12Å; A327-S330 WeakPolarHBondContact O-CB 3.39Å; A327-S330 PolarHBondContact O-N 3.3Å; A327-A331 VanDerWaalsContact O-CB 3.27Å; A327-A331 WeakPolarHBondContact O-CB 3.47Å; A327-A331 PolarHBondContact O-N 2.8Å; A327-V338 HydrophobicContact CB-CG1 4.09Å; A327-V338 HydrophobicContact CB-CG2 4.41Å; A327-E343 HydrophobicContact CB-CG 4.48Å
328	Q	89.9	Confident	90.4	Very high	77 Å²	77	44.4 Å²	44.4	36%	0.36	23%	0.228	S	C	.	.	H	α-helix	trans	-65.2	-40.1	175.3	-69.8	-179.1	-15.5	0	0	111.8	L324 S330 A331 K332 D340	L324-Q328 HydrophobicContact CD1-CG 4.11Å; L324-Q328 HydrophobicContact CG-CG 4.13Å; L324-Q328 WeakPolarHBondContact O-CB 3.43Å; L324-Q328 WeakPolarHBondContact O-CG 3.39Å; L324-Q328 PolarHBondContact O-N 3.26Å; Q328-S330 PolarHBondContact O-N 2.8Å; Q328-A331 WeakPolarHBondContact O-CB 3.19Å; Q328-A331 PolarHBondContact O-N 2.72Å; Q328-K332 WeakPolarHBondContact O-CB 3.25Å; Q328-K332 PolarHBondContact O-N 3.15Å; Q328-D340 PolarHBondContact NE2-OD1 3.36Å; Q328-D340 PolarHBondContact NE2-OD2 2.89Å
329	G	88.4	Confident	90.5	Very high	36 Å²	36	48.2 Å²	48.2	37%	0.371	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-43	173.6	0	0	0	0	0	112.6	A325 L326 K333	A325-G329 PolarHBondContact O-N 2.98Å; L326-G329 PolarHBondContact O-N 3.4Å; G329-K333 WeakPolarHBondContact O-CB 3.28Å; G329-K333 PolarHBondContact O-N 3.36Å; G329-K333 VanDerWaalsContact O-N 3.1Å
330	S	90.4	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-47.6	173.1	-57.9	0	0	0	0	111.1	L326 A327 Q328 K332 K333 F334 Y336 Y373	L326-S330 WeakPolarHBondContact O-CB 3.39Å; L326-S330 PolarHBondContact O-N 2.9Å; L326-S330 PolarHBondContact O-OG 3.29Å; A327-S330 WeakPolarHBondContact O-CB 3.39Å; A327-S330 PolarHBondContact O-N 3.3Å; Q328-S330 PolarHBondContact O-N 2.8Å; S330-K332 PolarHBondContact O-N 3.31Å; S330-K333 PolarHBondContact O-N 3.17Å; S330-F334 WeakPolarHBondContact O-CD2 3.33Å; S330-F334 PolarHBondContact O-N 3.04Å; S330-Y336 WeakPolarHBondContact CB-OH 3.34Å; S330-Y336 WeakPolarHBondContact O-CE1 3.38Å; S330-Y373 PolarHBondContact OG-OH 2.82Å
331	A	91.3	Very high	90.5	Very high	8 Å²	8	50.6 Å²	50.6	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-47.3	-178.8	0	0	0	0	0	111.7	A327 Q328 K333 K335 Y336 V338	A327-A331 VanDerWaalsContact O-CB 3.27Å; A327-A331 WeakPolarHBondContact O-CB 3.47Å; A327-A331 PolarHBondContact O-N 2.8Å; Q328-A331 WeakPolarHBondContact O-CB 3.19Å; Q328-A331 PolarHBondContact O-N 2.72Å; A331-K333 PolarHBondContact O-N 3.37Å; A331-K335 WeakPolarHBondContact O-CA 3.32Å; A331-K335 PolarHBondContact O-N 3.37Å; A331-Y336 CarbonylContact C-O 3.46Å; A331-Y336 HydrophobicContact CB-CD2 4.06Å; A331-Y336 HydrophobicContact CB-CE1 4.48Å; A331-Y336 HydrophobicContact CB-CE2 3.85Å; A331-Y336 HydrophobicContact CB-CG 4.46Å; A331-Y336 VanDerWaalsContact CB-O 3.3Å; A331-Y336 WeakPolarHBondContact CB-O 3.3Å; A331-Y336 PolarHBondContact O-N 3.38Å; A331-V338 HydrophobicContact CB-CB 4.38Å; A331-V338 HydrophobicContact CB-CG2 3.71Å
332	K	90.4	Very high	90.7	Very high	181 Å²	181	50.5 Å²	50.5	79%	0.787	26%	0.261	S	S	*	.	H	α-helix	trans	-62.5	-42	175.9	-172.6	176.1	-177.7	176.5	0	112.3	Q328 S330	Q328-K332 WeakPolarHBondContact O-CB 3.25Å; Q328-K332 PolarHBondContact O-N 3.15Å; S330-K332 PolarHBondContact O-N 3.31Å
333	K	89.2	Confident	91	Very high	124 Å²	124	50 Å²	50	54%	0.539	26%	0.257	S	S	.	.	H	α-helix	trans	-69.9	-41.6	-178.2	-174.8	173.2	179.7	179.7	0	112.9	G329 S330 A331 Y373	G329-K333 WeakPolarHBondContact O-CB 3.28Å; G329-K333 PolarHBondContact O-N 3.36Å; G329-K333 VanDerWaalsContact O-N 3.1Å; S330-K333 PolarHBondContact O-N 3.17Å; A331-K333 PolarHBondContact O-N 3.37Å; K333-Y373 HydrophobicContact CD-CD2 4.28Å; K333-Y373 HydrophobicContact CD-CE2 4.41Å
334	F	89.4	Confident	91.1	Very high	75 Å²	75	50.4 Å²	50.4	33%	0.329	26%	0.259	S	S	.	.	H	α-helix	trans	-103.7	12.2	-176	-63.8	-81.6	0	0	0	113.7	H98 S330 Y336 Y373	H98-F334 HydrophobicContact CB-CE2 4.29Å; H98-F334 AromaticContact CD2-CE2 3.99Å; H98-F334 AromaticContact CD2-CZ 3.98Å; H98-F334 AromaticContact CE1-CD1 3.9Å; H98-F334 AromaticContact CE1-CD2 3.78Å; H98-F334 AromaticContact CE1-CG 3.62Å; H98-F334 AromaticContact CG-CD2 3.96Å; H98-F334 AromaticContact CG-CE2 3.84Å; H98-F334 AromaticContact ND1-CD2 3.6Å; H98-F334 AromaticContact ND1-CE2 3.97Å; H98-F334 AromaticContact ND1-CG 3.9Å; H98-F334 AromaticContact NE2-CD1 3.96Å; H98-F334 AromaticContact NE2-CE1 3.94Å; S330-F334 WeakPolarHBondContact O-CD2 3.33Å; S330-F334 PolarHBondContact O-N 3.04Å; F334-Y336 HydrophobicContact CB-CD1 3.79Å; F334-Y336 HydrophobicContact CB-CE1 3.85Å; F334-Y336 PolarHBondContact O-N 2.99Å; F334-Y373 AromaticContact CE2-CD1 3.5Å; F334-Y373 HydrophobicContact CE2-CD1 3.5Å; F334-Y373 AromaticContact CE2-CE1 3.7Å; F334-Y373 HydrophobicContact CE2-CE1 3.7Å; F334-Y373 HydrophobicContact CE2-CG 4.15Å; F334-Y373 AromaticContact CZ-CD1 3.88Å; F334-Y373 HydrophobicContact CZ-CD1 3.88Å; F334-Y373 HydrophobicContact CZ-CG 4.3Å
335	K	90.2	Very high	91.3	Very high	200 Å²	200	51 Å²	51	87%	0.87	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	47.9	174	-55.6	-177.3	-179.6	-178.2	0	114.1	A331	A331-K335 WeakPolarHBondContact O-CA 3.32Å; A331-K335 PolarHBondContact O-N 3.37Å
336	Y	90.4	Very high	91.6	Very high	37 Å²	37	49.7 Å²	49.7	15%	0.145	25%	0.251	C	S	.	.			trans	-123.7	171.3	168.7	68.2	-90.5	0	0	0	110.3	G96 R97 H98 S330 A331 F334 V338	G96-Y336 WeakPolarHBondContact CA-OH 3.08Å; R97-Y336 PolarHBondContact N-OH 3.23Å; H98-Y336 AromaticContact ND1-CE1 3.91Å; S330-Y336 WeakPolarHBondContact CB-OH 3.34Å; S330-Y336 WeakPolarHBondContact O-CE1 3.38Å; A331-Y336 CarbonylContact C-O 3.46Å; A331-Y336 HydrophobicContact CB-CD2 4.06Å; A331-Y336 HydrophobicContact CB-CE1 4.48Å; A331-Y336 HydrophobicContact CB-CE2 3.85Å; A331-Y336 HydrophobicContact CB-CG 4.46Å; A331-Y336 VanDerWaalsContact CB-O 3.3Å; A331-Y336 WeakPolarHBondContact CB-O 3.3Å; A331-Y336 PolarHBondContact O-N 3.38Å; F334-Y336 HydrophobicContact CB-CD1 3.79Å; F334-Y336 HydrophobicContact CB-CE1 3.85Å; F334-Y336 PolarHBondContact O-N 2.99Å; Y336-V338 HydrophobicContact CD2-CG2 4.07Å; Y336-V338 HydrophobicContact CE2-CG2 3.47Å; Y336-V338 VanDerWaalsContact CE2-CG2 3.47Å
337	S	89.8	Confident	91.8	Very high	97 Å²	97	48.8 Å²	48.8	68%	0.678	25%	0.246	S	C	*	.			trans	-106.6	147.2	178.2	55.9	0	0	0	0	111.8
338	V	91.5	Very high	92.1	Very high	25 Å²	25	48.8 Å²	48.8	15%	0.152	25%	0.246	C	C	.	.			trans	-124	138.6	174.6	170.7	0	0	0	0	107.6	M95 A327 A331 Y336 E343	M95-V338 HydrophobicContact CB-CG1 4.42Å; M95-V338 HydrophobicContact CB-CG2 4.4Å; A327-V338 HydrophobicContact CB-CG1 4.09Å; A327-V338 HydrophobicContact CB-CG2 4.41Å; A331-V338 HydrophobicContact CB-CB 4.38Å; A331-V338 HydrophobicContact CB-CG2 3.71Å; Y336-V338 HydrophobicContact CD2-CG2 4.07Å; Y336-V338 HydrophobicContact CE2-CG2 3.47Å; Y336-V338 VanDerWaalsContact CE2-CG2 3.47Å; V338-E343 HydrophobicContact CG1-CG 3.52Å
339	N	91.6	Very high	92.4	Very high	81 Å²	81	46.7 Å²	46.7	43%	0.433	24%	0.237	S	C	.	.			trans	-97	114.6	173.3	-176.6	-33.9	0	0	0	109.5	M95 N341 Q342 E343	M95-N339 HydrophobicContact CE-CB 4.37Å; M95-N339 HydrophobicContact SD-CB 3.51Å; M95-N339 VanDerWaalsContact SD-CB 3.51Å; M95-N339 PolarHBondContact SD-N 3.46Å; N339-N341 PolarHBondContact O-N 3.49Å; N339-N341 PolarHBondContact OD1-N 3.44Å; N339-Q342 HydrophobicContact CB-CB 3.95Å; N339-Q342 WeakPolarHBondContact O-CB 3.41Å; N339-Q342 PolarHBondContact O-N 3.41Å; N339-Q342 PolarHBondContact OD1-N 3.49Å; N339-E343 PolarHBondContact O-N 3.41Å; N339-E343 VanDerWaalsContact O-N 3.15Å
340	D	92.4	Very high	92.8	Very high	39 Å²	39	45 Å²	45	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-55	-37.3	-177.8	-60.6	-1.4	0	0	0	112.7	Y320 L324 Q328 E343 F344	Y320-D340 PolarHBondContact OH-O 2.94Å; L324-D340 HydrophobicContact CD1-CB 4.12Å; L324-D340 HydrophobicContact CD2-CB 4.34Å; Q328-D340 PolarHBondContact NE2-OD1 3.36Å; Q328-D340 PolarHBondContact NE2-OD2 2.89Å; D340-E343 PolarHBondContact O-N 2.87Å; D340-F344 PolarHBondContact O-N 3.28Å
341	N	92.9	Very high	93.1	Very high	16 Å²	16	45 Å²	45	9%	0.086	22%	0.219	C	C	.	.	H	α-helix	trans	-73.2	-35.8	178.5	-157.2	49.3	0	0	0	111.9	F163 G168 N339 E343 F344 L345	F163-N341 VanDerWaalsContact CD2-ND2 3.27Å; F163-N341 WeakPolarHBondContact CD2-ND2 3.45Å; F163-N341 WeakPolarHBondContact CD2-O 3.41Å; F163-N341 WeakPolarHBondContact CE2-ND2 3.37Å; F163-N341 PolarHBondContact O-ND2 3.39Å; F163-N341 VanDerWaalsContact O-ND2 3.13Å; F163-N341 PolarHBondContact O-OD1 2.9Å; G168-N341 PolarHBondContact N-OD1 2.79Å; N339-N341 PolarHBondContact O-N 3.49Å; N339-N341 PolarHBondContact OD1-N 3.44Å; N341-E343 PolarHBondContact O-N 3.43Å; N341-F344 WeakPolarHBondContact O-CB 3.27Å; N341-F344 PolarHBondContact O-N 2.98Å; N341-L345 PolarHBondContact O-N 3.11Å
342	Q	93.1	Very high	93.4	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-32.1	175.9	-177.4	62	24.1	0	0	111.6	R31 P33 F93 M95 N339 F344 L345 A346	R31-Q342 PolarHBondContact O-NE2 3.24Å; P33-Q342 HydrophobicContact CG-CG 4.5Å; F93-Q342 PolarHBondContact O-NE2 3.24Å; M95-Q342 HydrophobicContact CG-CB 4.28Å; M95-Q342 HydrophobicContact CG-CG 3.75Å; M95-Q342 HydrophobicContact SD-CB 3.77Å; M95-Q342 HydrophobicContact SD-CG 3.8Å; N339-Q342 HydrophobicContact CB-CB 3.95Å; N339-Q342 WeakPolarHBondContact O-CB 3.41Å; N339-Q342 PolarHBondContact O-N 3.41Å; N339-Q342 PolarHBondContact OD1-N 3.49Å; Q342-F344 VanDerWaalsContact C-N 3.31Å; Q342-F344 PolarHBondContact O-N 3.47Å; Q342-L345 WeakPolarHBondContact O-CB 3.42Å; Q342-L345 PolarHBondContact O-N 2.91Å; Q342-L345 VanDerWaalsContact O-N 3.16Å; Q342-A346 PolarHBondContact O-N 3Å
343	E	94	Very high	93.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-31.2	175.2	-69.2	-62	140.8	0	0	112.6	Y90 M95 G96 Y320 L324 A327 V338 N339 D340 N341 L345 A346 H347	Y90-E343 WeakPolarHBondContact CE2-OE2 3.47Å; Y90-E343 PolarHBondContact OH-OE2 3.16Å; M95-E343 WeakPolarHBondContact CB-OE1 3.44Å; M95-E343 PolarHBondContact N-OE1 3.3Å; G96-E343 PolarHBondContact N-OE1 3.07Å; Y320-E343 HydrophobicContact CE2-CB 4.06Å; L324-E343 HydrophobicContact CD1-CB 4.17Å; L324-E343 HydrophobicContact CD1-CG 4.12Å; A327-E343 HydrophobicContact CB-CG 4.48Å; V338-E343 HydrophobicContact CG1-CG 3.52Å; N339-E343 PolarHBondContact O-N 3.41Å; N339-E343 VanDerWaalsContact O-N 3.15Å; D340-E343 PolarHBondContact O-N 2.87Å; N341-E343 PolarHBondContact O-N 3.43Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.02Å; E343-A346 PolarHBondContact O-N 3.2Å; E343-H347 WeakPolarHBondContact O-CB 3.48Å; E343-H347 PolarHBondContact O-CD2 3.15Å; E343-H347 VanDerWaalsContact O-CD2 3.31Å; E343-H347 PolarHBondContact O-N 3.05Å; E343-H347 IonicContact OE2-CD2 2.89Å; E343-H347 IonicContact OE2-NE2 2.77Å
344	F	94.4	Very high	94	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-42.8	170.6	-85.3	-66.1	0	0	0	111.4	Q159 M160 M162 F163 L167 Y320 D340 N341 Q342 G348	Q159-F344 HydrophobicContact CB-CD1 4.42Å; M160-F344 WeakPolarHBondContact CE-O 3.26Å; M162-F344 HydrophobicContact CB-CD1 3.86Å; M162-F344 HydrophobicContact CB-CE1 3.71Å; M162-F344 HydrophobicContact CB-CG 4.34Å; M162-F344 HydrophobicContact CB-CZ 4.06Å; M162-F344 HydrophobicContact CG-CE1 4.28Å; M162-F344 HydrophobicContact SD-CD1 4.43Å; M162-F344 HydrophobicContact SD-CE1 3.57Å; M162-F344 VanDerWaalsContact SD-CE1 3.57Å; M162-F344 HydrophobicContact SD-CZ 4.05Å; F163-F344 HydrophobicContact CB-CB 3.76Å; L167-F344 HydrophobicContact CB-CE2 4.27Å; L167-F344 HydrophobicContact CB-CZ 4.48Å; Y320-F344 HydrophobicContact CD1-CD1 4.11Å; Y320-F344 AromaticContact CD1-CE1 3.35Å; Y320-F344 HydrophobicContact CD1-CE1 3.35Å; Y320-F344 HydrophobicContact CD1-CE2 4.12Å; Y320-F344 AromaticContact CD1-CZ 3.37Å; Y320-F344 HydrophobicContact CD1-CZ 3.37Å; Y320-F344 AromaticContact CD2-CD1 3.41Å; Y320-F344 HydrophobicContact CD2-CD1 3.41Å; Y320-F344 VanDerWaalsContact CD2-CD1 3.41Å; Y320-F344 HydrophobicContact CD2-CD2 4.34Å; Y320-F344 AromaticContact CD2-CE1 3.57Å; Y320-F344 HydrophobicContact CD2-CE1 3.57Å; Y320-F344 HydrophobicContact CD2-CE2 4.47Å; Y320-F344 AromaticContact CD2-CG 3.83Å; Y320-F344 HydrophobicContact CD2-CG 3.83Å; Y320-F344 HydrophobicContact CD2-CZ 4.12Å; Y320-F344 HydrophobicContact CE1-CD1 4.21Å; Y320-F344 HydrophobicContact CE1-CD2 4.08Å; Y320-F344 AromaticContact CE1-CE1 3.55Å; Y320-F344 HydrophobicContact CE1-CE1 3.55Å; Y320-F344 AromaticContact CE1-CE2 3.39Å; Y320-F344 HydrophobicContact CE1-CE2 3.39Å; Y320-F344 HydrophobicContact CE1-CG 4.44Å; Y320-F344 AromaticContact CE1-CZ 3.09Å; Y320-F344 HydrophobicContact CE1-CZ 3.09Å; Y320-F344 HydrophobicContact CE2-CB 4.14Å; Y320-F344 AromaticContact CE2-CD1 3.53Å; Y320-F344 HydrophobicContact CE2-CD1 3.53Å; Y320-F344 AromaticContact CE2-CD2 3.59Å; Y320-F344 HydrophobicContact CE2-CD2 3.59Å; Y320-F344 AromaticContact CE2-CE1 3.75Å; Y320-F344 HydrophobicContact CE2-CE1 3.75Å; Y320-F344 AromaticContact CE2-CE2 3.81Å; Y320-F344 HydrophobicContact CE2-CE2 3.81Å; Y320-F344 AromaticContact CE2-CG 3.44Å; Y320-F344 HydrophobicContact CE2-CG 3.44Å; Y320-F344 VanDerWaalsContact CE2-CG 3.44Å; Y320-F344 AromaticContact CE2-CZ 3.9Å; Y320-F344 HydrophobicContact CE2-CZ 3.9Å; Y320-F344 AromaticContact CG-CD1 3.7Å; Y320-F344 HydrophobicContact CG-CD1 3.7Å; Y320-F344 AromaticContact CG-CE1 3.35Å; Y320-F344 HydrophobicContact CG-CE1 3.35Å; Y320-F344 HydrophobicContact CG-CG 4.46Å; Y320-F344 AromaticContact CG-CZ 3.87Å; Y320-F344 HydrophobicContact CG-CZ 3.87Å; Y320-F344 AromaticContact CZ-CD1 3.92Å; Y320-F344 AromaticContact CZ-CD2 3.41Å; Y320-F344 VanDerWaalsContact CZ-CD2 3.41Å; Y320-F344 AromaticContact CZ-CE1 3.72Å; Y320-F344 AromaticContact CZ-CE2 3.18Å; Y320-F344 AromaticContact CZ-CG 3.77Å; Y320-F344 AromaticContact CZ-CZ 3.37Å; Y320-F344 WeakPolarHBondContact OH-CD2 3.45Å; Y320-F344 WeakPolarHBondContact OH-CE2 3.48Å; D340-F344 PolarHBondContact O-N 3.28Å; N341-F344 WeakPolarHBondContact O-CB 3.27Å; N341-F344 PolarHBondContact O-N 2.98Å; Q342-F344 VanDerWaalsContact C-N 3.31Å; Q342-F344 PolarHBondContact O-N 3.47Å; F344-G348 PolarHBondContact O-N 3.36Å
345	L	95.6	Very high	94.4	Very high	17 Å²	17	30.7 Å²	30.7	9%	0.089	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-44.2	176	-179.1	62.9	0	0	0	111.5	R31 M160 F163 N341 Q342 E343 L349	R31-L345 HydrophobicContact CB-CD2 4.28Å; R31-L345 HydrophobicContact CG-CD2 4.44Å; M160-L345 VanDerWaalsContact CE-CA 3.49Å; M160-L345 HydrophobicContact CE-CD1 3.88Å; M160-L345 VanDerWaalsContact CE-O 3.26Å; M160-L345 WeakPolarHBondContact CE-O 3.29Å; M160-L345 HydrophobicContact SD-CD1 3.5Å; M160-L345 VanDerWaalsContact SD-CD1 3.5Å; F163-L345 HydrophobicContact CD1-CB 4.25Å; F163-L345 HydrophobicContact CD1-CD1 4.08Å; F163-L345 HydrophobicContact CD2-CB 3.87Å; F163-L345 HydrophobicContact CE1-CB 4.33Å; F163-L345 HydrophobicContact CE1-CD1 4.03Å; F163-L345 HydrophobicContact CE1-CD2 4.14Å; F163-L345 HydrophobicContact CE1-CG 4.4Å; F163-L345 HydrophobicContact CE2-CB 3.93Å; F163-L345 HydrophobicContact CE2-CD2 4.31Å; F163-L345 HydrophobicContact CG-CB 4Å; F163-L345 HydrophobicContact CZ-CB 4.17Å; F163-L345 HydrophobicContact CZ-CD2 3.85Å; F163-L345 HydrophobicContact CZ-CG 4.41Å; N341-L345 PolarHBondContact O-N 3.11Å; Q342-L345 WeakPolarHBondContact O-CB 3.42Å; Q342-L345 PolarHBondContact O-N 2.91Å; Q342-L345 VanDerWaalsContact O-N 3.16Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.02Å; L345-L349 HydrophobicContact CD1-CD1 3.75Å; L345-L349 HydrophobicContact CD1-CG 4.05Å; L345-L349 HydrophobicContact CG-CD1 4.09Å; L345-L349 WeakPolarHBondContact O-CB 3.48Å; L345-L349 WeakPolarHBondContact O-CG 3.41Å; L345-L349 PolarHBondContact O-N 3.4Å; L345-L349 VanDerWaalsContact O-N 3.14Å
346	A	95.8	Very high	94.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.3	-49.6	-179.6	0	0	0	0	0	111.9	Y90 F93 Q342 E343 S350	Y90-A346 HydrophobicContact CD2-CB 4.03Å; Y90-A346 HydrophobicContact CE2-CB 4.13Å; F93-A346 HydrophobicContact CB-CB 4.08Å; Q342-A346 PolarHBondContact O-N 3Å; E343-A346 PolarHBondContact O-N 3.2Å; A346-S350 VanDerWaalsContact O-CB 3.3Å; A346-S350 WeakPolarHBondContact O-CB 3.23Å; A346-S350 PolarHBondContact O-N 3.31Å; A346-S350 PolarHBondContact O-OG 2.76Å
347	H	95.5	Very high	94.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-72.2	-39.2	-177.5	-80.5	-72.1	0	0	0	113.3	Y90 Q159 S323 E343 S350 N351	Y90-H347 AromaticContact CD2-NE2 4Å; Y90-H347 AromaticContact CE2-CE1 3.8Å; Y90-H347 AromaticContact CE2-NE2 3.4Å; Y90-H347 WeakPolarHBondContact CE2-NE2 3.47Å; Q159-H347 VanDerWaalsContact OE1-C 3.27Å; Q159-H347 PolarHBondContact OE1-O 3.48Å; S323-H347 WeakPolarHBondContact CB-CE1 3.41Å; S323-H347 WeakPolarHBondContact CB-NE2 3.31Å; S323-H347 PolarHBondContact OG-CE1 3.24Å; E343-H347 WeakPolarHBondContact O-CB 3.48Å; E343-H347 PolarHBondContact O-CD2 3.15Å; E343-H347 VanDerWaalsContact O-CD2 3.31Å; E343-H347 PolarHBondContact O-N 3.05Å; E343-H347 IonicContact OE2-CD2 2.89Å; E343-H347 IonicContact OE2-NE2 2.77Å; H347-S350 CarbonylContact O-C 3.42Å; H347-S350 PolarHBondContact O-N 2.97Å; H347-N351 PolarHBondContact O-N 2.74Å; H347-N351 VanDerWaalsContact O-N 3.12Å; H347-N351 PolarHBondContact O-ND2 2.91Å
348	G	97	Very high	94.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.6	-38.1	178.9	0	0	0	0	0	112	G156 M160 F344 S350 N351 V352	G156-G348 WeakPolarHBondContact CA-O 3.48Å; M160-G348 VanDerWaalsContact CE-C 3.47Å; F344-G348 PolarHBondContact O-N 3.36Å; G348-S350 VanDerWaalsContact C-N 3.32Å; G348-S350 PolarHBondContact O-N 3.13Å; G348-N351 PolarHBondContact O-N 3.47Å; G348-N351 VanDerWaalsContact O-N 3.16Å; G348-V352 WeakPolarHBondContact O-CG2 3.28Å; G348-V352 PolarHBondContact O-N 2.99Å
349	L	97.1	Very high	95	Very high	33 Å²	33	20 Å²	20	17%	0.173	10%	0.101	C	C	.	.	H	α-helix	trans	-65.7	-36.5	171.7	-70.9	176.7	0	0	0	112	I89 F93 M160 L345 N351 V352 I353 P354	I89-L349 HydrophobicContact CG2-CB 3.87Å; F93-L349 HydrophobicContact CD1-CD1 3.69Å; F93-L349 HydrophobicContact CD2-CD1 3.86Å; F93-L349 HydrophobicContact CE1-CD1 3.64Å; F93-L349 HydrophobicContact CE2-CD1 3.83Å; F93-L349 HydrophobicContact CG-CD1 3.8Å; F93-L349 HydrophobicContact CZ-CD1 3.72Å; M160-L349 HydrophobicContact CE-CG 4.04Å; M160-L349 VanDerWaalsContact CE-N 3.31Å; M160-L349 HydrophobicContact SD-CD2 4.01Å; M160-L349 HydrophobicContact SD-CG 3.99Å; L345-L349 HydrophobicContact CD1-CD1 3.75Å; L345-L349 HydrophobicContact CD1-CG 4.05Å; L345-L349 HydrophobicContact CG-CD1 4.09Å; L345-L349 WeakPolarHBondContact O-CB 3.48Å; L345-L349 WeakPolarHBondContact O-CG 3.41Å; L345-L349 PolarHBondContact O-N 3.4Å; L345-L349 VanDerWaalsContact O-N 3.14Å; L349-N351 PolarHBondContact O-N 3.05Å; L349-V352 PolarHBondContact O-N 2.9Å; L349-I353 HydrophobicContact CB-CD1 4.36Å; L349-I353 HydrophobicContact CD2-CD1 4.35Å; L349-I353 PolarHBondContact O-N 2.97Å; L349-P354 WeakPolarHBondContact O-CD 3.26Å
350	S	96.3	Very high	95.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-68	-8.3	175.4	-57.3	0	0	0	0	113.7	P86 Y90 A346 H347 G348 P354 S362	P86-S350 WeakPolarHBondContact CB-O 3.22Å; Y90-S350 PolarHBondContact N-OG 3.19Å; A346-S350 VanDerWaalsContact O-CB 3.3Å; A346-S350 WeakPolarHBondContact O-CB 3.23Å; A346-S350 PolarHBondContact O-N 3.31Å; A346-S350 PolarHBondContact O-OG 2.76Å; H347-S350 CarbonylContact O-C 3.42Å; H347-S350 PolarHBondContact O-N 2.97Å; G348-S350 VanDerWaalsContact C-N 3.32Å; G348-S350 PolarHBondContact O-N 3.13Å; S350-P354 WeakPolarHBondContact O-CD 3.35Å; S350-P354 WeakPolarHBondContact O-CG 3.28Å; S350-S362 PolarHBondContact O-OG 3.48Å
351	N	97.1	Very high	95.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-107.8	-41.5	171.2	-76.9	-43.7	0	0	0	112.1	S152 Q159 H347 G348 L349 S355 S362	S152-N351 PolarHBondContact OG-O 3.15Å; S152-N351 PolarHBondContact OG-OD1 3.38Å; Q159-N351 PolarHBondContact OE1-ND2 3.47Å; H347-N351 PolarHBondContact O-N 2.74Å; H347-N351 VanDerWaalsContact O-N 3.12Å; H347-N351 PolarHBondContact O-ND2 2.91Å; G348-N351 PolarHBondContact O-N 3.47Å; G348-N351 VanDerWaalsContact O-N 3.16Å; L349-N351 PolarHBondContact O-N 3.05Å; N351-S355 WeakPolarHBondContact O-CB 3.41Å; N351-S355 PolarHBondContact O-N 3.37Å; N351-S362 PolarHBondContact ND2-O 2.88Å; N351-S362 VanDerWaalsContact ND2-O 3.14Å; N351-S362 WeakPolarHBondContact OD1-CA 3.42Å; N351-S362 WeakPolarHBondContact OD1-CB 3.27Å; N351-S362 PolarHBondContact OD1-N 3.5Å; N351-S362 PolarHBondContact OD1-O 2.92Å; N351-S362 PolarHBondContact OD1-OG 3.4Å
352	V	97.6	Very high	95.4	Very high	24 Å²	24	13.6 Å²	13.6	15%	0.145	7%	0.066	C	C	.	.	H	α-helix	trans	-63	-55.2	178.2	173.3	0	0	0	0	111.7	F153 G156 V157 G348 L349 S355 F356	F153-V352 HydrophobicContact CD2-CG1 4.08Å; F153-V352 HydrophobicContact CE2-CG1 3.96Å; G156-V352 VanDerWaalsContact C-CG2 3.43Å; V157-V352 HydrophobicContact CG2-CG2 3.97Å; G348-V352 WeakPolarHBondContact O-CG2 3.28Å; G348-V352 PolarHBondContact O-N 2.99Å; L349-V352 PolarHBondContact O-N 2.9Å; V352-S355 PolarHBondContact O-N 3.48Å; V352-S355 PolarHBondContact O-OG 3.38Å; V352-F356 HydrophobicContact CG1-CE2 4.3Å; V352-F356 VanDerWaalsContact O-CD2 3.25Å; V352-F356 WeakPolarHBondContact O-CD2 3.37Å; V352-F356 WeakPolarHBondContact O-CE2 3.42Å
353	I	97	Very high	95.4	Very high	62 Å²	62	13.5 Å²	13.5	32%	0.318	7%	0.066	S	C	.	.	H	α-helix	trans	-66.7	-46.6	-173.5	-59.5	168.4	0	0	0	110.9	I89 L349 S355 F356	I89-I353 HydrophobicContact CD1-CB 4.31Å; I89-I353 HydrophobicContact CD1-CD1 3.94Å; I89-I353 HydrophobicContact CD1-CG2 4.02Å; I89-I353 HydrophobicContact CG1-CB 4.32Å; I89-I353 HydrophobicContact CG1-CD1 4.44Å; I89-I353 HydrophobicContact CG1-CG2 4.41Å; I89-I353 HydrophobicContact CG2-CD1 4.23Å; L349-I353 HydrophobicContact CB-CD1 4.36Å; L349-I353 HydrophobicContact CD2-CD1 4.35Å; L349-I353 PolarHBondContact O-N 2.97Å; I353-S355 VanDerWaalsContact C-N 3.26Å; I353-S355 PolarHBondContact O-N 3.27Å; I353-F356 PolarHBondContact O-N 2.9Å
354	P	95.8	Very high	95.3	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-66.4	-23	179.3	-29.4	44.1	0	0	0	114.4	F85 P86 I89 L349 S350 F356 F357 C359	F85-P354 HydrophobicContact CB-CB 3.73Å; F85-P354 HydrophobicContact CB-CG 3.79Å; P86-P354 HydrophobicContact CB-CG 4.39Å; P86-P354 HydrophobicContact CG-CB 3.94Å; P86-P354 HydrophobicContact CG-CG 3.88Å; I89-P354 HydrophobicContact CG1-CG 4.24Å; L349-P354 WeakPolarHBondContact O-CD 3.26Å; S350-P354 WeakPolarHBondContact O-CD 3.35Å; S350-P354 WeakPolarHBondContact O-CG 3.28Å; P354-F356 PolarHBondContact O-N 3.23Å; P354-F357 CarbonylContact O-C 3.54Å; P354-F357 WeakPolarHBondContact O-CA 3.48Å; P354-F357 PolarHBondContact O-N 2.8Å; P354-C359 HydrophobicContact CB-CB 3.67Å; P354-C359 VanDerWaalsContact O-CB 3.25Å; P354-C359 WeakPolarHBondContact O-CB 3.3Å; P354-C359 PolarHBondContact O-N 2.88Å; P354-C359 PolarHBondContact O-SG 3Å; P354-C359 VanDerWaalsContact O-SG 3.35Å
355	S	96.3	Very high	94.9	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-58.7	-29.1	176.8	72.9	0	0	0	0	113.2	A149 F153 N351 V352 I353 F357 F358	A149-S355 WeakPolarHBondContact O-CB 3.38Å; F153-S355 WeakPolarHBondContact CB-OG 3.49Å; F153-S355 WeakPolarHBondContact CD2-OG 3.16Å; N351-S355 WeakPolarHBondContact O-CB 3.41Å; N351-S355 PolarHBondContact O-N 3.37Å; V352-S355 PolarHBondContact O-N 3.48Å; V352-S355 PolarHBondContact O-OG 3.38Å; I353-S355 VanDerWaalsContact C-N 3.26Å; I353-S355 PolarHBondContact O-N 3.27Å; S355-F357 PolarHBondContact O-N 3.15Å; S355-F358 PolarHBondContact O-N 3.21Å
356	F	95.2	Very high	94.3	Very high	66 Å²	66	15.3 Å²	15.3	29%	0.289	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16	174.8	-66.8	-91.6	0	0	0	113.2	F153 P297 R298 A299 V352 I353 P354	F153-F356 HydrophobicContact CD2-CE2 4.14Å; F153-F356 HydrophobicContact CD2-CZ 4.38Å; F153-F356 AromaticContact CE2-CE2 3.99Å; F153-F356 HydrophobicContact CE2-CE2 3.99Å; F153-F356 AromaticContact CE2-CZ 3.93Å; F153-F356 HydrophobicContact CE2-CZ 3.93Å; P297-F356 CarbonylContact C-O 3.49Å; P297-F356 VanDerWaalsContact CA-O 3.26Å; P297-F356 WeakPolarHBondContact CA-O 3.4Å; R298-F356 PolarHBondContact N-O 2.86Å; R298-F356 CarbonylContact O-C 3.52Å; R298-F356 VanDerWaalsContact O-CA 3.27Å; R298-F356 WeakPolarHBondContact O-CA 3.44Å; R298-F356 VanDerWaalsContact O-O 3.07Å; A299-F356 HydrophobicContact CB-CD1 4.37Å; A299-F356 HydrophobicContact CB-CE1 4.13Å; V352-F356 HydrophobicContact CG1-CE2 4.3Å; V352-F356 VanDerWaalsContact O-CD2 3.25Å; V352-F356 WeakPolarHBondContact O-CD2 3.37Å; V352-F356 WeakPolarHBondContact O-CE2 3.42Å; I353-F356 PolarHBondContact O-N 2.9Å; P354-F356 PolarHBondContact O-N 3.23Å
357	F	93.7	Very high	93.6	Very high	48 Å²	48	16.9 Å²	16.9	21%	0.211	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	23.2	176.6	-61.1	-86.1	0	0	0	111.9	F85 P297 P354 S355 C359	F85-F357 HydrophobicContact CD1-CD2 4.11Å; F85-F357 HydrophobicContact CD1-CE2 4.38Å; F85-F357 HydrophobicContact CD1-CG 4.29Å; F85-F357 HydrophobicContact CD2-CB 3.85Å; F85-F357 HydrophobicContact CD2-CG 4.23Å; F85-F357 AromaticContact CE1-CD1 3.94Å; F85-F357 HydrophobicContact CE1-CD1 3.94Å; F85-F357 HydrophobicContact CE1-CD2 4.04Å; F85-F357 HydrophobicContact CE1-CE1 4.08Å; F85-F357 HydrophobicContact CE1-CE2 4.19Å; F85-F357 AromaticContact CE1-CG 3.91Å; F85-F357 HydrophobicContact CE1-CG 3.91Å; F85-F357 HydrophobicContact CE1-CZ 4.2Å; F85-F357 HydrophobicContact CE2-CB 3.59Å; F85-F357 HydrophobicContact CE2-CD1 4.08Å; F85-F357 AromaticContact CE2-CG 3.84Å; F85-F357 HydrophobicContact CE2-CG 3.84Å; F85-F357 HydrophobicContact CG-CB 4.43Å; F85-F357 HydrophobicContact CG-CD2 4.39Å; F85-F357 HydrophobicContact CG-CG 4.44Å; F85-F357 HydrophobicContact CZ-CB 3.96Å; F85-F357 AromaticContact CZ-CD1 3.55Å; F85-F357 HydrophobicContact CZ-CD1 3.55Å; F85-F357 HydrophobicContact CZ-CD2 4.27Å; F85-F357 HydrophobicContact CZ-CE1 4.06Å; F85-F357 AromaticContact CZ-CG 3.66Å; F85-F357 HydrophobicContact CZ-CG 3.66Å; P297-F357 HydrophobicContact CB-CD1 4.3Å; P297-F357 HydrophobicContact CB-CE1 3.86Å; P297-F357 HydrophobicContact CB-CZ 4.09Å; P297-F357 HydrophobicContact CG-CE1 4.3Å; P354-F357 CarbonylContact O-C 3.54Å; P354-F357 WeakPolarHBondContact O-CA 3.48Å; P354-F357 PolarHBondContact O-N 2.8Å; S355-F357 PolarHBondContact O-N 3.15Å; F357-C359 VanDerWaalsContact C-N 3.29Å; F357-C359 PolarHBondContact O-N 3.36Å
358	F	91.8	Very high	93.2	Very high	21 Å²	21	16.9 Å²	16.9	9%	0.092	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	36	-179.2	-57.1	-80.8	0	0	0	113.6	F78 L142 I145 P295 R298 S355	F78-F358 HydrophobicContact CD1-CB 3.87Å; F78-F358 WeakPolarHBondContact CD1-O 3.23Å; F78-F358 HydrophobicContact CE1-CB 3.76Å; F78-F358 HydrophobicContact CE1-CG 4.43Å; L142-F358 HydrophobicContact CD1-CE1 4.03Å; L142-F358 HydrophobicContact CD1-CZ 4.15Å; I145-F358 WeakPolarHBondContact CD1-O 3.31Å; I145-F358 HydrophobicContact CG1-CB 3.73Å; I145-F358 HydrophobicContact CG1-CD1 4.34Å; I145-F358 HydrophobicContact CG1-CG 4.5Å; I145-F358 WeakPolarHBondContact CG1-O 3.45Å; I145-F358 HydrophobicContact CG2-CD1 3.86Å; I145-F358 HydrophobicContact CG2-CG 4.49Å; P295-F358 HydrophobicContact CB-CD2 3.67Å; P295-F358 HydrophobicContact CB-CE2 3.97Å; P295-F358 HydrophobicContact CG-CD2 3.83Å; R298-F358 HydrophobicContact CB-CE2 3.99Å; R298-F358 HydrophobicContact CB-CZ 3.67Å; R298-F358 HydrophobicContact CG-CZ 4.29Å; S355-F358 PolarHBondContact O-N 3.21Å
359	C	94.4	Very high	92.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.091	C	C	.	.	P	Polyproline II helix	trans	-82.4	137.8	175.2	-66.4	0	0	0	0	111.7	Y81 P354 F357	Y81-C359 PolarHBondContact O-SG 2.87Å; Y81-C359 VanDerWaalsContact O-SG 3.37Å; P354-C359 HydrophobicContact CB-CB 3.67Å; P354-C359 VanDerWaalsContact O-CB 3.25Å; P354-C359 WeakPolarHBondContact O-CB 3.3Å; P354-C359 PolarHBondContact O-N 2.88Å; P354-C359 PolarHBondContact O-SG 3Å; P354-C359 VanDerWaalsContact O-SG 3.35Å; F357-C359 VanDerWaalsContact C-N 3.29Å; F357-C359 PolarHBondContact O-N 3.36Å
360	I	95.2	Very high	92.2	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	10%	0.101	C	C	.	.	P	Polyproline II helix	trans	-68.8	159.6	168.1	64.8	179	0	0	0	111.1	A69 V74 F78 T103 I145 A148 S362	A69-I360 HydrophobicContact CB-CD1 4.3Å; V74-I360 HydrophobicContact CG2-CG2 3.67Å; F78-I360 HydrophobicContact CB-CG2 4.5Å; T103-I360 HydrophobicContact CG2-CD1 3.68Å; T103-I360 HydrophobicContact CG2-CG1 3.86Å; I145-I360 HydrophobicContact CD1-CG2 3.79Å; A148-I360 HydrophobicContact CB-CG2 4.2Å; I360-S362 PolarHBondContact O-N 3.44Å
361	P	95.8	Very high	91.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-50.7	130.3	176.1	-33.2	40.2	0	0	0	114.7	T107 V151 S152 V315	T107-P361 PolarHBondContact OG1-O 3.11Å; T107-P361 VanDerWaalsContact OG1-O 3.11Å; V151-P361 HydrophobicContact CB-CG 4.35Å; V151-P361 HydrophobicContact CG1-CG 3.96Å; S152-P361 WeakPolarHBondContact OG-CA 3.31Å; V315-P361 HydrophobicContact CG1-CB 3.76Å; V315-P361 HydrophobicContact CG1-CG 4.39Å; V315-P361 HydrophobicContact CG2-CB 4.06Å; V315-P361 HydrophobicContact CG2-CG 4.21Å
362	S	93.8	Very high	91.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	149.8	-175.2	78.7	0	0	0	0	112.9	P86 G102 S350 N351 I360	P86-S362 WeakPolarHBondContact CB-OG 3.43Å; G102-S362 CarbonylContact O-C 3.26Å; G102-S362 WeakPolarHBondContact O-CA 3.09Å; G102-S362 VanDerWaalsContact O-CB 3.26Å; G102-S362 WeakPolarHBondContact O-CB 3.33Å; S350-S362 PolarHBondContact O-OG 3.48Å; N351-S362 PolarHBondContact ND2-O 2.88Å; N351-S362 VanDerWaalsContact ND2-O 3.14Å; N351-S362 WeakPolarHBondContact OD1-CA 3.42Å; N351-S362 WeakPolarHBondContact OD1-CB 3.27Å; N351-S362 PolarHBondContact OD1-N 3.5Å; N351-S362 PolarHBondContact OD1-O 2.92Å; N351-S362 PolarHBondContact OD1-OG 3.4Å; I360-S362 PolarHBondContact O-N 3.44Å
363	A	94	Very high	90.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	173.4	171.7	0	0	0	0	0	109.7	G102 F104 T107 R368	G102-A363 PolarHBondContact N-O 3Å; G102-A363 PolarHBondContact O-N 3.1Å; F104-A363 HydrophobicContact CB-CB 3.82Å; F104-A363 HydrophobicContact CD1-CB 3.77Å; F104-A363 HydrophobicContact CG-CB 4.01Å; T107-A363 HydrophobicContact CG2-CB 4.28Å; A363-R368 PolarHBondContact O-NH2 3.43Å
364	A	91.5	Very high	89.8	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.7	170.4	0	0	0	0	0	111.1	V99 A100 T101 S323 L326	V99-A364 HydrophobicContact CG1-CB 3.39Å; A100-A364 WeakPolarHBondContact O-CA 3.42Å; T101-A364 HydrophobicContact CG2-CB 4.28Å; S323-A364 PolarHBondContact OG-N 2.85Å; L326-A364 HydrophobicContact CD1-CB 3.76Å
365	A	86.2	Confident	89.2	Confident	5 Å²	5	20.3 Å²	20.3	4%	0.041	12%	0.121	C	C	.	.			trans	-108.4	135.5	177.8	0	0	0	0	0	111.8	A100 F104 R368 T369	A100-A365 PolarHBondContact O-N 3.39Å; A100-A365 VanDerWaalsContact O-N 3.15Å; F104-A365 HydrophobicContact CD2-CB 4.36Å; A365-R368 HydrophobicContact CB-CB 4.34Å; A365-R368 HydrophobicContact CB-CG 4.29Å; A365-R368 VanDerWaalsContact CB-NE 3.33Å; A365-R368 VanDerWaalsContact CB-NH2 3.3Å; A365-T369 VanDerWaalsContact O-CB 3.27Å; A365-T369 WeakPolarHBondContact O-CB 3.4Å; A365-T369 PolarHBondContact O-N 2.84Å; A365-T369 VanDerWaalsContact O-N 3.11Å; A365-T369 PolarHBondContact O-OG1 3.11Å
366	M	82.8	Confident	88.7	Confident	58 Å²	58	21.8 Å²	21.8	29%	0.286	14%	0.137	S	C	.	.	H	α-helix	trans	-63.8	-46.3	-178.5	-175.7	177.8	-73.6	0	0	112.2	L326 R368 T369 A370 M420	L326-M366 HydrophobicContact CD1-CB 4.41Å; L326-M366 HydrophobicContact CD2-CB 4.02Å; L326-M366 HydrophobicContact CD2-CE 4.29Å; L326-M366 HydrophobicContact CD2-CG 4.06Å; M366-R368 PolarHBondContact O-N 3.21Å; M366-T369 PolarHBondContact O-N 3.45Å; M366-A370 VanDerWaalsContact O-CB 3.28Å; M366-A370 WeakPolarHBondContact O-CB 3.31Å; M366-A370 PolarHBondContact O-N 3.21Å; M366-M420 HydrophobicContact CE-CG 4.45Å; M366-M420 HydrophobicContact SD-CG 3.78Å
367	G	80.7	Confident	88.4	Confident	33 Å²	33	18.8 Å²	18.8	34%	0.34	12%	0.124	S	C	.	.	H	α-helix	trans	-61.7	-44.4	-178.2	0	0	0	0	0	113.3	A370 G371	G367-A370 PolarHBondContact O-N 3.46Å; G367-G371 PolarHBondContact O-N 3.02Å
368	R	87.4	Confident	88.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-46.5	178.1	-66.7	-172.3	-81.9	133.1	4.2	111.8	L57 Q60 Q61 A100 T101 T103 A363 A365 M366 A370 G371 L372	L57-R368 HydrophobicContact CD1-CB 3.72Å; L57-R368 HydrophobicContact CD1-CG 4.08Å; Q60-R368 HydrophobicContact CB-CG 4.49Å; Q61-R368 VanDerWaalsContact CD-NH1 3.35Å; A100-R368 HydrophobicContact CB-CB 3.64Å; T101-R368 PolarHBondContact O-NH1 3.15Å; T103-R368 PolarHBondContact O-NH2 3.42Å; A363-R368 PolarHBondContact O-NH2 3.43Å; A365-R368 HydrophobicContact CB-CB 4.34Å; A365-R368 HydrophobicContact CB-CG 4.29Å; A365-R368 VanDerWaalsContact CB-NE 3.33Å; A365-R368 VanDerWaalsContact CB-NH2 3.3Å; M366-R368 PolarHBondContact O-N 3.21Å; R368-A370 PolarHBondContact O-N 3Å; R368-G371 PolarHBondContact O-N 2.95Å; R368-G371 VanDerWaalsContact O-N 3.16Å; R368-L372 PolarHBondContact O-N 3Å
369	T	89.9	Confident	88	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-41.4	176.7	-62.5	0	0	0	0	111.8	H98 A100 A365 M366 G371 L372 Y373	H98-T369 WeakPolarHBondContact O-CG2 3.37Å; A100-T369 PolarHBondContact N-OG1 3.13Å; A100-T369 VanDerWaalsContact N-OG1 3.08Å; A365-T369 VanDerWaalsContact O-CB 3.27Å; A365-T369 WeakPolarHBondContact O-CB 3.4Å; A365-T369 PolarHBondContact O-N 2.84Å; A365-T369 VanDerWaalsContact O-N 3.11Å; A365-T369 PolarHBondContact O-OG1 3.11Å; M366-T369 PolarHBondContact O-N 3.45Å; T369-G371 VanDerWaalsContact C-N 3.32Å; T369-G371 PolarHBondContact O-N 3.27Å; T369-L372 WeakPolarHBondContact O-CB 3.31Å; T369-L372 PolarHBondContact O-N 3.45Å; T369-Y373 HydrophobicContact CG2-CE1 3.59Å; T369-Y373 HydrophobicContact CG2-CE2 4.07Å; T369-Y373 WeakPolarHBondContact CG2-OH 3.31Å; T369-Y373 WeakPolarHBondContact O-CD1 3.26Å; T369-Y373 WeakPolarHBondContact O-CE1 3.32Å; T369-Y373 VanDerWaalsContact O-CG 3.32Å; T369-Y373 PolarHBondContact O-N 3.39Å; T369-Y373 VanDerWaalsContact O-N 3.14Å
370	A	83.9	Confident	87.9	Confident	46 Å²	46	21.6 Å²	21.6	38%	0.38	14%	0.138	S	C	.	.	H	α-helix	trans	-64.4	-36.3	174	0	0	0	0	0	112.6	M366 G367 R368 Y373 S374	M366-A370 VanDerWaalsContact O-CB 3.28Å; M366-A370 WeakPolarHBondContact O-CB 3.31Å; M366-A370 PolarHBondContact O-N 3.21Å; G367-A370 PolarHBondContact O-N 3.46Å; R368-A370 PolarHBondContact O-N 3Å; A370-Y373 WeakPolarHBondContact O-CB 3.19Å; A370-Y373 PolarHBondContact O-N 3.27Å; A370-S374 PolarHBondContact O-N 3.48Å; A370-S374 VanDerWaalsContact O-N 3.08Å; A370-S374 PolarHBondContact O-OG 3.22Å
371	G	82.3	Confident	87.8	Confident	13 Å²	13	22.7 Å²	22.7	13%	0.134	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-40.4	172.5	0	0	0	0	0	113.2	G367 R368 T369 Y373 S374 T375	G367-G371 PolarHBondContact O-N 3.02Å; R368-G371 PolarHBondContact O-N 2.95Å; R368-G371 VanDerWaalsContact O-N 3.16Å; T369-G371 VanDerWaalsContact C-N 3.32Å; T369-G371 PolarHBondContact O-N 3.27Å; G371-Y373 VanDerWaalsContact C-N 3.31Å; G371-Y373 PolarHBondContact O-N 3.16Å; G371-S374 PolarHBondContact O-N 3.48Å; G371-S374 PolarHBondContact O-OG 3.46Å; G371-T375 WeakPolarHBondContact O-CB 3.32Å; G371-T375 WeakPolarHBondContact O-CG2 3.29Å; G371-T375 PolarHBondContact O-N 2.75Å; G371-T375 PolarHBondContact O-OG1 3.05Å
372	L	88.1	Confident	87.7	Confident	3 Å²	3	22.7 Å²	22.7	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-40.8	172.3	-73.8	176.3	0	0	0	111.6	L57 H98 A100 R368 T369 S374 T375 G376 A377 A382	L57-L372 HydrophobicContact CB-CD2 4.3Å; L57-L372 HydrophobicContact CD2-CD1 4.22Å; L57-L372 HydrophobicContact CD2-CD2 4.04Å; L57-L372 HydrophobicContact CD2-CG 4.34Å; H98-L372 WeakPolarHBondContact O-CD1 3.48Å; A100-L372 HydrophobicContact CB-CD1 3.87Å; R368-L372 PolarHBondContact O-N 3Å; T369-L372 WeakPolarHBondContact O-CB 3.31Å; T369-L372 PolarHBondContact O-N 3.45Å; L372-S374 VanDerWaalsContact C-N 3.35Å; L372-S374 PolarHBondContact O-N 3.14Å; L372-T375 PolarHBondContact O-OG1 2.93Å; L372-G376 PolarHBondContact O-N 3.07Å; L372-A377 HydrophobicContact CB-CB 3.96Å; L372-A377 HydrophobicContact CD2-CB 3.78Å; L372-A377 HydrophobicContact CG-CB 4.43Å; L372-A377 WeakPolarHBondContact O-CB 3.46Å; L372-A377 PolarHBondContact O-N 2.98Å; L372-A377 VanDerWaalsContact O-N 3.1Å; L372-A382 HydrophobicContact CD2-CB 3.87Å
373	Y	85.5	Confident	87.7	Confident	47 Å²	47	22.8 Å²	22.8	18%	0.184	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-39.2	177.2	-55	-18.9	0	0	0	113	H98 S330 K333 F334 T369 A370 G371	H98-Y373 HydrophobicContact CB-CD1 3.98Å; H98-Y373 HydrophobicContact CB-CE1 3.62Å; S330-Y373 PolarHBondContact OG-OH 2.82Å; K333-Y373 HydrophobicContact CD-CD2 4.28Å; K333-Y373 HydrophobicContact CD-CE2 4.41Å; F334-Y373 AromaticContact CE2-CD1 3.5Å; F334-Y373 HydrophobicContact CE2-CD1 3.5Å; F334-Y373 AromaticContact CE2-CE1 3.7Å; F334-Y373 HydrophobicContact CE2-CE1 3.7Å; F334-Y373 HydrophobicContact CE2-CG 4.15Å; F334-Y373 AromaticContact CZ-CD1 3.88Å; F334-Y373 HydrophobicContact CZ-CD1 3.88Å; F334-Y373 HydrophobicContact CZ-CG 4.3Å; T369-Y373 HydrophobicContact CG2-CE1 3.59Å; T369-Y373 HydrophobicContact CG2-CE2 4.07Å; T369-Y373 WeakPolarHBondContact CG2-OH 3.31Å; T369-Y373 WeakPolarHBondContact O-CD1 3.26Å; T369-Y373 WeakPolarHBondContact O-CE1 3.32Å; T369-Y373 VanDerWaalsContact O-CG 3.32Å; T369-Y373 PolarHBondContact O-N 3.39Å; T369-Y373 VanDerWaalsContact O-N 3.14Å; A370-Y373 WeakPolarHBondContact O-CB 3.19Å; A370-Y373 PolarHBondContact O-N 3.27Å; G371-Y373 VanDerWaalsContact C-N 3.31Å; G371-Y373 PolarHBondContact O-N 3.16Å
374	S	82.3	Confident	87.8	Confident	54 Å²	54	25.4 Å²	25.4	38%	0.378	16%	0.159	S	C	.	.	H	α-helix	trans	-78.1	-30.7	-175.3	63.4	0	0	0	0	112.7	A370 G371 L372 G376	A370-S374 PolarHBondContact O-N 3.48Å; A370-S374 VanDerWaalsContact O-N 3.08Å; A370-S374 PolarHBondContact O-OG 3.22Å; G371-S374 PolarHBondContact O-N 3.48Å; G371-S374 PolarHBondContact O-OG 3.46Å; L372-S374 VanDerWaalsContact C-N 3.35Å; L372-S374 PolarHBondContact O-N 3.14Å; S374-G376 VanDerWaalsContact C-N 3.33Å
375	T	83	Confident	87.9	Confident	30 Å²	30	26.4 Å²	26.4	18%	0.184	16%	0.164	C	C	.	.	H	α-helix	trans	-82.9	-10.1	177.1	52.3	0	0	0	0	113.4	S53 M56 G371 L372	S53-T375 WeakPolarHBondContact CB-OG1 3.43Å; S53-T375 WeakPolarHBondContact OG-CB 3.16Å; S53-T375 PolarHBondContact OG-OG1 2.73Å; M56-T375 HydrophobicContact CB-CG2 4.2Å; M56-T375 HydrophobicContact CG-CG2 4.12Å; G371-T375 WeakPolarHBondContact O-CB 3.32Å; G371-T375 WeakPolarHBondContact O-CG2 3.29Å; G371-T375 PolarHBondContact O-N 2.75Å; G371-T375 PolarHBondContact O-OG1 3.05Å; L372-T375 PolarHBondContact O-OG1 2.93Å
376	G	84.9	Confident	88.3	Confident	32 Å²	32	26.2 Å²	26.2	33%	0.33	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	24.6	173.3	0	0	0	0	0	114.5	L372 S374	L372-G376 PolarHBondContact O-N 3.07Å; S374-G376 VanDerWaalsContact C-N 3.33Å
377	A	89	Confident	88.9	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.025	15%	0.151	C	C	.	.			trans	-52.2	145.1	173.9	0	0	0	0	0	110.8	S53 H98 L372 A382	S53-A377 WeakPolarHBondContact OG-CA 3.41Å; S53-A377 PolarHBondContact OG-N 3.3Å; H98-A377 PolarHBondContact CD2-O 3.47Å; H98-A377 PolarHBondContact NE2-O 3.04Å; H98-A377 VanDerWaalsContact NE2-O 3.09Å; L372-A377 HydrophobicContact CB-CB 3.96Å; L372-A377 HydrophobicContact CD2-CB 3.78Å; L372-A377 HydrophobicContact CG-CB 4.43Å; L372-A377 WeakPolarHBondContact O-CB 3.46Å; L372-A377 PolarHBondContact O-N 2.98Å; L372-A377 VanDerWaalsContact O-N 3.1Å; A377-A382 HydrophobicContact CB-CB 4.18Å
378	K	87.3	Confident	89.6	Confident	107 Å²	107	27 Å²	27	47%	0.465	16%	0.16	S	C	.	.			trans	-113.5	-35.4	-177.5	-61.7	-65.9	-175.7	174.9	0	111.8	N46 P49 D50 H98	N46-K378 HydrophobicContact CB-CB 4.27Å; N46-K378 HydrophobicContact CB-CG 4.42Å; P49-K378 HydrophobicContact CG-CG 4.26Å; D50-K378 PolarHBondContact OD1-N 3.06Å; H98-K378 PolarHBondContact NE2-O 3.3Å
379	T	90.5	Very high	89.9	Confident	19 Å²	19	30.5 Å²	30.5	12%	0.117	18%	0.175	C	C	.	.	S	Bend	trans	-143.7	174.2	-174	72.5	0	0	0	0	113.2	Y41 D50 R97 V381 A382	Y41-T379 HydrophobicContact CD2-CG2 3.69Å; Y41-T379 HydrophobicContact CE2-CG2 3.63Å; Y41-T379 VanDerWaalsContact CE2-OG1 3.22Å; Y41-T379 WeakPolarHBondContact CE2-OG1 3.36Å; D50-T379 PolarHBondContact OD1-N 3.45Å; D50-T379 PolarHBondContact OD2-OG1 3.08Å; R97-T379 CarbonylContact O-C 3.42Å; R97-T379 VanDerWaalsContact O-C 3.26Å; T379-V381 PolarHBondContact O-N 3.16Å; T379-V381 VanDerWaalsContact O-N 3.14Å; T379-V381 VanDerWaalsContact OG1-CB 3.32Å; T379-V381 WeakPolarHBondContact OG1-CB 3.46Å; T379-V381 VanDerWaalsContact OG1-CG2 3.29Å; T379-V381 WeakPolarHBondContact OG1-CG2 3.3Å; T379-V381 PolarHBondContact OG1-N 2.99Å; T379-A382 PolarHBondContact O-N 3.47Å
380	Q	92.2	Very high	90	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.014	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-7.1	172.7	-75.2	-62.7	-31.2	0	0	113.7	W37 A91 G96 R97 V99 A382 C383 L384	W37-Q380 HydrophobicContact CZ2-CB 4.12Å; A91-Q380 HydrophobicContact CB-CB 4.22Å; G96-Q380 PolarHBondContact O-NE2 2.9Å; R97-Q380 PolarHBondContact O-N 3.24Å; R97-Q380 PolarHBondContact O-NE2 3.35Å; V99-Q380 PolarHBondContact O-NE2 3.06Å; Q380-A382 PolarHBondContact O-N 3.48Å; Q380-C383 WeakPolarHBondContact O-CB 3.48Å; Q380-C383 PolarHBondContact O-N 3.04Å; Q380-C383 PolarHBondContact OE1-SG 3.48Å; Q380-L384 PolarHBondContact O-N 3.38Å; Q380-L384 VanDerWaalsContact O-N 3.12Å
381	V	93.5	Very high	90.5	Very high	23 Å²	23	31.5 Å²	31.5	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-34.5	170.4	177.6	0	0	0	0	110.9	W37 Y41 D50 T379 C383 L384 I385	W37-V381 HydrophobicContact CH2-CG2 3.91Å; W37-V381 HydrophobicContact CZ3-CG2 3.62Å; Y41-V381 HydrophobicContact CD2-CG2 4.29Å; Y41-V381 HydrophobicContact CE1-CG2 4.31Å; Y41-V381 HydrophobicContact CE2-CB 4.39Å; Y41-V381 HydrophobicContact CE2-CG2 3.92Å; D50-V381 HydrophobicContact CB-CB 4.34Å; D50-V381 HydrophobicContact CB-CG1 4.37Å; T379-V381 PolarHBondContact O-N 3.16Å; T379-V381 VanDerWaalsContact O-N 3.14Å; T379-V381 VanDerWaalsContact OG1-CB 3.32Å; T379-V381 WeakPolarHBondContact OG1-CB 3.46Å; T379-V381 VanDerWaalsContact OG1-CG2 3.29Å; T379-V381 WeakPolarHBondContact OG1-CG2 3.3Å; T379-V381 PolarHBondContact OG1-N 2.99Å; V381-C383 VanDerWaalsContact C-N 3.29Å; V381-C383 PolarHBondContact O-N 3.04Å; V381-L384 PolarHBondContact O-N 3.36Å; V381-L384 VanDerWaalsContact O-N 3.14Å; V381-I385 HydrophobicContact CG1-CD1 3.84Å; V381-I385 HydrophobicContact CG1-CG1 4.15Å; V381-I385 WeakPolarHBondContact O-CG1 3.21Å; V381-I385 PolarHBondContact O-N 3.47Å
382	A	93.6	Very high	91	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-41.6	174.5	0	0	0	0	0	112	D50 G54 L372 A377 T379 Q380 I385 S386	D50-A382 HydrophobicContact CB-CB 4.15Å; D50-A382 WeakPolarHBondContact O-CA 3.48Å; D50-A382 WeakPolarHBondContact O-CB 3.43Å; G54-A382 WeakPolarHBondContact CA-O 3.47Å; L372-A382 HydrophobicContact CD2-CB 3.87Å; A377-A382 HydrophobicContact CB-CB 4.18Å; T379-A382 PolarHBondContact O-N 3.47Å; Q380-A382 PolarHBondContact O-N 3.48Å; A382-I385 PolarHBondContact O-N 3.1Å; A382-S386 PolarHBondContact O-N 3.28Å
383	C	93.4	Very high	91.1	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-42.1	175.1	-64.1	0	0	0	0	111.7	L57 Q380 V381 I385 S386 C387	L57-C383 HydrophobicContact CD2-CB 4.4Å; Q380-C383 WeakPolarHBondContact O-CB 3.48Å; Q380-C383 PolarHBondContact O-N 3.04Å; Q380-C383 PolarHBondContact OE1-SG 3.48Å; V381-C383 VanDerWaalsContact C-N 3.29Å; V381-C383 PolarHBondContact O-N 3.04Å; C383-I385 PolarHBondContact O-N 3.35Å; C383-S386 WeakPolarHBondContact O-CB 3.36Å; C383-S386 PolarHBondContact O-N 3.38Å; C383-S386 VanDerWaalsContact O-N 3.12Å; C383-S386 PolarHBondContact O-OG 3.04Å; C383-C387 PolarHBondContact O-N 3.4Å; C383-C387 PolarHBondContact O-SG 3.44Å
384	L	94.9	Very high	91.3	Very high	55 Å²	55	33.3 Å²	33.3	29%	0.288	18%	0.183	S	C	.	.	H	α-helix	trans	-64	-40.1	176.5	-67.1	177	0	0	0	112.7	A91 Q380 V381 S386 C387 I388	A91-L384 HydrophobicContact CB-CD1 4.36Å; A91-L384 HydrophobicContact CB-CD2 3.71Å; A91-L384 HydrophobicContact CB-CG 3.95Å; Q380-L384 PolarHBondContact O-N 3.38Å; Q380-L384 VanDerWaalsContact O-N 3.12Å; V381-L384 PolarHBondContact O-N 3.36Å; V381-L384 VanDerWaalsContact O-N 3.14Å; L384-S386 VanDerWaalsContact C-N 3.27Å; L384-S386 PolarHBondContact O-N 3.22Å; L384-C387 VanDerWaalsContact O-CB 3.31Å; L384-C387 WeakPolarHBondContact O-CB 3.5Å; L384-C387 PolarHBondContact O-N 3.36Å; L384-I388 PolarHBondContact O-N 3Å
385	I	95.2	Very high	91.6	Very high	21 Å²	21	37 Å²	37	11%	0.108	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-42	172.9	-68.3	172.4	0	0	0	109.4	T51 V381 A382 C383 C387 I388 F389	T51-I385 WeakPolarHBondContact OG1-CD1 3.2Å; V381-I385 HydrophobicContact CG1-CD1 3.84Å; V381-I385 HydrophobicContact CG1-CG1 4.15Å; V381-I385 WeakPolarHBondContact O-CG1 3.21Å; V381-I385 PolarHBondContact O-N 3.47Å; A382-I385 PolarHBondContact O-N 3.1Å; C383-I385 PolarHBondContact O-N 3.35Å; I385-C387 VanDerWaalsContact C-N 3.26Å; I385-C387 PolarHBondContact O-N 3.09Å; I385-I388 WeakPolarHBondContact O-CB 3.31Å; I385-I388 PolarHBondContact O-N 3.22Å; I385-I388 VanDerWaalsContact O-N 3.1Å; I385-F389 HydrophobicContact CG2-CD2 3.97Å; I385-F389 HydrophobicContact CG2-CE2 3.91Å; I385-F389 WeakPolarHBondContact O-CD2 3.35Å; I385-F389 PolarHBondContact O-N 2.94Å
386	S	94.7	Very high	91.9	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-36.9	176.9	84.7	0	0	0	0	112.9	G54 A382 C383 L384 I388 F389 V390	G54-S386 WeakPolarHBondContact O-CA 3.42Å; G54-S386 VanDerWaalsContact O-CB 3.23Å; G54-S386 WeakPolarHBondContact O-CB 3.2Å; A382-S386 PolarHBondContact O-N 3.28Å; C383-S386 WeakPolarHBondContact O-CB 3.36Å; C383-S386 PolarHBondContact O-N 3.38Å; C383-S386 VanDerWaalsContact O-N 3.12Å; C383-S386 PolarHBondContact O-OG 3.04Å; L384-S386 VanDerWaalsContact C-N 3.27Å; L384-S386 PolarHBondContact O-N 3.22Å; S386-I388 VanDerWaalsContact C-N 3.34Å; S386-I388 PolarHBondContact O-N 2.97Å; S386-F389 PolarHBondContact O-N 3.49Å; S386-V390 WeakPolarHBondContact O-CG2 3.34Å; S386-V390 PolarHBondContact O-N 3.37Å
387	C	95.1	Very high	92	Very high	7 Å²	7	40.4 Å²	40.4	5%	0.047	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-41.1	174.6	-65.3	0	0	0	0	112.3	L84 I88 C383 L384 I385 F389 V390 L391	L84-C387 HydrophobicContact CD1-CB 3.58Å; L84-C387 WeakPolarHBondContact CD1-O 3.5Å; I88-C387 HydrophobicContact CD1-CB 4.41Å; I88-C387 HydrophobicContact CG1-CB 4.15Å; C383-C387 PolarHBondContact O-N 3.4Å; C383-C387 PolarHBondContact O-SG 3.44Å; L384-C387 VanDerWaalsContact O-CB 3.31Å; L384-C387 WeakPolarHBondContact O-CB 3.5Å; L384-C387 PolarHBondContact O-N 3.36Å; I385-C387 VanDerWaalsContact C-N 3.26Å; I385-C387 PolarHBondContact O-N 3.09Å; C387-F389 VanDerWaalsContact C-N 3.33Å; C387-F389 PolarHBondContact O-N 3.11Å; C387-V390 PolarHBondContact O-N 2.65Å; C387-L391 WeakPolarHBondContact O-CB 3.16Å; C387-L391 PolarHBondContact O-N 3.48Å
388	I	95.3	Very high	91.7	Very high	102 Å²	102	40.2 Å²	40.2	52%	0.523	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-42.6	176.3	-62.3	169.7	0	0	0	110.4	L384 I385 S386 L391 I392	L384-I388 PolarHBondContact O-N 3Å; I385-I388 WeakPolarHBondContact O-CB 3.31Å; I385-I388 PolarHBondContact O-N 3.22Å; I385-I388 VanDerWaalsContact O-N 3.1Å; S386-I388 VanDerWaalsContact C-N 3.34Å; S386-I388 PolarHBondContact O-N 2.97Å; I388-L391 WeakPolarHBondContact O-CB 3.37Å; I388-L391 PolarHBondContact O-N 3.21Å; I388-I392 HydrophobicContact CG2-CD1 4.41Å; I388-I392 WeakPolarHBondContact O-CG1 3.3Å; I388-I392 PolarHBondContact O-N 2.92Å
389	F	93.4	Very high	91.6	Very high	73 Å²	73	38.5 Å²	38.5	32%	0.32	21%	0.206	S	C	.	.	H	α-helix	trans	-67.7	-40.4	177	-83.8	-85.6	0	0	0	112.9	I55 A58 I385 S386 C387 L391 I392 V393	I55-F389 HydrophobicContact CD1-CE2 4.15Å; I55-F389 HydrophobicContact CD1-CZ 3.88Å; I55-F389 HydrophobicContact CG1-CD2 4.03Å; I55-F389 HydrophobicContact CG1-CE1 4.19Å; I55-F389 HydrophobicContact CG1-CE2 3.43Å; I55-F389 VanDerWaalsContact CG1-CE2 3.43Å; I55-F389 HydrophobicContact CG1-CZ 3.52Å; A58-F389 HydrophobicContact CB-CB 3.42Å; A58-F389 VanDerWaalsContact CB-CB 3.42Å; A58-F389 HydrophobicContact CB-CG 4.24Å; I385-F389 HydrophobicContact CG2-CD2 3.97Å; I385-F389 HydrophobicContact CG2-CE2 3.91Å; I385-F389 WeakPolarHBondContact O-CD2 3.35Å; I385-F389 PolarHBondContact O-N 2.94Å; S386-F389 PolarHBondContact O-N 3.49Å; C387-F389 VanDerWaalsContact C-N 3.33Å; C387-F389 PolarHBondContact O-N 3.11Å; F389-L391 VanDerWaalsContact C-N 3.26Å; F389-L391 PolarHBondContact O-N 2.95Å; F389-I392 WeakPolarHBondContact O-CB 3.19Å; F389-I392 PolarHBondContact O-N 3.46Å; F389-V393 VanDerWaalsContact O-CG2 3.31Å; F389-V393 WeakPolarHBondContact O-CG2 3.37Å; F389-V393 PolarHBondContact O-N 2.93Å
390	V	92.9	Very high	91.4	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-37.4	173.8	172.8	0	0	0	0	110.8	Q61 V62 L80 L84 S386 C387 V393 I394	Q61-V390 HydrophobicContact CB-CG2 4.28Å; Q61-V390 HydrophobicContact CG-CG2 4.17Å; V62-V390 HydrophobicContact CG2-CG2 4.25Å; L80-V390 HydrophobicContact CB-CG1 4.49Å; L84-V390 HydrophobicContact CB-CG1 4.22Å; S386-V390 WeakPolarHBondContact O-CG2 3.34Å; S386-V390 PolarHBondContact O-N 3.37Å; C387-V390 PolarHBondContact O-N 2.65Å; V390-V393 WeakPolarHBondContact O-CB 3.16Å; V390-V393 PolarHBondContact O-N 2.86Å; V390-I394 HydrophobicContact CG1-CD1 4.04Å; V390-I394 WeakPolarHBondContact O-CG1 3.34Å; V390-I394 PolarHBondContact O-N 3.26Å
391	L	92.9	Very high	91.2	Very high	66 Å²	66	43.6 Å²	43.6	35%	0.346	23%	0.232	S	C	.	.	H	α-helix	trans	-61.4	-45.8	174	-170.1	69.8	0	0	0	111.6	L84 I294 C387 I388 F389 V393 I394 Y395	L84-L391 HydrophobicContact CD2-CD1 4.28Å; I294-L391 HydrophobicContact CD1-CD1 3.6Å; C387-L391 WeakPolarHBondContact O-CB 3.16Å; C387-L391 PolarHBondContact O-N 3.48Å; I388-L391 WeakPolarHBondContact O-CB 3.37Å; I388-L391 PolarHBondContact O-N 3.21Å; F389-L391 VanDerWaalsContact C-N 3.26Å; F389-L391 PolarHBondContact O-N 2.95Å; L391-V393 PolarHBondContact O-N 3.33Å; L391-I394 PolarHBondContact O-N 3.22Å; L391-Y395 HydrophobicContact CD1-CD2 3.95Å; L391-Y395 HydrophobicContact CD1-CE2 3.62Å; L391-Y395 HydrophobicContact CG-CD2 4.11Å; L391-Y395 HydrophobicContact CG-CE2 4.2Å; L391-Y395 WeakPolarHBondContact O-CD2 3.31Å; L391-Y395 PolarHBondContact O-N 3.18Å; L391-Y395 VanDerWaalsContact O-N 3.13Å
392	I	92.4	Very high	91	Very high	81 Å²	81	45.7 Å²	45.7	42%	0.415	24%	0.238	S	C	.	.	H	α-helix	trans	-58.1	-41.3	174.4	-66.8	166.2	0	0	0	110.4	I388 F389 Y395 A396	I388-I392 HydrophobicContact CG2-CD1 4.41Å; I388-I392 WeakPolarHBondContact O-CG1 3.3Å; I388-I392 PolarHBondContact O-N 2.92Å; F389-I392 WeakPolarHBondContact O-CB 3.19Å; F389-I392 PolarHBondContact O-N 3.46Å; I392-Y395 PolarHBondContact O-N 3.46Å; I392-A396 HydrophobicContact CG2-CB 4.47Å; I392-A396 WeakPolarHBondContact O-CB 3.2Å; I392-A396 PolarHBondContact O-N 2.98Å
393	V	90.3	Very high	90.8	Very high	18 Å²	18	48.5 Å²	48.5	11%	0.109	25%	0.248	C	C	.	.	I	π-helix	trans	-63	-45.2	178.8	171.6	0	0	0	0	111.4	V62 F389 V390 L391 Y395 I397 G398 L401	V62-V393 HydrophobicContact CG1-CG1 4.03Å; V62-V393 HydrophobicContact CG2-CB 4.17Å; V62-V393 HydrophobicContact CG2-CG1 3.96Å; V62-V393 HydrophobicContact CG2-CG2 3.89Å; F389-V393 VanDerWaalsContact O-CG2 3.31Å; F389-V393 WeakPolarHBondContact O-CG2 3.37Å; F389-V393 PolarHBondContact O-N 2.93Å; V390-V393 WeakPolarHBondContact O-CB 3.16Å; V390-V393 PolarHBondContact O-N 2.86Å; L391-V393 PolarHBondContact O-N 3.33Å; V393-Y395 VanDerWaalsContact C-N 3.33Å; V393-Y395 PolarHBondContact O-N 2.97Å; V393-I397 HydrophobicContact CB-CB 4.46Å; V393-I397 HydrophobicContact CG1-CB 4.27Å; V393-I397 HydrophobicContact CG2-CD1 3.97Å; V393-I397 CarbonylContact O-C 3.52Å; V393-I397 PolarHBondContact O-N 3.16Å; V393-G398 PolarHBondContact O-N 3.27Å; V393-L401 HydrophobicContact CG1-CD1 4.04Å
394	I	89.6	Confident	90.7	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.248	C	C	.	.	I	π-helix	trans	-60.2	-40.8	178.7	-69.6	163.1	0	0	0	111.9	L80 Y81 L84 G293 V390 L391	L80-I394 HydrophobicContact CB-CD1 4.07Å; L80-I394 HydrophobicContact CB-CG1 3.93Å; L80-I394 HydrophobicContact CD1-CG1 3.98Å; Y81-I394 HydrophobicContact CD1-CD1 3.87Å; Y81-I394 HydrophobicContact CE1-CD1 3.97Å; Y81-I394 HydrophobicContact CE1-CG1 4.42Å; Y81-I394 HydrophobicContact CE1-CG2 4.19Å; L84-I394 HydrophobicContact CD2-CD1 4.28Å; G293-I394 WeakPolarHBondContact O-CG2 3.19Å; V390-I394 HydrophobicContact CG1-CD1 4.04Å; V390-I394 WeakPolarHBondContact O-CG1 3.34Å; V390-I394 PolarHBondContact O-N 3.26Å; L391-I394 PolarHBondContact O-N 3.22Å
395	Y	89.9	Confident	90.6	Very high	131 Å²	131	45.8 Å²	45.8	51%	0.514	23%	0.234	S	C	.	.	I	π-helix	trans	-89.6	-30.1	-175	-79.6	-80.4	0	0	0	114.6	I294 L391 I392 V393	I294-Y395 HydrophobicContact CD1-CE2 4.23Å; I294-Y395 HydrophobicContact CG1-CE2 4.19Å; L391-Y395 HydrophobicContact CD1-CD2 3.95Å; L391-Y395 HydrophobicContact CD1-CE2 3.62Å; L391-Y395 HydrophobicContact CG-CD2 4.11Å; L391-Y395 HydrophobicContact CG-CE2 4.2Å; L391-Y395 WeakPolarHBondContact O-CD2 3.31Å; L391-Y395 PolarHBondContact O-N 3.18Å; L391-Y395 VanDerWaalsContact O-N 3.13Å; I392-Y395 PolarHBondContact O-N 3.46Å; V393-Y395 VanDerWaalsContact C-N 3.33Å; V393-Y395 PolarHBondContact O-N 2.97Å
396	A	89.1	Confident	90.4	Very high	65 Å²	65	45.7 Å²	45.7	54%	0.537	23%	0.233	S	C	.	.	I	π-helix	trans	-117.5	-35.8	-171.4	0	0	0	0	0	114.4	I392	I392-A396 HydrophobicContact CG2-CB 4.47Å; I392-A396 WeakPolarHBondContact O-CB 3.2Å; I392-A396 PolarHBondContact O-N 2.98Å
397	I	86.8	Confident	90.3	Very high	69 Å²	69	45.8 Å²	45.8	35%	0.354	23%	0.234	S	C	.	.	I	π-helix	trans	-101.9	-16.8	-170.1	-54.8	175.8	0	0	0	112.2	V393 P399 L400	V393-I397 HydrophobicContact CB-CB 4.46Å; V393-I397 HydrophobicContact CG1-CB 4.27Å; V393-I397 HydrophobicContact CG2-CD1 3.97Å; V393-I397 CarbonylContact O-C 3.52Å; V393-I397 PolarHBondContact O-N 3.16Å; I397-P399 VanDerWaalsContact C-N 3.35Å; I397-P399 VanDerWaalsContact O-N 3.15Å; I397-L400 HydrophobicContact CG2-CB 4.34Å; I397-L400 HydrophobicContact CG2-CD1 4.45Å; I397-L400 WeakPolarHBondContact O-CB 3.26Å; I397-L400 PolarHBondContact O-N 3.34Å
398	G	83.4	Confident	90.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-41.6	-50.5	-179.1	0	0	0	0	0	114.9	V393 L400 L401	V393-G398 PolarHBondContact O-N 3.27Å; G398-L400 VanDerWaalsContact C-N 3.29Å; G398-L400 PolarHBondContact O-N 3.45Å; G398-L401 WeakPolarHBondContact O-CB 3.27Å; G398-L401 PolarHBondContact O-N 2.89Å; G398-L401 VanDerWaalsContact O-N 3.09Å
399	P	84.1	Confident	90	Very high	71 Å²	71	40.8 Å²	40.8	46%	0.461	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-60.5	-31.6	179	-26.6	35.9	0	0	0	114.8	I397 L401 Y402	I397-P399 VanDerWaalsContact C-N 3.35Å; I397-P399 VanDerWaalsContact O-N 3.15Å; P399-L401 PolarHBondContact O-N 2.93Å; P399-Y402 WeakPolarHBondContact O-CB 3.37Å; P399-Y402 PolarHBondContact O-N 2.95Å
400	L	86.1	Confident	89.9	Confident	118 Å²	118	37.3 Å²	37.3	62%	0.618	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-69	-23.3	178.7	-72.3	92.4	0	0	0	112.3	I397 G398 Y402	I397-L400 HydrophobicContact CG2-CB 4.34Å; I397-L400 HydrophobicContact CG2-CD1 4.45Å; I397-L400 WeakPolarHBondContact O-CB 3.26Å; I397-L400 PolarHBondContact O-N 3.34Å; G398-L400 VanDerWaalsContact C-N 3.29Å; G398-L400 PolarHBondContact O-N 3.45Å; L400-Y402 VanDerWaalsContact C-N 3.27Å; L400-Y402 PolarHBondContact O-N 3.43Å
401	L	87.7	Confident	90	Very high	11 Å²	11	37.2 Å²	37.2	6%	0.058	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-80.8	-6.4	-179.3	-60.9	171.1	0	0	0	113	V62 L66 I266 I290 V393 G398 P399 W403 L404	V62-L401 HydrophobicContact CG1-CD1 4.27Å; L66-L401 HydrophobicContact CD1-CD1 4.12Å; I266-L401 HydrophobicContact CG2-CD2 4.23Å; I290-L401 HydrophobicContact CD1-CB 3.61Å; I290-L401 HydrophobicContact CD1-CD1 4.06Å; I290-L401 HydrophobicContact CD1-CG 4.48Å; V393-L401 HydrophobicContact CG1-CD1 4.04Å; G398-L401 WeakPolarHBondContact O-CB 3.27Å; G398-L401 PolarHBondContact O-N 2.89Å; G398-L401 VanDerWaalsContact O-N 3.09Å; P399-L401 PolarHBondContact O-N 2.93Å; L401-W403 VanDerWaalsContact C-N 3.3Å; L401-W403 PolarHBondContact O-N 3.12Å; L401-L404 VanDerWaalsContact O-CB 3.26Å; L401-L404 WeakPolarHBondContact O-CB 3.39Å; L401-L404 PolarHBondContact O-N 2.64Å
402	Y	89.4	Confident	89.9	Confident	66 Å²	66	34.1 Å²	34.1	26%	0.259	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-47.7	177.9	176.2	-80.5	0	0	0	112.1	E279 V286 G288 P399 L400 L404	E279-Y402 PolarHBondContact OE1-OH 3.29Å; E279-Y402 WeakPolarHBondContact OE2-CE1 3.26Å; E279-Y402 PolarHBondContact OE2-OH 2.85Å; V286-Y402 HydrophobicContact CG2-CE1 4.39Å; G288-Y402 PolarHBondContact N-O 3.49Å; G288-Y402 WeakPolarHBondContact O-CA 3.37Å; G288-Y402 WeakPolarHBondContact O-CD2 3.42Å; P399-Y402 WeakPolarHBondContact O-CB 3.37Å; P399-Y402 PolarHBondContact O-N 2.95Å; L400-Y402 VanDerWaalsContact C-N 3.27Å; L400-Y402 PolarHBondContact O-N 3.43Å; Y402-L404 PolarHBondContact O-N 3.09Å
403	W	90.3	Very high	89.7	Confident	59 Å²	59	30.4 Å²	30.4	22%	0.223	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	5.2	-172.8	-65.9	98.4	0	0	0	114	C273 Y274 E279 L401 P405	C273-W403 WeakPolarHBondContact CB-O 3.35Å; Y274-W403 AromaticContact CD2-CD1 3.96Å; Y274-W403 HydrophobicContact CD2-CD2 4.04Å; Y274-W403 AromaticContact CD2-CE2 3.59Å; Y274-W403 HydrophobicContact CD2-CG 4.27Å; Y274-W403 AromaticContact CD2-CZ2 3.97Å; Y274-W403 HydrophobicContact CD2-CZ2 3.97Å; Y274-W403 AromaticContact CD2-NE1 3.54Å; Y274-W403 HydrophobicContact CE2-CZ2 4.4Å; E279-W403 HydrophobicContact CB-CZ3 4.43Å; L401-W403 VanDerWaalsContact C-N 3.3Å; L401-W403 PolarHBondContact O-N 3.12Å; W403-P405 VanDerWaalsContact O-CD 3.3Å; W403-P405 WeakPolarHBondContact O-CD 3.38Å
404	L	91.1	Very high	89.7	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.			trans	-73.9	124	-177.3	-178.9	57	0	0	0	110.6	L66 I266 V286 V287 L401 Y402 L409	L66-L404 HydrophobicContact CD1-CD2 4.45Å; I266-L404 HydrophobicContact CB-CD1 4.24Å; I266-L404 HydrophobicContact CD1-CD2 4.21Å; I266-L404 HydrophobicContact CG1-CD1 3.97Å; I266-L404 HydrophobicContact CG1-CD2 4.26Å; I266-L404 HydrophobicContact CG2-CD1 4.01Å; I266-L404 HydrophobicContact CG2-CD2 4.09Å; V286-L404 WeakPolarHBondContact CA-O 3.2Å; V287-L404 HydrophobicContact CB-CB 4.45Å; V287-L404 HydrophobicContact CG2-CB 3.9Å; V287-L404 HydrophobicContact CG2-CD2 4.28Å; V287-L404 HydrophobicContact CG2-CG 4.19Å; V287-L404 WeakPolarHBondContact CG2-O 3.48Å; V287-L404 PolarHBondContact N-O 2.89Å; L401-L404 VanDerWaalsContact O-CB 3.26Å; L401-L404 WeakPolarHBondContact O-CB 3.39Å; L401-L404 PolarHBondContact O-N 2.64Å; Y402-L404 PolarHBondContact O-N 3.09Å; L404-L409 HydrophobicContact CD2-CD1 4.15Å; L404-L409 HydrophobicContact CD2-CD2 3.61Å; L404-L409 HydrophobicContact CD2-CG 3.94Å; L404-L409 HydrophobicContact CG-CD1 4.4Å; L404-L409 HydrophobicContact CG-CD2 4.3Å; L404-L409 HydrophobicContact CG-CG 4.14Å
405	P	92.7	Very high	89.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-72.9	139.8	178.5	-24.5	38.1	0	0	0	113.6	L233 C273 L284 W403 C407 V408 L409	L233-P405 HydrophobicContact CD2-CB 4.17Å; L233-P405 HydrophobicContact CD2-CG 3.99Å; C273-P405 HydrophobicContact CB-CG 4.28Å; C273-P405 WeakPolarHBondContact SG-CG 3.26Å; L284-P405 HydrophobicContact CD2-CB 3.87Å; L284-P405 HydrophobicContact CD2-CG 4.03Å; W403-P405 VanDerWaalsContact O-CD 3.3Å; W403-P405 WeakPolarHBondContact O-CD 3.38Å; P405-C407 VanDerWaalsContact C-N 3.26Å; P405-C407 PolarHBondContact O-N 3.29Å; P405-V408 HydrophobicContact CB-CG2 4.07Å; P405-V408 HydrophobicContact CG-CG2 4.27Å; P405-V408 PolarHBondContact O-N 2.8Å; P405-L409 PolarHBondContact O-N 3.25Å
406	M	90.9	Very high	89.4	Confident	20 Å²	20	26.9 Å²	26.9	10%	0.099	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-32.8	175.8	-65	-54.4	-162.2	0	0	112.7	I70 P76 Y197 E285 V287 V408 L409 A410	I70-M406 HydrophobicContact CD1-CE 3.55Å; I70-M406 HydrophobicContact CD1-SD 3.31Å; I70-M406 WeakPolarHBondContact CD1-SD 3.26Å; I70-M406 HydrophobicContact CG1-CE 4.01Å; I70-M406 HydrophobicContact CG1-SD 4.31Å; P76-M406 HydrophobicContact CG-CE 4.36Å; Y197-M406 HydrophobicContact CD1-CB 4.08Å; E285-M406 HydrophobicContact CB-CB 4.45Å; E285-M406 HydrophobicContact CB-CG 4.17Å; E285-M406 HydrophobicContact CG-CG 3.99Å; E285-M406 WeakPolarHBondContact O-CG 3.33Å; E285-M406 PolarHBondContact O-N 3.25Å; V287-M406 HydrophobicContact CG2-CE 4.29Å; V287-M406 HydrophobicContact CG2-SD 4Å; M406-V408 VanDerWaalsContact C-N 3.31Å; M406-V408 PolarHBondContact O-N 3.34Å; M406-L409 WeakPolarHBondContact O-CB 3.41Å; M406-L409 PolarHBondContact O-N 2.93Å; M406-L409 HydrophobicContact SD-CD1 3.97Å; M406-A410 WeakPolarHBondContact O-CB 3.23Å; M406-A410 PolarHBondContact O-N 2.97Å
407	C	93.4	Very high	89.3	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.02	13%	0.133	C	C	.	.	H	α-helix	trans	-65	-33.9	178.4	64.8	0	0	0	0	112.6	Y197 A230 P405 A410 S411	Y197-C407 WeakPolarHBondContact O-CA 3.32Å; Y197-C407 WeakPolarHBondContact O-CB 3.22Å; A230-C407 HydrophobicContact CB-CB 4.36Å; P405-C407 VanDerWaalsContact C-N 3.26Å; P405-C407 PolarHBondContact O-N 3.29Å; C407-A410 PolarHBondContact O-N 3.43Å; C407-S411 PolarHBondContact O-N 2.98Å; C407-S411 PolarHBondContact O-OG 3.14Å; C407-S411 VanDerWaalsContact O-OG 3.14Å
408	V	93.6	Very high	89.2	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-71	-41.7	176	177	0	0	0	0	110.7	L233 L265 A269 P405 M406 A410 S411 I412	L233-V408 HydrophobicContact CD1-CG2 4.4Å; L233-V408 HydrophobicContact CD2-CG2 3.92Å; L233-V408 HydrophobicContact CG-CG2 3.87Å; L265-V408 HydrophobicContact CD2-CG1 3.86Å; L265-V408 HydrophobicContact CG-CG1 3.93Å; A269-V408 HydrophobicContact CB-CG1 4.24Å; A269-V408 HydrophobicContact CB-CG2 3.91Å; P405-V408 HydrophobicContact CB-CG2 4.07Å; P405-V408 HydrophobicContact CG-CG2 4.27Å; P405-V408 PolarHBondContact O-N 2.8Å; M406-V408 VanDerWaalsContact C-N 3.31Å; M406-V408 PolarHBondContact O-N 3.34Å; V408-A410 VanDerWaalsContact C-N 3.32Å; V408-A410 PolarHBondContact O-N 3.46Å; V408-S411 WeakPolarHBondContact O-CB 3.44Å; V408-S411 PolarHBondContact O-N 3.45Å; V408-I412 HydrophobicContact CG1-CD1 4.31Å; V408-I412 WeakPolarHBondContact O-CG1 3.39Å; V408-I412 PolarHBondContact O-N 2.73Å
409	L	90.6	Very high	89.2	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-41.9	173.7	-73.2	178.2	0	0	0	111.9	S67 I70 V287 L404 P405 M406 I412 I413	S67-L409 WeakPolarHBondContact OG-CB 3.26Å; S67-L409 WeakPolarHBondContact OG-CD2 3.35Å; I70-L409 HydrophobicContact CD1-CD1 3.9Å; V287-L409 HydrophobicContact CG2-CD1 3.63Å; L404-L409 HydrophobicContact CD2-CD1 4.15Å; L404-L409 HydrophobicContact CD2-CD2 3.61Å; L404-L409 HydrophobicContact CD2-CG 3.94Å; L404-L409 HydrophobicContact CG-CD1 4.4Å; L404-L409 HydrophobicContact CG-CD2 4.3Å; L404-L409 HydrophobicContact CG-CG 4.14Å; P405-L409 PolarHBondContact O-N 3.25Å; M406-L409 WeakPolarHBondContact O-CB 3.41Å; M406-L409 PolarHBondContact O-N 2.93Å; M406-L409 HydrophobicContact SD-CD1 3.97Å; L409-I412 PolarHBondContact O-N 2.69Å; L409-I413 PolarHBondContact O-N 2.76Å; L409-I413 VanDerWaalsContact O-N 3.09Å
410	A	91.7	Very high	89.3	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-43.7	174.8	0	0	0	0	0	111.9	Q194 L198 M406 C407 V408 I412 I413 V414	Q194-A410 HydrophobicContact CB-CB 4.19Å; L198-A410 HydrophobicContact CD2-CB 3.84Å; L198-A410 HydrophobicContact CG-CB 4.13Å; M406-A410 WeakPolarHBondContact O-CB 3.23Å; M406-A410 PolarHBondContact O-N 2.97Å; C407-A410 PolarHBondContact O-N 3.43Å; V408-A410 VanDerWaalsContact C-N 3.32Å; V408-A410 PolarHBondContact O-N 3.46Å; A410-I412 VanDerWaalsContact C-N 3.33Å; A410-I412 PolarHBondContact O-N 3.47Å; A410-I413 PolarHBondContact O-N 3.03Å; A410-V414 WeakPolarHBondContact O-CG2 3.47Å; A410-V414 PolarHBondContact O-N 3.41Å
411	S	94	Very high	89.4	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.2	-41.6	174.2	-66.5	0	0	0	0	112.5	L198 S234 C407 V408 I413 V414 V415	L198-S411 WeakPolarHBondContact CD2-OG 3.47Å; S234-S411 WeakPolarHBondContact CA-OG 3.43Å; S234-S411 PolarHBondContact O-OG 3.1Å; C407-S411 PolarHBondContact O-N 2.98Å; C407-S411 PolarHBondContact O-OG 3.14Å; C407-S411 VanDerWaalsContact O-OG 3.14Å; V408-S411 WeakPolarHBondContact O-CB 3.44Å; V408-S411 PolarHBondContact O-N 3.45Å; S411-I413 PolarHBondContact O-N 2.86Å; S411-V414 PolarHBondContact O-N 2.85Å; S411-V415 WeakPolarHBondContact O-CG2 3.16Å; S411-V415 PolarHBondContact O-N 2.96Å
412	I	90.1	Very high	89.4	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-42.8	176	-67.9	167.4	0	0	0	111	L241 L265 I266 V408 L409 A410 G416	L241-I412 HydrophobicContact CD1-CG1 3.89Å; L265-I412 HydrophobicContact CD2-CG1 4.29Å; I266-I412 HydrophobicContact CD1-CD1 4.02Å; I266-I412 HydrophobicContact CG1-CD1 3.88Å; V408-I412 HydrophobicContact CG1-CD1 4.31Å; V408-I412 WeakPolarHBondContact O-CG1 3.39Å; V408-I412 PolarHBondContact O-N 2.73Å; L409-I412 PolarHBondContact O-N 2.69Å; A410-I412 VanDerWaalsContact C-N 3.33Å; A410-I412 PolarHBondContact O-N 3.47Å; I412-G416 PolarHBondContact O-N 3.26Å
413	I	88.4	Confident	89.4	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-52.4	176	-68.2	168.6	0	0	0	110.5	F68 V190 Q194 L409 A410 S411 V415 G416 L417	F68-I413 HydrophobicContact CD1-CD1 4.23Å; F68-I413 HydrophobicContact CD1-CG1 4.48Å; F68-I413 HydrophobicContact CE1-CD1 4.14Å; F68-I413 HydrophobicContact CE1-CG1 3.96Å; F68-I413 HydrophobicContact CE1-CG2 4.29Å; V190-I413 HydrophobicContact CG1-CG2 3.73Å; Q194-I413 HydrophobicContact CG-CB 4.15Å; Q194-I413 HydrophobicContact CG-CD1 4.24Å; Q194-I413 HydrophobicContact CG-CG2 3.94Å; L409-I413 PolarHBondContact O-N 2.76Å; L409-I413 VanDerWaalsContact O-N 3.09Å; A410-I413 PolarHBondContact O-N 3.03Å; S411-I413 PolarHBondContact O-N 2.86Å; I413-V415 VanDerWaalsContact C-N 3.33Å; I413-V415 PolarHBondContact O-N 3.39Å; I413-G416 CarbonylContact O-C 3.6Å; I413-G416 WeakPolarHBondContact O-CA 3.45Å; I413-G416 PolarHBondContact O-N 2.9Å; I413-L417 HydrophobicContact CG2-CD1 3.75Å; I413-L417 HydrophobicContact CG2-CG 4.22Å; I413-L417 WeakPolarHBondContact O-CG 3.4Å; I413-L417 PolarHBondContact O-N 2.64Å
414	V	91.3	Very high	89.3	Confident	30 Å²	30	25.3 Å²	25.3	18%	0.182	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-45.8	-175.1	171.3	0	0	0	0	111.1	V191 Q194 L198 A410 S411 G416 L417	V191-V414 HydrophobicContact CG1-CG2 4.36Å; V191-V414 HydrophobicContact CG2-CG1 4.46Å; V191-V414 HydrophobicContact CG2-CG2 4.29Å; Q194-V414 HydrophobicContact CB-CG2 3.96Å; Q194-V414 HydrophobicContact CG-CG2 4.18Å; L198-V414 HydrophobicContact CD1-CG2 4.1Å; A410-V414 WeakPolarHBondContact O-CG2 3.47Å; A410-V414 PolarHBondContact O-N 3.41Å; S411-V414 PolarHBondContact O-N 2.85Å; V414-G416 VanDerWaalsContact C-N 3.34Å; V414-G416 PolarHBondContact O-N 2.95Å; V414-L417 PolarHBondContact O-N 3.09Å
415	V	89.5	Confident	89.2	Confident	14 Å²	14	34.8 Å²	34.8	9%	0.085	18%	0.179	C	C	.	.	H	α-helix	trans	-67.2	-36.7	176.5	178.6	0	0	0	0	111.4	I238 L241 V242 K245 S411 I413 L417 K418	I238-V415 HydrophobicContact CB-CG2 4.5Å; I238-V415 HydrophobicContact CG1-CG2 4.34Å; I238-V415 HydrophobicContact CG2-CG2 4.19Å; L241-V415 HydrophobicContact CB-CB 4.35Å; L241-V415 HydrophobicContact CB-CG1 4.07Å; L241-V415 HydrophobicContact CB-CG2 4.04Å; L241-V415 HydrophobicContact CD1-CB 4.37Å; L241-V415 HydrophobicContact CD1-CG2 4.15Å; V242-V415 HydrophobicContact CG2-CG1 4.1Å; V242-V415 HydrophobicContact CG2-CG2 3.9Å; K245-V415 HydrophobicContact CD-CG1 4.02Å; S411-V415 WeakPolarHBondContact O-CG2 3.16Å; S411-V415 PolarHBondContact O-N 2.96Å; I413-V415 VanDerWaalsContact C-N 3.33Å; I413-V415 PolarHBondContact O-N 3.39Å; V415-L417 PolarHBondContact O-N 2.94Å; V415-K418 VanDerWaalsContact O-CB 3.25Å; V415-K418 WeakPolarHBondContact O-CB 3.45Å; V415-K418 PolarHBondContact O-N 2.81Å
416	G	83.5	Confident	88.9	Confident	32 Å²	32	37.4 Å²	37.4	33%	0.33	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-27.7	176.2	0	0	0	0	0	114.1	I412 I413 V414 K418	I412-G416 PolarHBondContact O-N 3.26Å; I413-G416 CarbonylContact O-C 3.6Å; I413-G416 WeakPolarHBondContact O-CA 3.45Å; I413-G416 PolarHBondContact O-N 2.9Å; V414-G416 VanDerWaalsContact C-N 3.34Å; V414-G416 PolarHBondContact O-N 2.95Å; G416-K418 VanDerWaalsContact C-N 3.35Å
417	L	86.1	Confident	88.9	Confident	13 Å²	13	37.8 Å²	37.8	7%	0.068	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.3	179	-67.6	174.7	0	0	0	114.2	A187 V190 V191 I413 V414 V415 G419 M420 L421	A187-L417 HydrophobicContact CB-CB 4.41Å; A187-L417 HydrophobicContact CB-CD2 4.44Å; V190-L417 HydrophobicContact CB-CD1 3.7Å; V190-L417 HydrophobicContact CG1-CD1 3.5Å; V191-L417 HydrophobicContact CG2-CD1 4.08Å; I413-L417 HydrophobicContact CG2-CD1 3.75Å; I413-L417 HydrophobicContact CG2-CG 4.22Å; I413-L417 WeakPolarHBondContact O-CG 3.4Å; I413-L417 PolarHBondContact O-N 2.64Å; V414-L417 PolarHBondContact O-N 3.09Å; V415-L417 PolarHBondContact O-N 2.94Å; L417-G419 PolarHBondContact O-N 3.46Å; L417-G419 VanDerWaalsContact O-N 3.12Å; L417-M420 HydrophobicContact CD2-SD 3.68Å; L417-M420 PolarHBondContact O-N 2.9Å; L417-L421 PolarHBondContact O-N 2.7Å; L417-L421 VanDerWaalsContact O-N 3.11Å
418	K	86.1	Confident	88.7	Confident	82 Å²	82	45.2 Å²	45.2	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-47.9	-43.4	178.1	175.9	177.1	176.3	172.5	0	112.7	E246 V415 G416 M420 L421 I422	E246-K418 IonicContact OE1-NZ 3.76Å; E246-K418 PolarHBondContact OE1-NZ 3.47Å; V415-K418 VanDerWaalsContact O-CB 3.25Å; V415-K418 WeakPolarHBondContact O-CB 3.45Å; V415-K418 PolarHBondContact O-N 2.81Å; G416-K418 VanDerWaalsContact C-N 3.35Å; K418-M420 VanDerWaalsContact C-N 3.32Å; K418-M420 PolarHBondContact O-N 3.05Å; K418-L421 PolarHBondContact O-N 3.32Å; K418-I422 HydrophobicContact CD-CD1 4.29Å; K418-I422 HydrophobicContact CG-CD1 3.65Å; K418-I422 HydrophobicContact CG-CG1 4.31Å; K418-I422 VanDerWaalsContact O-CG1 3.26Å; K418-I422 WeakPolarHBondContact O-CG1 3.13Å; K418-I422 PolarHBondContact O-N 3.25Å
419	G	81.8	Confident	88.7	Confident	43 Å²	43	50.3 Å²	50.3	44%	0.443	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-36	-179.4	0	0	0	0	0	113.8	L417	L417-G419 PolarHBondContact O-N 3.46Å; L417-G419 VanDerWaalsContact O-N 3.12Å
420	M	86.2	Confident	88.8	Confident	15 Å²	15	50.9 Å²	50.9	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-76.5	-35.1	177.8	-64.1	171.8	70.4	0	0	111.3	T183 T184 A187 M366 L417 K418 Q423	T183-M420 HydrophobicContact CG2-CE 4.17Å; T183-M420 WeakPolarHBondContact O-CE 3.3Å; T184-M420 PolarHBondContact OG1-O 3.48Å; A187-M420 HydrophobicContact CB-CB 3.7Å; A187-M420 HydrophobicContact CB-CE 4.36Å; M366-M420 HydrophobicContact CE-CG 4.45Å; M366-M420 HydrophobicContact SD-CG 3.78Å; L417-M420 HydrophobicContact CD2-SD 3.68Å; L417-M420 PolarHBondContact O-N 2.9Å; K418-M420 VanDerWaalsContact C-N 3.32Å; K418-M420 PolarHBondContact O-N 3.05Å; M420-Q423 WeakPolarHBondContact O-CB 3.44Å; M420-Q423 PolarHBondContact O-N 3.21Å; M420-Q423 PolarHBondContact O-OE1 3.38Å
421	L	89.3	Confident	88.9	Confident	59 Å²	59	56.5 Å²	56.5	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-71.7	-31.2	177.2	-65.6	171.7	0	0	0	113	A187 V191 L417 K418 Q423 F424	A187-L421 HydrophobicContact CB-CD2 3.79Å; A187-L421 HydrophobicContact CB-CG 4.08Å; V191-L421 HydrophobicContact CG2-CD1 4.2Å; L417-L421 PolarHBondContact O-N 2.7Å; L417-L421 VanDerWaalsContact O-N 3.11Å; K418-L421 PolarHBondContact O-N 3.32Å; L421-Q423 PolarHBondContact O-N 3.08Å; L421-F424 WeakPolarHBondContact O-CB 2.82Å; L421-F424 PolarHBondContact O-N 3.06Å
422	I	88.3	Confident	88.9	Confident	77 Å²	77	62.1 Å²	62.1	40%	0.395	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.3	-21.6	177.8	-74.9	167.7	0	0	0	112.5	K418 F424 R425	K418-I422 HydrophobicContact CD-CD1 4.29Å; K418-I422 HydrophobicContact CG-CD1 3.65Å; K418-I422 HydrophobicContact CG-CG1 4.31Å; K418-I422 VanDerWaalsContact O-CG1 3.26Å; K418-I422 WeakPolarHBondContact O-CG1 3.13Å; K418-I422 PolarHBondContact O-N 3.25Å; I422-F424 PolarHBondContact O-N 3.02Å; I422-F424 VanDerWaalsContact O-N 3.07Å; I422-R425 VanDerWaalsContact O-CB 3.26Å; I422-R425 WeakPolarHBondContact O-CB 3.28Å; I422-R425 PolarHBondContact O-N 2.91Å
423	Q	88	Confident	89	Confident	34 Å²	34	67.6 Å²	67.6	16%	0.159	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-59.6	-18.2	176.1	-65.9	178.8	-34.8	0	0	112.9	T183 T184 M420 L421 R425 D426	T183-Q423 PolarHBondContact OG1-OE1 3.32Å; T184-Q423 WeakPolarHBondContact OG1-CB 3.3Å; M420-Q423 WeakPolarHBondContact O-CB 3.44Å; M420-Q423 PolarHBondContact O-N 3.21Å; M420-Q423 PolarHBondContact O-OE1 3.38Å; L421-Q423 PolarHBondContact O-N 3.08Å; Q423-R425 PolarHBondContact O-N 3.25Å; Q423-R425 VanDerWaalsContact O-N 3.08Å; Q423-D426 VanDerWaalsContact O-CB 3.26Å; Q423-D426 WeakPolarHBondContact O-CB 3.46Å; Q423-D426 PolarHBondContact O-N 3.12Å
424	F	89	Confident	89.1	Confident	103 Å²	103	69.3 Å²	69.3	45%	0.452	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.1	169.2	-154.6	-84.1	0	0	0	112.7	T184 L421 I422 D426 L427 W441 Y445	T184-F424 HydrophobicContact CG2-CB 4.43Å; T184-F424 HydrophobicContact CG2-CD2 4.22Å; L421-F424 WeakPolarHBondContact O-CB 2.82Å; L421-F424 PolarHBondContact O-N 3.06Å; I422-F424 PolarHBondContact O-N 3.02Å; I422-F424 VanDerWaalsContact O-N 3.07Å; F424-D426 VanDerWaalsContact C-N 3.27Å; F424-D426 PolarHBondContact O-N 3.08Å; F424-L427 HydrophobicContact CE1-CD2 4.39Å; F424-L427 VanDerWaalsContact O-CB 3.24Å; F424-L427 WeakPolarHBondContact O-CB 3.39Å; F424-L427 PolarHBondContact O-N 2.94Å; F424-W441 AromaticContact CD2-CH2 3.51Å; F424-W441 HydrophobicContact CD2-CH2 3.51Å; F424-W441 HydrophobicContact CD2-CZ2 4.43Å; F424-W441 HydrophobicContact CD2-CZ3 4.28Å; F424-W441 AromaticContact CE2-CH2 3.73Å; F424-W441 HydrophobicContact CE2-CH2 3.73Å; F424-W441 HydrophobicContact CE2-CZ3 4.05Å; F424-W441 HydrophobicContact CG-CH2 4.14Å; F424-Y445 HydrophobicContact CE2-CE1 4.2Å
425	R	89.6	Confident	89.1	Confident	199 Å²	199	74.7 Å²	74.7	75%	0.751	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-70.9	-21.2	176.4	-165.9	169.7	65.6	162	1	113.2	I422 Q423 L427 K428	I422-R425 VanDerWaalsContact O-CB 3.26Å; I422-R425 WeakPolarHBondContact O-CB 3.28Å; I422-R425 PolarHBondContact O-N 2.91Å; Q423-R425 PolarHBondContact O-N 3.25Å; Q423-R425 VanDerWaalsContact O-N 3.08Å; R425-L427 PolarHBondContact O-N 3.47Å; R425-K428 PolarHBondContact O-N 3.22Å
426	D	85.3	Confident	89.2	Confident	54 Å²	54	77 Å²	77	29%	0.289	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-67.3	-16.1	176.4	-62.4	-31.8	0	0	0	111.9	Q423 F424 K428 K429 Y430	Q423-D426 VanDerWaalsContact O-CB 3.26Å; Q423-D426 WeakPolarHBondContact O-CB 3.46Å; Q423-D426 PolarHBondContact O-N 3.12Å; F424-D426 VanDerWaalsContact C-N 3.27Å; F424-D426 PolarHBondContact O-N 3.08Å; D426-K428 PolarHBondContact O-N 3.35Å; D426-K429 WeakPolarHBondContact O-CA 3.41Å; D426-K429 VanDerWaalsContact O-CB 3.26Å; D426-K429 WeakPolarHBondContact O-CB 3.38Å; D426-K429 PolarHBondContact O-N 3.04Å; D426-Y430 HydrophobicContact CB-CD2 4.47Å; D426-Y430 HydrophobicContact CB-CE2 3.84Å; D426-Y430 WeakPolarHBondContact O-CD2 3.47Å; D426-Y430 PolarHBondContact O-N 3.23Å
427	L	90.6	Very high	89.6	Confident	28 Å²	28	78 Å²	78	15%	0.147	38%	0.375	C	S	.	.	H	α-helix	trans	-56.7	-37.4	177	-167.6	63.2	0	0	0	112.7	F424 R425 K429 Y430 W431 W438 W441 I442	F424-L427 HydrophobicContact CE1-CD2 4.39Å; F424-L427 VanDerWaalsContact O-CB 3.24Å; F424-L427 WeakPolarHBondContact O-CB 3.39Å; F424-L427 PolarHBondContact O-N 2.94Å; R425-L427 PolarHBondContact O-N 3.47Å; L427-K429 VanDerWaalsContact C-N 3.32Å; L427-K429 PolarHBondContact O-N 3.24Å; L427-Y430 PolarHBondContact O-N 3.35Å; L427-W431 PolarHBondContact O-N 3.32Å; L427-W438 HydrophobicContact CD1-CD2 4.47Å; L427-W438 HydrophobicContact CD1-CG 4.01Å; L427-W438 VanDerWaalsContact CD1-NE1 3.31Å; L427-W438 VanDerWaalsContact CG-NE1 3.32Å; L427-W438 VanDerWaalsContact O-CD1 3.32Å; L427-W441 HydrophobicContact CD1-CD2 3.99Å; L427-W441 HydrophobicContact CD1-CE3 3.55Å; L427-W441 HydrophobicContact CD1-CG 4.4Å; L427-W441 HydrophobicContact CD1-CZ3 4.12Å; L427-W441 HydrophobicContact CD2-CZ3 4.38Å; L427-I442 HydrophobicContact CD1-CD1 4.1Å; L427-I442 HydrophobicContact CD1-CG1 3.81Å; L427-I442 HydrophobicContact CD2-CD1 4.19Å; L427-I442 HydrophobicContact CD2-CG1 4.37Å
428	K	90.9	Very high	90	Very high	160 Å²	160	81.1 Å²	81.1	70%	0.696	39%	0.386	S	S	*	.	H	α-helix	trans	-65.6	-36.5	175.4	-174.4	175.9	-179.5	178	0	111.9	R425 D426 N432	R425-K428 PolarHBondContact O-N 3.22Å; D426-K428 PolarHBondContact O-N 3.35Å; K428-N432 PolarHBondContact O-N 3.03Å
429	K	92.1	Very high	90.4	Very high	107 Å²	107	78.5 Å²	78.5	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-64.5	-47.4	176.3	176.1	-168.2	171.4	-165.1	0	109.9	E176 D426 L427 N432 V433	E176-K429 IonicContact OE1-NZ 3.41Å; D426-K429 WeakPolarHBondContact O-CA 3.41Å; D426-K429 VanDerWaalsContact O-CB 3.26Å; D426-K429 WeakPolarHBondContact O-CB 3.38Å; D426-K429 PolarHBondContact O-N 3.04Å; L427-K429 VanDerWaalsContact C-N 3.32Å; L427-K429 PolarHBondContact O-N 3.24Å; K429-N432 PolarHBondContact O-N 3.38Å; K429-V433 WeakPolarHBondContact O-CG2 3.42Å; K429-V433 PolarHBondContact O-N 3.4Å
430	Y	92.6	Very high	91	Very high	15 Å²	15	76.6 Å²	76.6	6%	0.059	36%	0.362	C	S	.	.	H	α-helix	trans	-63.9	-43.3	179.9	-58.7	-47.1	0	0	0	112.3	P177 D426 L427 N432 V433 D434 W441	P177-Y430 HydrophobicContact CG-CD1 4.44Å; P177-Y430 HydrophobicContact CG-CE1 4.1Å; D426-Y430 HydrophobicContact CB-CD2 4.47Å; D426-Y430 HydrophobicContact CB-CE2 3.84Å; D426-Y430 WeakPolarHBondContact O-CD2 3.47Å; D426-Y430 PolarHBondContact O-N 3.23Å; L427-Y430 PolarHBondContact O-N 3.35Å; Y430-N432 VanDerWaalsContact C-N 3.25Å; Y430-N432 PolarHBondContact O-N 3.01Å; Y430-V433 PolarHBondContact O-N 3.13Å; Y430-V433 VanDerWaalsContact O-N 3.07Å; Y430-D434 CarbonylContact O-C 3.45Å; Y430-D434 PolarHBondContact O-N 2.84Å; Y430-W441 HydrophobicContact CD2-CB 4.44Å; Y430-W441 AromaticContact CD2-CD1 3.98Å; Y430-W441 HydrophobicContact CD2-CG 4.25Å; Y430-W441 AromaticContact CE2-CD1 3.55Å; Y430-W441 HydrophobicContact CE2-CG 4.25Å
431	W	94.6	Very high	91.4	Very high	117 Å²	117	76 Å²	76	44%	0.443	36%	0.359	S	S	.	.	H	α-helix	trans	-56.6	-39	177.7	-176.5	-100.1	0	0	0	113.3	L427 W438	L427-W431 PolarHBondContact O-N 3.32Å; W431-W438 HydrophobicContact CB-CG 4.29Å; W431-W438 HydrophobicContact CE3-CB 4.31Å; W431-W438 AromaticContact CE3-CD1 3.82Å; W431-W438 AromaticContact CE3-CD2 3.42Å; W431-W438 HydrophobicContact CE3-CD2 3.42Å; W431-W438 VanDerWaalsContact CE3-CD2 3.42Å; W431-W438 AromaticContact CE3-CE2 3.47Å; W431-W438 VanDerWaalsContact CE3-CE2 3.47Å; W431-W438 AromaticContact CE3-CE3 3.88Å; W431-W438 HydrophobicContact CE3-CE3 3.88Å; W431-W438 AromaticContact CE3-CG 3.63Å; W431-W438 HydrophobicContact CE3-CG 3.63Å; W431-W438 HydrophobicContact CE3-CH2 4.4Å; W431-W438 AromaticContact CE3-CZ2 3.97Å; W431-W438 HydrophobicContact CE3-CZ2 3.97Å; W431-W438 HydrophobicContact CE3-CZ3 4.36Å; W431-W438 AromaticContact CE3-NE1 3.71Å; W431-W438 AromaticContact CZ3-CD2 3.76Å; W431-W438 HydrophobicContact CZ3-CD2 3.76Å; W431-W438 AromaticContact CZ3-CE2 3.86Å; W431-W438 AromaticContact CZ3-CE3 3.72Å; W431-W438 HydrophobicContact CZ3-CE3 3.72Å; W431-W438 HydrophobicContact CZ3-CG 4.39Å; W431-W438 AromaticContact CZ3-CH2 3.94Å; W431-W438 HydrophobicContact CZ3-CH2 3.94Å; W431-W438 AromaticContact CZ3-CZ2 3.95Å; W431-W438 HydrophobicContact CZ3-CZ2 3.95Å; W431-W438 AromaticContact CZ3-CZ3 3.83Å; W431-W438 HydrophobicContact CZ3-CZ3 3.83Å
432	N	94.3	Very high	91.7	Very high	118 Å²	118	75.2 Å²	75.2	63%	0.631	36%	0.355	S	S	*	.	H	α-helix	trans	-78.2	-18.8	-178.9	-70.6	-6.4	0	0	0	113.4	K428 K429 Y430	K428-N432 PolarHBondContact O-N 3.03Å; K429-N432 PolarHBondContact O-N 3.38Å; Y430-N432 VanDerWaalsContact C-N 3.25Å; Y430-N432 PolarHBondContact O-N 3.01Å
433	V	91.9	Very high	92	Very high	116 Å²	116	73.2 Å²	73.2	70%	0.703	35%	0.348	S	S	*	.	H	α-helix	trans	-99	-61.2	-177.8	175.9	0	0	0	0	111.2	K429 Y430	K429-V433 WeakPolarHBondContact O-CG2 3.42Å; K429-V433 PolarHBondContact O-N 3.4Å; Y430-V433 PolarHBondContact O-N 3.13Å; Y430-V433 VanDerWaalsContact O-N 3.07Å
434	D	90.1	Very high	92.4	Very high	39 Å²	39	71.6 Å²	71.6	21%	0.209	34%	0.34	C	S	.	.			trans	-144.4	121.3	177.3	-165.4	-15.3	0	0	0	110.3	Y430 I436 D437 W438 R471	Y430-D434 CarbonylContact O-C 3.45Å; Y430-D434 PolarHBondContact O-N 2.84Å; D434-I436 PolarHBondContact O-N 2.96Å; D434-I436 WeakPolarHBondContact OD1-CB 3.45Å; D434-I436 PolarHBondContact OD1-N 3.32Å; D434-D437 HydrophobicContact CB-CB 4.36Å; D434-D437 PolarHBondContact O-N 3.36Å; D434-W438 PolarHBondContact O-N 2.87Å; D434-R471 IonicContact OD2-CZ 3.77Å; D434-R471 IonicContact OD2-NH1 2.8Å; D434-R471 PolarHBondContact OD2-NH1 3.06Å
435	K	92.2	Very high	92.7	Very high	143 Å²	143	68.9 Å²	68.9	62%	0.622	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-25.1	178	-63.8	-177.2	-178.2	-179.3	0	112.2	G439	K435-G439 PolarHBondContact O-N 2.87Å
436	I	90.9	Very high	92.9	Very high	63 Å²	63	63.6 Å²	63.6	32%	0.323	31%	0.313	S	S	.	.	H	α-helix	trans	-71.2	-47.5	178.3	-62.9	-178.3	0	0	0	110.5	D434 W438 G439 I440 I467	D434-I436 PolarHBondContact O-N 2.96Å; D434-I436 WeakPolarHBondContact OD1-CB 3.45Å; D434-I436 PolarHBondContact OD1-N 3.32Å; I436-W438 VanDerWaalsContact C-N 3.26Å; I436-W438 PolarHBondContact O-N 3.02Å; I436-G439 CarbonylContact O-C 3.49Å; I436-G439 WeakPolarHBondContact O-CA 3.45Å; I436-G439 PolarHBondContact O-N 3.16Å; I436-I440 HydrophobicContact CG2-CD1 4.25Å; I436-I440 WeakPolarHBondContact O-CG1 3.49Å; I436-I440 PolarHBondContact O-N 2.69Å; I436-I467 HydrophobicContact CG2-CD1 4.09Å; I436-I467 HydrophobicContact CG2-CG2 3.34Å
437	D	92.1	Very high	93.3	Very high	53 Å²	53	64.6 Å²	64.6	28%	0.283	32%	0.315	S	S	.	.	H	α-helix	trans	-61.5	-37.8	177.1	-75	-12.2	0	0	0	111.4	P177 D434 G439 I440 W441	P177-D437 HydrophobicContact CG-CB 4.02Å; D434-D437 HydrophobicContact CB-CB 4.36Å; D434-D437 PolarHBondContact O-N 3.36Å; D437-G439 VanDerWaalsContact C-N 3.35Å; D437-I440 PolarHBondContact O-N 2.87Å; D437-W441 WeakPolarHBondContact O-CB 3.48Å; D437-W441 PolarHBondContact O-N 3.17Å
438	W	94.6	Very high	93.4	Very high	78 Å²	78	63.2 Å²	63.2	30%	0.295	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-44.4	170.5	-179.2	95	0	0	0	112.4	L427 W431 D434 I436 W441 I442	L427-W438 HydrophobicContact CD1-CD2 4.47Å; L427-W438 HydrophobicContact CD1-CG 4.01Å; L427-W438 VanDerWaalsContact CD1-NE1 3.31Å; L427-W438 VanDerWaalsContact CG-NE1 3.32Å; L427-W438 VanDerWaalsContact O-CD1 3.32Å; W431-W438 HydrophobicContact CB-CG 4.29Å; W431-W438 HydrophobicContact CE3-CB 4.31Å; W431-W438 AromaticContact CE3-CD1 3.82Å; W431-W438 AromaticContact CE3-CD2 3.42Å; W431-W438 HydrophobicContact CE3-CD2 3.42Å; W431-W438 VanDerWaalsContact CE3-CD2 3.42Å; W431-W438 AromaticContact CE3-CE2 3.47Å; W431-W438 VanDerWaalsContact CE3-CE2 3.47Å; W431-W438 AromaticContact CE3-CE3 3.88Å; W431-W438 HydrophobicContact CE3-CE3 3.88Å; W431-W438 AromaticContact CE3-CG 3.63Å; W431-W438 HydrophobicContact CE3-CG 3.63Å; W431-W438 HydrophobicContact CE3-CH2 4.4Å; W431-W438 AromaticContact CE3-CZ2 3.97Å; W431-W438 HydrophobicContact CE3-CZ2 3.97Å; W431-W438 HydrophobicContact CE3-CZ3 4.36Å; W431-W438 AromaticContact CE3-NE1 3.71Å; W431-W438 AromaticContact CZ3-CD2 3.76Å; W431-W438 HydrophobicContact CZ3-CD2 3.76Å; W431-W438 AromaticContact CZ3-CE2 3.86Å; W431-W438 AromaticContact CZ3-CE3 3.72Å; W431-W438 HydrophobicContact CZ3-CE3 3.72Å; W431-W438 HydrophobicContact CZ3-CG 4.39Å; W431-W438 AromaticContact CZ3-CH2 3.94Å; W431-W438 HydrophobicContact CZ3-CH2 3.94Å; W431-W438 AromaticContact CZ3-CZ2 3.95Å; W431-W438 HydrophobicContact CZ3-CZ2 3.95Å; W431-W438 AromaticContact CZ3-CZ3 3.83Å; W431-W438 HydrophobicContact CZ3-CZ3 3.83Å; D434-W438 PolarHBondContact O-N 2.87Å; I436-W438 VanDerWaalsContact C-N 3.26Å; I436-W438 PolarHBondContact O-N 3.02Å; W438-W441 PolarHBondContact O-N 2.9Å; W438-I442 HydrophobicContact CD2-CD1 3.71Å; W438-I442 HydrophobicContact CD2-CG1 4.45Å; W438-I442 HydrophobicContact CE3-CD1 3.87Å; W438-I442 HydrophobicContact CH2-CD1 3.26Å; W438-I442 HydrophobicContact CZ2-CD1 3.06Å; W438-I442 HydrophobicContact CZ2-CG1 4.44Å; W438-I442 HydrophobicContact CZ3-CD1 3.65Å; W438-I442 PolarHBondContact O-N 3.27Å
439	G	94.1	Very high	93.6	Very high	28 Å²	28	56.3 Å²	56.3	29%	0.289	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.8	0	0	0	0	0	113.1	K435 I436 D437 W441 S443	K435-G439 PolarHBondContact O-N 2.87Å; I436-G439 CarbonylContact O-C 3.49Å; I436-G439 WeakPolarHBondContact O-CA 3.45Å; I436-G439 PolarHBondContact O-N 3.16Å; D437-G439 VanDerWaalsContact C-N 3.35Å; G439-W441 VanDerWaalsContact C-N 3.34Å; G439-S443 VanDerWaalsContact O-CB 3.3Å; G439-S443 WeakPolarHBondContact O-CB 3.46Å; G439-S443 PolarHBondContact O-N 3.14Å; G439-S443 PolarHBondContact O-OG 3.12Å
440	I	93.8	Very high	93.6	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-46	173.9	-67.2	169.2	0	0	0	110	V178 I436 D437 S443 T444 I467	V178-I440 HydrophobicContact CG2-CG2 3.59Å; I436-I440 HydrophobicContact CG2-CD1 4.25Å; I436-I440 WeakPolarHBondContact O-CG1 3.49Å; I436-I440 PolarHBondContact O-N 2.69Å; D437-I440 PolarHBondContact O-N 2.87Å; I440-S443 PolarHBondContact O-OG 3.19Å; I440-S443 VanDerWaalsContact O-OG 3.1Å; I440-T444 WeakPolarHBondContact O-CB 3.41Å; I440-T444 PolarHBondContact O-N 3.25Å; I440-T444 PolarHBondContact O-OG1 2.67Å; I440-I467 HydrophobicContact CD1-CD1 3.66Å; I440-I467 HydrophobicContact CD1-CG2 4.45Å; I440-I467 HydrophobicContact CG1-CD1 3.36Å
441	W	95.3	Very high	93.5	Very high	2 Å²	2	56 Å²	56	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-50.9	-179.8	-168.6	100.3	0	0	0	111.5	P177 S180 A181 T184 F424 L427 Y430 D437 W438 G439 T444 Y445	P177-W441 HydrophobicContact CB-CB 4.34Å; S180-W441 PolarHBondContact OG-NE1 2.8Å; A181-W441 HydrophobicContact CB-CB 4.45Å; A181-W441 HydrophobicContact CB-CD2 4Å; A181-W441 HydrophobicContact CB-CG 3.84Å; A181-W441 VanDerWaalsContact CB-O 3.26Å; A181-W441 WeakPolarHBondContact CB-O 2.99Å; T184-W441 HydrophobicContact CG2-CH2 4.47Å; T184-W441 HydrophobicContact CG2-CZ2 4.31Å; F424-W441 AromaticContact CD2-CH2 3.51Å; F424-W441 HydrophobicContact CD2-CH2 3.51Å; F424-W441 HydrophobicContact CD2-CZ2 4.43Å; F424-W441 HydrophobicContact CD2-CZ3 4.28Å; F424-W441 AromaticContact CE2-CH2 3.73Å; F424-W441 HydrophobicContact CE2-CH2 3.73Å; F424-W441 HydrophobicContact CE2-CZ3 4.05Å; F424-W441 HydrophobicContact CG-CH2 4.14Å; L427-W441 HydrophobicContact CD1-CD2 3.99Å; L427-W441 HydrophobicContact CD1-CE3 3.55Å; L427-W441 HydrophobicContact CD1-CG 4.4Å; L427-W441 HydrophobicContact CD1-CZ3 4.12Å; L427-W441 HydrophobicContact CD2-CZ3 4.38Å; Y430-W441 HydrophobicContact CD2-CB 4.44Å; Y430-W441 AromaticContact CD2-CD1 3.98Å; Y430-W441 HydrophobicContact CD2-CG 4.25Å; Y430-W441 AromaticContact CE2-CD1 3.55Å; Y430-W441 HydrophobicContact CE2-CG 4.25Å; D437-W441 WeakPolarHBondContact O-CB 3.48Å; D437-W441 PolarHBondContact O-N 3.17Å; W438-W441 PolarHBondContact O-N 2.9Å; G439-W441 VanDerWaalsContact C-N 3.34Å; W441-T444 PolarHBondContact O-N 2.82Å; W441-Y445 HydrophobicContact CH2-CD2 4.17Å; W441-Y445 HydrophobicContact CH2-CG 4.19Å; W441-Y445 HydrophobicContact CZ3-CG 4.13Å; W441-Y445 WeakPolarHBondContact O-CB 3.3Å; W441-Y445 PolarHBondContact O-N 3.42Å
442	I	95.8	Very high	93.1	Very high	43 Å²	43	51.9 Å²	51.9	22%	0.221	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-47.5	-178.1	-72.3	-178.2	0	0	0	111.8	L427 W438 T444 Y445 I446	L427-I442 HydrophobicContact CD1-CD1 4.1Å; L427-I442 HydrophobicContact CD1-CG1 3.81Å; L427-I442 HydrophobicContact CD2-CD1 4.19Å; L427-I442 HydrophobicContact CD2-CG1 4.37Å; W438-I442 HydrophobicContact CD2-CD1 3.71Å; W438-I442 HydrophobicContact CD2-CG1 4.45Å; W438-I442 HydrophobicContact CE3-CD1 3.87Å; W438-I442 HydrophobicContact CH2-CD1 3.26Å; W438-I442 HydrophobicContact CZ2-CD1 3.06Å; W438-I442 HydrophobicContact CZ2-CG1 4.44Å; W438-I442 HydrophobicContact CZ3-CD1 3.65Å; W438-I442 PolarHBondContact O-N 3.27Å; I442-T444 VanDerWaalsContact C-N 3.32Å; I442-T444 PolarHBondContact O-N 3.42Å; I442-Y445 PolarHBondContact O-N 2.73Å; I442-I446 HydrophobicContact CG2-CD1 3.61Å; I442-I446 HydrophobicContact CG2-CG1 4.29Å; I442-I446 WeakPolarHBondContact O-CG1 3.32Å; I442-I446 PolarHBondContact O-N 3.27Å
443	S	95.2	Very high	92.6	Very high	35 Å²	35	46.4 Å²	46.4	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-41.9	-179.3	58.5	0	0	0	0	111.4	G439 I440 I446 F447	G439-S443 VanDerWaalsContact O-CB 3.3Å; G439-S443 WeakPolarHBondContact O-CB 3.46Å; G439-S443 PolarHBondContact O-N 3.14Å; G439-S443 PolarHBondContact O-OG 3.12Å; I440-S443 PolarHBondContact O-OG 3.19Å; I440-S443 VanDerWaalsContact O-OG 3.1Å; S443-I446 PolarHBondContact O-N 2.71Å; S443-F447 WeakPolarHBondContact O-CB 3.42Å; S443-F447 PolarHBondContact O-N 3.45Å
444	T	95.1	Very high	92.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-43.4	175.1	-57.2	0	0	0	0	111.9	V178 A181 I440 W441 I442 T448 G460	V178-T444 HydrophobicContact CG1-CG2 4.49Å; A181-T444 HydrophobicContact CB-CG2 3.85Å; I440-T444 WeakPolarHBondContact O-CB 3.41Å; I440-T444 PolarHBondContact O-N 3.25Å; I440-T444 PolarHBondContact O-OG1 2.67Å; W441-T444 PolarHBondContact O-N 2.82Å; I442-T444 VanDerWaalsContact C-N 3.32Å; I442-T444 PolarHBondContact O-N 3.42Å; T444-T448 WeakPolarHBondContact O-CB 3.47Å; T444-T448 PolarHBondContact O-N 3.01Å; T444-T448 PolarHBondContact O-OG1 3.36Å; T444-G460 VanDerWaalsContact OG1-CA 3.3Å; T444-G460 WeakPolarHBondContact OG1-CA 3.38Å
445	Y	95.2	Very high	92.2	Very high	45 Å²	45	43.4 Å²	43.4	18%	0.176	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-47.1	177.6	179.5	-97.5	0	0	0	111.6	T184 T188 F424 W441 I442 F447 T448 I449	T184-Y445 HydrophobicContact CG2-CD2 4.27Å; T184-Y445 HydrophobicContact CG2-CE2 3.84Å; T188-Y445 PolarHBondContact OG1-OH 3.43Å; F424-Y445 HydrophobicContact CE2-CE1 4.2Å; W441-Y445 HydrophobicContact CH2-CD2 4.17Å; W441-Y445 HydrophobicContact CH2-CG 4.19Å; W441-Y445 HydrophobicContact CZ3-CG 4.13Å; W441-Y445 WeakPolarHBondContact O-CB 3.3Å; W441-Y445 PolarHBondContact O-N 3.42Å; I442-Y445 PolarHBondContact O-N 2.73Å; Y445-F447 PolarHBondContact O-N 3.08Å; Y445-T448 WeakPolarHBondContact O-CB 3.27Å; Y445-T448 PolarHBondContact O-N 3.3Å; Y445-I449 HydrophobicContact CD1-CG1 4.28Å; Y445-I449 HydrophobicContact CE1-CG1 3.83Å; Y445-I449 HydrophobicContact CE2-CD1 4.29Å; Y445-I449 HydrophobicContact CE2-CG1 4.22Å; Y445-I449 WeakPolarHBondContact O-CG1 3.43Å; Y445-I449 PolarHBondContact O-N 2.96Å
446	I	94.8	Very high	92.1	Very high	89 Å²	89	36.6 Å²	36.6	46%	0.456	20%	0.195	S	C	.	.	H	α-helix	trans	-60.8	-47.8	177.8	-68.4	170.8	0	0	0	110.6	I442 S443 T448 I449 C450	I442-I446 HydrophobicContact CG2-CD1 3.61Å; I442-I446 HydrophobicContact CG2-CG1 4.29Å; I442-I446 WeakPolarHBondContact O-CG1 3.32Å; I442-I446 PolarHBondContact O-N 3.27Å; S443-I446 PolarHBondContact O-N 2.71Å; I446-T448 VanDerWaalsContact C-N 3.27Å; I446-T448 PolarHBondContact O-N 3.46Å; I446-I449 PolarHBondContact O-N 3.2Å; I446-C450 WeakPolarHBondContact O-CB 3.46Å; I446-C450 PolarHBondContact O-N 3.06Å; I446-C450 PolarHBondContact O-SG 3.06Å; I446-C450 VanDerWaalsContact O-SG 3.35Å
447	F	94	Very high	92.1	Very high	74 Å²	74	33.6 Å²	33.6	33%	0.325	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-38.6	176.6	-108.2	-94.3	0	0	0	112.3	S443 Y445 F451 F459	S443-F447 WeakPolarHBondContact O-CB 3.42Å; S443-F447 PolarHBondContact O-N 3.45Å; Y445-F447 PolarHBondContact O-N 3.08Å; F447-F451 AromaticContact CD1-CD2 3.72Å; F447-F451 HydrophobicContact CD1-CD2 3.72Å; F447-F451 AromaticContact CD1-CE2 3.84Å; F447-F451 HydrophobicContact CD1-CE2 3.84Å; F447-F451 HydrophobicContact CE1-CD2 4.03Å; F447-F451 AromaticContact CE1-CE2 3.67Å; F447-F451 HydrophobicContact CE1-CE2 3.67Å; F447-F451 HydrophobicContact CZ-CE2 4.38Å; F447-F451 PolarHBondContact O-N 2.92Å; F447-F459 HydrophobicContact CB-CB 4.38Å; F447-F459 HydrophobicContact CB-CD1 3.89Å; F447-F459 HydrophobicContact CB-CE1 4.39Å; F447-F459 HydrophobicContact CB-CG 4.08Å; F447-F459 HydrophobicContact CD1-CB 4.15Å; F447-F459 HydrophobicContact CD1-CD1 4.49Å; F447-F459 AromaticContact CD1-CD2 3.91Å; F447-F459 HydrophobicContact CD1-CD2 3.91Å; F447-F459 HydrophobicContact CD1-CE2 4.48Å; F447-F459 AromaticContact CD1-CG 3.91Å; F447-F459 HydrophobicContact CD1-CG 3.91Å; F447-F459 AromaticContact CD2-CD1 3.92Å; F447-F459 HydrophobicContact CD2-CD1 3.92Å; F447-F459 AromaticContact CD2-CD2 3.9Å; F447-F459 HydrophobicContact CD2-CD2 3.9Å; F447-F459 AromaticContact CD2-CE1 3.73Å; F447-F459 HydrophobicContact CD2-CE1 3.73Å; F447-F459 AromaticContact CD2-CE2 3.7Å; F447-F459 HydrophobicContact CD2-CE2 3.7Å; F447-F459 AromaticContact CD2-CG 4Å; F447-F459 HydrophobicContact CD2-CG 4Å; F447-F459 AromaticContact CD2-CZ 3.61Å; F447-F459 HydrophobicContact CD2-CZ 3.61Å; F447-F459 AromaticContact CE1-CD2 3.87Å; F447-F459 HydrophobicContact CE1-CD2 3.87Å; F447-F459 HydrophobicContact CE1-CE2 4.26Å; F447-F459 HydrophobicContact CE1-CG 4.35Å; F447-F459 AromaticContact CE2-CD2 3.86Å; F447-F459 HydrophobicContact CE2-CD2 3.86Å; F447-F459 HydrophobicContact CE2-CE1 4.29Å; F447-F459 AromaticContact CE2-CE2 3.45Å; F447-F459 HydrophobicContact CE2-CE2 3.45Å; F447-F459 VanDerWaalsContact CE2-CE2 3.45Å; F447-F459 HydrophobicContact CE2-CG 4.43Å; F447-F459 AromaticContact CE2-CZ 3.68Å; F447-F459 HydrophobicContact CE2-CZ 3.68Å; F447-F459 HydrophobicContact CG-CB 4.26Å; F447-F459 AromaticContact CG-CD1 3.84Å; F447-F459 HydrophobicContact CG-CD1 3.84Å; F447-F459 AromaticContact CG-CD2 3.92Å; F447-F459 HydrophobicContact CG-CD2 3.92Å; F447-F459 HydrophobicContact CG-CE1 4.15Å; F447-F459 HydrophobicContact CG-CE2 4.21Å; F447-F459 AromaticContact CG-CG 3.71Å; F447-F459 HydrophobicContact CG-CG 3.71Å; F447-F459 HydrophobicContact CG-CZ 4.32Å; F447-F459 AromaticContact CZ-CD2 3.85Å; F447-F459 HydrophobicContact CZ-CD2 3.85Å; F447-F459 AromaticContact CZ-CE2 3.76Å; F447-F459 HydrophobicContact CZ-CE2 3.76Å; F447-F459 HydrophobicContact CZ-CZ 4.44Å
448	T	92.8	Very high	92	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-48.5	175.7	-61.4	0	0	0	0	111.1	H189 T444 Y445 I446 F451 A452 A453 G456	H189-T448 PolarHBondContact NE2-O 3Å; T444-T448 WeakPolarHBondContact O-CB 3.47Å; T444-T448 PolarHBondContact O-N 3.01Å; T444-T448 PolarHBondContact O-OG1 3.36Å; Y445-T448 WeakPolarHBondContact O-CB 3.27Å; Y445-T448 PolarHBondContact O-N 3.3Å; I446-T448 VanDerWaalsContact C-N 3.27Å; I446-T448 PolarHBondContact O-N 3.46Å; T448-F451 CarbonylContact O-C 3.46Å; T448-A452 PolarHBondContact O-N 3.2Å; T448-A453 HydrophobicContact CG2-CB 4.1Å; T448-G456 WeakPolarHBondContact OG1-CA 3.25Å
449	I	93.6	Very high	91.9	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.072	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-44.6	-179.8	-65.3	-62.8	0	0	0	111.9	T188 F212 F213 Y445 I446 F451	T188-I449 HydrophobicContact CG2-CD1 3.76Å; F212-I449 HydrophobicContact CD1-CG2 3.86Å; F212-I449 HydrophobicContact CD2-CG2 4.39Å; F212-I449 HydrophobicContact CE1-CG2 4.09Å; F212-I449 HydrophobicContact CE2-CD1 4.39Å; F212-I449 HydrophobicContact CG-CG2 4.03Å; F212-I449 HydrophobicContact CZ-CG2 4.43Å; F213-I449 HydrophobicContact CE2-CG2 4.46Å; F213-I449 HydrophobicContact CZ-CG2 4.21Å; Y445-I449 HydrophobicContact CD1-CG1 4.28Å; Y445-I449 HydrophobicContact CE1-CG1 3.83Å; Y445-I449 HydrophobicContact CE2-CD1 4.29Å; Y445-I449 HydrophobicContact CE2-CG1 4.22Å; Y445-I449 WeakPolarHBondContact O-CG1 3.43Å; Y445-I449 PolarHBondContact O-N 2.96Å; I446-I449 PolarHBondContact O-N 3.2Å; I449-F451 VanDerWaalsContact C-N 3.32Å; I449-F451 PolarHBondContact O-N 3.38Å
450	C	92.8	Very high	91.8	Very high	30 Å²	30	32.8 Å²	32.8	20%	0.203	17%	0.172	C	C	.	.	H	α-helix	trans	-69	-29.8	-178	-69.6	0	0	0	0	113.1	L210 I446	L210-C450 WeakPolarHBondContact CA-O 3.31Å; L210-C450 HydrophobicContact CD2-CB 4Å; L210-C450 PolarHBondContact N-O 3.37Å; I446-C450 WeakPolarHBondContact O-CB 3.46Å; I446-C450 PolarHBondContact O-N 3.06Å; I446-C450 PolarHBondContact O-SG 3.06Å; I446-C450 VanDerWaalsContact O-SG 3.35Å
451	F	90.4	Very high	91.7	Very high	85 Å²	85	33.9 Å²	33.9	37%	0.373	18%	0.179	S	C	.	.	S	Bend	trans	-117.4	-107.7	179.2	-62.4	-85.5	0	0	0	109.7	P209 F447 T448 I449 V455	P209-F451 HydrophobicContact CB-CD1 3.87Å; P209-F451 HydrophobicContact CB-CE1 3.9Å; P209-F451 HydrophobicContact CG-CD1 4.21Å; P209-F451 HydrophobicContact CG-CE1 4.3Å; F447-F451 AromaticContact CD1-CD2 3.72Å; F447-F451 HydrophobicContact CD1-CD2 3.72Å; F447-F451 AromaticContact CD1-CE2 3.84Å; F447-F451 HydrophobicContact CD1-CE2 3.84Å; F447-F451 HydrophobicContact CE1-CD2 4.03Å; F447-F451 AromaticContact CE1-CE2 3.67Å; F447-F451 HydrophobicContact CE1-CE2 3.67Å; F447-F451 HydrophobicContact CZ-CE2 4.38Å; F447-F451 PolarHBondContact O-N 2.92Å; T448-F451 CarbonylContact O-C 3.46Å; I449-F451 VanDerWaalsContact C-N 3.32Å; I449-F451 PolarHBondContact O-N 3.38Å; F451-V455 HydrophobicContact CB-CB 4.14Å; F451-V455 HydrophobicContact CB-CG1 4.13Å; F451-V455 HydrophobicContact CG-CG1 4.41Å
452	A	86	Confident	91.6	Very high	31 Å²	31	37.8 Å²	37.8	26%	0.256	20%	0.203	S	C	.	.			trans	-146.3	162.3	179.9	0	0	0	0	0	109.3	T448 N454 V455 G456	T448-A452 PolarHBondContact O-N 3.2Å; A452-N454 VanDerWaalsContact C-N 3.34Å; A452-N454 WeakPolarHBondContact CB-OD1 3.34Å; A452-N454 PolarHBondContact O-N 3.02Å; A452-V455 PolarHBondContact O-N 2.9Å; A452-V455 VanDerWaalsContact O-N 3.16Å; A452-G456 PolarHBondContact O-N 3.42Å
453	A	83.4	Confident	91.5	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-32.8	-174.9	0	0	0	0	0	114.7	L106 A186 T448 G456 L457	L106-A453 HydrophobicContact CD1-CB 3.52Å; L106-A453 HydrophobicContact CD2-CB 3.87Å; L106-A453 HydrophobicContact CG-CB 4.07Å; A186-A453 HydrophobicContact CB-CB 4.12Å; T448-A453 HydrophobicContact CG2-CB 4.1Å; A453-G456 PolarHBondContact O-N 2.76Å; A453-L457 WeakPolarHBondContact O-CB 3.37Å; A453-L457 PolarHBondContact O-N 2.98Å
454	N	85.3	Confident	91.3	Very high	34 Å²	34	35.9 Å²	35.9	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-42.1	173.4	59.6	-31.2	0	0	0	111.9	I110 V318 A452 L458	I110-N454 HydrophobicContact CD1-CB 4.36Å; V318-N454 HydrophobicContact CG2-CB 3.93Å; A452-N454 VanDerWaalsContact C-N 3.34Å; A452-N454 WeakPolarHBondContact CB-OD1 3.34Å; A452-N454 PolarHBondContact O-N 3.02Å; N454-L458 PolarHBondContact O-N 3.45Å; N454-L458 VanDerWaalsContact O-N 3.15Å
455	V	89.3	Confident	91.1	Very high	57 Å²	57	38.8 Å²	38.8	35%	0.345	21%	0.208	S	C	.	.	H	α-helix	trans	-67.6	-42.2	176.1	-178	0	0	0	0	110.6	F451 A452 L457 L458 F459	F451-V455 HydrophobicContact CB-CB 4.14Å; F451-V455 HydrophobicContact CB-CG1 4.13Å; F451-V455 HydrophobicContact CG-CG1 4.41Å; A452-V455 PolarHBondContact O-N 2.9Å; A452-V455 VanDerWaalsContact O-N 3.16Å; V455-L457 PolarHBondContact O-N 3.49Å; V455-L458 PolarHBondContact O-N 3.26Å; V455-F459 WeakPolarHBondContact O-CB 3.46Å; V455-F459 PolarHBondContact O-N 3.19Å
456	G	90.6	Very high	90.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-45.5	175.6	0	0	0	0	0	112.9	T448 A452 A453 F459 G460	T448-G456 WeakPolarHBondContact OG1-CA 3.25Å; A452-G456 PolarHBondContact O-N 3.42Å; A453-G456 PolarHBondContact O-N 2.76Å; G456-F459 PolarHBondContact O-N 2.91Å; G456-G460 PolarHBondContact O-N 3.36Å
457	L	89.1	Confident	90.6	Very high	1 Å²	1	38 Å²	38	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-48.3	175	176.3	56	0	0	0	112.1	V174 V178 M182 L317 V318 V321 A453 V455 F459 G460 V461	V174-L457 HydrophobicContact CG1-CD1 4.42Å; V178-L457 HydrophobicContact CG1-CD1 3.85Å; M182-L457 HydrophobicContact CE-CD1 3.64Å; M182-L457 HydrophobicContact CE-CD2 4.16Å; M182-L457 HydrophobicContact CE-CG 4.33Å; M182-L457 HydrophobicContact CG-CB 4.26Å; M182-L457 HydrophobicContact SD-CB 3.76Å; M182-L457 HydrophobicContact SD-CD1 3.96Å; M182-L457 HydrophobicContact SD-CD2 3.71Å; M182-L457 HydrophobicContact SD-CG 4.01Å; L317-L457 HydrophobicContact CD2-CD2 3.83Å; L317-L457 HydrophobicContact CD2-CG 4.13Å; L317-L457 HydrophobicContact CG-CD2 3.65Å; L317-L457 HydrophobicContact CG-CG 4.43Å; V318-L457 HydrophobicContact CB-CD2 4.44Å; V318-L457 HydrophobicContact CG2-CD2 3.83Å; V321-L457 HydrophobicContact CB-CD2 4.25Å; V321-L457 HydrophobicContact CG1-CD1 4.49Å; V321-L457 HydrophobicContact CG2-CD2 4.05Å; A453-L457 WeakPolarHBondContact O-CB 3.37Å; A453-L457 PolarHBondContact O-N 2.98Å; V455-L457 PolarHBondContact O-N 3.49Å; L457-F459 VanDerWaalsContact C-N 3.32Å; L457-F459 PolarHBondContact O-N 3.35Å; L457-G460 PolarHBondContact O-N 3.23Å; L457-V461 HydrophobicContact CD1-CG2 4.09Å; L457-V461 WeakPolarHBondContact O-CG2 3.42Å; L457-V461 PolarHBondContact O-N 3.09Å
458	L	90.3	Very high	90.2	Very high	91 Å²	91	38.7 Å²	38.7	48%	0.476	23%	0.225	S	C	.	.	H	α-helix	trans	-58.9	-46.7	178.4	-178.1	65	0	0	0	110.9	N454 V455 G460 V461 V462	N454-L458 PolarHBondContact O-N 3.45Å; N454-L458 VanDerWaalsContact O-N 3.15Å; V455-L458 PolarHBondContact O-N 3.26Å; L458-G460 PolarHBondContact O-N 3.39Å; L458-V461 PolarHBondContact O-N 3.4Å; L458-V462 HydrophobicContact CD1-CG2 4.45Å; L458-V462 WeakPolarHBondContact O-CB 3.3Å; L458-V462 VanDerWaalsContact O-CG2 3.28Å; L458-V462 WeakPolarHBondContact O-CG2 3.36Å; L458-V462 PolarHBondContact O-N 2.96Å
459	F	93.2	Very high	89.9	Confident	51 Å²	51	42.7 Å²	42.7	22%	0.224	25%	0.245	C	C	.	.	H	α-helix	trans	-58.3	-47.4	175.7	175.5	-91.9	0	0	0	111.7	F447 V455 G456 L457 V461 V462 C463	F447-F459 HydrophobicContact CB-CB 4.38Å; F447-F459 HydrophobicContact CB-CD1 3.89Å; F447-F459 HydrophobicContact CB-CE1 4.39Å; F447-F459 HydrophobicContact CB-CG 4.08Å; F447-F459 HydrophobicContact CD1-CB 4.15Å; F447-F459 HydrophobicContact CD1-CD1 4.49Å; F447-F459 AromaticContact CD1-CD2 3.91Å; F447-F459 HydrophobicContact CD1-CD2 3.91Å; F447-F459 HydrophobicContact CD1-CE2 4.48Å; F447-F459 AromaticContact CD1-CG 3.91Å; F447-F459 HydrophobicContact CD1-CG 3.91Å; F447-F459 AromaticContact CD2-CD1 3.92Å; F447-F459 HydrophobicContact CD2-CD1 3.92Å; F447-F459 AromaticContact CD2-CD2 3.9Å; F447-F459 HydrophobicContact CD2-CD2 3.9Å; F447-F459 AromaticContact CD2-CE1 3.73Å; F447-F459 HydrophobicContact CD2-CE1 3.73Å; F447-F459 AromaticContact CD2-CE2 3.7Å; F447-F459 HydrophobicContact CD2-CE2 3.7Å; F447-F459 AromaticContact CD2-CG 4Å; F447-F459 HydrophobicContact CD2-CG 4Å; F447-F459 AromaticContact CD2-CZ 3.61Å; F447-F459 HydrophobicContact CD2-CZ 3.61Å; F447-F459 AromaticContact CE1-CD2 3.87Å; F447-F459 HydrophobicContact CE1-CD2 3.87Å; F447-F459 HydrophobicContact CE1-CE2 4.26Å; F447-F459 HydrophobicContact CE1-CG 4.35Å; F447-F459 AromaticContact CE2-CD2 3.86Å; F447-F459 HydrophobicContact CE2-CD2 3.86Å; F447-F459 HydrophobicContact CE2-CE1 4.29Å; F447-F459 AromaticContact CE2-CE2 3.45Å; F447-F459 HydrophobicContact CE2-CE2 3.45Å; F447-F459 VanDerWaalsContact CE2-CE2 3.45Å; F447-F459 HydrophobicContact CE2-CG 4.43Å; F447-F459 AromaticContact CE2-CZ 3.68Å; F447-F459 HydrophobicContact CE2-CZ 3.68Å; F447-F459 HydrophobicContact CG-CB 4.26Å; F447-F459 AromaticContact CG-CD1 3.84Å; F447-F459 HydrophobicContact CG-CD1 3.84Å; F447-F459 AromaticContact CG-CD2 3.92Å; F447-F459 HydrophobicContact CG-CD2 3.92Å; F447-F459 HydrophobicContact CG-CE1 4.15Å; F447-F459 HydrophobicContact CG-CE2 4.21Å; F447-F459 AromaticContact CG-CG 3.71Å; F447-F459 HydrophobicContact CG-CG 3.71Å; F447-F459 HydrophobicContact CG-CZ 4.32Å; F447-F459 AromaticContact CZ-CD2 3.85Å; F447-F459 HydrophobicContact CZ-CD2 3.85Å; F447-F459 AromaticContact CZ-CE2 3.76Å; F447-F459 HydrophobicContact CZ-CE2 3.76Å; F447-F459 HydrophobicContact CZ-CZ 4.44Å; V455-F459 WeakPolarHBondContact O-CB 3.46Å; V455-F459 PolarHBondContact O-N 3.19Å; G456-F459 PolarHBondContact O-N 2.91Å; L457-F459 VanDerWaalsContact C-N 3.32Å; L457-F459 PolarHBondContact O-N 3.35Å; F459-V461 PolarHBondContact O-N 3.41Å; F459-V462 PolarHBondContact O-N 3.31Å; F459-C463 HydrophobicContact CE1-CB 4.46Å; F459-C463 WeakPolarHBondContact CZ-SG 3.33Å; F459-C463 WeakPolarHBondContact O-CB 3.24Å; F459-C463 PolarHBondContact O-N 3.28Å
460	G	92.8	Very high	89.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-41	-179.8	0	0	0	0	0	113.4	T444 G456 L457 L458 T464	T444-G460 VanDerWaalsContact OG1-CA 3.3Å; T444-G460 WeakPolarHBondContact OG1-CA 3.38Å; G456-G460 PolarHBondContact O-N 3.36Å; L457-G460 PolarHBondContact O-N 3.23Å; L458-G460 PolarHBondContact O-N 3.39Å; G460-T464 WeakPolarHBondContact O-CB 3.44Å; G460-T464 PolarHBondContact O-N 3.02Å; G460-T464 PolarHBondContact O-OG1 2.97Å
461	V	91.6	Very high	88.8	Confident	26 Å²	26	48.4 Å²	48.4	16%	0.158	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-47	175.1	173.5	0	0	0	0	110.9	V174 V178 L457 L458 F459 C463 T464 I465	V174-V461 HydrophobicContact CG2-CG2 4.06Å; V178-V461 HydrophobicContact CG1-CG2 4.44Å; L457-V461 HydrophobicContact CD1-CG2 4.09Å; L457-V461 WeakPolarHBondContact O-CG2 3.42Å; L457-V461 PolarHBondContact O-N 3.09Å; L458-V461 PolarHBondContact O-N 3.4Å; F459-V461 PolarHBondContact O-N 3.41Å; V461-C463 PolarHBondContact O-N 3.24Å; V461-T464 WeakPolarHBondContact O-CB 3.47Å; V461-T464 PolarHBondContact O-N 3.23Å; V461-I465 HydrophobicContact CG1-CD1 3.89Å; V461-I465 WeakPolarHBondContact O-CG1 3.36Å; V461-I465 PolarHBondContact O-N 2.89Å
462	V	93.1	Very high	88.2	Confident	84 Å²	84	47.6 Å²	47.6	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-43.5	177.7	171.9	0	0	0	0	111.2	L458 F459 T464 I465 A466	L458-V462 HydrophobicContact CD1-CG2 4.45Å; L458-V462 WeakPolarHBondContact O-CB 3.3Å; L458-V462 VanDerWaalsContact O-CG2 3.28Å; L458-V462 WeakPolarHBondContact O-CG2 3.36Å; L458-V462 PolarHBondContact O-N 2.96Å; F459-V462 PolarHBondContact O-N 3.31Å; V462-T464 VanDerWaalsContact C-N 3.35Å; V462-T464 PolarHBondContact O-N 3.39Å; V462-I465 PolarHBondContact O-N 3.42Å; V462-A466 WeakPolarHBondContact O-CB 3.41Å; V462-A466 PolarHBondContact O-N 2.98Å
463	C	92.7	Very high	87.4	Confident	30 Å²	30	47.4 Å²	47.4	20%	0.203	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-43.2	174.7	-99.3	0	0	0	0	111.8	F459 V461 A466 I467	F459-C463 HydrophobicContact CE1-CB 4.46Å; F459-C463 WeakPolarHBondContact CZ-SG 3.33Å; F459-C463 WeakPolarHBondContact O-CB 3.24Å; F459-C463 PolarHBondContact O-N 3.28Å; V461-C463 PolarHBondContact O-N 3.24Å; C463-A466 PolarHBondContact O-N 2.97Å; C463-I467 VanDerWaalsContact O-CB 3.3Å; C463-I467 WeakPolarHBondContact O-CB 3.26Å; C463-I467 WeakPolarHBondContact O-CD1 3.18Å; C463-I467 VanDerWaalsContact O-CG1 3.24Å; C463-I467 WeakPolarHBondContact O-CG1 3.26Å; C463-I467 PolarHBondContact O-N 3.42Å
464	T	90.9	Very high	86.7	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.049	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-47.2	176.8	-59.9	0	0	0	0	110.8	T175 V178 G460 V461 V462 I467 V468	T175-T464 HydrophobicContact CG2-CG2 3.66Å; V178-T464 WeakPolarHBondContact CG2-OG1 3.24Å; G460-T464 WeakPolarHBondContact O-CB 3.44Å; G460-T464 PolarHBondContact O-N 3.02Å; G460-T464 PolarHBondContact O-OG1 2.97Å; V461-T464 WeakPolarHBondContact O-CB 3.47Å; V461-T464 PolarHBondContact O-N 3.23Å; V462-T464 VanDerWaalsContact C-N 3.35Å; V462-T464 PolarHBondContact O-N 3.39Å; T464-I467 PolarHBondContact O-N 3.43Å; T464-V468 HydrophobicContact CG2-CG2 4.49Å; T464-V468 WeakPolarHBondContact O-CB 3.44Å; T464-V468 VanDerWaalsContact O-CG2 3.26Å; T464-V468 WeakPolarHBondContact O-CG2 3.3Å; T464-V468 PolarHBondContact O-N 3.32Å
465	I	90.8	Very high	85.7	Confident	61 Å²	61	57 Å²	57	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-49.1	176.8	-67.5	164.9	0	0	0	110.6	L173 V461 V462 I467 V468 I469	L173-I465 HydrophobicContact CD1-CD1 4.25Å; L173-I465 HydrophobicContact CD2-CG1 4.1Å; V461-I465 HydrophobicContact CG1-CD1 3.89Å; V461-I465 WeakPolarHBondContact O-CG1 3.36Å; V461-I465 PolarHBondContact O-N 2.89Å; V462-I465 PolarHBondContact O-N 3.42Å; I465-I467 VanDerWaalsContact C-N 3.31Å; I465-I467 PolarHBondContact O-N 2.9Å; I465-V468 PolarHBondContact O-N 2.9Å; I465-I469 HydrophobicContact CG2-CD1 3.63Å; I465-I469 HydrophobicContact CG2-CG1 4.39Å; I465-I469 WeakPolarHBondContact O-CB 3.2Å; I465-I469 VanDerWaalsContact O-CG1 3.26Å; I465-I469 WeakPolarHBondContact O-CG1 3.37Å; I465-I469 PolarHBondContact O-N 3.02Å
466	A	91.2	Very high	84.3	Confident	59 Å²	59	63.6 Å²	63.6	49%	0.488	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-39.9	-179.6	0	0	0	0	0	112.3	V462 C463 G470	V462-A466 WeakPolarHBondContact O-CB 3.41Å; V462-A466 PolarHBondContact O-N 2.98Å; C463-A466 PolarHBondContact O-N 2.97Å; A466-G470 PolarHBondContact O-N 3.34Å
467	I	88.8	Confident	82.7	Confident	58 Å²	58	63.8 Å²	63.8	30%	0.297	33%	0.331	S	S	.	.	H	α-helix	trans	-68.9	-43.5	177.4	-75.7	166.9	0	0	0	111.2	I436 I440 C463 T464 I465 I469 G470 R471	I436-I467 HydrophobicContact CG2-CD1 4.09Å; I436-I467 HydrophobicContact CG2-CG2 3.34Å; I440-I467 HydrophobicContact CD1-CD1 3.66Å; I440-I467 HydrophobicContact CD1-CG2 4.45Å; I440-I467 HydrophobicContact CG1-CD1 3.36Å; C463-I467 VanDerWaalsContact O-CB 3.3Å; C463-I467 WeakPolarHBondContact O-CB 3.26Å; C463-I467 WeakPolarHBondContact O-CD1 3.18Å; C463-I467 VanDerWaalsContact O-CG1 3.24Å; C463-I467 WeakPolarHBondContact O-CG1 3.26Å; C463-I467 PolarHBondContact O-N 3.42Å; T464-I467 PolarHBondContact O-N 3.43Å; I465-I467 VanDerWaalsContact C-N 3.31Å; I465-I467 PolarHBondContact O-N 2.9Å; I467-I469 VanDerWaalsContact C-N 3.33Å; I467-I469 PolarHBondContact O-N 3.22Å; I467-G470 PolarHBondContact O-N 2.98Å; I467-R471 WeakPolarHBondContact O-CB 3.46Å; I467-R471 PolarHBondContact O-N 3.3Å
468	V	85.7	Confident	81.1	Confident	88 Å²	88	65.1 Å²	65.1	53%	0.533	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-47	175.7	168.9	0	0	0	0	110	T464 I465 G470 R471 F472	T464-V468 HydrophobicContact CG2-CG2 4.49Å; T464-V468 WeakPolarHBondContact O-CB 3.44Å; T464-V468 VanDerWaalsContact O-CG2 3.26Å; T464-V468 WeakPolarHBondContact O-CG2 3.3Å; T464-V468 PolarHBondContact O-N 3.32Å; I465-V468 PolarHBondContact O-N 2.9Å; V468-G470 PolarHBondContact O-N 3.14Å; V468-R471 PolarHBondContact O-N 3.01Å; V468-F472 WeakPolarHBondContact O-CB 3.43Å; V468-F472 PolarHBondContact O-N 3.27Å
469	I	86.4	Confident	79.3	Confident	85 Å²	85	62.7 Å²	62.7	44%	0.436	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-41.5	176.3	-67	169.4	0	0	0	111.2	I465 I467 P473 L514	I465-I469 HydrophobicContact CG2-CD1 3.63Å; I465-I469 HydrophobicContact CG2-CG1 4.39Å; I465-I469 WeakPolarHBondContact O-CB 3.2Å; I465-I469 VanDerWaalsContact O-CG1 3.26Å; I465-I469 WeakPolarHBondContact O-CG1 3.37Å; I465-I469 PolarHBondContact O-N 3.02Å; I467-I469 VanDerWaalsContact C-N 3.33Å; I467-I469 PolarHBondContact O-N 3.22Å; I469-P473 WeakPolarHBondContact O-CD 3.49Å; I469-L514 HydrophobicContact CG2-CD2 4Å
470	G	83.3	Confident	77.3	Confident	32 Å²	32	64.1 Å²	64.1	33%	0.33	34%	0.337	S	S	.	.	H	α-helix	trans	-74	-28.3	179.6	0	0	0	0	0	114.3	A466 I467 V468	A466-G470 PolarHBondContact O-N 3.34Å; I467-G470 PolarHBondContact O-N 2.98Å; V468-G470 PolarHBondContact O-N 3.14Å
471	R	80.7	Confident	75	Confident	131 Å²	131	67.4 Å²	67.4	49%	0.494	36%	0.358	S	S	.	.	H	α-helix	trans	-80.5	-34.1	178.7	-176.7	173.9	168.7	147.3	-5.7	111.6	D434 I467 V468 R474 A475	D434-R471 IonicContact OD2-CZ 3.77Å; D434-R471 IonicContact OD2-NH1 2.8Å; D434-R471 PolarHBondContact OD2-NH1 3.06Å; I467-R471 WeakPolarHBondContact O-CB 3.46Å; I467-R471 PolarHBondContact O-N 3.3Å; V468-R471 PolarHBondContact O-N 3.01Å; R471-R474 CarbonylContact O-C 3.58Å; R471-R474 WeakPolarHBondContact O-CA 3.38Å; R471-R474 PolarHBondContact O-N 2.9Å; R471-A475 PolarHBondContact O-N 2.98Å
472	F	77.6	Confident	72.5	Confident	68 Å²	68	72.4 Å²	72.4	30%	0.298	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-47.7	-175.4	-170.2	-80.7	0	0	0	113.5	V468 R474 P510 V512 L514 N515	V468-F472 WeakPolarHBondContact O-CB 3.43Å; V468-F472 PolarHBondContact O-N 3.27Å; F472-R474 VanDerWaalsContact C-N 3.3Å; F472-R474 PolarHBondContact O-N 3.25Å; F472-P510 HydrophobicContact CZ-CB 4.22Å; F472-P510 HydrophobicContact CZ-CG 4.48Å; F472-V512 HydrophobicContact CD1-CG2 4.11Å; F472-V512 HydrophobicContact CE1-CG2 3.2Å; F472-V512 HydrophobicContact CZ-CG2 3.65Å; F472-L514 HydrophobicContact CB-CD1 4.35Å; F472-L514 HydrophobicContact CD1-CB 3.77Å; F472-L514 HydrophobicContact CD1-CD1 3.9Å; F472-L514 HydrophobicContact CE1-CB 4.29Å; F472-L514 HydrophobicContact CG-CD1 4.19Å; F472-N515 HydrophobicContact CD1-CB 4.46Å; F472-N515 HydrophobicContact CE1-CB 4.31Å
473	P	69.8	Low	69.9	Low	28 Å²	28	75.2 Å²	75.2	18%	0.182	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.3	173	-16	27.2	0	0	0	113.8	I469 L514 K518	I469-P473 WeakPolarHBondContact O-CD 3.49Å; P473-L514 WeakPolarHBondContact CB-O 3.49Å; P473-L514 HydrophobicContact CG-CB 4.2Å; P473-L514 VanDerWaalsContact CG-O 3.31Å; P473-L514 WeakPolarHBondContact CG-O 3.41Å; P473-K518 WeakPolarHBondContact O-CD 3.26Å; P473-K518 PolarHBondContact O-NZ 3.49Å
474	R	67.6	Low	66.9	Low	200 Å²	200	82.3 Å²	82.3	76%	0.755	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.1	-173.9	-73.3	-176.8	175.5	152.3	-1	113.6	R471 F472 K476	R471-R474 CarbonylContact O-C 3.58Å; R471-R474 WeakPolarHBondContact O-CA 3.38Å; R471-R474 PolarHBondContact O-N 2.9Å; F472-R474 VanDerWaalsContact C-N 3.3Å; F472-R474 PolarHBondContact O-N 3.25Å; R474-K476 PolarHBondContact O-N 3.37Å
475	A	65.2	Low	64.3	Low	39 Å²	39	89.8 Å²	89.8	32%	0.322	45%	0.454	S	S	.	.	S	Bend	trans	-52	138.8	170.9	0	0	0	0	0	109.9	R471 T477	R471-A475 PolarHBondContact O-N 2.98Å; A475-T477 PolarHBondContact O-N 3.39Å; A475-T477 PolarHBondContact O-OG1 3.12Å
476	K	59.5	Low	61.6	Low	196 Å²	196	92.2 Å²	92.2	85%	0.852	47%	0.468	S	S	*	.			trans	-64.7	104.2	174.9	-75.6	-174.9	178	-177.2	0	107.7	R474 N509	R474-K476 PolarHBondContact O-N 3.37Å; K476-N509 PolarHBondContact O-ND2 3.44Å
477	T	56.4	Low	58.8	Low	3 Å²	3	95 Å²	95	2%	0.018	47%	0.471	C	S	.	.			trans	-78.8	-24.3	-176.6	-48.6	0	0	0	0	112.5	A475 N508 N509 L519	A475-T477 PolarHBondContact O-N 3.39Å; A475-T477 PolarHBondContact O-OG1 3.12Å; T477-N508 PolarHBondContact O-N 2.92Å; T477-N509 VanDerWaalsContact CA-ND2 3.32Å; T477-N509 WeakPolarHBondContact CA-ND2 3.36Å; T477-N509 HydrophobicContact CG2-CB 3.9Å; T477-L519 HydrophobicContact CG2-CB 4.48Å; T477-L519 HydrophobicContact CG2-CD1 3.78Å
478	L	55.7	Low	56.2	Low	30 Å²	30	99 Å²	99	16%	0.157	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.5	-174.1	-64.6	174.9	0	0	0	109.3	I505 I507 L519 D522 L523 I526	L478-I505 HydrophobicContact CD2-CG2 3.61Å; L478-I507 HydrophobicContact CD2-CG1 4.31Å; L478-L519 HydrophobicContact CD1-CD1 4.1Å; L478-L519 HydrophobicContact CD2-CD1 3.37Å; L478-L519 HydrophobicContact CG-CD1 3.76Å; L478-D522 HydrophobicContact CD1-CB 3.76Å; L478-L523 HydrophobicContact CD1-CG 4.24Å; L478-I526 HydrophobicContact CD1-CD1 3.84Å
479	S	52.3	Low	53.4	Low	40 Å²	40	101.4 Å²	101.4	28%	0.28	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.4	154.6	62.1	0	0	0	0	107.1	T481 S506 N508	S479-T481 PolarHBondContact O-N 3.23Å; S479-T481 VanDerWaalsContact O-N 3.08Å; S479-S506 PolarHBondContact N-O 3.32Å; S479-S506 PolarHBondContact O-N 3.41Å; S479-N508 WeakPolarHBondContact CB-ND2 3.31Å; S479-N508 PolarHBondContact OG-ND2 3.47Å
480	I	51.7	Low	50.8	Low	80 Å²	80	103 Å²	103	41%	0.41	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	101.1	165.5	-57.3	173.5	0	0	0	105.3	N482 I526	I480-N482 VanDerWaalsContact C-N 3.26Å; I480-N482 WeakPolarHBondContact CG2-OD1 3.46Å; I480-N482 PolarHBondContact O-N 3.11Å; I480-N482 VanDerWaalsContact O-N 3.12Å; I480-I526 HydrophobicContact CD1-CD1 3.89Å; I480-I526 HydrophobicContact CD1-CG1 4.27Å; I480-I526 HydrophobicContact CG1-CD1 4.28Å
481	T	43.6	Very low	48	Very low	69 Å²	69	111 Å²	111	42%	0.423	53%	0.528	S	S	.	.			trans	-80.8	87.9	166.1	-43.4	0	0	0	0	105.5	S479 M483	S479-T481 PolarHBondContact O-N 3.23Å; S479-T481 VanDerWaalsContact O-N 3.08Å; T481-M483 HydrophobicContact CG2-CG 4.29Å; T481-M483 PolarHBondContact O-N 3.45Å
482	N	40.2	Very low	45.6	Very low	131 Å²	131	108.9 Å²	108.9	70%	0.701	53%	0.53	S	S	*	.			trans	-65.4	80.4	158.3	-78.7	-1.1	0	0	0	105.7	I480 K484	I480-N482 VanDerWaalsContact C-N 3.26Å; I480-N482 WeakPolarHBondContact CG2-OD1 3.46Å; I480-N482 PolarHBondContact O-N 3.11Å; I480-N482 VanDerWaalsContact O-N 3.12Å; N482-K484 PolarHBondContact O-N 3.23Å
483	M	37.1	Very low	43.6	Very low	143 Å²	143	114.8 Å²	114.8	70%	0.704	56%	0.559	S	S	*	*			trans	-54.8	124.5	148.9	-81.8	-158.9	123.4	0	0	104.2	T481 E485	T481-M483 HydrophobicContact CG2-CG 4.29Å; T481-M483 PolarHBondContact O-N 3.45Å; M483-E485 PolarHBondContact O-N 3.01Å
484	K	31.4	Very low	41.7	Very low	180 Å²	180	121.8 Å²	121.8	78%	0.783	59%	0.591	S	S	*	*			trans	-25.3	136	-179.1	-71.5	174.7	173.3	-179.3	0	110	N482 L486	N482-K484 PolarHBondContact O-N 3.23Å; K484-L486 PolarHBondContact O-N 3.29Å
485	E	35.9	Very low	40.3	Very low	164 Å²	164	120 Å²	120	77%	0.766	60%	0.597	S	S	*	*			trans	-36.5	92.7	145.2	-86.6	170.1	148.3	0	0	107.2	M483 E487	M483-E485 PolarHBondContact O-N 3.01Å; E485-E487 HydrophobicContact CB-CG 4.47Å; E485-E487 PolarHBondContact O-N 3.07Å; E485-E487 VanDerWaalsContact O-N 3.17Å
486	L	32.8	Very low	38.8	Very low	113 Å²	113	125 Å²	125	59%	0.592	62%	0.618	S	S	*	*			trans	-88	80.3	161.1	-110	160.5	0	0	0	99.3	K484 F488	K484-L486 PolarHBondContact O-N 3.29Å; L486-F488 HydrophobicContact CB-CD2 3.53Å; L486-F488 HydrophobicContact CB-CE2 3.49Å; L486-F488 VanDerWaalsContact CB-CE2 3.49Å; L486-F488 HydrophobicContact CB-CG 4.39Å; L486-F488 HydrophobicContact CB-CZ 4.29Å; L486-F488 HydrophobicContact CD1-CD2 4.41Å; L486-F488 HydrophobicContact CD1-CE2 3.48Å; L486-F488 VanDerWaalsContact CD1-CE2 3.48Å; L486-F488 HydrophobicContact CD1-CZ 3.73Å; L486-F488 HydrophobicContact CD2-CD1 3.92Å; L486-F488 HydrophobicContact CD2-CD2 3.71Å; L486-F488 HydrophobicContact CD2-CE1 3.49Å; L486-F488 VanDerWaalsContact CD2-CE1 3.49Å; L486-F488 HydrophobicContact CD2-CE2 3.27Å; L486-F488 HydrophobicContact CD2-CG 4.03Å; L486-F488 HydrophobicContact CD2-CZ 3.14Å; L486-F488 HydrophobicContact CG-CD2 4.02Å; L486-F488 HydrophobicContact CG-CE2 3.52Å; L486-F488 HydrophobicContact CG-CZ 3.84Å; L486-F488 PolarHBondContact O-N 2.97Å
487	E	33.2	Very low	37.5	Very low	117 Å²	117	122.9 Å²	122.9	55%	0.547	61%	0.611	S	S	.	*			trans	-53.9	79.4	153.3	-70.6	-170.1	154.8	0	0	105.9	E485 K489 L499	E485-E487 HydrophobicContact CB-CG 4.47Å; E485-E487 PolarHBondContact O-N 3.07Å; E485-E487 VanDerWaalsContact O-N 3.17Å; E487-K489 VanDerWaalsContact C-N 3.27Å; E487-K489 PolarHBondContact O-N 3.42Å; E487-L499 HydrophobicContact CB-CD2 4.25Å; E487-L499 HydrophobicContact CG-CD2 3.85Å
488	F	33.4	Very low	36.5	Very low	143 Å²	143	126.8 Å²	126.8	63%	0.627	64%	0.635	S	S	*	*			trans	-80.5	90.6	170.4	-84.4	-65.1	0	0	0	105.7	L486 V490	L486-F488 HydrophobicContact CB-CD2 3.53Å; L486-F488 HydrophobicContact CB-CE2 3.49Å; L486-F488 VanDerWaalsContact CB-CE2 3.49Å; L486-F488 HydrophobicContact CB-CG 4.39Å; L486-F488 HydrophobicContact CB-CZ 4.29Å; L486-F488 HydrophobicContact CD1-CD2 4.41Å; L486-F488 HydrophobicContact CD1-CE2 3.48Å; L486-F488 VanDerWaalsContact CD1-CE2 3.48Å; L486-F488 HydrophobicContact CD1-CZ 3.73Å; L486-F488 HydrophobicContact CD2-CD1 3.92Å; L486-F488 HydrophobicContact CD2-CD2 3.71Å; L486-F488 HydrophobicContact CD2-CE1 3.49Å; L486-F488 VanDerWaalsContact CD2-CE1 3.49Å; L486-F488 HydrophobicContact CD2-CE2 3.27Å; L486-F488 HydrophobicContact CD2-CG 4.03Å; L486-F488 HydrophobicContact CD2-CZ 3.14Å; L486-F488 HydrophobicContact CG-CD2 4.02Å; L486-F488 HydrophobicContact CG-CE2 3.52Å; L486-F488 HydrophobicContact CG-CZ 3.84Å; L486-F488 PolarHBondContact O-N 2.97Å; F488-V490 VanDerWaalsContact C-N 3.3Å; F488-V490 PolarHBondContact O-N 3.36Å
489	K	26.8	Very low	35.9	Very low	137 Å²	137	130.4 Å²	130.4	60%	0.596	65%	0.654	S	S	*	*			trans	-59.4	96.3	161.9	-76.3	-165.6	173.8	-139.1	0	108.1	E487 K491 E497	E487-K489 VanDerWaalsContact C-N 3.27Å; E487-K489 PolarHBondContact O-N 3.42Å; K489-K491 PolarHBondContact O-N 3.16Å; K489-K491 VanDerWaalsContact O-N 3.12Å; K489-E497 IonicContact NZ-OE1 3.3Å; K489-E497 PolarHBondContact NZ-OE1 3.44Å; K489-E497 IonicContact NZ-OE2 3.85Å
490	V	31.6	Very low	35.8	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.715	65%	0.654	S	S	*	*			trans	-73.6	98.8	162.8	179.4	0	0	0	0	106	F488 T492	F488-V490 VanDerWaalsContact C-N 3.3Å; F488-V490 PolarHBondContact O-N 3.36Å; V490-T492 PolarHBondContact O-N 3.21Å; V490-T492 VanDerWaalsContact O-N 3.08Å
491	K	24.8	Very low	36.1	Very low	200 Å²	200	133.3 Å²	133.3	87%	0.87	66%	0.661	S	S	*	*			trans	-68.9	100.3	163.5	-87.2	-174.1	174.7	-177.3	0	107.5	K489	K489-K491 PolarHBondContact O-N 3.16Å; K489-K491 VanDerWaalsContact O-N 3.12Å
492	T	31.1	Very low	37.2	Very low	88 Å²	88	132.8 Å²	132.8	54%	0.54	66%	0.658	S	S	.	*			trans	-88.7	132.8	157	-13.9	0	0	0	0	106.8	V490 M494	V490-T492 PolarHBondContact O-N 3.21Å; V490-T492 VanDerWaalsContact O-N 3.08Å; T492-M494 PolarHBondContact O-N 2.77Å
493	E	35	Very low	38.6	Very low	191 Å²	191	128.1 Å²	128.1	89%	0.893	63%	0.632	S	S	*	*	S	Bend	trans	-60.3	120.5	164.3	-69.2	179.4	159.7	0	0	106.7
494	M	31.2	Very low	40.4	Very low	175 Å²	175	122.4 Å²	122.4	86%	0.862	60%	0.604	S	S	*	*	S	Bend	trans	98.2	114.8	-166.7	-57.5	-69.3	-143.8	0	0	114.1	T492 D496	T492-M494 PolarHBondContact O-N 2.77Å; M494-D496 PolarHBondContact O-N 2.92Å
495	N	37.7	Very low	42.7	Very low	164 Å²	164	113.9 Å²	113.9	88%	0.877	57%	0.567	S	S	*	*	S	Bend	trans	-53.6	117.8	-173.2	-66.9	-29.5	0	0	0	114
496	D	32.8	Very low	44.8	Very low	144 Å²	144	106.3 Å²	106.3	77%	0.77	53%	0.532	S	S	*	.			trans	-172.8	118.8	131.4	-103.8	-18.1	0	0	0	109.7	M494 T498	M494-D496 PolarHBondContact O-N 2.92Å; D496-T498 PolarHBondContact O-N 2.85Å
497	E	32.9	Very low	47.1	Very low	150 Å²	150	101 Å²	101	70%	0.701	50%	0.504	S	S	*	.			trans	-83	86.4	-178.9	-68	-167	145.9	0	0	110.9	K489 L499	K489-E497 IonicContact NZ-OE1 3.3Å; K489-E497 PolarHBondContact NZ-OE1 3.44Å; K489-E497 IonicContact NZ-OE2 3.85Å; E497-L499 PolarHBondContact O-N 3.16Å
498	T	36.2	Very low	49.2	Very low	86 Å²	86	99.1 Å²	99.1	53%	0.528	50%	0.498	S	S	.	.			trans	-88.9	102.4	169.9	56.7	0	0	0	0	111	D496	D496-T498 PolarHBondContact O-N 2.85Å
499	L	41.6	Very low	51.2	Low	105 Å²	105	94 Å²	94	55%	0.55	48%	0.477	S	S	.	.			trans	-74.9	117.1	170.2	-92.9	147.8	0	0	0	109.7	E487 E497	E487-L499 HydrophobicContact CB-CD2 4.25Å; E487-L499 HydrophobicContact CG-CD2 3.85Å; E497-L499 PolarHBondContact O-N 3.16Å
500	Q	51.4	Low	54	Low	61 Å²	61	89 Å²	89	29%	0.285	46%	0.459	S	S	.	.			trans	-109.2	120.9	178.4	-154	-178.6	5.8	0	0	111.5	V502 K569 K645	Q500-V502 PolarHBondContact O-N 3.1Å; Q500-K569 PolarHBondContact NE2-O 2.98Å; Q500-K645 VanDerWaalsContact CD-CE 3.5Å; Q500-K645 VanDerWaalsContact OE1-CD 3.31Å
501	Q	58	Low	56.5	Low	120 Å²	120	83.6 Å²	83.6	56%	0.561	43%	0.425	S	S	*	.			trans	-84.8	112.1	177.4	-67.1	179.9	-7.6	0	0	109.8
502	V	66	Low	59.4	Low	59 Å²	59	74.6 Å²	74.6	36%	0.358	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.6	168.9	-179.8	0	0	0	0	108.3	Q500 S571 V573 I641	Q500-V502 PolarHBondContact O-N 3.1Å; V502-S571 WeakPolarHBondContact CA-O 3.22Å; V502-V573 HydrophobicContact CG1-CG2 4.04Å; V502-I641 HydrophobicContact CG1-CD1 4.41Å
503	K	69.8	Low	61.9	Low	32 Å²	32	76.6 Å²	76.6	14%	0.139	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.8	-178.8	-163.4	168.4	-162.6	156	0	110.5	I505 I526 E530 S571 L572 V573	K503-I505 HydrophobicContact CG-CG1 4.3Å; K503-I526 HydrophobicContact CD-CG2 4.17Å; K503-I526 VanDerWaalsContact NZ-CG2 3.34Å; K503-E530 WeakPolarHBondContact CD-OE2 3.32Å; K503-E530 IonicContact NZ-OE1 2.65Å; K503-E530 PolarHBondContact NZ-OE1 3.25Å; K503-E530 IonicContact NZ-OE2 3.11Å; K503-E530 PolarHBondContact NZ-OE2 2.94Å; K503-S571 PolarHBondContact N-O 2.99Å; K503-L572 HydrophobicContact CB-CD1 4.09Å; K503-L572 HydrophobicContact CG-CD1 4.42Å; K503-V573 PolarHBondContact O-N 3.39Å
504	I	75.2	Confident	64.2	Low	24 Å²	24	70.1 Å²	70.1	12%	0.123	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.6	178.2	-53.4	169	0	0	0	108.3	V573 V634 I638	I504-V573 CarbonylContact C-O 3.56Å; I504-V573 WeakPolarHBondContact CA-O 3.2Å; I504-V573 HydrophobicContact CG1-CB 4.19Å; I504-V634 HydrophobicContact CD1-CG1 3.86Å; I504-V634 HydrophobicContact CG1-CG1 4.46Å; I504-V634 HydrophobicContact CG2-CG1 4.1Å; I504-I638 HydrophobicContact CD1-CD1 3.9Å
505	I	79.8	Confident	66.7	Low	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.6	178	-59.4	-179.4	0	0	0	108.3	L478 K503 L523 I526 L572 V573 L574 D575	L478-I505 HydrophobicContact CD2-CG2 3.61Å; K503-I505 HydrophobicContact CG-CG1 4.3Å; I505-L523 HydrophobicContact CB-CD2 4.44Å; I505-L523 HydrophobicContact CD1-CD2 3.51Å; I505-L523 HydrophobicContact CG2-CD2 4.02Å; I505-I526 HydrophobicContact CD1-CG2 3.91Å; I505-L572 HydrophobicContact CD1-CD1 3.62Å; I505-L572 HydrophobicContact CG1-CD1 3.87Å; I505-V573 PolarHBondContact N-O 3.42Å; I505-L574 HydrophobicContact CB-CD2 4.15Å; I505-L574 HydrophobicContact CG2-CD2 4.45Å; I505-L574 WeakPolarHBondContact O-CA 3.36Å; I505-D575 PolarHBondContact O-N 3.44Å
506	S	80.3	Confident	68.9	Low	6 Å²	6	54 Å²	54	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.6	178	-168	0	0	0	0	111	S479 N508 D575	S479-S506 PolarHBondContact N-O 3.32Å; S479-S506 PolarHBondContact O-N 3.41Å; S506-N508 PolarHBondContact OG-OD1 3.49Å; S506-D575 WeakPolarHBondContact CB-OD2 3.4Å; S506-D575 PolarHBondContact OG-OD2 2.9Å
507	I	81.3	Confident	71.3	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	106.9	178.4	-56.3	172.1	0	0	0	107.7	L478 L519 L574 D575 G578 L579 L590	L478-I507 HydrophobicContact CD2-CG1 4.31Å; I507-L519 HydrophobicContact CD1-CD2 4.42Å; I507-L519 HydrophobicContact CG2-CD2 4.49Å; I507-L574 HydrophobicContact CD1-CD2 4.47Å; I507-D575 PolarHBondContact N-O 2.95Å; I507-G578 CarbonylContact O-C 3.58Å; I507-G578 WeakPolarHBondContact O-CA 3.28Å; I507-G578 PolarHBondContact O-N 3.18Å; I507-L579 HydrophobicContact CB-CD1 4.39Å; I507-L579 HydrophobicContact CB-CG 4.31Å; I507-L579 HydrophobicContact CD1-CD1 4.16Å; I507-L579 HydrophobicContact CG2-CD1 4.24Å; I507-L579 HydrophobicContact CG2-CD2 3.88Å; I507-L579 HydrophobicContact CG2-CG 3.86Å; I507-L590 HydrophobicContact CD1-CD1 4.45Å
508	N	76.2	Confident	73.7	Confident	77 Å²	77	51.1 Å²	51.1	41%	0.412	26%	0.256	S	S	.	.			trans	-99.9	-3.1	-170.8	-72.4	-13.4	0	0	0	115.1	T477 S479 S506	T477-N508 PolarHBondContact O-N 2.92Å; S479-N508 WeakPolarHBondContact CB-ND2 3.31Å; S479-N508 PolarHBondContact OG-ND2 3.47Å; S506-N508 PolarHBondContact OG-OD1 3.49Å
509	N	75.9	Confident	75.9	Confident	37 Å²	37	47.3 Å²	47.3	20%	0.198	23%	0.232	C	C	.	.	S	Bend	trans	-121.1	153.8	-176	-76.4	-17.8	0	0	0	111	K476 T477	K476-N509 PolarHBondContact O-ND2 3.44Å; T477-N509 VanDerWaalsContact CA-ND2 3.32Å; T477-N509 WeakPolarHBondContact CA-ND2 3.36Å; T477-N509 HydrophobicContact CG2-CB 3.9Å
510	P	84.4	Confident	77.9	Confident	32 Å²	32	43.8 Å²	43.8	21%	0.208	21%	0.214	C	C	.	.			trans	-54.4	143.6	168.8	-22.6	32.2	0	0	0	111.8	F472 N515 F581	F472-P510 HydrophobicContact CZ-CB 4.22Å; F472-P510 HydrophobicContact CZ-CG 4.48Å; P510-N515 PolarHBondContact O-ND2 3.43Å; P510-N515 PolarHBondContact O-OD1 3.38Å; P510-F581 CarbonylContact C-O 3.58Å; P510-F581 WeakPolarHBondContact CA-O 3.3Å; P510-F581 HydrophobicContact CB-CB 4.07Å; P510-F581 HydrophobicContact CB-CD1 4.46Å; P510-F581 VanDerWaalsContact CB-O 3.31Å; P510-F581 WeakPolarHBondContact CB-O 3.42Å
511	L	85	Confident	79.4	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-107.6	98.9	-176.7	-176.3	58.4	0	0	0	111.1	A516 L519 L579 F581 F582 D583 G586 L590	L511-A516 HydrophobicContact CD1-CB 4.02Å; L511-L519 HydrophobicContact CD1-CB 4.38Å; L511-L519 HydrophobicContact CD1-CD2 3.46Å; L511-L519 VanDerWaalsContact CD1-CD2 3.46Å; L511-L519 HydrophobicContact CD2-CD2 4.15Å; L511-L519 HydrophobicContact CG-CD2 4.4Å; L511-L579 HydrophobicContact CB-CD2 3.33Å; L511-L579 HydrophobicContact CD2-CD2 4.26Å; L511-L579 HydrophobicContact CG-CD2 4.41Å; L511-F581 PolarHBondContact N-O 2.92Å; L511-F582 HydrophobicContact CB-CB 4.4Å; L511-F582 WeakPolarHBondContact O-CA 3.27Å; L511-F582 WeakPolarHBondContact O-CB 3.41Å; L511-D583 PolarHBondContact O-N 3.02Å; L511-D583 VanDerWaalsContact O-N 3.15Å; L511-G586 VanDerWaalsContact CD2-O 3.22Å; L511-G586 WeakPolarHBondContact CD2-O 3.41Å; L511-L590 HydrophobicContact CD2-CB 4.1Å
512	V	85	Confident	80.5	Confident	11 Å²	11	40.8 Å²	40.8	7%	0.067	21%	0.206	C	C	.	.			trans	-129.1	168.9	-175.9	-64.9	0	0	0	0	111	F472 L514 N515 A516 F581 D583	F472-V512 HydrophobicContact CD1-CG2 4.11Å; F472-V512 HydrophobicContact CE1-CG2 3.2Å; F472-V512 HydrophobicContact CZ-CG2 3.65Å; V512-L514 HydrophobicContact CG2-CB 4.12Å; V512-L514 PolarHBondContact O-N 2.81Å; V512-N515 PolarHBondContact N-OD1 3.27Å; V512-N515 PolarHBondContact O-N 3.11Å; V512-N515 PolarHBondContact O-OD1 2.97Å; V512-A516 WeakPolarHBondContact O-CB 2.97Å; V512-A516 PolarHBondContact O-N 2.85Å; V512-F581 HydrophobicContact CG1-CD1 3.58Å; V512-F581 HydrophobicContact CG1-CE1 3.5Å; V512-F581 VanDerWaalsContact CG1-CE1 3.5Å; V512-D583 WeakPolarHBondContact CA-OD1 3.29Å; V512-D583 WeakPolarHBondContact CA-OD2 3.38Å; V512-D583 HydrophobicContact CG1-CB 4.41Å
513	F	84.4	Confident	81.2	Confident	130 Å²	130	38 Å²	38	57%	0.57	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-28.8	-179.5	75.2	-88	0	0	0	114	D583 T585	F513-D583 WeakPolarHBondContact CD1-OD2 3.42Å; F513-D583 PolarHBondContact N-OD1 3.44Å; F513-D583 PolarHBondContact N-OD2 3.48Å; F513-T585 HydrophobicContact CB-CG2 4.17Å
514	L	82.2	Confident	81.7	Confident	55 Å²	55	37.5 Å²	37.5	29%	0.288	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-38.3	178.7	-68.3	173.8	0	0	0	113.6	I469 F472 P473 V512	I469-L514 HydrophobicContact CG2-CD2 4Å; F472-L514 HydrophobicContact CB-CD1 4.35Å; F472-L514 HydrophobicContact CD1-CB 3.77Å; F472-L514 HydrophobicContact CD1-CD1 3.9Å; F472-L514 HydrophobicContact CE1-CB 4.29Å; F472-L514 HydrophobicContact CG-CD1 4.19Å; P473-L514 WeakPolarHBondContact CB-O 3.49Å; P473-L514 HydrophobicContact CG-CB 4.2Å; P473-L514 VanDerWaalsContact CG-O 3.31Å; P473-L514 WeakPolarHBondContact CG-O 3.41Å; V512-L514 HydrophobicContact CG2-CB 4.12Å; V512-L514 PolarHBondContact O-N 2.81Å
515	N	84.2	Confident	82	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-11.4	-173.4	68.9	-18.3	0	0	0	114.3	F472 P510 V512 K517 K518 L519	F472-N515 HydrophobicContact CD1-CB 4.46Å; F472-N515 HydrophobicContact CE1-CB 4.31Å; P510-N515 PolarHBondContact O-ND2 3.43Å; P510-N515 PolarHBondContact O-OD1 3.38Å; V512-N515 PolarHBondContact N-OD1 3.27Å; V512-N515 PolarHBondContact O-N 3.11Å; V512-N515 PolarHBondContact O-OD1 2.97Å; N515-K517 PolarHBondContact O-N 3.15Å; N515-K518 PolarHBondContact O-N 2.75Å; N515-K518 VanDerWaalsContact O-N 3.11Å; N515-L519 PolarHBondContact O-N 3.14Å
516	A	83.9	Confident	81.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-52.8	-50.6	-177.1	0	0	0	0	0	113.4	L511 V512 K518 L519 N520 T585 T589	L511-A516 HydrophobicContact CD1-CB 4.02Å; V512-A516 WeakPolarHBondContact O-CB 2.97Å; V512-A516 PolarHBondContact O-N 2.85Å; A516-K518 VanDerWaalsContact C-N 3.33Å; A516-K518 PolarHBondContact O-N 3.09Å; A516-L519 PolarHBondContact O-N 2.62Å; A516-N520 PolarHBondContact O-N 3.25Å; A516-T585 HydrophobicContact CB-CG2 4.46Å; A516-T589 HydrophobicContact CB-CG2 4.35Å
517	K	84.5	Confident	81.5	Confident	162 Å²	162	44.5 Å²	44.5	70%	0.704	22%	0.218	S	C	*	.	H	α-helix	trans	-60.4	-42.1	178.5	-69.9	-171.5	177.7	-174.8	0	112.6	N515 N520 T521	N515-K517 PolarHBondContact O-N 3.15Å; K517-N520 PolarHBondContact O-N 3.04Å; K517-T521 PolarHBondContact O-N 3.12Å; K517-T521 PolarHBondContact O-OG1 3.45Å; K517-T521 VanDerWaalsContact O-OG1 3.11Å
518	K	82.3	Confident	81.1	Confident	73 Å²	73	48.3 Å²	48.3	32%	0.317	24%	0.238	S	C	.	.	H	α-helix	trans	-68	-41.9	-179.6	-169.7	-168.1	172.6	-169	0	111.3	P473 N515 A516 N520 T521 D522	P473-K518 WeakPolarHBondContact O-CD 3.26Å; P473-K518 PolarHBondContact O-NZ 3.49Å; N515-K518 PolarHBondContact O-N 2.75Å; N515-K518 VanDerWaalsContact O-N 3.11Å; A516-K518 VanDerWaalsContact C-N 3.33Å; A516-K518 PolarHBondContact O-N 3.09Å; K518-N520 VanDerWaalsContact C-N 3.29Å; K518-N520 PolarHBondContact O-N 3.19Å; K518-T521 PolarHBondContact O-N 3.1Å; K518-D522 WeakPolarHBondContact O-CB 3.4Å; K518-D522 VanDerWaalsContact O-CG 3.29Å; K518-D522 PolarHBondContact O-N 3.27Å
519	L	81.8	Confident	80.6	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-56	-46.9	174	176.7	71	0	0	0	110.4	T477 L478 I507 L511 N515 A516 D522 L523	T477-L519 HydrophobicContact CG2-CB 4.48Å; T477-L519 HydrophobicContact CG2-CD1 3.78Å; L478-L519 HydrophobicContact CD1-CD1 4.1Å; L478-L519 HydrophobicContact CD2-CD1 3.37Å; L478-L519 HydrophobicContact CG-CD1 3.76Å; I507-L519 HydrophobicContact CD1-CD2 4.42Å; I507-L519 HydrophobicContact CG2-CD2 4.49Å; L511-L519 HydrophobicContact CD1-CB 4.38Å; L511-L519 HydrophobicContact CD1-CD2 3.46Å; L511-L519 VanDerWaalsContact CD1-CD2 3.46Å; L511-L519 HydrophobicContact CD2-CD2 4.15Å; L511-L519 HydrophobicContact CG-CD2 4.4Å; N515-L519 PolarHBondContact O-N 3.14Å; A516-L519 PolarHBondContact O-N 2.62Å; L519-D522 PolarHBondContact O-N 2.91Å; L519-L523 HydrophobicContact CD1-CD1 3.89Å; L519-L523 HydrophobicContact CD2-CD1 4.4Å; L519-L523 HydrophobicContact CG-CD1 3.87Å; L519-L523 WeakPolarHBondContact O-CB 3.49Å; L519-L523 PolarHBondContact O-N 3.17Å
520	N	84.3	Confident	79.6	Confident	31 Å²	31	53.6 Å²	53.6	17%	0.166	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-50.4	177.6	-170.5	8.8	0	0	0	111.6	A516 K517 K518 D522 L523 M524 T589 L593	A516-N520 PolarHBondContact O-N 3.25Å; K517-N520 PolarHBondContact O-N 3.04Å; K518-N520 VanDerWaalsContact C-N 3.29Å; K518-N520 PolarHBondContact O-N 3.19Å; N520-D522 VanDerWaalsContact C-N 3.31Å; N520-D522 PolarHBondContact O-N 3.11Å; N520-L523 PolarHBondContact O-N 3.07Å; N520-M524 WeakPolarHBondContact O-CB 3.26Å; N520-M524 VanDerWaalsContact O-CG 3.27Å; N520-M524 WeakPolarHBondContact O-CG 3.31Å; N520-M524 PolarHBondContact O-N 3.34Å; N520-M524 WeakPolarHBondContact OD1-CG 3.48Å; N520-T589 HydrophobicContact CB-CG2 3.65Å; N520-L593 HydrophobicContact CB-CD1 4.45Å
521	T	83.8	Confident	78.2	Confident	71 Å²	71	56.7 Å²	56.7	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-58.8	-41.4	177.1	-53.3	0	0	0	0	112.7	K517 K518 K525	K517-T521 PolarHBondContact O-N 3.12Å; K517-T521 PolarHBondContact O-OG1 3.45Å; K517-T521 VanDerWaalsContact O-OG1 3.11Å; K518-T521 PolarHBondContact O-N 3.1Å; T521-K525 HydrophobicContact CG2-CD 4.31Å; T521-K525 WeakPolarHBondContact O-CB 3.39Å; T521-K525 VanDerWaalsContact O-CG 3.29Å; T521-K525 WeakPolarHBondContact O-CG 3.45Å; T521-K525 PolarHBondContact O-N 2.96Å
522	D	80.4	Confident	76.1	Confident	48 Å²	48	63.2 Å²	63.2	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-69.3	-42.8	-179.1	-71.2	-17.5	0	0	0	111.2	L478 K518 L519 N520 K525 I526	L478-D522 HydrophobicContact CD1-CB 3.76Å; K518-D522 WeakPolarHBondContact O-CB 3.4Å; K518-D522 VanDerWaalsContact O-CG 3.29Å; K518-D522 PolarHBondContact O-N 3.27Å; L519-D522 PolarHBondContact O-N 2.91Å; N520-D522 VanDerWaalsContact C-N 3.31Å; N520-D522 PolarHBondContact O-N 3.11Å; D522-K525 PolarHBondContact O-N 3.31Å; D522-I526 WeakPolarHBondContact O-CD1 3.33Å; D522-I526 VanDerWaalsContact O-CG1 3.23Å; D522-I526 WeakPolarHBondContact O-CG1 3.26Å; D522-I526 PolarHBondContact O-N 3.06Å
523	L	79.8	Confident	73.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-48.7	173.6	-93.1	158	0	0	0	111.6	L478 I505 L519 N520 K525 I526 I527 L574 L593	L478-L523 HydrophobicContact CD1-CG 4.24Å; I505-L523 HydrophobicContact CB-CD2 4.44Å; I505-L523 HydrophobicContact CD1-CD2 3.51Å; I505-L523 HydrophobicContact CG2-CD2 4.02Å; L519-L523 HydrophobicContact CD1-CD1 3.89Å; L519-L523 HydrophobicContact CD2-CD1 4.4Å; L519-L523 HydrophobicContact CG-CD1 3.87Å; L519-L523 WeakPolarHBondContact O-CB 3.49Å; L519-L523 PolarHBondContact O-N 3.17Å; N520-L523 PolarHBondContact O-N 3.07Å; L523-K525 VanDerWaalsContact C-N 3.31Å; L523-K525 PolarHBondContact O-N 2.99Å; L523-I526 WeakPolarHBondContact O-CB 3.38Å; L523-I526 PolarHBondContact O-N 2.88Å; L523-I526 VanDerWaalsContact O-N 3.07Å; L523-I527 VanDerWaalsContact O-CG1 3.3Å; L523-I527 WeakPolarHBondContact O-CG1 3.47Å; L523-I527 PolarHBondContact O-N 3.46Å; L523-L574 HydrophobicContact CD1-CD2 4.41Å; L523-L574 HydrophobicContact CD2-CD2 3.86Å; L523-L593 HydrophobicContact CB-CD1 3.73Å; L523-L593 HydrophobicContact CD1-CD1 3.41Å; L523-L593 VanDerWaalsContact CD1-CD1 3.41Å; L523-L593 HydrophobicContact CD1-CD2 4.42Å; L523-L593 HydrophobicContact CG-CD1 4.13Å
524	M	81	Confident	71.6	Confident	21 Å²	21	64.6 Å²	64.6	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-36.7	179.5	-68.9	-57.7	-74.4	0	0	112.1	N520 I527 L528 R600	N520-M524 WeakPolarHBondContact O-CB 3.26Å; N520-M524 VanDerWaalsContact O-CG 3.27Å; N520-M524 WeakPolarHBondContact O-CG 3.31Å; N520-M524 PolarHBondContact O-N 3.34Å; N520-M524 WeakPolarHBondContact OD1-CG 3.48Å; M524-I527 PolarHBondContact O-N 3.35Å; M524-I527 HydrophobicContact SD-CD1 4.29Å; M524-L528 VanDerWaalsContact O-CB 3.23Å; M524-L528 WeakPolarHBondContact O-CB 3.17Å; M524-L528 WeakPolarHBondContact O-CG 3.22Å; M524-L528 PolarHBondContact O-N 3.25Å; M524-R600 VanDerWaalsContact CE-NH1 3.33Å
525	K	81	Confident	69.1	Low	130 Å²	130	69.5 Å²	69.5	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-63.4	-40.1	171.8	-79.9	175.2	-178.5	175.1	0	112.5	T521 D522 L523 I527 K529	T521-K525 HydrophobicContact CG2-CD 4.31Å; T521-K525 WeakPolarHBondContact O-CB 3.39Å; T521-K525 VanDerWaalsContact O-CG 3.29Å; T521-K525 WeakPolarHBondContact O-CG 3.45Å; T521-K525 PolarHBondContact O-N 2.96Å; D522-K525 PolarHBondContact O-N 3.31Å; L523-K525 VanDerWaalsContact C-N 3.31Å; L523-K525 PolarHBondContact O-N 2.99Å; K525-I527 VanDerWaalsContact C-N 3.33Å; K525-K529 VanDerWaalsContact O-CB 3.22Å; K525-K529 WeakPolarHBondContact O-CB 3.38Å; K525-K529 PolarHBondContact O-N 3.36Å
526	I	75.7	Confident	66.5	Low	31 Å²	31	74.5 Å²	74.5	16%	0.159	39%	0.386	C	S	.	.	H	α-helix	trans	-66.1	-38.3	178.6	-69.7	162.6	0	0	0	111	L478 I480 K503 I505 D522 L523	L478-I526 HydrophobicContact CD1-CD1 3.84Å; I480-I526 HydrophobicContact CD1-CD1 3.89Å; I480-I526 HydrophobicContact CD1-CG1 4.27Å; I480-I526 HydrophobicContact CG1-CD1 4.28Å; K503-I526 HydrophobicContact CD-CG2 4.17Å; K503-I526 VanDerWaalsContact NZ-CG2 3.34Å; I505-I526 HydrophobicContact CD1-CG2 3.91Å; D522-I526 WeakPolarHBondContact O-CD1 3.33Å; D522-I526 VanDerWaalsContact O-CG1 3.23Å; D522-I526 WeakPolarHBondContact O-CG1 3.26Å; D522-I526 PolarHBondContact O-N 3.06Å; L523-I526 WeakPolarHBondContact O-CB 3.38Å; L523-I526 PolarHBondContact O-N 2.88Å; L523-I526 VanDerWaalsContact O-N 3.07Å
527	I	74.4	Confident	64	Low	16 Å²	16	83 Å²	83	8%	0.082	43%	0.431	C	S	.	.	H	α-helix	trans	-72.1	-43.3	177.5	-63.4	163.7	0	0	0	110.5	L523 M524 K525 L572	L523-I527 VanDerWaalsContact O-CG1 3.3Å; L523-I527 WeakPolarHBondContact O-CG1 3.47Å; L523-I527 PolarHBondContact O-N 3.46Å; M524-I527 PolarHBondContact O-N 3.35Å; M524-I527 HydrophobicContact SD-CD1 4.29Å; K525-I527 VanDerWaalsContact C-N 3.33Å; I527-L572 HydrophobicContact CD1-CD2 4.05Å
528	L	72.4	Confident	61.3	Low	81 Å²	81	82.5 Å²	82.5	42%	0.424	44%	0.435	S	S	.	.	H	α-helix	trans	-70.8	-38.2	-177.9	-77.3	170.7	0	0	0	113.9	M524 E530 N531 R600	M524-L528 VanDerWaalsContact O-CB 3.23Å; M524-L528 WeakPolarHBondContact O-CB 3.17Å; M524-L528 WeakPolarHBondContact O-CG 3.22Å; M524-L528 PolarHBondContact O-N 3.25Å; L528-E530 PolarHBondContact O-N 2.96Å; L528-E530 VanDerWaalsContact O-N 3.11Å; L528-N531 PolarHBondContact O-N 3.25Å; L528-R600 VanDerWaalsContact CD2-NH1 3.33Å
529	K	66.1	Low	58.9	Low	170 Å²	170	86.5 Å²	86.5	74%	0.739	46%	0.461	S	S	*	.	H	α-helix	trans	-61.9	-20.8	-178.3	-172.1	175.5	178.5	-175	0	112.9	K525 S533	K525-K529 VanDerWaalsContact O-CB 3.22Å; K525-K529 WeakPolarHBondContact O-CB 3.38Å; K525-K529 PolarHBondContact O-N 3.36Å; K529-S533 PolarHBondContact O-OG 3.14Å
530	E	55.8	Low	56.3	Low	56 Å²	56	93.1 Å²	93.1	26%	0.262	50%	0.501	S	S	.	.	H	α-helix	trans	-89.9	-34.7	-175.7	-141.9	153.4	-131.6	0	0	112.2	K503 L528 D532 S533 S534	K503-E530 WeakPolarHBondContact CD-OE2 3.32Å; K503-E530 IonicContact NZ-OE1 2.65Å; K503-E530 PolarHBondContact NZ-OE1 3.25Å; K503-E530 IonicContact NZ-OE2 3.11Å; K503-E530 PolarHBondContact NZ-OE2 2.94Å; L528-E530 PolarHBondContact O-N 2.96Å; L528-E530 VanDerWaalsContact O-N 3.11Å; E530-D532 PolarHBondContact O-N 3.07Å; E530-S533 VanDerWaalsContact CA-OG 3.31Å; E530-S533 WeakPolarHBondContact CA-OG 3.26Å; E530-S533 PolarHBondContact O-N 3.45Å; E530-S533 PolarHBondContact O-OG 3.41Å; E530-S534 PolarHBondContact O-N 2.94Å; E530-S534 PolarHBondContact O-OG 2.9Å
531	N	53.6	Low	53.6	Low	96 Å²	96	96.4 Å²	96.4	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-62	-30	173.1	-77.9	4.8	0	0	0	112.8	L528 S534	L528-N531 PolarHBondContact O-N 3.25Å; N531-S534 PolarHBondContact O-OG 3.34Å
532	D	42.4	Very low	51.1	Low	141 Å²	141	103.1 Å²	103.1	75%	0.754	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-25.5	174.2	-81.7	-19.1	0	0	0	112.6	E530	E530-D532 PolarHBondContact O-N 3.07Å
533	S	37.6	Very low	48.6	Very low	87 Å²	87	105.9 Å²	105.9	61%	0.608	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-9.2	-178.8	55.4	0	0	0	0	114.6	K529 E530 H535	K529-S533 PolarHBondContact O-OG 3.14Å; E530-S533 VanDerWaalsContact CA-OG 3.31Å; E530-S533 WeakPolarHBondContact CA-OG 3.26Å; E530-S533 PolarHBondContact O-N 3.45Å; E530-S533 PolarHBondContact O-OG 3.41Å; S533-H535 VanDerWaalsContact C-N 3.31Å
534	S	36.5	Very low	46.1	Very low	82 Å²	82	114.4 Å²	114.4	57%	0.573	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	6.9	176.2	44.9	0	0	0	0	114.6	E530 N531	E530-S534 PolarHBondContact O-N 2.94Å; E530-S534 PolarHBondContact O-OG 2.9Å; N531-S534 PolarHBondContact O-OG 3.34Å
535	H	30.8	Very low	43.8	Very low	158 Å²	158	122.4 Å²	122.4	73%	0.731	65%	0.648	S	S	*	*			trans	-117.5	99.4	168.7	-81.7	-69	0	0	0	111	S533 L537	S533-H535 VanDerWaalsContact C-N 3.31Å; H535-L537 PolarHBondContact O-N 3.34Å
536	P	28.2	Very low	41.3	Very low	106 Å²	106	123.2 Å²	123.2	69%	0.688	66%	0.658	S	S	*	*			trans	-68.6	121.7	156.8	-3.9	21.1	0	0	0	107.6	D538	P536-D538 PolarHBondContact O-N 3.24Å; P536-D538 VanDerWaalsContact O-N 3.12Å
537	L	31.8	Very low	39	Very low	179 Å²	179	127.9 Å²	127.9	94%	0.937	69%	0.689	S	S	*	*			trans	-60.9	106.7	157.2	-89.2	113.6	0	0	0	107.4	H535	H535-L537 PolarHBondContact O-N 3.34Å
538	D	27.3	Very low	36.9	Very low	150 Å²	150	134.6 Å²	134.6	80%	0.802	72%	0.724	S	S	*	*			trans	-107	130.8	160.4	-89.4	-25.9	0	0	0	109.9	P536	P536-D538 PolarHBondContact O-N 3.24Å; P536-D538 VanDerWaalsContact O-N 3.12Å
539	D	32.1	Very low	34.9	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	74%	0.743	S	S	*	*			trans	-48.3	123.4	-173.5	-80.6	-50.6	0	0	0	115.7
540	V	27.6	Very low	33	Very low	143 Å²	143	135.4 Å²	135.4	87%	0.867	74%	0.744	S	S	*	*			trans	-148.9	100.1	140.5	-176.2	0	0	0	0	109.5
541	S	27.6	Very low	32.2	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	77%	0.765	S	S	*	*				166.9	75.4	130	66.3	0	0	0	0	112.5	C543	S541-C543 PolarHBondContact O-N 2.67Å
542	K	30.8	Very low	31	Very low	213 Å²	213	141.2 Å²	141.2	93%	0.926	78%	0.782	S	S	*	*			trans	-80.4	90.8	140.3	-92.3	-176.8	177.2	173	0	107.2
543	C	27.3	Very low	30.3	Very low	106 Å²	106	140 Å²	140	72%	0.716	79%	0.785	S	S	*	*			trans	154.3	116.6	169.7	-91.7	0	0	0	0	103.4	S541	S541-C543 PolarHBondContact O-N 2.67Å
544	E	28.9	Very low	29.9	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	80%	0.798	S	S	*	*			cis	-146.2	124.7	27.3	-73.8	164.7	135.8	0	0	108.9	N546	E544-N546 PolarHBondContact O-N 3.35Å
545	Q	31.3	Very low	29.5	Very low	189 Å²	189	143.4 Å²	143.4	88%	0.883	81%	0.808	S	S	*	*			trans	-62.3	107.1	138	-108.2	154.3	-30.7	0	0	105.5
546	N	28.3	Very low	29.3	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	81%	0.814	S	S	*	*			trans	-178.5	137.5	139.1	-86.8	-24.2	0	0	0	111.8	E544	E544-N546 PolarHBondContact O-N 3.35Å
547	T	28.4	Very low	29.1	Very low	129 Å²	129	144 Å²	144	79%	0.791	82%	0.819	S	S	*	*			trans	89.4	83.7	154.7	-9.7	0	0	0	0	118.3
548	L	29.6	Very low	28.7	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	81%	0.812	S	S	*	*			trans	-56.8	148.1	138.6	-87.2	164.2	0	0	0	110.8
549	L	30.5	Very low	28.9	Very low	158 Å²	158	144.9 Å²	144.9	83%	0.827	82%	0.818	S	S	*	*			trans	79.2	129.4	166.3	-60.9	143.9	0	0	0	113.7
550	S	26.3	Very low	28.4	Very low	109 Å²	109	146.4 Å²	146.4	76%	0.762	82%	0.82	S	S	*	*			cis	-173.3	-171	22.6	74.3	0	0	0	0	108.4
551	P	39.7	Very low	28.4	Very low	106 Å²	106	144.3 Å²	144.3	69%	0.688	82%	0.818	S	S	*	*			trans	-108.5	-176.8	-141.5	33	-12.6	0	0	0	116.2
552	L	27.6	Very low	28.2	Very low	169 Å²	169	145 Å²	145	89%	0.885	82%	0.822	S	S	*	*			trans	86.2	112.5	168.2	-66.9	125.7	0	0	0	117.6
553	S	27.3	Very low	27.9	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	82%	0.821	S	S	*	*				-175.3	137.3	111.4	-176.6	0	0	0	0	111.2
554	N	29.9	Very low	27.6	Very low	164 Å²	164	150.3 Å²	150.3	88%	0.877	83%	0.83	S	S	*	*			trans	-48.5	138.8	165.9	-90.7	-16.8	0	0	0	112.4
555	G	27.5	Very low	27.3	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	83%	0.826	S	S	*	*			trans	-167.1	90.5	167	0	0	0	0	0	109.7
556	N	27.4	Very low	27.3	Very low	159 Å²	159	144 Å²	144	85%	0.85	82%	0.822	S	S	*	*			trans	-69.4	126.3	171.2	-157.3	42.6	0	0	0	108.5
557	C	23.3	Very low	27.4	Very low	118 Å²	118	142.8 Å²	142.8	80%	0.797	82%	0.824	S	S	*	*			trans	-171	106.4	157.2	-100.1	0	0	0	0	112.1
558	N	23.9	Very low	28.4	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	82%	0.817	S	S	*	*			trans	42	128.2	139.5	-62.2	-6.1	0	0	0	122.1	E560	N558-E560 PolarHBondContact O-N 3.3Å
559	E	31.3	Very low	29.5	Very low	196 Å²	196	141.1 Å²	141.1	92%	0.916	81%	0.805	S	S	*	*			trans	-40.5	118.8	156.2	-63.4	171.2	147.7	0	0	112.9
560	E	22.7	Very low	31.1	Very low	190 Å²	190	135.2 Å²	135.2	89%	0.888	78%	0.776	S	S	*	*			trans	-124.1	116.5	145.5	-79.8	-170.6	167.7	0	0	108	N558 S562	N558-E560 PolarHBondContact O-N 3.3Å; E560-S562 PolarHBondContact O-N 3.5Å
561	A	27.1	Very low	33.4	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	74%	0.741	S	S	*	*			trans	-59.7	115.7	177	0	0	0	0	0	109.7	Q563	A561-Q563 PolarHBondContact O-N 3.09Å; A561-Q563 VanDerWaalsContact O-N 3.08Å
562	S	24.2	Very low	35.3	Very low	114 Å²	114	125.4 Å²	125.4	80%	0.797	71%	0.71	S	S	*	*			trans	-69.5	108.9	166	71	0	0	0	0	108.7	E560 R564	E560-S562 PolarHBondContact O-N 3.5Å; S562-R564 PolarHBondContact O-N 3.2Å
563	Q	23.3	Very low	38	Very low	191 Å²	191	117.3 Å²	117.3	89%	0.893	67%	0.667	S	S	*	*			trans	-53.3	113.4	171.7	-128.2	158.8	-16.1	0	0	109	A561 C565	A561-Q563 PolarHBondContact O-N 3.09Å; A561-Q563 VanDerWaalsContact O-N 3.08Å; Q563-C565 PolarHBondContact O-N 3.45Å
564	R	21.6	Very low	40.7	Very low	240 Å²	240	112 Å²	112	91%	0.906	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-68.1	125	169.9	-81.7	-179.7	177.4	157	-0.3	109	S562	S562-R564 PolarHBondContact O-N 3.2Å
565	C	22.6	Very low	43.3	Very low	113 Å²	113	105.2 Å²	105.2	76%	0.764	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-55.3	147.7	166.4	-65.9	0	0	0	0	110.7	Q563 C567	Q563-C565 PolarHBondContact O-N 3.45Å; C565-C567 PolarHBondContact O-N 3.46Å
566	P	30.1	Very low	45.9	Very low	123 Å²	123	101.6 Å²	101.6	80%	0.799	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.6	119.3	-176.9	-0.9	15.9	0	0	0	109.3	D568	P566-D568 PolarHBondContact O-N 3.32Å
567	C	32.1	Very low	48.6	Very low	120 Å²	120	99.6 Å²	99.6	81%	0.811	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-57	129.1	166.1	-79.2	0	0	0	0	109.3	C565 K569	C565-C567 PolarHBondContact O-N 3.46Å; C567-K569 PolarHBondContact O-N 2.96Å
568	D	47.4	Very low	51	Low	123 Å²	123	94.7 Å²	94.7	66%	0.658	52%	0.515	S	S	*	.			trans	-53.1	115.2	167.3	-82.9	-41.9	0	0	0	109.4	P566 C570	P566-D568 PolarHBondContact O-N 3.32Å; D568-C570 PolarHBondContact O-N 3.24Å
569	K	54.1	Low	53.7	Low	130 Å²	130	87.7 Å²	87.7	57%	0.565	48%	0.477	S	S	*	.			trans	-65.7	106.5	-179.7	-73	-176.6	178.3	-178.3	0	109.8	Q500 C567	Q500-K569 PolarHBondContact NE2-O 2.98Å; C567-K569 PolarHBondContact O-N 2.96Å
570	C	63.8	Low	56	Low	34 Å²	34	83.8 Å²	83.8	23%	0.23	47%	0.467	C	S	.	.			trans	-70.3	127.8	169.1	-174.3	0	0	0	0	109.3	D568 V602 D603	D568-C570 PolarHBondContact O-N 3.24Å; C570-V602 WeakPolarHBondContact O-CG1 3.26Å; C570-D603 PolarHBondContact O-N 3.48Å
571	S	74.6	Confident	58.9	Low	4 Å²	4	80.9 Å²	80.9	3%	0.028	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.3	176.5	-60.7	0	0	0	0	109.8	V502 K503 D603	V502-S571 WeakPolarHBondContact CA-O 3.22Å; K503-S571 PolarHBondContact N-O 2.99Å; S571-D603 CarbonylContact C-O 3.57Å; S571-D603 WeakPolarHBondContact CA-O 3.16Å
572	L	80.3	Confident	61.8	Low	4 Å²	4	78.2 Å²	78.2	2%	0.021	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.6	-178.2	179.4	68.9	0	0	0	110.2	K503 I505 I527 L574 V602 D603 V604 F605	K503-L572 HydrophobicContact CB-CD1 4.09Å; K503-L572 HydrophobicContact CG-CD1 4.42Å; I505-L572 HydrophobicContact CD1-CD1 3.62Å; I505-L572 HydrophobicContact CG1-CD1 3.87Å; I527-L572 HydrophobicContact CD1-CD2 4.05Å; L572-L574 HydrophobicContact CD2-CD2 4.29Å; L572-L574 HydrophobicContact CD2-CG 4.33Å; L572-L574 HydrophobicContact CG-CG 4.46Å; L572-V602 HydrophobicContact CB-CG1 3.99Å; L572-D603 PolarHBondContact N-O 2.89Å; L572-V604 HydrophobicContact CB-CG2 4.37Å; L572-V604 HydrophobicContact CD2-CG1 4.45Å; L572-V604 HydrophobicContact CD2-CG2 4.2Å; L572-V604 CarbonylContact O-C 3.54Å; L572-V604 WeakPolarHBondContact O-CA 3.32Å; L572-F605 PolarHBondContact O-N 2.83Å
573	V	82.8	Confident	64.9	Low	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.7	171.7	-176	0	0	0	0	109.1	V502 K503 I504 I505 F605 A607 V634 A637 I641	V502-V573 HydrophobicContact CG1-CG2 4.04Å; K503-V573 PolarHBondContact O-N 3.39Å; I504-V573 CarbonylContact C-O 3.56Å; I504-V573 WeakPolarHBondContact CA-O 3.2Å; I504-V573 HydrophobicContact CG1-CB 4.19Å; I505-V573 PolarHBondContact N-O 3.42Å; V573-F605 CarbonylContact C-O 3.6Å; V573-F605 WeakPolarHBondContact CA-O 3.39Å; V573-F605 HydrophobicContact CG2-CB 4.36Å; V573-A607 HydrophobicContact CG1-CB 4.1Å; V573-V634 HydrophobicContact CG1-CG1 4.36Å; V573-A637 HydrophobicContact CG1-CB 4.12Å; V573-A637 HydrophobicContact CG2-CB 4.49Å; V573-I641 HydrophobicContact CG2-CD1 3.84Å
574	L	83.9	Confident	68	Low	2 Å²	2	73.6 Å²	73.6	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	111.3	172.9	-70.2	173	0	0	0	109	I505 I507 L523 L572 L593 V604 F605 L606 A607	I505-L574 HydrophobicContact CB-CD2 4.15Å; I505-L574 HydrophobicContact CG2-CD2 4.45Å; I505-L574 WeakPolarHBondContact O-CA 3.36Å; I507-L574 HydrophobicContact CD1-CD2 4.47Å; L523-L574 HydrophobicContact CD1-CD2 4.41Å; L523-L574 HydrophobicContact CD2-CD2 3.86Å; L572-L574 HydrophobicContact CD2-CD2 4.29Å; L572-L574 HydrophobicContact CD2-CG 4.33Å; L572-L574 HydrophobicContact CG-CG 4.46Å; L574-L593 HydrophobicContact CD1-CD2 4.19Å; L574-V604 HydrophobicContact CD1-CG1 3.66Å; L574-V604 HydrophobicContact CG-CG1 4.12Å; L574-F605 PolarHBondContact N-O 2.9Å; L574-L606 HydrophobicContact CB-CD2 3.89Å; L574-L606 HydrophobicContact CD1-CD2 3.92Å; L574-A607 PolarHBondContact O-N 3.46Å
575	D	84.5	Confident	71.2	Confident	22 Å²	22	65 Å²	65	12%	0.118	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112	173.1	170.7	29.4	0	0	0	109.9	I505 S506 I507 N577 N608 V634	I505-D575 PolarHBondContact O-N 3.44Å; S506-D575 WeakPolarHBondContact CB-OD2 3.4Å; S506-D575 PolarHBondContact OG-OD2 2.9Å; I507-D575 PolarHBondContact N-O 2.95Å; D575-N577 VanDerWaalsContact OD1-CB 3.3Å; D575-N577 WeakPolarHBondContact OD1-CB 3.13Å; D575-N577 PolarHBondContact OD1-N 3.16Å; D575-N577 VanDerWaalsContact OD1-N 3.15Å; D575-N608 PolarHBondContact OD1-ND2 2.9Å; D575-V634 HydrophobicContact CB-CG2 3.84Å
576	C	83.8	Confident	74.3	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.014	32%	0.32	C	S	.	.			trans	-95.4	10.3	-175.5	-66.1	0	0	0	0	113.8	G578 L579 A607 N608 L613	C576-G578 PolarHBondContact O-N 3.05Å; C576-L579 HydrophobicContact CB-CD1 3.71Å; C576-L579 WeakPolarHBondContact O-CB 3.3Å; C576-L579 PolarHBondContact O-N 2.92Å; C576-A607 WeakPolarHBondContact CB-O 3.48Å; C576-A607 PolarHBondContact N-O 3.01Å; C576-N608 CarbonylContact C-O 3.55Å; C576-L613 HydrophobicContact CB-CD2 4.23Å
577	N	82.4	Confident	77	Confident	117 Å²	117	54 Å²	54	63%	0.626	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.6	-176.3	-171.5	34.3	0	0	0	113.5	D575 L579 N608	D575-N577 VanDerWaalsContact OD1-CB 3.3Å; D575-N577 WeakPolarHBondContact OD1-CB 3.13Å; D575-N577 PolarHBondContact OD1-N 3.16Å; D575-N577 VanDerWaalsContact OD1-N 3.15Å; N577-L579 VanDerWaalsContact C-N 3.32Å; N577-L579 PolarHBondContact O-N 3.31Å; N577-N608 HydrophobicContact CB-CB 3.8Å
578	G	74.3	Confident	79.7	Confident	14 Å²	14	49.5 Å²	49.5	14%	0.144	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-2.3	178.9	0	0	0	0	0	115.5	I507 C576 T580	I507-G578 CarbonylContact O-C 3.58Å; I507-G578 WeakPolarHBondContact O-CA 3.28Å; I507-G578 PolarHBondContact O-N 3.18Å; C576-G578 PolarHBondContact O-N 3.05Å; G578-T580 PolarHBondContact O-N 3.37Å
579	L	80.6	Confident	81.6	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	23%	0.227	C	C	.	.			trans	-77.5	72	176.1	-76.1	163.5	0	0	0	111.2	I507 L511 C576 N577 L613	I507-L579 HydrophobicContact CB-CD1 4.39Å; I507-L579 HydrophobicContact CB-CG 4.31Å; I507-L579 HydrophobicContact CD1-CD1 4.16Å; I507-L579 HydrophobicContact CG2-CD1 4.24Å; I507-L579 HydrophobicContact CG2-CD2 3.88Å; I507-L579 HydrophobicContact CG2-CG 3.86Å; L511-L579 HydrophobicContact CB-CD2 3.33Å; L511-L579 HydrophobicContact CD2-CD2 4.26Å; L511-L579 HydrophobicContact CG-CD2 4.41Å; C576-L579 HydrophobicContact CB-CD1 3.71Å; C576-L579 WeakPolarHBondContact O-CB 3.3Å; C576-L579 PolarHBondContact O-N 2.92Å; N577-L579 VanDerWaalsContact C-N 3.32Å; N577-L579 PolarHBondContact O-N 3.31Å; L579-L613 HydrophobicContact CD1-CD2 4.05Å
580	T	80.3	Confident	83.2	Confident	115 Å²	115	38.3 Å²	38.3	71%	0.706	20%	0.201	S	C	*	.			trans	-71.5	-31.8	178.4	50.9	0	0	0	0	113.4	G578	G578-T580 PolarHBondContact O-N 3.37Å
581	F	83.3	Confident	84.3	Confident	128 Å²	128	37.1 Å²	37.1	56%	0.561	19%	0.192	S	C	*	.			trans	-144.7	143.4	-178.9	178	-95.1	0	0	0	110.9	P510 L511 V512	P510-F581 CarbonylContact C-O 3.58Å; P510-F581 WeakPolarHBondContact CA-O 3.3Å; P510-F581 HydrophobicContact CB-CB 4.07Å; P510-F581 HydrophobicContact CB-CD1 4.46Å; P510-F581 VanDerWaalsContact CB-O 3.31Å; P510-F581 WeakPolarHBondContact CB-O 3.42Å; L511-F581 PolarHBondContact N-O 2.92Å; V512-F581 HydrophobicContact CG1-CD1 3.58Å; V512-F581 HydrophobicContact CG1-CE1 3.5Å; V512-F581 VanDerWaalsContact CG1-CE1 3.5Å
582	F	87.9	Confident	84.9	Confident	44 Å²	44	41.5 Å²	41.5	19%	0.193	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-149.8	152.9	178.5	50.9	-94.8	0	0	0	112.3	L511 V587 L613 A616	L511-F582 HydrophobicContact CB-CB 4.4Å; L511-F582 WeakPolarHBondContact O-CA 3.27Å; L511-F582 WeakPolarHBondContact O-CB 3.41Å; F582-V587 HydrophobicContact CB-CG2 4.28Å; F582-V587 HydrophobicContact CD2-CG2 3.42Å; F582-V587 VanDerWaalsContact CD2-CG2 3.42Å; F582-V587 HydrophobicContact CE2-CG2 4.08Å; F582-V587 HydrophobicContact CG-CG2 4.08Å; F582-L613 HydrophobicContact CD1-CD1 3.97Å; F582-L613 HydrophobicContact CD2-CD1 4.37Å; F582-L613 HydrophobicContact CE1-CB 3.77Å; F582-L613 HydrophobicContact CE1-CD1 3.96Å; F582-L613 HydrophobicContact CE1-CG 4.43Å; F582-L613 HydrophobicContact CE2-CD1 4.36Å; F582-L613 HydrophobicContact CG-CD1 4.19Å; F582-L613 HydrophobicContact CZ-CB 3.93Å; F582-L613 HydrophobicContact CZ-CD1 4.17Å; F582-A616 HydrophobicContact CD2-CB 4.44Å; F582-A616 HydrophobicContact CE2-CB 3.67Å; F582-A616 HydrophobicContact CZ-CB 4.38Å
583	D	89.6	Confident	85.2	Confident	39 Å²	39	41.4 Å²	41.4	21%	0.209	21%	0.212	C	C	.	.			trans	-113.8	178.2	172.9	70.6	11.4	0	0	0	112.2	L511 V512 F513 T585 G586 V587	L511-D583 PolarHBondContact O-N 3.02Å; L511-D583 VanDerWaalsContact O-N 3.15Å; V512-D583 WeakPolarHBondContact CA-OD1 3.29Å; V512-D583 WeakPolarHBondContact CA-OD2 3.38Å; V512-D583 HydrophobicContact CG1-CB 4.41Å; F513-D583 WeakPolarHBondContact CD1-OD2 3.42Å; F513-D583 PolarHBondContact N-OD1 3.44Å; F513-D583 PolarHBondContact N-OD2 3.48Å; D583-T585 PolarHBondContact O-N 2.86Å; D583-T585 PolarHBondContact OD1-N 3.5Å; D583-G586 PolarHBondContact O-N 3.46Å; D583-G586 PolarHBondContact OD1-N 3.43Å; D583-V587 WeakPolarHBondContact O-CG2 3.3Å; D583-V587 PolarHBondContact O-N 2.89Å
584	Y	88.7	Confident	85.3	Confident	168 Å²	168	42 Å²	42	66%	0.659	21%	0.214	S	C	*	.	H	α-helix	trans	-57.9	-45.6	-179.9	176.7	-95.1	0	0	0	112.4	G586 V587 S588 C620	Y584-G586 VanDerWaalsContact C-N 3.32Å; Y584-G586 PolarHBondContact O-N 2.93Å; Y584-V587 PolarHBondContact O-N 3.48Å; Y584-S588 WeakPolarHBondContact O-CB 3.36Å; Y584-S588 PolarHBondContact O-N 3.38Å; Y584-C620 WeakPolarHBondContact CE2-SG 3.46Å
585	T	87.7	Confident	85.3	Confident	59 Å²	59	45.9 Å²	45.9	36%	0.362	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-41.7	179.8	-56.9	0	0	0	0	111.2	F513 A516 D583 S588 T589	F513-T585 HydrophobicContact CB-CG2 4.17Å; A516-T585 HydrophobicContact CB-CG2 4.46Å; D583-T585 PolarHBondContact O-N 2.86Å; D583-T585 PolarHBondContact OD1-N 3.5Å; T585-S588 PolarHBondContact O-N 2.86Å; T585-T589 WeakPolarHBondContact O-CB 3.17Å; T585-T589 PolarHBondContact O-N 3.26Å; T585-T589 PolarHBondContact O-OG1 2.95Å
586	G	87.3	Confident	85.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-49.1	175.3	0	0	0	0	0	112.8	L511 D583 Y584 T589 L590	L511-G586 VanDerWaalsContact CD2-O 3.22Å; L511-G586 WeakPolarHBondContact CD2-O 3.41Å; D583-G586 PolarHBondContact O-N 3.46Å; D583-G586 PolarHBondContact OD1-N 3.43Å; Y584-G586 VanDerWaalsContact C-N 3.32Å; Y584-G586 PolarHBondContact O-N 2.93Å; G586-T589 PolarHBondContact O-N 2.95Å; G586-L590 PolarHBondContact O-N 2.87Å
587	V	88.5	Confident	85.2	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-43.6	177.6	177.1	0	0	0	0	111.3	F582 D583 Y584 T589 L590 V591 L613 A616 M617 C620	F582-V587 HydrophobicContact CB-CG2 4.28Å; F582-V587 HydrophobicContact CD2-CG2 3.42Å; F582-V587 VanDerWaalsContact CD2-CG2 3.42Å; F582-V587 HydrophobicContact CE2-CG2 4.08Å; F582-V587 HydrophobicContact CG-CG2 4.08Å; D583-V587 WeakPolarHBondContact O-CG2 3.3Å; D583-V587 PolarHBondContact O-N 2.89Å; Y584-V587 PolarHBondContact O-N 3.48Å; V587-T589 VanDerWaalsContact C-N 3.35Å; V587-T589 PolarHBondContact O-N 3.34Å; V587-L590 WeakPolarHBondContact O-CB 3.36Å; V587-L590 PolarHBondContact O-N 2.54Å; V587-L590 VanDerWaalsContact O-N 3.16Å; V587-V591 WeakPolarHBondContact O-CG2 3.37Å; V587-V591 PolarHBondContact O-N 3.43Å; V587-L613 HydrophobicContact CG2-CD1 4.31Å; V587-A616 HydrophobicContact CG1-CB 4.18Å; V587-A616 HydrophobicContact CG2-CB 4.03Å; V587-M617 HydrophobicContact CG1-CG 4.01Å; V587-C620 HydrophobicContact CG1-CB 3.8Å
588	S	88.3	Confident	85.1	Confident	26 Å²	26	45.4 Å²	45.4	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-46.6	176.3	-169	0	0	0	0	111.5	Y584 T585 L590 V591 E592	Y584-S588 WeakPolarHBondContact O-CB 3.36Å; Y584-S588 PolarHBondContact O-N 3.38Å; T585-S588 PolarHBondContact O-N 2.86Å; S588-L590 VanDerWaalsContact C-N 3.31Å; S588-L590 PolarHBondContact O-N 2.93Å; S588-V591 PolarHBondContact O-N 3Å; S588-E592 WeakPolarHBondContact O-CG 3.3Å; S588-E592 PolarHBondContact O-N 2.94Å; S588-E592 PolarHBondContact OG-OE1 3.39Å
589	T	86.9	Confident	85.4	Confident	15 Å²	15	49.1 Å²	49.1	9%	0.092	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-33.4	177.8	-58.7	0	0	0	0	112.5	A516 N520 T585 G586 V587 L593	A516-T589 HydrophobicContact CB-CG2 4.35Å; N520-T589 HydrophobicContact CB-CG2 3.65Å; T585-T589 WeakPolarHBondContact O-CB 3.17Å; T585-T589 PolarHBondContact O-N 3.26Å; T585-T589 PolarHBondContact O-OG1 2.95Å; G586-T589 PolarHBondContact O-N 2.95Å; V587-T589 VanDerWaalsContact C-N 3.35Å; V587-T589 PolarHBondContact O-N 3.34Å; T589-L593 VanDerWaalsContact O-CB 3.26Å; T589-L593 WeakPolarHBondContact O-CB 3.46Å; T589-L593 PolarHBondContact O-N 3.42Å
590	L	87.4	Confident	85.3	Confident	4 Å²	4	55 Å²	55	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-68.3	-39.1	174.8	-171.7	68.2	0	0	0	111.8	I507 L511 G586 V587 S588 L593 Y594 L613 M617	I507-L590 HydrophobicContact CD1-CD1 4.45Å; L511-L590 HydrophobicContact CD2-CB 4.1Å; G586-L590 PolarHBondContact O-N 2.87Å; V587-L590 WeakPolarHBondContact O-CB 3.36Å; V587-L590 PolarHBondContact O-N 2.54Å; V587-L590 VanDerWaalsContact O-N 3.16Å; S588-L590 VanDerWaalsContact C-N 3.31Å; S588-L590 PolarHBondContact O-N 2.93Å; L590-L593 PolarHBondContact O-N 2.94Å; L590-Y594 PolarHBondContact O-N 3.42Å; L590-L613 HydrophobicContact CD2-CD1 4.44Å; L590-M617 HydrophobicContact CD2-CE 4.4Å; L590-M617 HydrophobicContact CD2-SD 3.87Å; L590-M617 HydrophobicContact CG-CE 4.47Å
591	V	87.5	Confident	84.9	Confident	8 Å²	8	51.8 Å²	51.8	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-67.4	-45.9	175.1	173.5	0	0	0	0	110.9	V587 S588 L593 Y594 L595 M617	V587-V591 WeakPolarHBondContact O-CG2 3.37Å; V587-V591 PolarHBondContact O-N 3.43Å; S588-V591 PolarHBondContact O-N 3Å; V591-L593 VanDerWaalsContact C-N 3.29Å; V591-L593 PolarHBondContact O-N 3.26Å; V591-Y594 WeakPolarHBondContact O-CB 3.49Å; V591-Y594 PolarHBondContact O-N 3.39Å; V591-L595 HydrophobicContact CG1-CD1 4.15Å; V591-L595 WeakPolarHBondContact O-CG 3.42Å; V591-L595 PolarHBondContact O-N 3.45Å; V591-M617 HydrophobicContact CG2-CB 4.39Å; V591-M617 HydrophobicContact CG2-CE 3.84Å; V591-M617 HydrophobicContact CG2-CG 4.26Å
592	E	87.3	Confident	84.7	Confident	96 Å²	96	46.2 Å²	46.2	45%	0.449	24%	0.241	S	C	.	.	H	α-helix	trans	-56.3	-44.9	173.6	-76.1	167.8	-160.3	0	0	111.1	S588 Y594 L595 D596	S588-E592 WeakPolarHBondContact O-CG 3.3Å; S588-E592 PolarHBondContact O-N 2.94Å; S588-E592 PolarHBondContact OG-OE1 3.39Å; E592-Y594 VanDerWaalsContact C-N 3.34Å; E592-Y594 PolarHBondContact O-N 3.21Å; E592-L595 PolarHBondContact O-N 3.03Å; E592-D596 WeakPolarHBondContact O-CB 3.5Å; E592-D596 PolarHBondContact O-N 3.01Å
593	L	85.4	Confident	84.3	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-41.2	177.4	-172.9	149.9	0	0	0	112.2	N520 L523 L574 T589 L590 V591 D596 C597	N520-L593 HydrophobicContact CB-CD1 4.45Å; L523-L593 HydrophobicContact CB-CD1 3.73Å; L523-L593 HydrophobicContact CD1-CD1 3.41Å; L523-L593 VanDerWaalsContact CD1-CD1 3.41Å; L523-L593 HydrophobicContact CD1-CD2 4.42Å; L523-L593 HydrophobicContact CG-CD1 4.13Å; L574-L593 HydrophobicContact CD1-CD2 4.19Å; T589-L593 VanDerWaalsContact O-CB 3.26Å; T589-L593 WeakPolarHBondContact O-CB 3.46Å; T589-L593 PolarHBondContact O-N 3.42Å; L590-L593 PolarHBondContact O-N 2.94Å; V591-L593 VanDerWaalsContact C-N 3.29Å; V591-L593 PolarHBondContact O-N 3.26Å; L593-D596 PolarHBondContact O-N 3.18Å; L593-C597 WeakPolarHBondContact O-CB 3.11Å; L593-C597 PolarHBondContact O-N 3.5Å; L593-C597 PolarHBondContact O-SG 3.41Å
594	Y	85.8	Confident	83.9	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-47.1	175.7	176.5	-96.5	0	0	0	111.4	L590 V591 E592 K598 V604 P628	L590-Y594 PolarHBondContact O-N 3.42Å; V591-Y594 WeakPolarHBondContact O-CB 3.49Å; V591-Y594 PolarHBondContact O-N 3.39Å; E592-Y594 VanDerWaalsContact C-N 3.34Å; E592-Y594 PolarHBondContact O-N 3.21Å; Y594-K598 HydrophobicContact CE1-CD 4.42Å; Y594-K598 WeakPolarHBondContact O-CB 3.39Å; Y594-K598 PolarHBondContact O-N 3.26Å; Y594-K598 VanDerWaalsContact O-N 3.09Å; Y594-V604 HydrophobicContact CD2-CB 3.96Å; Y594-V604 HydrophobicContact CD2-CG1 4.1Å; Y594-V604 HydrophobicContact CE2-CB 4.11Å; Y594-P628 HydrophobicContact CE1-CB 4.39Å; Y594-P628 HydrophobicContact CE1-CG 4.43Å; Y594-P628 HydrophobicContact CE2-CB 4.22Å
595	L	84.2	Confident	83.7	Confident	83 Å²	83	38.6 Å²	38.6	44%	0.435	21%	0.213	S	C	.	.	H	α-helix	trans	-65.4	-42.9	178.1	-66	173	0	0	0	111.9	V591 E592 K598 S599	V591-L595 HydrophobicContact CG1-CD1 4.15Å; V591-L595 WeakPolarHBondContact O-CG 3.42Å; V591-L595 PolarHBondContact O-N 3.45Å; E592-L595 PolarHBondContact O-N 3.03Å; L595-K598 PolarHBondContact O-N 3.35Å; L595-S599 PolarHBondContact O-N 3.14Å
596	D	84.7	Confident	83.7	Confident	70 Å²	70	35.9 Å²	35.9	37%	0.374	20%	0.196	S	C	.	.	H	α-helix	trans	-62.3	-44.6	177.7	-89	5.1	0	0	0	111.7	E592 L593 K598 S599 R600	E592-D596 WeakPolarHBondContact O-CB 3.5Å; E592-D596 PolarHBondContact O-N 3.01Å; L593-D596 PolarHBondContact O-N 3.18Å; D596-K598 VanDerWaalsContact C-N 3.31Å; D596-K598 PolarHBondContact O-N 2.99Å; D596-S599 PolarHBondContact O-N 2.94Å; D596-S599 PolarHBondContact O-OG 3.44Å; D596-R600 WeakPolarHBondContact O-CG 3.45Å; D596-R600 PolarHBondContact O-N 3.21Å
597	C	81.4	Confident	83.5	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-40.7	177.1	-68.2	0	0	0	0	111.5	L593 R600 G601 V602 V604	L593-C597 WeakPolarHBondContact O-CB 3.11Å; L593-C597 PolarHBondContact O-N 3.5Å; L593-C597 PolarHBondContact O-SG 3.41Å; C597-R600 PolarHBondContact O-N 2.94Å; C597-R600 VanDerWaalsContact O-N 3.16Å; C597-G601 PolarHBondContact O-N 3.43Å; C597-V602 HydrophobicContact CB-CB 4.48Å; C597-V602 PolarHBondContact O-N 3.23Å; C597-V602 VanDerWaalsContact O-N 3.14Å; C597-V604 HydrophobicContact CB-CG2 3.29Å
598	K	80.4	Confident	83.3	Confident	60 Å²	60	37.8 Å²	37.8	26%	0.261	21%	0.206	S	C	.	.	H	α-helix	trans	-68.8	-39.1	-180	-165.7	160.9	-174.6	-171	0	112.8	Y594 L595 D596 R600 G601 E626	Y594-K598 HydrophobicContact CE1-CD 4.42Å; Y594-K598 WeakPolarHBondContact O-CB 3.39Å; Y594-K598 PolarHBondContact O-N 3.26Å; Y594-K598 VanDerWaalsContact O-N 3.09Å; L595-K598 PolarHBondContact O-N 3.35Å; D596-K598 VanDerWaalsContact C-N 3.31Å; D596-K598 PolarHBondContact O-N 2.99Å; K598-R600 PolarHBondContact O-N 3.33Å; K598-R600 VanDerWaalsContact O-N 3.14Å; K598-G601 PolarHBondContact O-N 3.01Å; K598-E626 WeakPolarHBondContact CD-OE2 3.33Å; K598-E626 WeakPolarHBondContact CE-OE1 3.44Å; K598-E626 WeakPolarHBondContact CE-OE2 3.43Å; K598-E626 VanDerWaalsContact NZ-CB 3.34Å; K598-E626 IonicContact NZ-OE1 3.82Å; K598-E626 PolarHBondContact NZ-OE1 2.95Å; K598-E626 IonicContact NZ-OE2 2.8Å; K598-E626 PolarHBondContact NZ-OE2 2.84Å
599	S	80.3	Confident	83	Confident	93 Å²	93	37.6 Å²	37.6	65%	0.65	21%	0.205	S	C	*	.	H	α-helix	trans	-59.3	-23.6	172.8	77.1	0	0	0	0	113.2	L595 D596	L595-S599 PolarHBondContact O-N 3.14Å; D596-S599 PolarHBondContact O-N 2.94Å; D596-S599 PolarHBondContact O-OG 3.44Å
600	R	78.3	Confident	82.9	Confident	127 Å²	127	40 Å²	40	48%	0.479	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	5.1	177.9	-65.7	174.4	-177.3	-143.5	0	113.8	M524 L528 D596 C597 K598	M524-R600 VanDerWaalsContact CE-NH1 3.33Å; L528-R600 VanDerWaalsContact CD2-NH1 3.33Å; D596-R600 WeakPolarHBondContact O-CG 3.45Å; D596-R600 PolarHBondContact O-N 3.21Å; C597-R600 PolarHBondContact O-N 2.94Å; C597-R600 VanDerWaalsContact O-N 3.16Å; K598-R600 PolarHBondContact O-N 3.33Å; K598-R600 VanDerWaalsContact O-N 3.14Å
601	G	73.2	Confident	82.7	Confident	46 Å²	46	43.7 Å²	43.7	47%	0.474	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	18.2	179	0	0	0	0	0	115	C597 K598	C597-G601 PolarHBondContact O-N 3.43Å; K598-G601 PolarHBondContact O-N 3.01Å
602	V	78.7	Confident	82.5	Confident	12 Å²	12	47.2 Å²	47.2	7%	0.073	28%	0.275	C	S	.	.			trans	-95.9	121.1	174.5	179.5	0	0	0	0	109.1	C570 L572 C597 V604	C570-V602 WeakPolarHBondContact O-CG1 3.26Å; L572-V602 HydrophobicContact CB-CG1 3.99Å; C597-V602 HydrophobicContact CB-CB 4.48Å; C597-V602 PolarHBondContact O-N 3.23Å; C597-V602 VanDerWaalsContact O-N 3.14Å; V602-V604 HydrophobicContact CG1-CG2 4.44Å; V602-V604 PolarHBondContact O-N 3.28Å
603	D	78.6	Confident	82.4	Confident	62 Å²	62	42.8 Å²	42.8	33%	0.332	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.4	176.9	-73.3	-39.3	0	0	0	109.8	C570 S571 L572 F605	C570-D603 PolarHBondContact O-N 3.48Å; S571-D603 CarbonylContact C-O 3.57Å; S571-D603 WeakPolarHBondContact CA-O 3.16Å; L572-D603 PolarHBondContact N-O 2.89Å; D603-F605 HydrophobicContact CB-CE2 3.83Å; D603-F605 HydrophobicContact CB-CZ 4.08Å
604	V	82.3	Confident	82.3	Confident	8 Å²	8	45.3 Å²	45.3	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.1	179.9	-174.9	0	0	0	0	111.3	L572 L574 Y594 C597 V602	L572-V604 HydrophobicContact CB-CG2 4.37Å; L572-V604 HydrophobicContact CD2-CG1 4.45Å; L572-V604 HydrophobicContact CD2-CG2 4.2Å; L572-V604 CarbonylContact O-C 3.54Å; L572-V604 WeakPolarHBondContact O-CA 3.32Å; L574-V604 HydrophobicContact CD1-CG1 3.66Å; L574-V604 HydrophobicContact CG-CG1 4.12Å; Y594-V604 HydrophobicContact CD2-CB 3.96Å; Y594-V604 HydrophobicContact CD2-CG1 4.1Å; Y594-V604 HydrophobicContact CE2-CB 4.11Å; C597-V604 HydrophobicContact CB-CG2 3.29Å; V602-V604 HydrophobicContact CG1-CG2 4.44Å; V602-V604 PolarHBondContact O-N 3.28Å
605	F	84.6	Confident	82.3	Confident	21 Å²	21	50.8 Å²	50.8	9%	0.092	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.8	177.4	-59.2	-74.3	0	0	0	110.6	L572 V573 L574 D603 I629 F631 I641	L572-F605 PolarHBondContact O-N 2.83Å; V573-F605 CarbonylContact C-O 3.6Å; V573-F605 WeakPolarHBondContact CA-O 3.39Å; V573-F605 HydrophobicContact CG2-CB 4.36Å; L574-F605 PolarHBondContact N-O 2.9Å; D603-F605 HydrophobicContact CB-CE2 3.83Å; D603-F605 HydrophobicContact CB-CZ 4.08Å; F605-I629 HydrophobicContact CD1-CB 4.25Å; F605-I629 HydrophobicContact CD1-CD1 4.37Å; F605-I629 HydrophobicContact CD1-CG2 4.42Å; F605-I629 HydrophobicContact CE1-CD1 3.97Å; F605-F631 HydrophobicContact CB-CD2 4.15Å; F605-F631 HydrophobicContact CB-CE2 3.86Å; F605-F631 AromaticContact CD1-CE2 3.51Å; F605-F631 HydrophobicContact CD1-CE2 3.51Å; F605-F631 HydrophobicContact CD1-CZ 4.18Å; F605-F631 HydrophobicContact CE1-CE2 4.34Å; F605-F631 AromaticContact CG-CE2 3.95Å; F605-F631 HydrophobicContact CG-CE2 3.95Å; F605-I641 HydrophobicContact CD2-CD1 3.51Å; F605-I641 HydrophobicContact CD2-CG1 3.81Å; F605-I641 HydrophobicContact CE1-CG1 4.47Å; F605-I641 HydrophobicContact CE2-CD1 3.62Å; F605-I641 HydrophobicContact CE2-CG1 3.45Å; F605-I641 VanDerWaalsContact CE2-CG1 3.45Å; F605-I641 HydrophobicContact CG-CD1 4.28Å; F605-I641 HydrophobicContact CG-CG1 4.45Å; F605-I641 HydrophobicContact CZ-CD1 4.43Å; F605-I641 HydrophobicContact CZ-CG1 3.8Å
606	L	86.1	Confident	82.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.2	-179.2	-70.3	158.2	0	0	0	109.5	L574 M617 P628 I629 F630 F631	L574-L606 HydrophobicContact CB-CD2 3.89Å; L574-L606 HydrophobicContact CD1-CD2 3.92Å; L606-M617 HydrophobicContact CD1-CE 3.87Å; L606-M617 HydrophobicContact CD1-SD 4Å; L606-P628 HydrophobicContact CD1-CB 4.03Å; L606-I629 PolarHBondContact N-O 3.35Å; L606-F630 HydrophobicContact CB-CD1 4Å; L606-F630 HydrophobicContact CB-CE1 4.37Å; L606-F630 HydrophobicContact CD1-CD1 4.19Å; L606-F630 HydrophobicContact CD1-CE1 3.74Å; L606-F630 HydrophobicContact CD1-CZ 4.45Å; L606-F630 CarbonylContact O-C 3.47Å; L606-F630 WeakPolarHBondContact O-CA 3.2Å; L606-F631 PolarHBondContact O-N 3.46Å
607	A	83.9	Confident	82.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.9	-179.6	0	0	0	0	0	111.7	V573 L574 C576 C609 F631 V634	V573-A607 HydrophobicContact CG1-CB 4.1Å; L574-A607 PolarHBondContact O-N 3.46Å; C576-A607 WeakPolarHBondContact CB-O 3.48Å; C576-A607 PolarHBondContact N-O 3.01Å; A607-C609 VanDerWaalsContact C-N 3.3Å; A607-C609 PolarHBondContact O-N 3.48Å; A607-F631 CarbonylContact C-O 3.55Å; A607-F631 WeakPolarHBondContact CA-O 3.26Å; A607-F631 HydrophobicContact CB-CB 4.5Å; A607-V634 HydrophobicContact CB-CB 4.46Å; A607-V634 HydrophobicContact CB-CG2 3.77Å
608	N	83.6	Confident	82.1	Confident	45 Å²	45	48.5 Å²	48.5	24%	0.241	29%	0.286	C	S	.	.	S	Bend	trans	56.3	37.3	178.5	-63.7	-36.9	0	0	0	113.9	D575 C576 N577 F631 D632 S633	D575-N608 PolarHBondContact OD1-ND2 2.9Å; C576-N608 CarbonylContact C-O 3.55Å; N577-N608 HydrophobicContact CB-CB 3.8Å; N608-F631 PolarHBondContact N-O 3.33Å; N608-D632 PolarHBondContact OD1-O 2.95Å; N608-S633 WeakPolarHBondContact OD1-CA 3.22Å
609	C	82.4	Confident	82.1	Confident	22 Å²	22	54.4 Å²	54.4	15%	0.149	31%	0.309	C	S	.	.			trans	-79.3	131	179.1	-72.9	0	0	0	0	111.9	A607 L613 I614 F630	A607-C609 VanDerWaalsContact C-N 3.3Å; A607-C609 PolarHBondContact O-N 3.48Å; C609-L613 HydrophobicContact CB-CD2 4.34Å; C609-I614 HydrophobicContact CB-CD1 4.2Å; C609-I614 HydrophobicContact CB-CG1 3.87Å; C609-F630 HydrophobicContact CB-CD1 4.02Å
610	T	84.1	Confident	81.6	Confident	64 Å²	64	51.5 Å²	51.5	39%	0.393	29%	0.288	S	S	.	.			trans	-69	148.8	172.3	61.4	0	0	0	0	111.1	S612 L613 I614	T610-S612 PolarHBondContact O-N 2.72Å; T610-S612 VanDerWaalsContact O-N 3.15Å; T610-L613 WeakPolarHBondContact O-CA 3.29Å; T610-L613 WeakPolarHBondContact O-CB 3.31Å; T610-L613 PolarHBondContact O-N 3.26Å; T610-L613 WeakPolarHBondContact OG1-CB 3.28Å; T610-L613 PolarHBondContact OG1-N 3.36Å; T610-I614 PolarHBondContact O-N 3.49Å
611	A	83.5	Confident	80.9	Confident	82 Å²	82	46.3 Å²	46.3	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-55.9	-34.4	177.8	0	0	0	0	0	112.7	K615	A611-K615 WeakPolarHBondContact O-CB 3.2Å; A611-K615 PolarHBondContact O-N 3.5Å
612	S	84.5	Confident	80.1	Confident	82 Å²	82	51.5 Å²	51.5	57%	0.573	29%	0.291	S	S	*	.	H	α-helix	trans	-64	-39.1	174.3	-58.3	0	0	0	0	112.5	T610 A616	T610-S612 PolarHBondContact O-N 2.72Å; T610-S612 VanDerWaalsContact O-N 3.15Å; S612-A616 WeakPolarHBondContact O-CB 3.48Å; S612-A616 PolarHBondContact O-N 2.9Å
613	L	84	Confident	79.3	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-69.7	-43.9	178.2	-179.4	63.3	0	0	0	111.2	C576 L579 F582 V587 L590 C609 T610 K615 A616 M617	C576-L613 HydrophobicContact CB-CD2 4.23Å; L579-L613 HydrophobicContact CD1-CD2 4.05Å; F582-L613 HydrophobicContact CD1-CD1 3.97Å; F582-L613 HydrophobicContact CD2-CD1 4.37Å; F582-L613 HydrophobicContact CE1-CB 3.77Å; F582-L613 HydrophobicContact CE1-CD1 3.96Å; F582-L613 HydrophobicContact CE1-CG 4.43Å; F582-L613 HydrophobicContact CE2-CD1 4.36Å; F582-L613 HydrophobicContact CG-CD1 4.19Å; F582-L613 HydrophobicContact CZ-CB 3.93Å; F582-L613 HydrophobicContact CZ-CD1 4.17Å; V587-L613 HydrophobicContact CG2-CD1 4.31Å; L590-L613 HydrophobicContact CD2-CD1 4.44Å; C609-L613 HydrophobicContact CB-CD2 4.34Å; T610-L613 WeakPolarHBondContact O-CA 3.29Å; T610-L613 WeakPolarHBondContact O-CB 3.31Å; T610-L613 PolarHBondContact O-N 3.26Å; T610-L613 WeakPolarHBondContact OG1-CB 3.28Å; T610-L613 PolarHBondContact OG1-N 3.36Å; L613-K615 VanDerWaalsContact C-N 3.29Å; L613-K615 PolarHBondContact O-N 2.92Å; L613-A616 PolarHBondContact O-N 3.41Å; L613-A616 VanDerWaalsContact O-N 3.11Å; L613-M617 HydrophobicContact CD1-CG 4.39Å; L613-M617 PolarHBondContact O-N 2.92Å
614	I	84.1	Confident	77.9	Confident	56 Å²	56	55.9 Å²	55.9	29%	0.287	31%	0.313	S	S	.	.	H	α-helix	trans	-58	-46.1	175.7	-61.6	171.8	0	0	0	109.9	C609 T610 A616 M617 T618 F630	C609-I614 HydrophobicContact CB-CD1 4.2Å; C609-I614 HydrophobicContact CB-CG1 3.87Å; T610-I614 PolarHBondContact O-N 3.49Å; I614-A616 PolarHBondContact O-N 3.42Å; I614-M617 PolarHBondContact O-N 3.35Å; I614-T618 WeakPolarHBondContact O-CG2 3.31Å; I614-T618 PolarHBondContact O-N 3.22Å; I614-T618 PolarHBondContact O-OG1 3.42Å; I614-F630 HydrophobicContact CD1-CB 4.43Å; I614-F630 HydrophobicContact CD1-CD1 4.46Å; I614-F630 HydrophobicContact CD1-CG 4.32Å; I614-F630 HydrophobicContact CG1-CD1 3.9Å; I614-F630 HydrophobicContact CG1-CE1 4.04Å; I614-F630 HydrophobicContact CG1-CG 4.15Å; I614-F630 HydrophobicContact CG1-CZ 4.41Å; I614-F630 HydrophobicContact CG2-CD2 4.23Å; I614-F630 HydrophobicContact CG2-CE2 4Å; I614-F630 HydrophobicContact CG2-CZ 4.23Å
615	K	84.4	Confident	76.4	Confident	127 Å²	127	61.7 Å²	61.7	55%	0.552	35%	0.349	S	S	*	.	H	α-helix	trans	-62	-43.5	175.5	-168.6	173.7	-178.1	178.5	0	111.4	A611 L613 T618 Y619	A611-K615 WeakPolarHBondContact O-CB 3.2Å; A611-K615 PolarHBondContact O-N 3.5Å; L613-K615 VanDerWaalsContact C-N 3.29Å; L613-K615 PolarHBondContact O-N 2.92Å; K615-T618 WeakPolarHBondContact CA-OG1 3.39Å; K615-T618 PolarHBondContact O-N 2.94Å; K615-T618 PolarHBondContact O-OG1 3.33Å; K615-Y619 HydrophobicContact CD-CE2 4.24Å; K615-Y619 HydrophobicContact CG-CD2 3.85Å; K615-Y619 HydrophobicContact CG-CE2 3.61Å; K615-Y619 WeakPolarHBondContact O-CD2 3.03Å; K615-Y619 PolarHBondContact O-N 2.94Å
616	A	84.3	Confident	75.2	Confident	27 Å²	27	64.9 Å²	64.9	22%	0.223	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-43.8	179.2	0	0	0	0	0	112.6	F582 V587 S612 L613 I614 T618 Y619 C620	F582-A616 HydrophobicContact CD2-CB 4.44Å; F582-A616 HydrophobicContact CE2-CB 3.67Å; F582-A616 HydrophobicContact CZ-CB 4.38Å; V587-A616 HydrophobicContact CG1-CB 4.18Å; V587-A616 HydrophobicContact CG2-CB 4.03Å; S612-A616 WeakPolarHBondContact O-CB 3.48Å; S612-A616 PolarHBondContact O-N 2.9Å; L613-A616 PolarHBondContact O-N 3.41Å; L613-A616 VanDerWaalsContact O-N 3.11Å; I614-A616 PolarHBondContact O-N 3.42Å; A616-T618 PolarHBondContact O-N 3.37Å; A616-Y619 PolarHBondContact O-N 3.39Å; A616-C620 VanDerWaalsContact O-CB 3.24Å; A616-C620 WeakPolarHBondContact O-CB 3.27Å; A616-C620 PolarHBondContact O-N 3.46Å
617	M	82.1	Confident	74.2	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-40.8	177.4	-73.9	-170.6	72.1	0	0	112.3	V587 L590 V591 L606 L613 I614 Y619 C620 G621 L623 P628 F630	V587-M617 HydrophobicContact CG1-CG 4.01Å; L590-M617 HydrophobicContact CD2-CE 4.4Å; L590-M617 HydrophobicContact CD2-SD 3.87Å; L590-M617 HydrophobicContact CG-CE 4.47Å; V591-M617 HydrophobicContact CG2-CB 4.39Å; V591-M617 HydrophobicContact CG2-CE 3.84Å; V591-M617 HydrophobicContact CG2-CG 4.26Å; L606-M617 HydrophobicContact CD1-CE 3.87Å; L606-M617 HydrophobicContact CD1-SD 4Å; L613-M617 HydrophobicContact CD1-CG 4.39Å; L613-M617 PolarHBondContact O-N 2.92Å; I614-M617 PolarHBondContact O-N 3.35Å; M617-Y619 VanDerWaalsContact C-N 3.31Å; M617-Y619 PolarHBondContact O-N 3.02Å; M617-C620 PolarHBondContact O-N 3.21Å; M617-G621 PolarHBondContact O-N 2.98Å; M617-L623 WeakPolarHBondContact O-CD1 3.39Å; M617-P628 HydrophobicContact CE-CG 4.44Å; M617-F630 HydrophobicContact SD-CE1 3.99Å; M617-F630 HydrophobicContact SD-CZ 4.23Å
618	T	80.8	Confident	73.6	Confident	78 Å²	78	73.7 Å²	73.7	48%	0.479	40%	0.404	S	S	.	.	H	α-helix	trans	-67.6	-27.4	178.3	47.6	0	0	0	0	113.6	I614 K615 A616	I614-T618 WeakPolarHBondContact O-CG2 3.31Å; I614-T618 PolarHBondContact O-N 3.22Å; I614-T618 PolarHBondContact O-OG1 3.42Å; K615-T618 WeakPolarHBondContact CA-OG1 3.39Å; K615-T618 PolarHBondContact O-N 2.94Å; K615-T618 PolarHBondContact O-OG1 3.33Å; A616-T618 PolarHBondContact O-N 3.37Å
619	Y	79.8	Confident	73.2	Confident	185 Å²	185	75.6 Å²	75.6	73%	0.725	41%	0.413	S	S	*	.	H	α-helix	trans	-84.7	-23.9	173.2	-81.4	-67.4	0	0	0	114	K615 A616 M617	K615-Y619 HydrophobicContact CD-CE2 4.24Å; K615-Y619 HydrophobicContact CG-CD2 3.85Å; K615-Y619 HydrophobicContact CG-CE2 3.61Å; K615-Y619 WeakPolarHBondContact O-CD2 3.03Å; K615-Y619 PolarHBondContact O-N 2.94Å; A616-Y619 PolarHBondContact O-N 3.39Å; M617-Y619 VanDerWaalsContact C-N 3.31Å; M617-Y619 PolarHBondContact O-N 3.02Å
620	C	70.6	Confident	73.2	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.216	42%	0.418	C	S	.	.	H	α-helix	trans	-90.9	-19.9	-170.1	-158.4	0	0	0	0	113.7	Y584 V587 A616 M617	Y584-C620 WeakPolarHBondContact CE2-SG 3.46Å; V587-C620 HydrophobicContact CG1-CB 3.8Å; A616-C620 VanDerWaalsContact O-CB 3.24Å; A616-C620 WeakPolarHBondContact O-CB 3.27Å; A616-C620 PolarHBondContact O-N 3.46Å; M617-C620 PolarHBondContact O-N 3.21Å
621	G	62.8	Low	73.1	Confident	18 Å²	18	75.2 Å²	75.2	19%	0.186	40%	0.404	C	S	.	.	S	Bend	trans	-120.7	141.3	179.9	0	0	0	0	0	113.1	M617 L623	M617-G621 PolarHBondContact O-N 2.98Å; G621-L623 PolarHBondContact O-N 2.97Å
622	D	57.2	Low	72.8	Confident	154 Å²	154	78.8 Å²	78.8	82%	0.824	41%	0.412	S	S	*	.			trans	-66.7	68.9	158.2	-95.2	-12.6	0	0	0	108.6	D624	D622-D624 PolarHBondContact O-N 3.43Å; D622-D624 VanDerWaalsContact O-N 3.13Å
623	L	60.6	Low	72.5	Confident	17 Å²	17	76.9 Å²	76.9	9%	0.089	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	26	179.2	-74.4	156.5	0	0	0	111.8	M617 G621 T625 P628	M617-L623 WeakPolarHBondContact O-CD1 3.39Å; G621-L623 PolarHBondContact O-N 2.97Å; L623-T625 VanDerWaalsContact C-N 3.28Å; L623-T625 PolarHBondContact O-N 3.29Å; L623-P628 HydrophobicContact CD1-CG 4.03Å; L623-P628 HydrophobicContact CD2-CG 3.95Å
624	D	50.1	Low	72.2	Confident	149 Å²	149	77.7 Å²	77.7	80%	0.797	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.9	-172.4	-79.3	-17.8	0	0	0	113.1	D622	D622-D624 PolarHBondContact O-N 3.43Å; D622-D624 VanDerWaalsContact O-N 3.13Å
625	T	50.3	Low	71.9	Confident	131 Å²	131	79.3 Å²	79.3	80%	0.804	42%	0.417	S	S	*	.	S	Bend	trans	-93.2	-31.6	179.1	42.2	0	0	0	0	113.2	L623	L623-T625 VanDerWaalsContact C-N 3.28Å; L623-T625 PolarHBondContact O-N 3.29Å
626	E	60.5	Low	71.6	Confident	88 Å²	88	74.8 Å²	74.8	41%	0.411	40%	0.404	S	S	.	.			trans	-152.8	107.2	-174.4	-66.5	-169.6	127.7	0	0	113.4	K598	K598-E626 WeakPolarHBondContact CD-OE2 3.33Å; K598-E626 WeakPolarHBondContact CE-OE1 3.44Å; K598-E626 WeakPolarHBondContact CE-OE2 3.43Å; K598-E626 VanDerWaalsContact NZ-CB 3.34Å; K598-E626 IonicContact NZ-OE1 3.82Å; K598-E626 PolarHBondContact NZ-OE1 2.95Å; K598-E626 IonicContact NZ-OE2 2.8Å; K598-E626 PolarHBondContact NZ-OE2 2.84Å
627	K	65.1	Low	71.3	Confident	174 Å²	174	73.5 Å²	73.5	76%	0.757	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-77.9	138.1	-176.5	-67	180	-178.4	175	0	112.2
628	P	71.2	Confident	71	Confident	13 Å²	13	75.8 Å²	75.8	8%	0.084	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-66.3	139.5	173.8	-7.5	23.4	0	0	0	110.3	Y594 L606 M617 L623 F630	Y594-P628 HydrophobicContact CE1-CB 4.39Å; Y594-P628 HydrophobicContact CE1-CG 4.43Å; Y594-P628 HydrophobicContact CE2-CB 4.22Å; L606-P628 HydrophobicContact CD1-CB 4.03Å; M617-P628 HydrophobicContact CE-CG 4.44Å; L623-P628 HydrophobicContact CD1-CG 4.03Å; L623-P628 HydrophobicContact CD2-CG 3.95Å; P628-F630 HydrophobicContact CB-CE1 4.34Å; P628-F630 HydrophobicContact CB-CE2 3.86Å; P628-F630 HydrophobicContact CB-CZ 3.74Å; P628-F630 HydrophobicContact CG-CE2 4.1Å; P628-F630 HydrophobicContact CG-CZ 3.93Å; P628-F630 WeakPolarHBondContact O-CD2 3.46Å; P628-F630 WeakPolarHBondContact O-CE2 3.49Å
629	I	73.9	Confident	70.7	Confident	84 Å²	84	75 Å²	75	43%	0.431	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-90.4	117.4	175.6	-56.7	170.5	0	0	0	108	F605 L606 F631	F605-I629 HydrophobicContact CD1-CB 4.25Å; F605-I629 HydrophobicContact CD1-CD1 4.37Å; F605-I629 HydrophobicContact CD1-CG2 4.42Å; F605-I629 HydrophobicContact CE1-CD1 3.97Å; L606-I629 PolarHBondContact N-O 3.35Å; I629-F631 HydrophobicContact CB-CE2 4.47Å; I629-F631 HydrophobicContact CG2-CD2 4.3Å; I629-F631 HydrophobicContact CG2-CE1 4.12Å; I629-F631 HydrophobicContact CG2-CE2 3.59Å; I629-F631 HydrophobicContact CG2-CZ 3.48Å; I629-F631 VanDerWaalsContact CG2-CZ 3.48Å
630	F	82.6	Confident	70.4	Confident	56 Å²	56	68.6 Å²	68.6	25%	0.246	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.6	179.6	-59.7	-79.8	0	0	0	110.4	L606 C609 I614 M617 P628	L606-F630 HydrophobicContact CB-CD1 4Å; L606-F630 HydrophobicContact CB-CE1 4.37Å; L606-F630 HydrophobicContact CD1-CD1 4.19Å; L606-F630 HydrophobicContact CD1-CE1 3.74Å; L606-F630 HydrophobicContact CD1-CZ 4.45Å; L606-F630 CarbonylContact O-C 3.47Å; L606-F630 WeakPolarHBondContact O-CA 3.2Å; C609-F630 HydrophobicContact CB-CD1 4.02Å; I614-F630 HydrophobicContact CD1-CB 4.43Å; I614-F630 HydrophobicContact CD1-CD1 4.46Å; I614-F630 HydrophobicContact CD1-CG 4.32Å; I614-F630 HydrophobicContact CG1-CD1 3.9Å; I614-F630 HydrophobicContact CG1-CE1 4.04Å; I614-F630 HydrophobicContact CG1-CG 4.15Å; I614-F630 HydrophobicContact CG1-CZ 4.41Å; I614-F630 HydrophobicContact CG2-CD2 4.23Å; I614-F630 HydrophobicContact CG2-CE2 4Å; I614-F630 HydrophobicContact CG2-CZ 4.23Å; M617-F630 HydrophobicContact SD-CE1 3.99Å; M617-F630 HydrophobicContact SD-CZ 4.23Å; P628-F630 HydrophobicContact CB-CE1 4.34Å; P628-F630 HydrophobicContact CB-CE2 3.86Å; P628-F630 HydrophobicContact CB-CZ 3.74Å; P628-F630 HydrophobicContact CG-CE2 4.1Å; P628-F630 HydrophobicContact CG-CZ 3.93Å; P628-F630 WeakPolarHBondContact O-CD2 3.46Å; P628-F630 WeakPolarHBondContact O-CE2 3.49Å
631	F	82.2	Confident	70.5	Confident	23 Å²	23	67.5 Å²	67.5	10%	0.101	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	142.8	175.6	-64.7	-74.8	0	0	0	111.8	F605 L606 A607 N608 I629 S633 A637 T640	F605-F631 HydrophobicContact CB-CD2 4.15Å; F605-F631 HydrophobicContact CB-CE2 3.86Å; F605-F631 AromaticContact CD1-CE2 3.51Å; F605-F631 HydrophobicContact CD1-CE2 3.51Å; F605-F631 HydrophobicContact CD1-CZ 4.18Å; F605-F631 HydrophobicContact CE1-CE2 4.34Å; F605-F631 AromaticContact CG-CE2 3.95Å; F605-F631 HydrophobicContact CG-CE2 3.95Å; L606-F631 PolarHBondContact O-N 3.46Å; A607-F631 CarbonylContact C-O 3.55Å; A607-F631 WeakPolarHBondContact CA-O 3.26Å; A607-F631 HydrophobicContact CB-CB 4.5Å; N608-F631 PolarHBondContact N-O 3.33Å; I629-F631 HydrophobicContact CB-CE2 4.47Å; I629-F631 HydrophobicContact CG2-CD2 4.3Å; I629-F631 HydrophobicContact CG2-CE1 4.12Å; I629-F631 HydrophobicContact CG2-CE2 3.59Å; I629-F631 HydrophobicContact CG2-CZ 3.48Å; I629-F631 VanDerWaalsContact CG2-CZ 3.48Å; F631-S633 PolarHBondContact O-N 3.28Å; F631-A637 HydrophobicContact CB-CB 3.98Å; F631-A637 HydrophobicContact CD1-CB 4.4Å; F631-A637 HydrophobicContact CD2-CB 3.32Å; F631-A637 HydrophobicContact CE2-CB 3.79Å; F631-A637 HydrophobicContact CG-CB 3.65Å; F631-T640 HydrophobicContact CE1-CG2 3.8Å; F631-T640 VanDerWaalsContact CE1-OG1 3.22Å; F631-T640 WeakPolarHBondContact CE1-OG1 3.25Å; F631-T640 HydrophobicContact CZ-CG2 3.78Å
632	D	77.1	Confident	70.6	Confident	157 Å²	157	71.8 Å²	71.8	84%	0.84	39%	0.39	S	S	*	.	S	Bend	trans	-68.8	-22.5	177.3	-66.6	-29.4	0	0	0	112.8	N608	N608-D632 PolarHBondContact OD1-O 2.95Å
633	S	79.2	Confident	70.9	Confident	41 Å²	41	67.4 Å²	67.4	29%	0.287	37%	0.371	S	S	.	.	S	Bend	trans	-153.8	156.4	178.2	71	0	0	0	0	112.3	N608 F631 A636 A637	N608-S633 WeakPolarHBondContact OD1-CA 3.22Å; F631-S633 PolarHBondContact O-N 3.28Å; S633-A636 PolarHBondContact O-N 3.1Å; S633-A636 WeakPolarHBondContact OG-CB 3.39Å; S633-A636 PolarHBondContact OG-N 3.31Å; S633-A637 PolarHBondContact O-N 3.32Å; S633-A637 VanDerWaalsContact O-N 3.11Å
634	V	77.3	Confident	70.9	Confident	21 Å²	21	69.6 Å²	69.6	13%	0.127	39%	0.388	C	S	.	.	H	α-helix	trans	-59	-43.5	175.2	177.6	0	0	0	0	112.1	I504 V573 D575 A607 A636 A637 I638	I504-V634 HydrophobicContact CD1-CG1 3.86Å; I504-V634 HydrophobicContact CG1-CG1 4.46Å; I504-V634 HydrophobicContact CG2-CG1 4.1Å; V573-V634 HydrophobicContact CG1-CG1 4.36Å; D575-V634 HydrophobicContact CB-CG2 3.84Å; A607-V634 HydrophobicContact CB-CB 4.46Å; A607-V634 HydrophobicContact CB-CG2 3.77Å; V634-A636 VanDerWaalsContact C-N 3.31Å; V634-A636 PolarHBondContact O-N 3.11Å; V634-A637 WeakPolarHBondContact O-CB 3.47Å; V634-A637 PolarHBondContact O-N 3.38Å; V634-I638 HydrophobicContact CG1-CD1 3.97Å; V634-I638 WeakPolarHBondContact O-CG1 3.4Å; V634-I638 PolarHBondContact O-N 3.33Å
635	P	78.1	Confident	71.1	Confident	90 Å²	90	66.3 Å²	66.3	58%	0.584	37%	0.366	S	S	*	.	H	α-helix	trans	-60.3	-36.8	175.1	-25.2	35.7	0	0	0	113.7	I638 S639	P635-I638 PolarHBondContact O-N 3.27Å; P635-S639 PolarHBondContact O-N 3.09Å; P635-S639 PolarHBondContact O-OG 2.92Å
636	A	78	Confident	70.9	Confident	32 Å²	32	65.3 Å²	65.3	26%	0.264	36%	0.356	S	S	.	.	H	α-helix	trans	-67.8	-35.4	176.5	0	0	0	0	0	112.3	S633 V634 S639 T640	S633-A636 PolarHBondContact O-N 3.1Å; S633-A636 WeakPolarHBondContact OG-CB 3.39Å; S633-A636 PolarHBondContact OG-N 3.31Å; V634-A636 VanDerWaalsContact C-N 3.31Å; V634-A636 PolarHBondContact O-N 3.11Å; A636-S639 WeakPolarHBondContact CA-OG 3.32Å; A636-S639 PolarHBondContact O-OG 3.26Å; A636-S639 VanDerWaalsContact O-OG 3.05Å; A636-T640 WeakPolarHBondContact O-CB 3.29Å; A636-T640 PolarHBondContact O-N 3Å; A636-T640 VanDerWaalsContact O-N 3.12Å; A636-T640 PolarHBondContact O-OG1 3.3Å
637	A	77.6	Confident	69.7	Low	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-46.4	171.9	0	0	0	0	0	110.7	V573 F631 S633 V634 T640 I641	V573-A637 HydrophobicContact CG1-CB 4.12Å; V573-A637 HydrophobicContact CG2-CB 4.49Å; F631-A637 HydrophobicContact CB-CB 3.98Å; F631-A637 HydrophobicContact CD1-CB 4.4Å; F631-A637 HydrophobicContact CD2-CB 3.32Å; F631-A637 HydrophobicContact CE2-CB 3.79Å; F631-A637 HydrophobicContact CG-CB 3.65Å; S633-A637 PolarHBondContact O-N 3.32Å; S633-A637 VanDerWaalsContact O-N 3.11Å; V634-A637 WeakPolarHBondContact O-CB 3.47Å; V634-A637 PolarHBondContact O-N 3.38Å; A637-T640 PolarHBondContact O-N 3.39Å; A637-I641 WeakPolarHBondContact O-CD1 3.41Å; A637-I641 VanDerWaalsContact O-CG1 3.24Å; A637-I641 WeakPolarHBondContact O-CG1 3.18Å; A637-I641 PolarHBondContact O-N 3Å
638	I	76.2	Confident	68.6	Low	49 Å²	49	62.2 Å²	62.2	25%	0.251	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-46	179.8	-63.6	165.6	0	0	0	111.5	I504 V634 P635 T640 I641 Q642	I504-I638 HydrophobicContact CD1-CD1 3.9Å; V634-I638 HydrophobicContact CG1-CD1 3.97Å; V634-I638 WeakPolarHBondContact O-CG1 3.4Å; V634-I638 PolarHBondContact O-N 3.33Å; P635-I638 PolarHBondContact O-N 3.27Å; I638-T640 VanDerWaalsContact C-N 3.25Å; I638-T640 PolarHBondContact O-N 2.88Å; I638-I641 PolarHBondContact O-N 3.43Å; I638-Q642 WeakPolarHBondContact O-CG 3.49Å; I638-Q642 PolarHBondContact O-N 2.96Å
639	S	73.4	Confident	67.1	Low	60 Å²	60	67 Å²	67	42%	0.42	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-33.6	179.2	64.2	0	0	0	0	112.1	P635 A636 Q642 S643	P635-S639 PolarHBondContact O-N 3.09Å; P635-S639 PolarHBondContact O-OG 2.92Å; A636-S639 WeakPolarHBondContact CA-OG 3.32Å; A636-S639 PolarHBondContact O-OG 3.26Å; A636-S639 VanDerWaalsContact O-OG 3.05Å; S639-Q642 WeakPolarHBondContact O-CB 3.12Å; S639-Q642 PolarHBondContact O-N 3.49Å; S639-S643 WeakPolarHBondContact O-CB 3.46Å; S639-S643 PolarHBondContact O-N 3.41Å; S639-S643 PolarHBondContact O-OG 2.92Å
640	T	74.7	Confident	65.3	Low	52 Å²	52	67.8 Å²	67.8	32%	0.319	38%	0.383	S	S	.	.	H	α-helix	trans	-70.3	-43.7	177.2	-53	0	0	0	0	111.3	F631 A636 A637 I638 Q642 S643 S644	F631-T640 HydrophobicContact CE1-CG2 3.8Å; F631-T640 VanDerWaalsContact CE1-OG1 3.22Å; F631-T640 WeakPolarHBondContact CE1-OG1 3.25Å; F631-T640 HydrophobicContact CZ-CG2 3.78Å; A636-T640 WeakPolarHBondContact O-CB 3.29Å; A636-T640 PolarHBondContact O-N 3Å; A636-T640 VanDerWaalsContact O-N 3.12Å; A636-T640 PolarHBondContact O-OG1 3.3Å; A637-T640 PolarHBondContact O-N 3.39Å; I638-T640 VanDerWaalsContact C-N 3.25Å; I638-T640 PolarHBondContact O-N 2.88Å; T640-Q642 PolarHBondContact O-N 2.94Å; T640-S643 WeakPolarHBondContact CA-OG 3.23Å; T640-S643 PolarHBondContact O-N 2.91Å; T640-S643 PolarHBondContact O-OG 3.46Å; T640-S644 PolarHBondContact O-N 2.98Å; T640-S644 PolarHBondContact O-OG 3.44Å
641	I	72.8	Confident	62.9	Low	9 Å²	9	68 Å²	68	5%	0.046	39%	0.391	C	S	.	.	H	α-helix	trans	-55.9	-40.7	173.1	-66.5	163.7	0	0	0	111	V502 V573 F605 A637 I638 S644	V502-I641 HydrophobicContact CG1-CD1 4.41Å; V573-I641 HydrophobicContact CG2-CD1 3.84Å; F605-I641 HydrophobicContact CD2-CD1 3.51Å; F605-I641 HydrophobicContact CD2-CG1 3.81Å; F605-I641 HydrophobicContact CE1-CG1 4.47Å; F605-I641 HydrophobicContact CE2-CD1 3.62Å; F605-I641 HydrophobicContact CE2-CG1 3.45Å; F605-I641 VanDerWaalsContact CE2-CG1 3.45Å; F605-I641 HydrophobicContact CG-CD1 4.28Å; F605-I641 HydrophobicContact CG-CG1 4.45Å; F605-I641 HydrophobicContact CZ-CD1 4.43Å; F605-I641 HydrophobicContact CZ-CG1 3.8Å; A637-I641 WeakPolarHBondContact O-CD1 3.41Å; A637-I641 VanDerWaalsContact O-CG1 3.24Å; A637-I641 WeakPolarHBondContact O-CG1 3.18Å; A637-I641 PolarHBondContact O-N 3Å; I638-I641 PolarHBondContact O-N 3.43Å; I641-S644 PolarHBondContact O-OG 2.65Å
642	Q	64.9	Low	60.7	Low	107 Å²	107	72.8 Å²	72.8	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-65.8	-42.7	175.3	-70	172.8	-14.8	0	0	112	I638 S639 T640 N646	I638-Q642 WeakPolarHBondContact O-CG 3.49Å; I638-Q642 PolarHBondContact O-N 2.96Å; S639-Q642 WeakPolarHBondContact O-CB 3.12Å; S639-Q642 PolarHBondContact O-N 3.49Å; T640-Q642 PolarHBondContact O-N 2.94Å; Q642-N646 PolarHBondContact O-N 2.89Å
643	S	62.9	Low	58.8	Low	62 Å²	62	73.1 Å²	73.1	43%	0.434	41%	0.414	S	S	.	.	H	α-helix	trans	-72	-38.6	-177.6	71.4	0	0	0	0	114.2	S639 T640 K645 N646 L647	S639-S643 WeakPolarHBondContact O-CB 3.46Å; S639-S643 PolarHBondContact O-N 3.41Å; S639-S643 PolarHBondContact O-OG 2.92Å; T640-S643 WeakPolarHBondContact CA-OG 3.23Å; T640-S643 PolarHBondContact O-N 2.91Å; T640-S643 PolarHBondContact O-OG 3.46Å; S643-K645 VanDerWaalsContact C-N 3.25Å; S643-K645 PolarHBondContact O-N 3.48Å; S643-N646 PolarHBondContact O-N 3.02Å; S643-L647 PolarHBondContact O-N 3.08Å
644	S	60.2	Low	56.5	Low	64 Å²	64	75.5 Å²	75.5	45%	0.448	43%	0.431	S	S	.	.	H	α-helix	trans	-65.8	-29.6	-179.2	54.4	0	0	0	0	112.4	T640 I641 S648	T640-S644 PolarHBondContact O-N 2.98Å; T640-S644 PolarHBondContact O-OG 3.44Å; I641-S644 PolarHBondContact O-OG 2.65Å; S644-S648 PolarHBondContact O-N 3.07Å
645	K	54.3	Low	54.6	Low	79 Å²	79	83 Å²	83	34%	0.343	47%	0.465	S	S	.	.	H	α-helix	trans	-76.3	-34.9	174.2	-90.8	-165.3	163.2	-162.9	0	114	Q500 S643 L647 S648 K649	Q500-K645 VanDerWaalsContact CD-CE 3.5Å; Q500-K645 VanDerWaalsContact OE1-CD 3.31Å; S643-K645 VanDerWaalsContact C-N 3.25Å; S643-K645 PolarHBondContact O-N 3.48Å; K645-L647 PolarHBondContact O-N 3.49Å; K645-S648 PolarHBondContact O-N 2.94Å; K645-S648 PolarHBondContact O-OG 3.03Å; K645-S648 VanDerWaalsContact O-OG 3.11Å; K645-K649 PolarHBondContact O-N 3.31Å; K645-K649 VanDerWaalsContact O-N 3.12Å
646	N	47.2	Very low	52.4	Low	111 Å²	111	88.3 Å²	88.3	59%	0.594	50%	0.495	S	S	*	.	H	α-helix	trans	-64.1	-33	173.3	-73	-15.1	0	0	0	110.8	Q642 S643 V650	Q642-N646 PolarHBondContact O-N 2.89Å; S643-N646 PolarHBondContact O-N 3.02Å; N646-V650 VanDerWaalsContact O-CG2 3.22Å; N646-V650 WeakPolarHBondContact O-CG2 3.31Å; N646-V650 PolarHBondContact O-N 3.4Å
647	L	35.8	Very low	51.1	Low	138 Å²	138	91.1 Å²	91.1	72%	0.723	51%	0.506	S	S	*	.	H	α-helix	trans	-73.6	-40	176.7	-130.3	78.4	0	0	0	113.2	S643 K645 V650 S651	S643-L647 PolarHBondContact O-N 3.08Å; K645-L647 PolarHBondContact O-N 3.49Å; L647-V650 PolarHBondContact O-N 3.43Å; L647-S651 PolarHBondContact O-N 3.07Å
648	S	41.6	Very low	49.8	Very low	59 Å²	59	95.9 Å²	95.9	41%	0.413	53%	0.533	S	S	.	.	H	α-helix	trans	-69.8	-32	178.1	65.5	0	0	0	0	113.1	S644 K645 V650 S651 D652	S644-S648 PolarHBondContact O-N 3.07Å; K645-S648 PolarHBondContact O-N 2.94Å; K645-S648 PolarHBondContact O-OG 3.03Å; K645-S648 VanDerWaalsContact O-OG 3.11Å; S648-V650 VanDerWaalsContact C-N 3.33Å; S648-S651 PolarHBondContact O-OG 3.08Å; S648-D652 PolarHBondContact O-N 2.67Å
649	K	39.1	Very low	48.3	Very low	112 Å²	112	98.5 Å²	98.5	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-71.5	-25.8	173.3	-79.7	-171.2	173.8	-171.1	0	113.2	K645 H653	K645-K649 PolarHBondContact O-N 3.31Å; K645-K649 VanDerWaalsContact O-N 3.12Å; K649-H653 PolarHBondContact O-CD2 2.98Å; K649-H653 VanDerWaalsContact O-CD2 3.24Å
650	V	36.5	Very low	46.8	Very low	102 Å²	102	100.8 Å²	100.8	62%	0.618	56%	0.556	S	S	*	*	H	α-helix	trans	-79.2	-31.6	177.4	172.3	0	0	0	0	111.5	N646 L647 S648 H653 S654	N646-V650 VanDerWaalsContact O-CG2 3.22Å; N646-V650 WeakPolarHBondContact O-CG2 3.31Å; N646-V650 PolarHBondContact O-N 3.4Å; L647-V650 PolarHBondContact O-N 3.43Å; S648-V650 VanDerWaalsContact C-N 3.33Å; V650-H653 PolarHBondContact O-N 3.05Å; V650-S654 PolarHBondContact O-OG 2.84Å
651	S	31.9	Very low	45.1	Very low	60 Å²	60	103.8 Å²	103.8	42%	0.42	57%	0.571	S	S	.	*	H	α-helix	trans	-69.7	-36.4	175.5	53.4	0	0	0	0	113.4	L647 S648 H653 S654	L647-S651 PolarHBondContact O-N 3.07Å; S648-S651 PolarHBondContact O-OG 3.08Å; S651-H653 PolarHBondContact O-N 3.33Å; S651-S654 WeakPolarHBondContact CA-OG 3.41Å; S651-S654 PolarHBondContact O-N 3.34Å; S651-S654 PolarHBondContact O-OG 3.39Å
652	D	35.3	Very low	43.2	Very low	124 Å²	124	110.1 Å²	110.1	66%	0.663	61%	0.606	S	S	*	*	H	α-helix	trans	-71.6	-18.8	178.6	-71	-11.5	0	0	0	112.9	S648	S648-D652 PolarHBondContact O-N 2.67Å
653	H	37.4	Very low	41.7	Very low	163 Å²	163	110.4 Å²	110.4	76%	0.755	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-2	174.1	-77.9	-49.8	0	0	0	114.2	K649 V650 S651	K649-H653 PolarHBondContact O-CD2 2.98Å; K649-H653 VanDerWaalsContact O-CD2 3.24Å; V650-H653 PolarHBondContact O-N 3.05Å; S651-H653 PolarHBondContact O-N 3.33Å
654	S	31.9	Very low	40	Very low	91 Å²	91	114.1 Å²	114.1	64%	0.636	63%	0.627	S	S	*	*	S	Bend	trans	-99.5	-0.8	175.6	42.5	0	0	0	0	114.5	V650 S651	V650-S654 PolarHBondContact O-OG 2.84Å; S651-S654 WeakPolarHBondContact CA-OG 3.41Å; S651-S654 PolarHBondContact O-N 3.34Å; S651-S654 PolarHBondContact O-OG 3.39Å
655	E	36.7	Very low	38.3	Very low	180 Å²	180	118.3 Å²	118.3	84%	0.841	64%	0.642	S	S	*	*			trans	-115.7	65.6	168.3	-72.7	-169.5	164.5	0	0	110.8
656	V	32.6	Very low	36.9	Very low	200 Å²	200	121.8 Å²	121.8	100%	1.212	67%	0.669	S	S	*	*			trans	-139.2	0	155.9	-178.6	0	0	0	0	109.1

Retrieved 656 of 656 residues in 357.2 ms (Link to these results)

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