A0A096NXA1_PAPAN Loading...

Transmembrane 9 superfamily member

Plays an essential role in autophagy.

AlphaFold DB (G7P9Y2), UniProt , Accession A0A096NXA1, Species PAPAN (Papio anubis, Olive baboon), Gene TM9SF1, Length 606 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	32.3	Very low	30.1	Very low	240 Å²	240	152.1 Å²	152.1	100%	1.182	83%	0.825	S	S	*	*				0	105	0	-94.8	165.6	164.8	0	0	108.5
2	T	33.6	Very low	30.9	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	81%	0.811	S	S	*	*			trans	22.5	113	152.2	52.3	0	0	0	0	119.4
3	V	27.7	Very low	31.5	Very low	146 Å²	146	147.7 Å²	147.7	89%	0.885	80%	0.802	S	S	*	*				-151	111.6	119.6	-179.5	0	0	0	0	108.1
4	I	30.2	Very low	32	Very low	161 Å²	161	151.2 Å²	151.2	83%	0.826	80%	0.798	S	S	*	*			trans	-86.8	117.1	169.8	-69.4	166.3	0	0	0	107.1
5	G	25.6	Very low	32.6	Very low	71 Å²	71	148.1 Å²	148.1	73%	0.732	78%	0.782	S	S	*	*			trans	-103.5	104.8	170.8	0	0	0	0	0	110.3
6	N	27.2	Very low	33.1	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	76%	0.759	S	S	*	*			trans	-64.2	132.9	177.5	-124.5	-3.1	0	0	0	111.4
7	P	31	Very low	33.6	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	74%	0.739	S	S	*	*			trans	-77.6	126.3	165.4	29.4	-27.1	0	0	0	109.4	S9	P7-S9 PolarHBondContact O-N 3.09Å; P7-S9 VanDerWaalsContact O-N 3.13Å
8	R	28.6	Very low	34	Very low	229 Å²	229	138.2 Å²	138.2	86%	0.864	73%	0.733	S	S	*	*			trans	-51.2	114.9	177	-79.1	174.8	164.5	167.5	-4.9	110.8	W10	R8-W10 PolarHBondContact O-N 2.75Å
9	S	29.8	Very low	34.5	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	72%	0.723	S	S	*	*			trans	-65.8	116.8	162.6	64.6	0	0	0	0	108.5	P7 S11	P7-S9 PolarHBondContact O-N 3.09Å; P7-S9 VanDerWaalsContact O-N 3.13Å; S9-S11 VanDerWaalsContact C-N 3.31Å; S9-S11 PolarHBondContact O-N 3.14Å
10	W	31.8	Very low	34.6	Very low	243 Å²	243	135 Å²	135	92%	0.92	71%	0.714	S	S	*	*			trans	-77.5	93	167.5	-73.4	61.1	0	0	0	107.2	R8	R8-W10 PolarHBondContact O-N 2.75Å
11	S	33.3	Very low	34.7	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	72%	0.715	S	S	*	*			trans	-57	139.4	172.6	-62	0	0	0	0	110.6	S9 Q13	S9-S11 VanDerWaalsContact C-N 3.31Å; S9-S11 PolarHBondContact O-N 3.14Å; S11-Q13 VanDerWaalsContact C-N 3.26Å; S11-Q13 PolarHBondContact O-N 3.24Å
12	C	40.2	Very low	35.1	Very low	98 Å²	98	129.6 Å²	129.6	66%	0.662	69%	0.689	S	S	*	*			trans	-41.5	74.2	165.5	-74.5	0	0	0	0	114.6	L15	C12-L15 HydrophobicContact CB-CB 4.48Å; C12-L15 HydrophobicContact CB-CD1 4.25Å
13	Q	38.3	Very low	35	Very low	149 Å²	149	126 Å²	126	70%	0.696	68%	0.677	S	S	*	*			trans	-88.4	-5.3	173.7	-78	-176.8	-24.5	0	0	113.3	S11	S11-Q13 VanDerWaalsContact C-N 3.26Å; S11-Q13 PolarHBondContact O-N 3.24Å
14	W	38.5	Very low	35.2	Very low	197 Å²	197	124 Å²	124	75%	0.746	67%	0.666	S	S	*	*	S	Bend	trans	-95.8	-17.5	176.2	-63.6	94.9	0	0	0	114.2	I17 L18	W14-I17 HydrophobicContact CE3-CD1 4Å; W14-I17 HydrophobicContact CZ3-CD1 4.23Å; W14-I17 PolarHBondContact O-N 3.48Å; W14-L18 PolarHBondContact O-N 2.95Å
15	L	41.6	Very low	35.2	Very low	105 Å²	105	118.9 Å²	118.9	55%	0.55	65%	0.653	S	S	.	*	H	α-helix	trans	-61.4	-44.5	172	-111.6	97.1	0	0	0	113.1	C12 I17 L18 I19	C12-L15 HydrophobicContact CB-CB 4.48Å; C12-L15 HydrophobicContact CB-CD1 4.25Å; L15-I17 VanDerWaalsContact C-N 3.28Å; L15-I17 PolarHBondContact O-N 2.95Å; L15-L18 PolarHBondContact O-N 2.92Å; L15-I19 VanDerWaalsContact O-CG1 3.28Å; L15-I19 WeakPolarHBondContact O-CG1 3.32Å; L15-I19 PolarHBondContact O-N 2.76Å
16	P	39.9	Very low	35.3	Very low	65 Å²	65	124.6 Å²	124.6	42%	0.422	66%	0.66	S	S	.	*	H	α-helix	trans	-71.7	-21	178.2	24	-29.7	0	0	0	113	L20	P16-L20 VanDerWaalsContact O-CB 3.31Å; P16-L20 WeakPolarHBondContact O-CB 3.41Å; P16-L20 WeakPolarHBondContact O-CD1 3.39Å; P16-L20 PolarHBondContact O-N 3.44Å
17	I	41.4	Very low	35.2	Very low	81 Å²	81	120.2 Å²	120.2	42%	0.415	65%	0.651	S	S	.	*	H	α-helix	trans	-78.5	-36.2	175	-61.7	171.8	0	0	0	110.9	W14 L15 I19 L20 L21	W14-I17 HydrophobicContact CE3-CD1 4Å; W14-I17 HydrophobicContact CZ3-CD1 4.23Å; W14-I17 PolarHBondContact O-N 3.48Å; L15-I17 VanDerWaalsContact C-N 3.28Å; L15-I17 PolarHBondContact O-N 2.95Å; I17-I19 VanDerWaalsContact C-N 3.32Å; I17-L20 PolarHBondContact O-N 3Å; I17-L21 HydrophobicContact CG2-CD1 4.22Å; I17-L21 WeakPolarHBondContact O-CB 3.49Å; I17-L21 PolarHBondContact O-N 3.36Å
18	L	41.5	Very low	35.3	Very low	119 Å²	119	120.5 Å²	120.5	62%	0.623	65%	0.653	S	S	*	*	H	α-helix	trans	-65.7	-37.1	171	-154.4	85.5	0	0	0	111.2	W14 L15 L22	W14-L18 PolarHBondContact O-N 2.95Å; L15-L18 PolarHBondContact O-N 2.92Å; L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 WeakPolarHBondContact O-CD1 3.47Å; L18-L22 WeakPolarHBondContact O-CG 3.44Å; L18-L22 PolarHBondContact O-N 2.91Å
19	I	43.5	Very low	35.3	Very low	107 Å²	107	112.3 Å²	112.3	55%	0.549	64%	0.64	S	S	.	*	H	α-helix	trans	-74.5	-32.4	174.8	-65	166.5	0	0	0	111.5	L15 I17 L22 G23	L15-I19 VanDerWaalsContact O-CG1 3.28Å; L15-I19 WeakPolarHBondContact O-CG1 3.32Å; L15-I19 PolarHBondContact O-N 2.76Å; I17-I19 VanDerWaalsContact C-N 3.32Å; I19-L22 CarbonylContact O-C 3.58Å; I19-L22 PolarHBondContact O-N 3.04Å; I19-G23 WeakPolarHBondContact O-CA 3.5Å; I19-G23 PolarHBondContact O-N 3.46Å
20	L	36.9	Very low	35.6	Very low	105 Å²	105	113.1 Å²	113.1	55%	0.55	64%	0.64	S	S	.	*	H	α-helix	trans	-73	-38.6	174.8	-109.4	104.8	0	0	0	112.4	P16 I17 L22 G23 T24	P16-L20 VanDerWaalsContact O-CB 3.31Å; P16-L20 WeakPolarHBondContact O-CB 3.41Å; P16-L20 WeakPolarHBondContact O-CD1 3.39Å; P16-L20 PolarHBondContact O-N 3.44Å; I17-L20 PolarHBondContact O-N 3Å; L20-L22 PolarHBondContact O-N 2.99Å; L20-G23 PolarHBondContact O-N 3.41Å; L20-G23 VanDerWaalsContact O-N 3.11Å; L20-T24 HydrophobicContact CD2-CG2 4.01Å; L20-T24 HydrophobicContact CG-CG2 4.23Å; L20-T24 PolarHBondContact O-N 3.07Å; L20-T24 PolarHBondContact O-OG1 3.3Å
21	L	36.2	Very low	35.9	Very low	141 Å²	141	110.1 Å²	110.1	74%	0.738	64%	0.636	S	S	*	*	H	α-helix	trans	-67.5	-23.9	173.2	-82.7	159.6	0	0	0	112.7	I17	I17-L21 HydrophobicContact CG2-CD1 4.22Å; I17-L21 WeakPolarHBondContact O-CB 3.49Å; I17-L21 PolarHBondContact O-N 3.36Å
22	L	39.4	Very low	36.5	Very low	121 Å²	121	108.7 Å²	108.7	63%	0.634	64%	0.635	S	S	*	*	H	α-helix	trans	-92.9	-10.9	170.8	-72.8	165.1	0	0	0	113.5	L18 I19 L20	L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 WeakPolarHBondContact O-CD1 3.47Å; L18-L22 WeakPolarHBondContact O-CG 3.44Å; L18-L22 PolarHBondContact O-N 2.91Å; I19-L22 CarbonylContact O-C 3.58Å; I19-L22 PolarHBondContact O-N 3.04Å; L20-L22 PolarHBondContact O-N 2.99Å
23	G	32.5	Very low	37.4	Very low	52 Å²	52	107.2 Å²	107.2	54%	0.536	62%	0.623	S	S	.	*	H	α-helix	trans	-123.8	-2	-164.3	0	0	0	0	0	115.6	I19 L20	I19-G23 WeakPolarHBondContact O-CA 3.5Å; I19-G23 PolarHBondContact O-N 3.46Å; L20-G23 PolarHBondContact O-N 3.41Å; L20-G23 VanDerWaalsContact O-N 3.11Å
24	T	32.3	Very low	39.1	Very low	104 Å²	104	102.9 Å²	102.9	64%	0.638	61%	0.606	S	S	*	*			trans	-114.7	26.6	169.2	61.4	0	0	0	0	113.1	L20 H26	L20-T24 HydrophobicContact CD2-CG2 4.01Å; L20-T24 HydrophobicContact CG-CG2 4.23Å; L20-T24 PolarHBondContact O-N 3.07Å; L20-T24 PolarHBondContact O-OG1 3.3Å; T24-H26 PolarHBondContact O-N 2.88Å
25	G	28.8	Very low	41.3	Very low	55 Å²	55	99.5 Å²	99.5	57%	0.567	60%	0.599	S	S	*	*			trans	-74.5	98.2	144.3	0	0	0	0	0	107.7	G27	G25-G27 VanDerWaalsContact C-N 3.31Å; G25-G27 PolarHBondContact O-N 2.86Å
26	H	28.1	Very low	43.6	Very low	190 Å²	190	95.8 Å²	95.8	88%	0.88	58%	0.578	S	S	*	*			trans	-42.3	114.1	138.4	-108.4	46.2	0	0	0	105	T24	T24-H26 PolarHBondContact O-N 2.88Å
27	G	26	Very low	46	Very low	59 Å²	59	100 Å²	100	61%	0.608	59%	0.589	S	S	*	*			trans	-47.3	134.3	-170.8	0	0	0	0	0	109.1	G25 G29	G25-G27 VanDerWaalsContact C-N 3.31Å; G25-G27 PolarHBondContact O-N 2.86Å; G27-G29 VanDerWaalsContact C-N 3.33Å; G27-G29 PolarHBondContact O-N 3.49Å
28	P	32.2	Very low	48.3	Very low	123 Å²	123	99.6 Å²	99.6	80%	0.799	60%	0.598	S	S	*	*			trans	-55.4	115	156.6	26.1	-28.1	0	0	0	103.7	V30	P28-V30 PolarHBondContact O-N 2.92Å
29	G	29.6	Very low	50.6	Low	57 Å²	57	95 Å²	95	59%	0.588	58%	0.579	S	S	*	*			trans	-42.9	131.9	-166.3	0	0	0	0	0	110.7	G27 E31	G27-G29 VanDerWaalsContact C-N 3.33Å; G27-G29 PolarHBondContact O-N 3.49Å; G29-E31 PolarHBondContact O-N 3.1Å
30	V	34.9	Very low	53	Low	117 Å²	117	92.6 Å²	92.6	71%	0.709	57%	0.568	S	S	*	*			trans	-76.7	69.2	159.4	-175.1	0	0	0	0	106.3	P28	P28-V30 PolarHBondContact O-N 2.92Å
31	E	38.5	Very low	55.7	Low	181 Å²	181	92.2 Å²	92.2	85%	0.846	57%	0.572	S	S	*	*			trans	-121.9	140.3	156.9	-70.7	-175.6	165.6	0	0	104.2	G29	G29-E31 PolarHBondContact O-N 3.1Å
32	G	46.5	Very low	58.4	Low	56 Å²	56	85.7 Å²	85.7	58%	0.577	54%	0.537	S	S	*	.			cis	-116.9	117.4	21.3	0	0	0	0	0	112.9	T34	G32-T34 PolarHBondContact O-N 3.31Å
33	V	58.5	Low	60.9	Low	68 Å²	68	83.8 Å²	83.8	41%	0.412	53%	0.527	S	S	.	.			trans	-71.7	104.2	142.3	173.5	0	0	0	0	104.7	H35 R173	V33-H35 PolarHBondContact O-CD2 2.03Å; V33-H35 PolarHBondContact O-N 3.38Å; V33-R173 HydrophobicContact CG1-CG 3.73Å
34	T	74.6	Confident	63.9	Low	57 Å²	57	81.3 Å²	81.3	35%	0.35	50%	0.502	S	S	.	.			trans	-65.7	121.2	175.7	34	0	0	0	0	108.9	G32 Y36 D134	G32-T34 PolarHBondContact O-N 3.31Å; T34-Y36 WeakPolarHBondContact O-CD2 3.46Å; T34-Y36 WeakPolarHBondContact O-CE2 3.35Å; T34-Y36 VanDerWaalsContact OG1-CE2 3.3Å; T34-Y36 WeakPolarHBondContact OG1-CE2 3.34Å; T34-Y36 PolarHBondContact OG1-OH 2.72Å; T34-Y36 VanDerWaalsContact OG1-OH 3.04Å; T34-D134 PolarHBondContact OG1-OD1 2.88Å; T34-D134 PolarHBondContact OG1-OD2 3.33Å; T34-D134 VanDerWaalsContact OG1-OD2 3.12Å
35	H	84.1	Confident	66.9	Low	126 Å²	126	78.3 Å²	78.3	58%	0.583	48%	0.479	S	S	*	.			trans	-93.5	125.9	173.3	-71.1	-91	0	0	0	108.4	V33 D172	V33-H35 PolarHBondContact O-CD2 2.03Å; V33-H35 PolarHBondContact O-N 3.38Å; H35-D172 CarbonylContact C-O 3.48Å; H35-D172 WeakPolarHBondContact CA-O 3.17Å; H35-D172 HydrophobicContact CB-CB 4.48Å
36	Y	89.7	Confident	70	Confident	28 Å²	28	75.8 Å²	75.8	11%	0.11	45%	0.452	C	S	.	.			trans	-111.2	134.5	-179.3	-61.2	-89.2	0	0	0	110.2	T34 D40 V42 F97 D134 D172 I174	T34-Y36 WeakPolarHBondContact O-CD2 3.46Å; T34-Y36 WeakPolarHBondContact O-CE2 3.35Å; T34-Y36 VanDerWaalsContact OG1-CE2 3.3Å; T34-Y36 WeakPolarHBondContact OG1-CE2 3.34Å; T34-Y36 PolarHBondContact OG1-OH 2.72Å; T34-Y36 VanDerWaalsContact OG1-OH 3.04Å; Y36-D40 HydrophobicContact CD1-CB 4.23Å; Y36-V42 HydrophobicContact CD1-CG2 3.98Å; Y36-V42 HydrophobicContact CE1-CG2 3.95Å; Y36-F97 HydrophobicContact CG-CD2 4.2Å; Y36-F97 HydrophobicContact CG-CG 4.25Å; Y36-F97 WeakPolarHBondContact O-CE1 3.06Å; Y36-D134 WeakPolarHBondContact CE2-OD2 3.43Å; Y36-D172 PolarHBondContact N-O 2.83Å; Y36-D172 VanDerWaalsContact O-CB 3.26Å; Y36-D172 WeakPolarHBondContact O-CB 3.46Å; Y36-I174 HydrophobicContact CD2-CD1 4.3Å; Y36-I174 HydrophobicContact CD2-CG1 4.14Å; Y36-I174 HydrophobicContact CE2-CD1 3.86Å; Y36-I174 HydrophobicContact CE2-CG1 4.01Å
37	K	91	Very high	73.1	Confident	153 Å²	153	66.7 Å²	66.7	67%	0.665	41%	0.41	S	S	*	.			trans	-85.3	155.9	163.3	-61.8	176.5	-179.2	175.8	0	109.4	G39 D40 F97	K37-G39 PolarHBondContact O-N 3.45Å; K37-D40 WeakPolarHBondContact CB-OD2 3.45Å; K37-D40 PolarHBondContact N-OD2 3.31Å; K37-D40 VanDerWaalsContact O-CB 3.25Å; K37-D40 WeakPolarHBondContact O-CB 3.44Å; K37-D40 PolarHBondContact O-N 3.03Å; K37-F97 WeakPolarHBondContact O-CD1 3.22Å
38	A	89.8	Confident	76.3	Confident	73 Å²	73	64.5 Å²	64.5	60%	0.603	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	130	175.5	0	0	0	0	0	110.4	D40	A38-D40 VanDerWaalsContact C-N 3.33Å
39	G	90	Very high	79.2	Confident	22 Å²	22	58.7 Å²	58.7	23%	0.227	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	-4.9	-176.5	0	0	0	0	0	115.4	K37 F97 E99	K37-G39 PolarHBondContact O-N 3.45Å; G39-F97 PolarHBondContact N-O 3.07Å; G39-E99 WeakPolarHBondContact CA-OE1 3.3Å
40	D	92.9	Very high	82.2	Confident	57 Å²	57	56 Å²	56	31%	0.305	32%	0.318	S	S	.	.			trans	-62.3	141.5	175.9	-77.4	-7.6	0	0	0	110.9	Y36 K37 A38 V42 R96 F97	Y36-D40 HydrophobicContact CD1-CB 4.23Å; K37-D40 WeakPolarHBondContact CB-OD2 3.45Å; K37-D40 PolarHBondContact N-OD2 3.31Å; K37-D40 VanDerWaalsContact O-CB 3.25Å; K37-D40 WeakPolarHBondContact O-CB 3.44Å; K37-D40 PolarHBondContact O-N 3.03Å; A38-D40 VanDerWaalsContact C-N 3.33Å; D40-V42 PolarHBondContact O-N 2.64Å; D40-R96 WeakPolarHBondContact O-CA 3.48Å; D40-F97 PolarHBondContact O-N 3.3Å
41	P	93.6	Very high	85	Confident	97 Å²	97	50.6 Å²	50.6	63%	0.63	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	127.3	178	28.2	-33.5	0	0	0	110.7
42	V	93.9	Very high	87.3	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	108.2	175.4	-179.1	0	0	0	0	107.9	Y36 D40 L44 I95 F97 V133 I174 W208	Y36-V42 HydrophobicContact CD1-CG2 3.98Å; Y36-V42 HydrophobicContact CE1-CG2 3.95Å; D40-V42 PolarHBondContact O-N 2.64Å; V42-L44 PolarHBondContact O-N 3.25Å; V42-I95 HydrophobicContact CB-CB 4.31Å; V42-I95 HydrophobicContact CB-CG2 4.04Å; V42-I95 PolarHBondContact N-O 3.22Å; V42-F97 HydrophobicContact CG2-CB 3.93Å; V42-F97 HydrophobicContact CG2-CD2 4.49Å; V42-V133 HydrophobicContact CG1-CG1 3.53Å; V42-I174 HydrophobicContact CG1-CD1 3.72Å; V42-I174 HydrophobicContact CG2-CD1 4.24Å; V42-W208 HydrophobicContact CG2-CH2 4.25Å; V42-W208 HydrophobicContact CG2-CZ2 4.29Å
43	I	92.5	Very high	89.2	Confident	81 Å²	81	45.6 Å²	45.6	42%	0.415	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	121.1	-178.2	-56.4	173.3	0	0	0	109.3	Y45 E90	I43-Y45 HydrophobicContact CB-CE2 4.19Å; I43-Y45 HydrophobicContact CG2-CD1 4.32Å; I43-Y45 HydrophobicContact CG2-CD2 4.28Å; I43-Y45 HydrophobicContact CG2-CE1 3.86Å; I43-Y45 HydrophobicContact CG2-CE2 3.83Å; I43-E90 HydrophobicContact CG2-CG 4.29Å
44	L	93.9	Very high	90.7	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.1	167	-175.5	152.6	0	0	0	109.3	V42 V46 S91 Y93 I95 F131 V133 F165	V42-L44 PolarHBondContact O-N 3.25Å; L44-V46 HydrophobicContact CD2-CG1 4.42Å; L44-S91 WeakPolarHBondContact CB-OG 3.1Å; L44-S91 WeakPolarHBondContact CD2-OG 3.23Å; L44-S91 WeakPolarHBondContact O-CB 3.21Å; L44-S91 PolarHBondContact O-N 2.66Å; L44-S91 PolarHBondContact O-OG 2.87Å; L44-Y93 HydrophobicContact CD2-CD2 3.95Å; L44-I95 HydrophobicContact CB-CD1 4.15Å; L44-I95 HydrophobicContact CD1-CD1 3.88Å; L44-F131 HydrophobicContact CD1-CD2 4.36Å; L44-F131 HydrophobicContact CD2-CB 4.01Å; L44-F131 HydrophobicContact CD2-CD2 3.85Å; L44-F131 HydrophobicContact CD2-CE2 4.49Å; L44-F131 HydrophobicContact CD2-CG 3.96Å; L44-F131 HydrophobicContact CG-CB 4.41Å; L44-V133 HydrophobicContact CB-CG2 3.75Å; L44-V133 HydrophobicContact CD1-CG2 3.6Å; L44-V133 HydrophobicContact CG-CG2 3.54Å; L44-F165 HydrophobicContact CD1-CD1 4.22Å; L44-F165 HydrophobicContact CD1-CE1 3.73Å; L44-F165 HydrophobicContact CD1-CZ 3.92Å
45	Y	94.9	Very high	91.3	Very high	41 Å²	41	40.7 Å²	40.7	16%	0.161	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.8	174.3	-62.9	-81.7	0	0	0	110.4	I43 K75 M88 A89 E90 F131 V132	I43-Y45 HydrophobicContact CB-CE2 4.19Å; I43-Y45 HydrophobicContact CG2-CD1 4.32Å; I43-Y45 HydrophobicContact CG2-CD2 4.28Å; I43-Y45 HydrophobicContact CG2-CE1 3.86Å; I43-Y45 HydrophobicContact CG2-CE2 3.83Å; Y45-K75 HydrophobicContact CD1-CB 3.98Å; Y45-K75 HydrophobicContact CD1-CD 4.22Å; Y45-K75 HydrophobicContact CD1-CG 4.47Å; Y45-K75 HydrophobicContact CD2-CD 4.18Å; Y45-K75 HydrophobicContact CE1-CB 3.74Å; Y45-K75 HydrophobicContact CE1-CD 4Å; Y45-K75 HydrophobicContact CE1-CG 3.98Å; Y45-K75 HydrophobicContact CE2-CD 3.95Å; Y45-K75 HydrophobicContact CG-CD 4.31Å; Y45-M88 HydrophobicContact CD1-CB 4.48Å; Y45-M88 HydrophobicContact CG-CB 4.47Å; Y45-A89 CarbonylContact C-O 3.51Å; Y45-A89 VanDerWaalsContact CA-O 3.23Å; Y45-A89 WeakPolarHBondContact CA-O 3.5Å; Y45-E90 HydrophobicContact CD1-CG 4.45Å; Y45-E90 HydrophobicContact CE1-CG 4Å; Y45-F131 CarbonylContact O-C 3.57Å; Y45-F131 VanDerWaalsContact O-CA 3.3Å; Y45-F131 WeakPolarHBondContact O-CA 3.04Å; Y45-F131 WeakPolarHBondContact O-CB 3.16Å; Y45-V132 PolarHBondContact N-O 3.14Å; Y45-V132 PolarHBondContact O-N 2.95Å
46	V	94.9	Very high	91.5	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	137.6	164.7	-56.6	0	0	0	0	108.8	L44 Y61 Y62 M88 A89 F131	L44-V46 HydrophobicContact CD2-CG1 4.42Å; V46-Y61 HydrophobicContact CB-CD1 3.74Å; V46-Y61 HydrophobicContact CB-CG 3.97Å; V46-Y61 HydrophobicContact CG1-CD1 3.65Å; V46-Y61 HydrophobicContact CG1-CE1 4.03Å; V46-Y61 HydrophobicContact CG1-CG 4.27Å; V46-Y61 HydrophobicContact CG2-CD1 4.05Å; V46-Y61 HydrophobicContact CG2-CG 4.46Å; V46-Y62 HydrophobicContact CG1-CE1 4.44Å; V46-Y62 HydrophobicContact CG2-CD2 4.15Å; V46-Y62 HydrophobicContact CG2-CE1 4.01Å; V46-Y62 HydrophobicContact CG2-CE2 3.55Å; V46-Y62 VanDerWaalsContact CG2-CZ 3.48Å; V46-M88 CarbonylContact O-C 3.54Å; V46-M88 VanDerWaalsContact O-CA 3.29Å; V46-M88 WeakPolarHBondContact O-CA 3.28Å; V46-A89 HydrophobicContact CG2-CB 4.1Å; V46-A89 PolarHBondContact N-O 3.21Å; V46-A89 PolarHBondContact O-N 2.84Å; V46-F131 HydrophobicContact CB-CD1 3.94Å; V46-F131 HydrophobicContact CB-CE1 3.88Å; V46-F131 HydrophobicContact CG1-CD1 3.85Å; V46-F131 HydrophobicContact CG1-CE1 3.57Å; V46-F131 HydrophobicContact CG1-CZ 4.08Å
47	N	93.3	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-85.1	-177.2	-172.4	24.8	0	0	0	111.1	D86 R87 M88 E130 V132	N47-D86 PolarHBondContact ND2-OD1 3.38Å; N47-D86 WeakPolarHBondContact OD1-CA 3.39Å; N47-R87 VanDerWaalsContact O-O 3.07Å; N47-R87 PolarHBondContact OD1-N 3.21Å; N47-M88 HydrophobicContact CB-CG 4.2Å; N47-E130 VanDerWaalsContact CB-O 3.26Å; N47-E130 WeakPolarHBondContact CB-O 3.49Å; N47-E130 PolarHBondContact N-O 3.27Å; N47-E130 PolarHBondContact ND2-OE1 3.46Å; N47-V132 HydrophobicContact CB-CG2 4.39Å
48	K	92.7	Very high	91.6	Very high	13 Å²	13	29.2 Å²	29.2	6%	0.057	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	157.5	-170.5	62.3	-162.8	179.4	-161.6	0	112.7	T58 Y59 D84 D86 E130	K48-T58 HydrophobicContact CD-CG2 4.15Å; K48-T58 HydrophobicContact CG-CG2 4.48Å; K48-Y59 CarbonylContact C-O 3.49Å; K48-Y59 WeakPolarHBondContact CA-O 3.45Å; K48-D84 PolarHBondContact NZ-O 2.99Å; K48-D84 IonicContact NZ-OD2 2.81Å; K48-D86 IonicContact NZ-OD1 3.94Å; K48-D86 PolarHBondContact NZ-OD1 2.91Å; K48-E130 WeakPolarHBondContact CE-OE1 3.39Å; K48-E130 HydrophobicContact CG-CB 4.33Å; K48-E130 PolarHBondContact N-O 3.2Å; K48-E130 PolarHBondContact O-N 2.96Å
49	V	94	Very high	91.8	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152.4	173.3	-64	0	0	0	0	109.4	T58 Y59 Y61 L64 Y128 F129	V49-T58 CarbonylContact O-C 3.57Å; V49-T58 WeakPolarHBondContact O-CA 3.42Å; V49-Y59 PolarHBondContact N-O 3.05Å; V49-Y59 PolarHBondContact O-N 2.98Å; V49-Y61 HydrophobicContact CG1-CD2 3.46Å; V49-Y61 VanDerWaalsContact CG1-CD2 3.46Å; V49-Y61 HydrophobicContact CG1-CE2 4.32Å; V49-Y61 HydrophobicContact CG1-CG 4.26Å; V49-L64 HydrophobicContact CB-CD1 4.11Å; V49-L64 HydrophobicContact CG1-CD1 3.97Å; V49-L64 HydrophobicContact CG2-CD1 3.91Å; V49-L64 HydrophobicContact CG2-CG 4.09Å; V49-Y128 WeakPolarHBondContact CA-O 3.39Å; V49-F129 HydrophobicContact CG1-CB 3.7Å
50	G	92.9	Very high	92	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	166.7	174.1	0	0	0	0	0	111.9	Y127 Y128	G50-Y127 VanDerWaalsContact O-CA 3.29Å; G50-Y127 WeakPolarHBondContact O-CA 3.4Å; G50-Y128 PolarHBondContact N-O 2.83Å; G50-Y128 VanDerWaalsContact N-O 3.12Å; G50-Y128 WeakPolarHBondContact O-CD1 3.45Å; G50-Y128 WeakPolarHBondContact O-CE1 3.29Å; G50-Y128 PolarHBondContact O-N 3.31Å
51	P	91.8	Very high	92.1	Very high	4 Å²	4	25.4 Å²	25.4	3%	0.026	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	144.1	175.9	27.6	-37.7	0	0	0	111.2	H53 N54 E57 E125 Y127 R492	P51-H53 VanDerWaalsContact C-N 3.32Å; P51-H53 PolarHBondContact O-N 3.07Å; P51-N54 HydrophobicContact CG-CB 3.71Å; P51-E57 HydrophobicContact CG-CB 4.27Å; P51-E57 HydrophobicContact CG-CG 4.36Å; P51-E125 HydrophobicContact CB-CB 4.22Å; P51-Y127 HydrophobicContact CB-CD1 3.99Å; P51-Y127 HydrophobicContact CB-CE1 3.68Å; P51-Y127 HydrophobicContact CG-CE1 4.1Å; P51-R492 PolarHBondContact O-NH2 3.35Å
52	Y	87.4	Confident	92.1	Very high	58 Å²	58	22.1 Å²	22.1	23%	0.227	10%	0.101	C	C	.	.	S	Bend	trans	-61.9	-40.1	179.1	177.5	-92.6	0	0	0	112.4	L126 F141 F228 R492	Y52-L126 WeakPolarHBondContact CB-O 3.44Å; Y52-L126 PolarHBondContact N-O 2.93Å; Y52-F141 AromaticContact CD2-CE1 3.94Å; Y52-F141 HydrophobicContact CD2-CE1 3.94Å; Y52-F141 AromaticContact CD2-CZ 3.94Å; Y52-F141 HydrophobicContact CD2-CZ 3.94Å; Y52-F141 HydrophobicContact CE2-CZ 4.29Å; Y52-F141 HydrophobicContact CG-CE1 4.44Å; Y52-F228 HydrophobicContact CD2-CD1 4.19Å; Y52-F228 AromaticContact CD2-CE1 3.8Å; Y52-F228 HydrophobicContact CD2-CE1 3.8Å; Y52-F228 AromaticContact CE2-CD1 3.49Å; Y52-F228 HydrophobicContact CE2-CD1 3.49Å; Y52-F228 VanDerWaalsContact CE2-CD1 3.49Å; Y52-F228 AromaticContact CE2-CE1 3.6Å; Y52-F228 HydrophobicContact CE2-CE1 3.6Å; Y52-R492 PolarHBondContact O-NH2 3.04Å
53	H	86.8	Confident	91.9	Very high	73 Å²	73	26.2 Å²	26.2	34%	0.338	12%	0.12	S	C	.	.	S	Bend	trans	-83.3	-12.9	-174.1	-66.8	-57.4	0	0	0	115.3	P51 P55 N559 M560	P51-H53 VanDerWaalsContact C-N 3.32Å; P51-H53 PolarHBondContact O-N 3.07Å; H53-P55 WeakPolarHBondContact O-CD 3.44Å; H53-N559 HydrophobicContact CB-CB 4.28Å; H53-N559 WeakPolarHBondContact CB-O 3.12Å; H53-M560 WeakPolarHBondContact O-CG 3.16Å
54	N	90.8	Very high	91.9	Very high	5 Å²	5	22.9 Å²	22.9	3%	0.027	10%	0.103	C	C	.	.			trans	-116	91	174.5	-53.4	-23.6	0	0	0	109.7	P51 Q56 E57 M560 S561 Q565	P51-N54 HydrophobicContact CG-CB 3.71Å; N54-Q56 VanDerWaalsContact C-N 3.29Å; N54-Q56 PolarHBondContact O-N 3.31Å; N54-E57 HydrophobicContact CB-CB 3.79Å; N54-E57 PolarHBondContact ND2-OE2 3.32Å; N54-E57 PolarHBondContact O-N 3.41Å; N54-M560 WeakPolarHBondContact OD1-CA 3.48Å; N54-S561 VanDerWaalsContact CG-O 3.31Å; N54-S561 PolarHBondContact ND2-O 3.33Å; N54-S561 PolarHBondContact OD1-N 3.09Å; N54-S561 PolarHBondContact OD1-O 3.37Å; N54-Q565 HydrophobicContact CB-CB 3.92Å; N54-Q565 HydrophobicContact CB-CG 3.82Å
55	P	86.7	Confident	91.8	Very high	17 Å²	17	23.3 Å²	23.3	11%	0.11	11%	0.106	C	C	.	.	S	Bend	trans	-65.2	-26.7	-173.5	-29.9	42.3	0	0	0	115.9	H53 W490 R492 M560	H53-P55 WeakPolarHBondContact O-CD 3.44Å; P55-W490 VanDerWaalsContact CG-O 3.29Å; P55-W490 WeakPolarHBondContact CG-O 3.38Å; P55-R492 VanDerWaalsContact CB-NE 3.27Å; P55-R492 HydrophobicContact CG-CG 4.17Å; P55-M560 HydrophobicContact CG-CE 4.5Å
56	Q	87.6	Confident	91.7	Very high	45 Å²	45	22.1 Å²	22.1	21%	0.21	10%	0.103	C	C	.	.	S	Bend	trans	-95.2	-17.1	-176.5	-53.8	-63.5	-12.3	0	0	112.3	N54 T58 Q405 W490 E568	N54-Q56 VanDerWaalsContact C-N 3.29Å; N54-Q56 PolarHBondContact O-N 3.31Å; Q56-T58 PolarHBondContact O-N 3.18Å; Q56-T58 VanDerWaalsContact O-N 3.11Å; Q56-Q405 WeakPolarHBondContact O-CG 3.21Å; Q56-W490 HydrophobicContact CG-CE3 4.45Å; Q56-W490 HydrophobicContact CG-CZ3 4.31Å; Q56-E568 HydrophobicContact CB-CG 4.44Å; Q56-E568 WeakPolarHBondContact CB-OE1 3.28Å; Q56-E568 WeakPolarHBondContact CB-OE2 3.26Å
57	E	91.4	Very high	91.5	Very high	20 Å²	20	22.6 Å²	22.6	9%	0.093	11%	0.106	C	C	.	.			trans	-76	101.3	169.6	-173.4	172.2	-172.6	0	0	109.9	P51 N54 Y59 V564	P51-E57 HydrophobicContact CG-CB 4.27Å; P51-E57 HydrophobicContact CG-CG 4.36Å; N54-E57 HydrophobicContact CB-CB 3.79Å; N54-E57 PolarHBondContact ND2-OE2 3.32Å; N54-E57 PolarHBondContact O-N 3.41Å; E57-Y59 HydrophobicContact CG-CE2 3.63Å; E57-Y59 WeakPolarHBondContact CG-OH 3.39Å; E57-Y59 PolarHBondContact OE1-OH 3.33Å; E57-V564 HydrophobicContact CB-CG1 4.39Å; E57-V564 HydrophobicContact CG-CB 4.35Å; E57-V564 HydrophobicContact CG-CG1 4.32Å
58	T	92.2	Very high	91.4	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	13%	0.126	C	C	.	.			trans	-133.8	146.2	-176.9	48.1	0	0	0	0	110.7	K48 V49 Q56 S403 T404 Q405	K48-T58 HydrophobicContact CD-CG2 4.15Å; K48-T58 HydrophobicContact CG-CG2 4.48Å; V49-T58 CarbonylContact O-C 3.57Å; V49-T58 WeakPolarHBondContact O-CA 3.42Å; Q56-T58 PolarHBondContact O-N 3.18Å; Q56-T58 VanDerWaalsContact O-N 3.11Å; T58-S403 CarbonylContact O-C 3.59Å; T58-S403 WeakPolarHBondContact O-CA 3.49Å; T58-S403 PolarHBondContact O-OG 2.83Å; T58-T404 VanDerWaalsContact C-OG1 3.24Å; T58-T404 VanDerWaalsContact CB-OG1 3.32Å; T58-T404 WeakPolarHBondContact CB-OG1 3.22Å; T58-T404 PolarHBondContact O-N 2.87Å; T58-T404 PolarHBondContact O-OG1 3.21Å; T58-T404 VanDerWaalsContact O-OG1 3.14Å; T58-T404 PolarHBondContact OG1-OG1 3.45Å; T58-Q405 PolarHBondContact OG1-NE2 2.9Å
59	Y	93.6	Very high	91.4	Very high	29 Å²	29	26.2 Å²	26.2	11%	0.114	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	156.2	-175	-60.8	-72.6	0	0	0	109.2	K48 V49 E57 Y127 N401	K48-Y59 CarbonylContact C-O 3.49Å; K48-Y59 WeakPolarHBondContact CA-O 3.45Å; V49-Y59 PolarHBondContact N-O 3.05Å; V49-Y59 PolarHBondContact O-N 2.98Å; E57-Y59 HydrophobicContact CG-CE2 3.63Å; E57-Y59 WeakPolarHBondContact CG-OH 3.39Å; E57-Y59 PolarHBondContact OE1-OH 3.33Å; Y59-Y127 HydrophobicContact CD2-CE2 4.24Å; Y59-N401 WeakPolarHBondContact CE1-O 3.47Å
60	H	94.4	Very high	91	Very high	21 Å²	21	36.3 Å²	36.3	10%	0.097	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	140.5	178.4	-175.9	-85.5	0	0	0	109.4	Y62 Q63 H74 R87 T404	H60-Y62 VanDerWaalsContact C-N 3.28Å; H60-Y62 AromaticContact CE1-CD2 3.38Å; H60-Y62 WeakPolarHBondContact CE1-CD2 3.38Å; H60-Y62 AromaticContact CE1-CG 3.88Å; H60-Y62 AromaticContact ND1-CD2 3.99Å; H60-Y62 PolarHBondContact ND1-N 2.8Å; H60-Y62 PolarHBondContact O-N 2.82Å; H60-Y62 VanDerWaalsContact O-N 3.16Å; H60-Q63 HydrophobicContact CB-CG 4.18Å; H60-Q63 VanDerWaalsContact O-CB 3.3Å; H60-Q63 WeakPolarHBondContact O-CB 3.31Å; H60-Q63 PolarHBondContact O-N 2.96Å; H60-H74 AromaticContact NE2-CE1 3.99Å; H60-R87 PolarHBondContact CD2-O 2.9Å; H60-R87 PolarHBondContact NE2-O 3.2Å; H60-T404 HydrophobicContact CB-CG2 3.95Å
61	Y	94.1	Very high	90.9	Very high	22 Å²	22	44 Å²	44	9%	0.086	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-52.1	-43.6	-175.2	178	-103.3	0	0	0	113.7	V46 V49 Q63 L64 V66 F129 F131	V46-Y61 HydrophobicContact CB-CD1 3.74Å; V46-Y61 HydrophobicContact CB-CG 3.97Å; V46-Y61 HydrophobicContact CG1-CD1 3.65Å; V46-Y61 HydrophobicContact CG1-CE1 4.03Å; V46-Y61 HydrophobicContact CG1-CG 4.27Å; V46-Y61 HydrophobicContact CG2-CD1 4.05Å; V46-Y61 HydrophobicContact CG2-CG 4.46Å; V49-Y61 HydrophobicContact CG1-CD2 3.46Å; V49-Y61 VanDerWaalsContact CG1-CD2 3.46Å; V49-Y61 HydrophobicContact CG1-CE2 4.32Å; V49-Y61 HydrophobicContact CG1-CG 4.26Å; Y61-Q63 PolarHBondContact O-N 3.07Å; Y61-Q63 VanDerWaalsContact O-N 3.15Å; Y61-L64 PolarHBondContact O-N 2.87Å; Y61-V66 HydrophobicContact CD1-CG2 3.93Å; Y61-V66 HydrophobicContact CE1-CB 4.24Å; Y61-V66 HydrophobicContact CE1-CG2 3.45Å; Y61-V66 VanDerWaalsContact CE1-CG2 3.45Å; Y61-F129 HydrophobicContact CD2-CB 3.95Å; Y61-F129 HydrophobicContact CE2-CB 4.01Å; Y61-F129 HydrophobicContact CE2-CG 4.38Å; Y61-F131 HydrophobicContact CD1-CE1 4.04Å; Y61-F131 HydrophobicContact CD1-CZ 4.43Å; Y61-F131 AromaticContact CD2-CE1 3.53Å; Y61-F131 HydrophobicContact CD2-CE1 3.53Å; Y61-F131 HydrophobicContact CD2-CZ 4.05Å; Y61-F131 HydrophobicContact CE1-CE1 4.04Å; Y61-F131 AromaticContact CE1-CZ 3.96Å; Y61-F131 HydrophobicContact CE1-CZ 3.96Å; Y61-F131 AromaticContact CE2-CE1 3.57Å; Y61-F131 HydrophobicContact CE2-CE1 3.57Å; Y61-F131 AromaticContact CE2-CZ 3.57Å; Y61-F131 HydrophobicContact CE2-CZ 3.57Å; Y61-F131 AromaticContact CG-CE1 3.8Å; Y61-F131 HydrophobicContact CG-CE1 3.8Å; Y61-F131 HydrophobicContact CG-CZ 4.47Å; Y61-F131 AromaticContact CZ-CE1 3.84Å; Y61-F131 AromaticContact CZ-CZ 3.53Å
62	Y	93.5	Very high	90.9	Very high	29 Å²	29	46.9 Å²	46.9	11%	0.114	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-71.7	2.5	177.5	-59.6	-41.9	0	0	0	115.6	V46 H60 L64 V66 C67 C68 P69 I72 A89 E90 S91	V46-Y62 HydrophobicContact CG1-CE1 4.44Å; V46-Y62 HydrophobicContact CG2-CD2 4.15Å; V46-Y62 HydrophobicContact CG2-CE1 4.01Å; V46-Y62 HydrophobicContact CG2-CE2 3.55Å; V46-Y62 VanDerWaalsContact CG2-CZ 3.48Å; H60-Y62 VanDerWaalsContact C-N 3.28Å; H60-Y62 AromaticContact CE1-CD2 3.38Å; H60-Y62 WeakPolarHBondContact CE1-CD2 3.38Å; H60-Y62 AromaticContact CE1-CG 3.88Å; H60-Y62 AromaticContact ND1-CD2 3.99Å; H60-Y62 PolarHBondContact ND1-N 2.8Å; H60-Y62 PolarHBondContact O-N 2.82Å; H60-Y62 VanDerWaalsContact O-N 3.16Å; Y62-L64 VanDerWaalsContact C-N 3.32Å; Y62-V66 HydrophobicContact CD1-CG2 4.17Å; Y62-C67 WeakPolarHBondContact CE1-O 3.49Å; Y62-C68 HydrophobicContact CD1-CB 4.19Å; Y62-P69 HydrophobicContact CE2-CG 4.26Å; Y62-I72 HydrophobicContact CD2-CD1 3.9Å; Y62-I72 HydrophobicContact CD2-CG1 4.04Å; Y62-I72 HydrophobicContact CD2-CG2 4.14Å; Y62-I72 HydrophobicContact CE2-CG1 4.35Å; Y62-I72 HydrophobicContact CE2-CG2 4.17Å; Y62-A89 HydrophobicContact CE2-CB 4.01Å; Y62-E90 PolarHBondContact OH-O 3Å; Y62-S91 WeakPolarHBondContact OH-CA 3.45Å
63	Q	91.3	Very high	91.1	Very high	88 Å²	88	51.1 Å²	51.1	41%	0.411	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-77.3	-22	167.8	-68.6	-178.4	7.8	0	0	112.1	H60 Y61 Q118 G402	H60-Q63 HydrophobicContact CB-CG 4.18Å; H60-Q63 VanDerWaalsContact O-CB 3.3Å; H60-Q63 WeakPolarHBondContact O-CB 3.31Å; H60-Q63 PolarHBondContact O-N 2.96Å; Y61-Q63 PolarHBondContact O-N 3.07Å; Y61-Q63 VanDerWaalsContact O-N 3.15Å; Q63-Q118 PolarHBondContact O-NE2 3.09Å; Q63-G402 PolarHBondContact NE2-O 2.97Å; Q63-G402 VanDerWaalsContact NE2-O 3.07Å
64	L	92.1	Very high	91.3	Very high	11 Å²	11	53.5 Å²	53.5	6%	0.058	25%	0.253	C	S	.	.	S	Bend	trans	-75.9	151.2	167.2	-67.2	175.6	0	0	0	109.7	V49 Y61 Y62 V66 A122 V142	V49-L64 HydrophobicContact CB-CD1 4.11Å; V49-L64 HydrophobicContact CG1-CD1 3.97Å; V49-L64 HydrophobicContact CG2-CD1 3.91Å; V49-L64 HydrophobicContact CG2-CG 4.09Å; Y61-L64 PolarHBondContact O-N 2.87Å; Y62-L64 VanDerWaalsContact C-N 3.32Å; L64-V66 HydrophobicContact CB-CG1 3.92Å; L64-V66 PolarHBondContact O-N 3.15Å; L64-A122 HydrophobicContact CD2-CB 4.04Å; L64-V142 HydrophobicContact CD1-CG1 4.46Å; L64-V142 HydrophobicContact CD1-CG2 4.05Å
65	P	92.2	Very high	91.2	Very high	11 Å²	11	55.8 Å²	55.8	7%	0.071	26%	0.263	C	S	.	.	S	Bend	trans	-77.1	76	177.4	33.1	-34.9	0	0	0	110.2	L111 Q115 L119	P65-L111 HydrophobicContact CB-CD2 3.95Å; P65-Q115 HydrophobicContact CB-CB 3.8Å; P65-Q115 HydrophobicContact CB-CG 3.87Å; P65-Q115 HydrophobicContact CG-CB 3.89Å; P65-Q115 HydrophobicContact CG-CG 4.36Å; P65-Q115 WeakPolarHBondContact CG-O 3.39Å; P65-L119 HydrophobicContact CG-CD1 3.84Å; P65-L119 HydrophobicContact CG-CD2 3.93Å; P65-L119 HydrophobicContact CG-CG 3.53Å
66	V	91.5	Very high	91.2	Very high	16 Å²	16	60.4 Å²	60.4	10%	0.097	30%	0.295	C	S	.	.	S	Bend	trans	-120.4	174.6	-179.2	-61.2	0	0	0	0	110.9	Y61 Y62 L64 C68 M109	Y61-V66 HydrophobicContact CD1-CG2 3.93Å; Y61-V66 HydrophobicContact CE1-CB 4.24Å; Y61-V66 HydrophobicContact CE1-CG2 3.45Å; Y61-V66 VanDerWaalsContact CE1-CG2 3.45Å; Y62-V66 HydrophobicContact CD1-CG2 4.17Å; L64-V66 HydrophobicContact CB-CG1 3.92Å; L64-V66 PolarHBondContact O-N 3.15Å; V66-C68 PolarHBondContact O-N 3.16Å; V66-C68 VanDerWaalsContact O-N 3.1Å; V66-M109 VanDerWaalsContact C-CE 3.45Å; V66-M109 WeakPolarHBondContact O-CE 3.21Å
67	C	91.7	Very high	91.1	Very high	10 Å²	10	60.2 Å²	60.2	7%	0.068	30%	0.295	C	S	.	.			trans	-57.5	116.9	176.1	-66.4	0	0	0	0	110.5	Y62 L92 L106 C107 M109 H202	Y62-C67 WeakPolarHBondContact CE1-O 3.49Å; C67-L92 HydrophobicContact CB-CD1 3.98Å; C67-L106 HydrophobicContact CB-CD2 3.87Å; C67-L106 HydrophobicContact CB-CG 4.31Å; C67-C107 VanDerWaalsContact CA-SG 3.58Å; C67-C107 HydrophobicContact CB-CB 3.93Å; C67-C107 WeakPolarHBondContact CB-SG 3.4Å; C67-C107 WeakPolarHBondContact SG-CB 3.32Å; C67-C107 CovalentContact SG-SG 2.03Å; C67-C107 PolarHBondContact SG-SG 3.43Å; C67-M109 HydrophobicContact CB-SD 4.42Å; C67-M109 PolarHBondContact N-SD 2.65Å; C67-H202 VanDerWaalsContact SG-CB 3.57Å
68	C	91.3	Very high	90.7	Very high	63 Å²	63	62 Å²	62	43%	0.426	31%	0.31	S	S	.	.			trans	-122.7	135.9	-178.8	-175.6	0	0	0	0	110.5	Y62 V66	Y62-C68 HydrophobicContact CD1-CB 4.19Å; V66-C68 PolarHBondContact O-N 3.16Å; V66-C68 VanDerWaalsContact O-N 3.1Å
69	P	91.5	Very high	90.1	Very high	26 Å²	26	64.8 Å²	64.8	17%	0.169	33%	0.325	C	S	.	.			trans	-67.2	153.8	171.9	28.1	-34.2	0	0	0	111.3	Y62 K71 I72 L92	Y62-P69 HydrophobicContact CE2-CG 4.26Å; P69-K71 PolarHBondContact O-N 3.21Å; P69-I72 HydrophobicContact CG-CG1 4.3Å; P69-L92 HydrophobicContact CB-CD2 3.81Å; P69-L92 HydrophobicContact CB-CG 4.24Å
70	E	87	Confident	89.4	Confident	213 Å²	213	63.4 Å²	63.4	100%	0.995	32%	0.319	S	S	*	.	S	Bend	trans	-59.5	-35.4	175	-67.5	-177	174.5	0	0	112.5
71	K	90.9	Very high	88.8	Confident	161 Å²	161	63.7 Å²	63.7	70%	0.7	32%	0.321	S	S	*	.	S	Bend	trans	-125.9	109.7	176.5	-172.1	176.1	-177.1	176.5	0	110.4	P69 R73	P69-K71 PolarHBondContact O-N 3.21Å; K71-R73 PolarHBondContact O-N 2.85Å
72	I	90.9	Very high	88.5	Confident	66 Å²	66	63.6 Å²	63.6	34%	0.338	32%	0.323	S	S	.	.			trans	-73.7	118.8	176.1	-56.8	170.3	0	0	0	109	Y62 P69 A89	Y62-I72 HydrophobicContact CD2-CD1 3.9Å; Y62-I72 HydrophobicContact CD2-CG1 4.04Å; Y62-I72 HydrophobicContact CD2-CG2 4.14Å; Y62-I72 HydrophobicContact CE2-CG1 4.35Å; Y62-I72 HydrophobicContact CE2-CG2 4.17Å; P69-I72 HydrophobicContact CG-CG1 4.3Å; I72-A89 HydrophobicContact CG2-CB 3.66Å
73	R	92.2	Very high	88	Confident	146 Å²	146	64 Å²	64	55%	0.551	33%	0.327	S	S	*	.			trans	-102.7	115.6	173.8	-67.7	179.9	179.3	-171.1	3.2	109.1	K71 A89 E90	K71-R73 PolarHBondContact O-N 2.85Å; R73-A89 CarbonylContact O-C 3.45Å; R73-A89 WeakPolarHBondContact O-CA 3.3Å; R73-E90 HydrophobicContact CB-CB 4.36Å; R73-E90 HydrophobicContact CB-CG 4.14Å; R73-E90 VanDerWaalsContact CD-OE2 3.28Å; R73-E90 WeakPolarHBondContact CD-OE2 3.36Å; R73-E90 PolarHBondContact O-N 2.89Å
74	H	90.3	Very high	87.6	Confident	123 Å²	123	62.6 Å²	62.6	57%	0.569	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-86.7	140	179.7	-68.1	-74.5	0	0	0	111.7	H60 M88	H60-H74 AromaticContact NE2-CE1 3.99Å; H74-M88 WeakPolarHBondContact CA-O 3.49Å
75	K	88.6	Confident	87.3	Confident	54 Å²	54	62 Å²	62	24%	0.235	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-74	139.4	170.6	-170.2	-173.5	177.6	-171.2	0	108.9	Y45 L77 M88 D135	Y45-K75 HydrophobicContact CD1-CB 3.98Å; Y45-K75 HydrophobicContact CD1-CD 4.22Å; Y45-K75 HydrophobicContact CD1-CG 4.47Å; Y45-K75 HydrophobicContact CD2-CD 4.18Å; Y45-K75 HydrophobicContact CE1-CB 3.74Å; Y45-K75 HydrophobicContact CE1-CD 4Å; Y45-K75 HydrophobicContact CE1-CG 3.98Å; Y45-K75 HydrophobicContact CE2-CD 3.95Å; Y45-K75 HydrophobicContact CG-CD 4.31Å; K75-L77 HydrophobicContact CD-CD2 4.35Å; K75-L77 PolarHBondContact O-N 2.84Å; K75-M88 HydrophobicContact CB-CB 3.96Å; K75-M88 HydrophobicContact CD-CB 4.36Å; K75-M88 HydrophobicContact CD-SD 3.95Å; K75-M88 PolarHBondContact N-O 2.89Å; K75-D135 IonicContact NZ-OD1 3.15Å; K75-D135 PolarHBondContact NZ-OD1 3.17Å
76	S	86.1	Confident	87.1	Confident	113 Å²	113	61.5 Å²	61.5	79%	0.79	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-69.3	122.1	167.6	57.4	0	0	0	0	109.6
77	L	85.8	Confident	87.1	Confident	41 Å²	41	63 Å²	63	22%	0.215	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-103.2	151.6	-178.2	-63.8	176.7	0	0	0	111.4	K75 E81 V82 D86 M88	K75-L77 HydrophobicContact CD-CD2 4.35Å; K75-L77 PolarHBondContact O-N 2.84Å; L77-E81 HydrophobicContact CB-CB 4.08Å; L77-E81 HydrophobicContact CD2-CB 4.28Å; L77-V82 HydrophobicContact CB-CG2 3.74Å; L77-V82 HydrophobicContact CD1-CG2 4.39Å; L77-D86 HydrophobicContact CD1-CB 4.05Å; L77-D86 WeakPolarHBondContact CD1-O 3.21Å; L77-M88 HydrophobicContact CD2-CB 4.06Å; L77-M88 HydrophobicContact CD2-CE 4.01Å; L77-M88 HydrophobicContact CD2-CG 3.9Å; L77-M88 HydrophobicContact CD2-SD 3.72Å
78	S	83.4	Confident	87.1	Confident	57 Å²	57	62.6 Å²	62.6	40%	0.399	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-68.8	160.7	168.6	67.8	0	0	0	0	111.3	G80 E81 V82	S78-G80 PolarHBondContact O-N 3.3Å; S78-E81 WeakPolarHBondContact CB-OE2 3.38Å; S78-E81 PolarHBondContact N-OE2 2.85Å; S78-E81 PolarHBondContact O-N 3.33Å; S78-E81 VanDerWaalsContact OG-CD 3.3Å; S78-E81 VanDerWaalsContact OG-CG 3.32Å; S78-E81 WeakPolarHBondContact OG-CG 3.38Å; S78-E81 PolarHBondContact OG-N 3.32Å; S78-E81 PolarHBondContact OG-OE2 2.89Å; S78-V82 WeakPolarHBondContact O-CG2 3.44Å; S78-V82 PolarHBondContact O-N 3.17Å
79	L	79.5	Confident	87.2	Confident	60 Å²	60	59.6 Å²	59.6	31%	0.314	30%	0.296	S	S	.	.	H	α-helix	trans	-56	-40.1	176.5	179.9	61.6	0	0	0	111.8	V82 L83 T411 L414	L79-V82 PolarHBondContact O-N 2.88Å; L79-L83 HydrophobicContact CD1-CD1 4.23Å; L79-L83 HydrophobicContact CD1-CG 4.37Å; L79-L83 HydrophobicContact CG-CD1 3.99Å; L79-L83 WeakPolarHBondContact O-CB 3.43Å; L79-L83 WeakPolarHBondContact O-CD1 3.45Å; L79-L83 WeakPolarHBondContact O-CG 3.32Å; L79-L83 PolarHBondContact O-N 3.02Å; L79-L83 VanDerWaalsContact O-N 3.09Å; L79-T411 HydrophobicContact CD1-CG2 3.85Å; L79-L414 HydrophobicContact CD1-CD2 3.75Å; L79-L414 HydrophobicContact CD2-CD2 3.94Å; L79-L414 HydrophobicContact CG-CD2 4.46Å
80	G	78.2	Confident	87.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-45.2	179	0	0	0	0	0	113.2	S78 L83 D84 G339 S343	S78-G80 PolarHBondContact O-N 3.3Å; G80-L83 PolarHBondContact O-N 3.46Å; G80-D84 PolarHBondContact O-N 2.82Å; G80-D84 VanDerWaalsContact O-N 3.09Å; G80-G339 VanDerWaalsContact C-CA 3.44Å; G80-G339 WeakPolarHBondContact CA-O 3.41Å; G80-G339 WeakPolarHBondContact O-CA 3.5Å; G80-S343 WeakPolarHBondContact CA-OG 3.16Å; G80-S343 PolarHBondContact N-OG 2.76Å
81	E	83.6	Confident	87.6	Confident	27 Å²	27	52.4 Å²	52.4	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-42.4	177.7	-71.7	163.1	138.4	0	0	111.1	L77 S78 L83 D84 G85 D86 H338	L77-E81 HydrophobicContact CB-CB 4.08Å; L77-E81 HydrophobicContact CD2-CB 4.28Å; S78-E81 WeakPolarHBondContact CB-OE2 3.38Å; S78-E81 PolarHBondContact N-OE2 2.85Å; S78-E81 PolarHBondContact O-N 3.33Å; S78-E81 VanDerWaalsContact OG-CD 3.3Å; S78-E81 VanDerWaalsContact OG-CG 3.32Å; S78-E81 WeakPolarHBondContact OG-CG 3.38Å; S78-E81 PolarHBondContact OG-N 3.32Å; S78-E81 PolarHBondContact OG-OE2 2.89Å; E81-L83 VanDerWaalsContact C-N 3.25Å; E81-L83 PolarHBondContact O-N 2.67Å; E81-D84 PolarHBondContact O-N 3.19Å; E81-D84 VanDerWaalsContact O-N 3.09Å; E81-G85 PolarHBondContact O-N 3.05Å; E81-D86 HydrophobicContact CB-CB 4.19Å; E81-D86 VanDerWaalsContact O-CB 3.3Å; E81-D86 WeakPolarHBondContact O-CB 3.5Å; E81-D86 PolarHBondContact O-N 3.17Å; E81-H338 HydrophobicContact CG-CB 3.82Å
82	V	86.5	Confident	87.8	Confident	21 Å²	21	47.9 Å²	47.9	13%	0.127	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-37.2	176.8	172.3	0	0	0	0	111.8	L77 S78 L79 G85 R87 T411	L77-V82 HydrophobicContact CB-CG2 3.74Å; L77-V82 HydrophobicContact CD1-CG2 4.39Å; S78-V82 WeakPolarHBondContact O-CG2 3.44Å; S78-V82 PolarHBondContact O-N 3.17Å; L79-V82 PolarHBondContact O-N 2.88Å; V82-G85 PolarHBondContact O-N 3.04Å; V82-R87 PolarHBondContact O-NH1 3.46Å; V82-T411 HydrophobicContact CG1-CG2 4.03Å
83	L	83.4	Confident	87.9	Confident	38 Å²	38	45.5 Å²	45.5	20%	0.199	23%	0.233	C	C	.	.	H	α-helix	trans	-74.4	-22.6	176.9	-71.6	169.9	0	0	0	113.7	L79 G80 E81 G85 I346 L407 L415	L79-L83 HydrophobicContact CD1-CD1 4.23Å; L79-L83 HydrophobicContact CD1-CG 4.37Å; L79-L83 HydrophobicContact CG-CD1 3.99Å; L79-L83 WeakPolarHBondContact O-CB 3.43Å; L79-L83 WeakPolarHBondContact O-CD1 3.45Å; L79-L83 WeakPolarHBondContact O-CG 3.32Å; L79-L83 PolarHBondContact O-N 3.02Å; L79-L83 VanDerWaalsContact O-N 3.09Å; G80-L83 PolarHBondContact O-N 3.46Å; E81-L83 VanDerWaalsContact C-N 3.25Å; E81-L83 PolarHBondContact O-N 2.67Å; L83-G85 PolarHBondContact O-N 3Å; L83-I346 HydrophobicContact CD1-CD1 3.3Å; L83-L407 HydrophobicContact CD2-CD1 4.1Å; L83-L407 HydrophobicContact CD2-CD2 4.03Å; L83-L415 HydrophobicContact CD2-CD1 4.15Å
84	D	82.4	Confident	88	Confident	57 Å²	57	43.7 Å²	43.7	31%	0.305	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	1.7	173.1	-150.5	58.4	0	0	0	112.2	K48 G80 E81 D86 H338 Q405	K48-D84 PolarHBondContact NZ-O 2.99Å; K48-D84 IonicContact NZ-OD2 2.81Å; G80-D84 PolarHBondContact O-N 2.82Å; G80-D84 VanDerWaalsContact O-N 3.09Å; E81-D84 PolarHBondContact O-N 3.19Å; E81-D84 VanDerWaalsContact O-N 3.09Å; D84-D86 VanDerWaalsContact C-N 3.34Å; D84-H338 IonicContact OD2-ND1 3.58Å; D84-Q405 PolarHBondContact O-NE2 3.47Å
85	G	86.1	Confident	88.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	15.8	-176	0	0	0	0	0	113.7	E81 V82 L83 T404	E81-G85 PolarHBondContact O-N 3.05Å; V82-G85 PolarHBondContact O-N 3.04Å; L83-G85 PolarHBondContact O-N 3Å; G85-T404 WeakPolarHBondContact O-CB 3.26Å; G85-T404 PolarHBondContact O-OG1 3.47Å
86	D	88.4	Confident	88.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.217	C	C	.	.			trans	-71.5	137.8	179.4	-65.8	-25.8	0	0	0	111.2	N47 K48 L77 E81 D84 M88 H338	N47-D86 PolarHBondContact ND2-OD1 3.38Å; N47-D86 WeakPolarHBondContact OD1-CA 3.39Å; K48-D86 IonicContact NZ-OD1 3.94Å; K48-D86 PolarHBondContact NZ-OD1 2.91Å; L77-D86 HydrophobicContact CD1-CB 4.05Å; L77-D86 WeakPolarHBondContact CD1-O 3.21Å; E81-D86 HydrophobicContact CB-CB 4.19Å; E81-D86 VanDerWaalsContact O-CB 3.3Å; E81-D86 WeakPolarHBondContact O-CB 3.5Å; E81-D86 PolarHBondContact O-N 3.17Å; D84-D86 VanDerWaalsContact C-N 3.34Å; D86-M88 HydrophobicContact CB-CE 4.16Å; D86-H338 IonicContact OD2-CG 3Å; D86-H338 IonicContact OD2-ND1 3.17Å; D86-H338 PolarHBondContact OD2-ND1 2.86Å
87	R	90.9	Very high	88.9	Confident	46 Å²	46	36.3 Å²	36.3	17%	0.174	18%	0.179	C	C	.	.			trans	-142.5	83.1	177.9	-63.5	-67.9	179.6	-93.9	-7.6	107.8	N47 H60 V82 T404 A406	N47-R87 VanDerWaalsContact O-O 3.07Å; N47-R87 PolarHBondContact OD1-N 3.21Å; H60-R87 PolarHBondContact CD2-O 2.9Å; H60-R87 PolarHBondContact NE2-O 3.2Å; V82-R87 PolarHBondContact O-NH1 3.46Å; R87-T404 HydrophobicContact CB-CG2 4.18Å; R87-T404 HydrophobicContact CG-CG2 3.72Å; R87-T404 PolarHBondContact NH2-O 2.79Å; R87-A406 PolarHBondContact NH2-O 3.01Å
88	M	91.7	Very high	89.2	Confident	2 Å²	2	39 Å²	39	1%	0.01	19%	0.187	C	C	.	.			trans	-86.7	134.1	-174.6	-63.4	-177.9	-159.2	0	0	112	Y45 V46 N47 H74 K75 L77 D86 V132	Y45-M88 HydrophobicContact CD1-CB 4.48Å; Y45-M88 HydrophobicContact CG-CB 4.47Å; V46-M88 CarbonylContact O-C 3.54Å; V46-M88 VanDerWaalsContact O-CA 3.29Å; V46-M88 WeakPolarHBondContact O-CA 3.28Å; N47-M88 HydrophobicContact CB-CG 4.2Å; H74-M88 WeakPolarHBondContact CA-O 3.49Å; K75-M88 HydrophobicContact CB-CB 3.96Å; K75-M88 HydrophobicContact CD-CB 4.36Å; K75-M88 HydrophobicContact CD-SD 3.95Å; K75-M88 PolarHBondContact N-O 2.89Å; L77-M88 HydrophobicContact CD2-CB 4.06Å; L77-M88 HydrophobicContact CD2-CE 4.01Å; L77-M88 HydrophobicContact CD2-CG 3.9Å; L77-M88 HydrophobicContact CD2-SD 3.72Å; D86-M88 HydrophobicContact CB-CE 4.16Å; M88-V132 HydrophobicContact CE-CB 4.48Å; M88-V132 HydrophobicContact CE-CG2 3.94Å; M88-V132 HydrophobicContact SD-CB 4.24Å; M88-V132 HydrophobicContact SD-CG1 4.4Å; M88-V132 HydrophobicContact SD-CG2 4.24Å
89	A	93.6	Very high	89.7	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.9	173.7	0	0	0	0	0	111.5	Y45 V46 Y62 I72 R73 S91	Y45-A89 CarbonylContact C-O 3.51Å; Y45-A89 VanDerWaalsContact CA-O 3.23Å; Y45-A89 WeakPolarHBondContact CA-O 3.5Å; V46-A89 HydrophobicContact CG2-CB 4.1Å; V46-A89 PolarHBondContact N-O 3.21Å; V46-A89 PolarHBondContact O-N 2.84Å; Y62-A89 HydrophobicContact CE2-CB 4.01Å; I72-A89 HydrophobicContact CG2-CB 3.66Å; R73-A89 CarbonylContact O-C 3.45Å; R73-A89 WeakPolarHBondContact O-CA 3.3Å; A89-S91 PolarHBondContact O-N 3.41Å
90	E	93.8	Very high	90.4	Very high	67 Å²	67	42.2 Å²	42.2	31%	0.313	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	135.6	175.5	-69.8	177.1	-167	0	0	110.6	I43 Y45 Y62 R73	I43-E90 HydrophobicContact CG2-CG 4.29Å; Y45-E90 HydrophobicContact CD1-CG 4.45Å; Y45-E90 HydrophobicContact CE1-CG 4Å; Y62-E90 PolarHBondContact OH-O 3Å; R73-E90 HydrophobicContact CB-CB 4.36Å; R73-E90 HydrophobicContact CB-CG 4.14Å; R73-E90 VanDerWaalsContact CD-OE2 3.28Å; R73-E90 WeakPolarHBondContact CD-OE2 3.36Å; R73-E90 PolarHBondContact O-N 2.89Å
91	S	94.1	Very high	91.2	Very high	22 Å²	22	43.7 Å²	43.7	15%	0.154	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	167.3	176.2	77.1	0	0	0	0	112.9	L44 Y62 A89 Y93	L44-S91 WeakPolarHBondContact CB-OG 3.1Å; L44-S91 WeakPolarHBondContact CD2-OG 3.23Å; L44-S91 WeakPolarHBondContact O-CB 3.21Å; L44-S91 PolarHBondContact O-N 2.66Å; L44-S91 PolarHBondContact O-OG 2.87Å; Y62-S91 WeakPolarHBondContact OH-CA 3.45Å; A89-S91 PolarHBondContact O-N 3.41Å; S91-Y93 VanDerWaalsContact C-N 3.28Å; S91-Y93 PolarHBondContact OG-N 3.44Å
92	L	93.6	Very high	91.6	Very high	65 Å²	65	50 Å²	50	34%	0.34	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-4.2	171.7	-71.6	170.6	0	0	0	113.2	C67 P69 E94 L106	C67-L92 HydrophobicContact CB-CD1 3.98Å; P69-L92 HydrophobicContact CB-CD2 3.81Å; P69-L92 HydrophobicContact CB-CG 4.24Å; L92-E94 PolarHBondContact O-N 3.35Å; L92-L106 HydrophobicContact CB-CD1 3.68Å; L92-L106 HydrophobicContact CB-CG 4.33Å
93	Y	94.1	Very high	91.8	Very high	17 Å²	17	56.4 Å²	56.4	7%	0.067	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	115.2	-177.6	-61.9	-81.9	0	0	0	110.5	L44 S91 I95 L106 F131 L163 F165 Y204	L44-Y93 HydrophobicContact CD2-CD2 3.95Å; S91-Y93 VanDerWaalsContact C-N 3.28Å; S91-Y93 PolarHBondContact OG-N 3.44Å; Y93-I95 PolarHBondContact O-N 3.49Å; Y93-L106 HydrophobicContact CD1-CD1 3.66Å; Y93-L106 HydrophobicContact CD1-CD2 4.29Å; Y93-L106 HydrophobicContact CE1-CD1 3.81Å; Y93-L106 HydrophobicContact CE1-CD2 3.56Å; Y93-L106 HydrophobicContact CE1-CG 4.24Å; Y93-L106 HydrophobicContact CE2-CD2 4.2Å; Y93-L106 HydrophobicContact CG-CD1 4.05Å; Y93-L106 WeakPolarHBondContact OH-CD2 3.11Å; Y93-F131 HydrophobicContact CE2-CE2 4.13Å; Y93-L163 WeakPolarHBondContact OH-CD1 3.48Å; Y93-F165 AromaticContact CD1-CE2 3.61Å; Y93-F165 HydrophobicContact CD1-CE2 3.61Å; Y93-F165 HydrophobicContact CD1-CZ 4.17Å; Y93-F165 HydrophobicContact CD2-CZ 4.43Å; Y93-F165 AromaticContact CE1-CE2 3.66Å; Y93-F165 HydrophobicContact CE1-CE2 3.66Å; Y93-F165 HydrophobicContact CE1-CZ 4.01Å; Y93-F165 HydrophobicContact CE2-CZ 4.29Å; Y93-F165 HydrophobicContact CG-CE2 4.11Å; Y93-F165 HydrophobicContact CG-CZ 4.38Å; Y93-Y204 AromaticContact CD1-CD1 3.8Å; Y93-Y204 HydrophobicContact CD1-CD1 3.8Å; Y93-Y204 AromaticContact CD1-CD2 3.84Å; Y93-Y204 HydrophobicContact CD1-CD2 3.84Å; Y93-Y204 HydrophobicContact CD1-CE1 4.24Å; Y93-Y204 HydrophobicContact CD1-CE2 4.27Å; Y93-Y204 AromaticContact CD1-CG 3.57Å; Y93-Y204 HydrophobicContact CD1-CG 3.57Å; Y93-Y204 HydrophobicContact CE1-CD1 4.16Å; Y93-Y204 AromaticContact CE1-CG 3.92Å; Y93-Y204 HydrophobicContact CE1-CG 3.92Å
94	E	93.8	Very high	92.3	Very high	108 Å²	108	59.3 Å²	59.3	51%	0.505	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	103.9	172.1	-68.6	-179.6	-159.6	0	0	109.7	L92 R104 Y204	L92-E94 PolarHBondContact O-N 3.35Å; E94-R104 VanDerWaalsContact CD-NH2 3.32Å; E94-R104 IonicContact OE1-NH2 3.58Å; E94-R104 IonicContact OE2-CZ 3.31Å; E94-R104 IonicContact OE2-NH1 2.64Å; E94-R104 PolarHBondContact OE2-NH1 3.21Å; E94-R104 IonicContact OE2-NH2 3.69Å; E94-R104 PolarHBondContact OE2-NH2 3.03Å; E94-Y204 PolarHBondContact N-OH 3.31Å; E94-Y204 PolarHBondContact O-OH 3.05Å
95	I	94.5	Very high	92.9	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131	177.4	-55.3	-178.6	0	0	0	108.4	V42 L44 Y93 L167 V206 W208	V42-I95 HydrophobicContact CB-CB 4.31Å; V42-I95 HydrophobicContact CB-CG2 4.04Å; V42-I95 PolarHBondContact N-O 3.22Å; L44-I95 HydrophobicContact CB-CD1 4.15Å; L44-I95 HydrophobicContact CD1-CD1 3.88Å; Y93-I95 PolarHBondContact O-N 3.49Å; I95-L167 HydrophobicContact CG2-CD1 3.82Å; I95-V206 HydrophobicContact CG1-CG2 4.08Å; I95-V206 HydrophobicContact CG2-CG1 4.07Å; I95-W208 HydrophobicContact CG2-CZ2 3.84Å
96	R	94.9	Very high	93.2	Very high	130 Å²	130	62.4 Å²	62.4	49%	0.491	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139.8	175.2	-72.1	-179.9	177.1	-157.8	2.5	110.3	D40 R98 E99 W208	D40-R96 WeakPolarHBondContact O-CA 3.48Å; R96-R98 PolarHBondContact O-N 3.26Å; R96-E99 HydrophobicContact CB-CB 3.96Å; R96-E99 HydrophobicContact CB-CG 4.09Å; R96-E99 WeakPolarHBondContact CB-OE2 3.41Å; R96-E99 WeakPolarHBondContact CD-OE2 3.3Å; R96-E99 PolarHBondContact O-N 3.15Å; R96-W208 WeakPolarHBondContact O-CZ2 3.44Å; R96-W208 PolarHBondContact O-NE1 3.35Å
97	F	94.4	Very high	93.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	125.9	-174.5	-173.4	-114.5	0	0	0	111.4	Y36 K37 G39 D40 V42 E99 F169 I174 W208	Y36-F97 HydrophobicContact CG-CD2 4.2Å; Y36-F97 HydrophobicContact CG-CG 4.25Å; Y36-F97 WeakPolarHBondContact O-CE1 3.06Å; K37-F97 WeakPolarHBondContact O-CD1 3.22Å; G39-F97 PolarHBondContact N-O 3.07Å; D40-F97 PolarHBondContact O-N 3.3Å; V42-F97 HydrophobicContact CG2-CB 3.93Å; V42-F97 HydrophobicContact CG2-CD2 4.49Å; F97-E99 PolarHBondContact O-N 3.48Å; F97-F169 HydrophobicContact CE2-CB 3.82Å; F97-F169 HydrophobicContact CE2-CG 4.31Å; F97-F169 HydrophobicContact CZ-CB 3.95Å; F97-F169 HydrophobicContact CZ-CD2 4.19Å; F97-F169 HydrophobicContact CZ-CG 4.17Å; F97-I174 HydrophobicContact CD2-CG1 4.26Å; F97-I174 HydrophobicContact CE2-CG1 4Å; F97-W208 HydrophobicContact CD2-CE3 4.43Å; F97-W208 AromaticContact CD2-CH2 3.55Å; F97-W208 HydrophobicContact CD2-CH2 3.55Å; F97-W208 HydrophobicContact CD2-CZ2 4.19Å; F97-W208 AromaticContact CD2-CZ3 3.69Å; F97-W208 HydrophobicContact CD2-CZ3 3.69Å; F97-W208 HydrophobicContact CE2-CE3 4.5Å; F97-W208 HydrophobicContact CE2-CH2 4.16Å; F97-W208 AromaticContact CE2-CZ3 3.83Å; F97-W208 HydrophobicContact CE2-CZ3 3.83Å
98	R	92.1	Very high	93.6	Very high	98 Å²	98	67.8 Å²	67.8	37%	0.37	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	16.4	-176.4	-54.4	-177.5	-173.6	161.1	11.4	115.8	R96 F169 G171 D172	R96-R98 PolarHBondContact O-N 3.26Å; R98-F169 HydrophobicContact CG-CD1 4.4Å; R98-F169 HydrophobicContact CG-CD2 4.38Å; R98-F169 HydrophobicContact CG-CE1 4.1Å; R98-F169 HydrophobicContact CG-CE2 4.09Å; R98-F169 HydrophobicContact CG-CZ 3.93Å; R98-F169 VanDerWaalsContact NE-CE2 3.29Å; R98-G171 PolarHBondContact NH2-O 2.84Å; R98-D172 IonicContact CZ-OD1 3.34Å; R98-D172 IonicContact NH2-OD1 3.61Å; R98-D172 PolarHBondContact NH2-OD1 3.42Å
99	E	94.4	Very high	93.6	Very high	77 Å²	77	69.4 Å²	69.4	36%	0.36	32%	0.323	S	S	.	.			trans	-107.7	115.2	175.1	-66.9	-175.6	-170.2	0	0	110.7	G39 R96 F97 W208	G39-E99 WeakPolarHBondContact CA-OE1 3.3Å; R96-E99 HydrophobicContact CB-CB 3.96Å; R96-E99 HydrophobicContact CB-CG 4.09Å; R96-E99 WeakPolarHBondContact CB-OE2 3.41Å; R96-E99 WeakPolarHBondContact CD-OE2 3.3Å; R96-E99 PolarHBondContact O-N 3.15Å; F97-E99 PolarHBondContact O-N 3.48Å; E99-W208 PolarHBondContact O-NE1 3.46Å
100	N	94.4	Very high	93.5	Very high	107 Å²	107	76.1 Å²	76.1	57%	0.572	35%	0.354	S	S	*	.			trans	-78	138.5	175.5	-68.7	-17.3	0	0	0	110.3	V206 W208	N100-V206 WeakPolarHBondContact CA-O 3.25Å; N100-W208 WeakPolarHBondContact OD1-CB 3.13Å; N100-W208 PolarHBondContact OD1-N 3.21Å
101	V	94.4	Very high	93.3	Very high	31 Å²	31	73 Å²	73	19%	0.188	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.4	179.5	179.6	0	0	0	0	107.8	R104 S205 V206	V101-R104 HydrophobicContact CG1-CB 3.5Å; V101-R104 HydrophobicContact CG1-CG 4.32Å; V101-S205 CarbonylContact O-C 3.4Å; V101-S205 WeakPolarHBondContact O-CA 3.36Å; V101-S205 WeakPolarHBondContact O-CB 3.28Å; V101-V206 HydrophobicContact CB-CB 4.27Å; V101-V206 HydrophobicContact CB-CG2 4.42Å; V101-V206 PolarHBondContact N-O 3.2Å; V101-V206 PolarHBondContact O-N 2.81Å
102	E	92.4	Very high	93.1	Very high	159 Å²	159	73.5 Å²	73.5	74%	0.743	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.9	176.9	-67.5	-168.3	164.2	0	0	110.7	R104	E102-R104 VanDerWaalsContact C-N 3.3Å; E102-R104 PolarHBondContact O-N 3.45Å
103	K	89.7	Confident	92.9	Very high	156 Å²	156	72.7 Å²	72.7	68%	0.678	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.9	46.3	169.1	-157.6	176.5	179.9	175	0	114.3	Y204 S205	K103-Y204 CarbonylContact C-O 3.6Å; K103-Y204 WeakPolarHBondContact CA-O 3.49Å; K103-Y204 PolarHBondContact N-O 3.33Å; K103-S205 PolarHBondContact N-OG 2.98Å
104	R	94.6	Very high	92.7	Very high	98 Å²	98	75.3 Å²	75.3	37%	0.37	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	139.3	173.3	-173.6	164.2	-177.5	-164.3	-0.6	110.1	E94 V101 E102 T203 Y204	E94-R104 VanDerWaalsContact CD-NH2 3.32Å; E94-R104 IonicContact OE1-NH2 3.58Å; E94-R104 IonicContact OE2-CZ 3.31Å; E94-R104 IonicContact OE2-NH1 2.64Å; E94-R104 PolarHBondContact OE2-NH1 3.21Å; E94-R104 IonicContact OE2-NH2 3.69Å; E94-R104 PolarHBondContact OE2-NH2 3.03Å; V101-R104 HydrophobicContact CG1-CB 3.5Å; V101-R104 HydrophobicContact CG1-CG 4.32Å; E102-R104 VanDerWaalsContact C-N 3.3Å; E102-R104 PolarHBondContact O-N 3.45Å; R104-T203 CarbonylContact O-C 3.53Å; R104-T203 WeakPolarHBondContact O-CA 3.37Å; R104-T203 WeakPolarHBondContact O-CB 3.46Å; R104-Y204 HydrophobicContact CB-CD1 4.24Å; R104-Y204 HydrophobicContact CB-CE1 3.85Å; R104-Y204 WeakPolarHBondContact CD-OH 3.33Å; R104-Y204 HydrophobicContact CG-CE1 3.87Å; R104-Y204 PolarHBondContact N-O 3.11Å; R104-Y204 WeakPolarHBondContact O-CD1 3.11Å; R104-Y204 PolarHBondContact O-N 2.76Å
105	I	94.7	Very high	92.5	Very high	95 Å²	95	73.4 Å²	73.4	49%	0.487	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.8	176.3	-60.2	170.1	0	0	0	108.4	T201 T203	I105-T201 HydrophobicContact CG2-CG2 3.97Å; I105-T203 HydrophobicContact CG1-CG2 4.21Å
106	L	93.7	Very high	92.3	Very high	27 Å²	27	73.5 Å²	73.5	14%	0.141	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-56.7	175.2	-174.7	69.7	0	0	0	110.2	C67 L92 Y93 H202 Y204	C67-L106 HydrophobicContact CB-CD2 3.87Å; C67-L106 HydrophobicContact CB-CG 4.31Å; L92-L106 HydrophobicContact CB-CD1 3.68Å; L92-L106 HydrophobicContact CB-CG 4.33Å; Y93-L106 HydrophobicContact CD1-CD1 3.66Å; Y93-L106 HydrophobicContact CD1-CD2 4.29Å; Y93-L106 HydrophobicContact CE1-CD1 3.81Å; Y93-L106 HydrophobicContact CE1-CD2 3.56Å; Y93-L106 HydrophobicContact CE1-CG 4.24Å; Y93-L106 HydrophobicContact CE2-CD2 4.2Å; Y93-L106 HydrophobicContact CG-CD1 4.05Å; Y93-L106 WeakPolarHBondContact OH-CD2 3.11Å; L106-H202 HydrophobicContact CB-CB 4.21Å; L106-H202 HydrophobicContact CD2-CB 4.33Å; L106-H202 PolarHBondContact N-O 3.41Å; L106-Y204 HydrophobicContact CB-CD1 4.09Å; L106-Y204 HydrophobicContact CD1-CD1 4.13Å; L106-Y204 HydrophobicContact CD1-CE1 4.12Å
107	C	93.8	Very high	92.1	Very high	27 Å²	27	70.6 Å²	70.6	18%	0.182	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	161.2	177.5	90.6	0	0	0	0	112.1	C67 M109 H202	C67-C107 VanDerWaalsContact CA-SG 3.58Å; C67-C107 HydrophobicContact CB-CB 3.93Å; C67-C107 WeakPolarHBondContact CB-SG 3.4Å; C67-C107 WeakPolarHBondContact SG-CB 3.32Å; C67-C107 CovalentContact SG-SG 2.03Å; C67-C107 PolarHBondContact SG-SG 3.43Å; C107-M109 WeakPolarHBondContact SG-CG 3.19Å; C107-H202 PolarHBondContact O-N 3.32Å
108	H	93.6	Very high	92	Very high	133 Å²	133	74.4 Å²	74.4	62%	0.616	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.8	167	-62.1	-71.1	0	0	0	109	T201	H108-T201 VanDerWaalsContact CE1-CG2 3.45Å; H108-T201 WeakPolarHBondContact CE1-CG2 3.48Å; H108-T201 PolarHBondContact CE1-OG1 2.95Å; H108-T201 WeakPolarHBondContact ND1-CG2 3.49Å; H108-T201 PolarHBondContact ND1-OG1 2.95Å
109	M	90.8	Very high	92	Very high	35 Å²	35	69.8 Å²	69.8	17%	0.172	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.6	-178.8	-63.7	-177.1	66.3	0	0	110.9	V66 C67 C107 L111 G199 L200	V66-M109 VanDerWaalsContact C-CE 3.45Å; V66-M109 WeakPolarHBondContact O-CE 3.21Å; C67-M109 HydrophobicContact CB-SD 4.42Å; C67-M109 PolarHBondContact N-SD 2.65Å; C107-M109 WeakPolarHBondContact SG-CG 3.19Å; M109-L111 HydrophobicContact CE-CD2 3.82Å; M109-G199 WeakPolarHBondContact O-CA 3.4Å; M109-L200 PolarHBondContact N-O 2.82Å; M109-L200 PolarHBondContact O-N 2.82Å
110	Q	90.8	Very high	91.8	Very high	142 Å²	142	69.3 Å²	69.3	66%	0.664	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.4	163.6	-65.1	-152.5	10.8	0	0	108.5	F197 L198	Q110-F197 HydrophobicContact CB-CB 4.43Å; Q110-L198 WeakPolarHBondContact CA-O 3.1Å
111	L	89.6	Confident	91.6	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.3	-179.4	-62.6	-176.9	0	0	0	110.4	P65 M109 Q115 V116 L119 F197 L198 L200	P65-L111 HydrophobicContact CB-CD2 3.95Å; M109-L111 HydrophobicContact CE-CD2 3.82Å; L111-Q115 HydrophobicContact CB-CB 4.38Å; L111-Q115 HydrophobicContact CD2-CB 4.23Å; L111-V116 HydrophobicContact CB-CG2 3.87Å; L111-V116 HydrophobicContact CD1-CG2 4.36Å; L111-L119 HydrophobicContact CD1-CD1 3.63Å; L111-F197 CarbonylContact O-C 3.59Å; L111-F197 VanDerWaalsContact O-CA 3.32Å; L111-F197 WeakPolarHBondContact O-CA 3.35Å; L111-L198 HydrophobicContact CB-CB 4.42Å; L111-L198 PolarHBondContact N-O 2.98Å; L111-L198 PolarHBondContact O-N 3.42Å; L111-L200 HydrophobicContact CD1-CD1 3.45Å; L111-L200 VanDerWaalsContact CD1-CD1 3.45Å; L111-L200 HydrophobicContact CG-CD1 4.21Å
112	S	90.9	Very high	91.4	Very high	33 Å²	33	67.5 Å²	67.5	23%	0.231	33%	0.334	C	S	.	.			trans	-74.5	160.7	167.8	60.8	0	0	0	0	111.6	A114 Q115 V116	S112-A114 PolarHBondContact O-N 3.03Å; S112-Q115 WeakPolarHBondContact O-CB 3.35Å; S112-Q115 PolarHBondContact O-N 2.91Å; S112-Q115 WeakPolarHBondContact OG-CG 3.19Å; S112-Q115 PolarHBondContact OG-OE1 3.01Å; S112-V116 WeakPolarHBondContact O-CG2 3.43Å; S112-V116 PolarHBondContact O-N 3.34Å
113	S	88.6	Confident	91.3	Very high	48 Å²	48	60.1 Å²	60.1	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-53.8	-38.7	176.2	52.4	0	0	0	0	113.3	V116 E117 P194	S113-V116 PolarHBondContact O-N 3.13Å; S113-E117 WeakPolarHBondContact O-CB 3.16Å; S113-E117 PolarHBondContact O-N 3.18Å; S113-P194 WeakPolarHBondContact CB-O 3.39Å; S113-P194 PolarHBondContact OG-O 2.76Å
114	A	89.8	Confident	91.3	Very high	72 Å²	72	56 Å²	56	60%	0.595	28%	0.283	S	S	*	.	H	α-helix	trans	-64.7	-38.7	175.2	0	0	0	0	0	113.2	S112 E117 Q118	S112-A114 PolarHBondContact O-N 3.03Å; A114-E117 PolarHBondContact O-N 3.35Å; A114-Q118 PolarHBondContact O-N 2.75Å
115	Q	91.2	Very high	91	Very high	67 Å²	67	56 Å²	56	31%	0.313	29%	0.287	S	S	.	.	H	α-helix	trans	-72.3	-36.5	177.2	-72.3	170	-50.9	0	0	111.9	P65 L111 S112 E117 Q118 L119	P65-Q115 HydrophobicContact CB-CB 3.8Å; P65-Q115 HydrophobicContact CB-CG 3.87Å; P65-Q115 HydrophobicContact CG-CB 3.89Å; P65-Q115 HydrophobicContact CG-CG 4.36Å; P65-Q115 WeakPolarHBondContact CG-O 3.39Å; L111-Q115 HydrophobicContact CB-CB 4.38Å; L111-Q115 HydrophobicContact CD2-CB 4.23Å; S112-Q115 WeakPolarHBondContact O-CB 3.35Å; S112-Q115 PolarHBondContact O-N 2.91Å; S112-Q115 WeakPolarHBondContact OG-CG 3.19Å; S112-Q115 PolarHBondContact OG-OE1 3.01Å; Q115-E117 VanDerWaalsContact C-N 3.33Å; Q115-Q118 PolarHBondContact O-N 2.78Å; Q115-L119 PolarHBondContact O-N 3.25Å; Q115-L119 VanDerWaalsContact O-N 3.07Å
116	V	90.4	Very high	90.8	Very high	8 Å²	8	54.9 Å²	54.9	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-44.4	172.6	175.9	0	0	0	0	110.3	L111 S112 S113 Q118 L119 R120 L189 L192 L198	L111-V116 HydrophobicContact CB-CG2 3.87Å; L111-V116 HydrophobicContact CD1-CG2 4.36Å; S112-V116 WeakPolarHBondContact O-CG2 3.43Å; S112-V116 PolarHBondContact O-N 3.34Å; S113-V116 PolarHBondContact O-N 3.13Å; V116-Q118 VanDerWaalsContact C-N 3.33Å; V116-Q118 PolarHBondContact O-N 2.93Å; V116-L119 PolarHBondContact O-N 3.39Å; V116-R120 WeakPolarHBondContact O-CB 3.34Å; V116-R120 PolarHBondContact O-N 3.11Å; V116-L189 HydrophobicContact CG1-CB 4.14Å; V116-L189 HydrophobicContact CG1-CD2 4.27Å; V116-L192 HydrophobicContact CG1-CD1 4.41Å; V116-L192 HydrophobicContact CG2-CD2 4.36Å; V116-L198 HydrophobicContact CG2-CB 4.22Å; V116-L198 HydrophobicContact CG2-CD2 4.29Å
117	E	90.3	Very high	90.8	Very high	68 Å²	68	54.8 Å²	54.8	32%	0.318	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-39.7	177	-176.9	56.3	-154	0	0	112.2	S113 A114 Q115 L119 R120 Q121	S113-E117 WeakPolarHBondContact O-CB 3.16Å; S113-E117 PolarHBondContact O-N 3.18Å; A114-E117 PolarHBondContact O-N 3.35Å; Q115-E117 VanDerWaalsContact C-N 3.33Å; E117-L119 PolarHBondContact O-N 3.02Å; E117-R120 WeakPolarHBondContact O-CB 3.5Å; E117-R120 PolarHBondContact O-N 3.5Å; E117-R120 IonicContact OE1-CZ 3.35Å; E117-R120 IonicContact OE1-NE 3.79Å; E117-R120 PolarHBondContact OE1-NE 3.14Å; E117-R120 IonicContact OE1-NH2 3.62Å; E117-R120 PolarHBondContact OE1-NH2 3.04Å; E117-R120 IonicContact OE2-CZ 3.88Å; E117-R120 IonicContact OE2-NE 3.74Å; E117-R120 PolarHBondContact OE2-NE 3.36Å; E117-R120 IonicContact OE2-NH2 3.93Å; E117-Q121 WeakPolarHBondContact O-CG 3.37Å; E117-Q121 PolarHBondContact O-N 2.81Å; E117-Q121 PolarHBondContact OE1-NE2 2.96Å
118	Q	91.7	Very high	90.7	Very high	81 Å²	81	53.9 Å²	53.9	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-43.4	174.1	-171.2	-171.9	-4.1	0	0	112	Q63 A114 Q115 V116 A122	Q63-Q118 PolarHBondContact O-NE2 3.09Å; A114-Q118 PolarHBondContact O-N 2.75Å; Q115-Q118 PolarHBondContact O-N 2.78Å; V116-Q118 VanDerWaalsContact C-N 3.33Å; V116-Q118 PolarHBondContact O-N 2.93Å; Q118-A122 WeakPolarHBondContact O-CB 3.36Å; Q118-A122 PolarHBondContact O-N 3.31Å; Q118-A122 VanDerWaalsContact O-N 3.07Å
119	L	91.4	Very high	90.7	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-37.9	174.9	-72.2	170.8	0	0	0	111.9	P65 L111 Q115 V116 E117 A122 I123 V142 L159 L189	P65-L119 HydrophobicContact CG-CD1 3.84Å; P65-L119 HydrophobicContact CG-CD2 3.93Å; P65-L119 HydrophobicContact CG-CG 3.53Å; L111-L119 HydrophobicContact CD1-CD1 3.63Å; Q115-L119 PolarHBondContact O-N 3.25Å; Q115-L119 VanDerWaalsContact O-N 3.07Å; V116-L119 PolarHBondContact O-N 3.39Å; E117-L119 PolarHBondContact O-N 3.02Å; L119-A122 PolarHBondContact O-N 3Å; L119-I123 WeakPolarHBondContact O-CD1 3.34Å; L119-I123 WeakPolarHBondContact O-CG1 3.29Å; L119-I123 PolarHBondContact O-N 3.38Å; L119-V142 HydrophobicContact CD2-CG1 4.46Å; L119-L159 HydrophobicContact CD1-CD1 4.48Å; L119-L159 HydrophobicContact CD1-CD2 4.11Å; L119-L159 HydrophobicContact CD2-CD1 4.39Å; L119-L189 HydrophobicContact CB-CD1 4.11Å
120	R	90.3	Very high	90.8	Very high	66 Å²	66	46.5 Å²	46.5	25%	0.249	24%	0.238	C	C	.	.	H	α-helix	trans	-58.5	-51.1	177.4	-164.6	-175.4	74.7	71	16.4	110.2	V116 E117 A122 I123 E124 I157	V116-R120 WeakPolarHBondContact O-CB 3.34Å; V116-R120 PolarHBondContact O-N 3.11Å; E117-R120 WeakPolarHBondContact O-CB 3.5Å; E117-R120 PolarHBondContact O-N 3.5Å; E117-R120 IonicContact OE1-CZ 3.35Å; E117-R120 IonicContact OE1-NE 3.79Å; E117-R120 PolarHBondContact OE1-NE 3.14Å; E117-R120 IonicContact OE1-NH2 3.62Å; E117-R120 PolarHBondContact OE1-NH2 3.04Å; E117-R120 IonicContact OE2-CZ 3.88Å; E117-R120 IonicContact OE2-NE 3.74Å; E117-R120 PolarHBondContact OE2-NE 3.36Å; E117-R120 IonicContact OE2-NH2 3.93Å; R120-A122 PolarHBondContact O-N 3Å; R120-I123 PolarHBondContact O-N 3.11Å; R120-E124 IonicContact CZ-OE1 3.66Å; R120-E124 IonicContact CZ-OE2 2.72Å; R120-E124 IonicContact NH1-OE1 3.45Å; R120-E124 PolarHBondContact NH1-OE1 3.14Å; R120-E124 IonicContact NH1-OE2 3.42Å; R120-E124 PolarHBondContact NH1-OE2 2.9Å; R120-E124 IonicContact NH2-OE2 2.76Å; R120-E124 PolarHBondContact NH2-OE2 3.19Å; R120-E124 WeakPolarHBondContact O-CG 3.23Å; R120-E124 PolarHBondContact O-N 3.49Å; R120-I157 HydrophobicContact CG-CD1 3.45Å; R120-I157 VanDerWaalsContact CG-CD1 3.45Å; R120-I157 HydrophobicContact CG-CG2 4.23Å
121	Q	90.3	Very high	90.9	Very high	95 Å²	95	39.7 Å²	39.7	44%	0.444	21%	0.206	S	C	.	.	H	α-helix	trans	-59.8	-44.4	176.3	-70.1	174.5	6.7	0	0	112	E117 I123 E124 E125	E117-Q121 WeakPolarHBondContact O-CG 3.37Å; E117-Q121 PolarHBondContact O-N 2.81Å; E117-Q121 PolarHBondContact OE1-NE2 2.96Å; Q121-I123 VanDerWaalsContact C-N 3.32Å; Q121-I123 PolarHBondContact O-N 2.91Å; Q121-E124 WeakPolarHBondContact O-CB 3.13Å; Q121-E124 PolarHBondContact O-N 2.86Å; Q121-E125 PolarHBondContact O-N 2.73Å
122	A	91.3	Very high	91	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-39.2	177.1	0	0	0	0	0	112.6	L64 Q118 L119 R120 L126 Y127	L64-A122 HydrophobicContact CD2-CB 4.04Å; Q118-A122 WeakPolarHBondContact O-CB 3.36Å; Q118-A122 PolarHBondContact O-N 3.31Å; Q118-A122 VanDerWaalsContact O-N 3.07Å; L119-A122 PolarHBondContact O-N 3Å; R120-A122 PolarHBondContact O-N 3Å; A122-L126 PolarHBondContact O-N 3.03Å; A122-Y127 HydrophobicContact CB-CD1 4.12Å; A122-Y127 HydrophobicContact CB-CD2 3.8Å; A122-Y127 HydrophobicContact CB-CE2 4.22Å; A122-Y127 HydrophobicContact CB-CG 3.74Å; A122-Y127 VanDerWaalsContact O-CB 3.23Å; A122-Y127 WeakPolarHBondContact O-CB 3.46Å; A122-Y127 WeakPolarHBondContact O-CD1 3.03Å; A122-Y127 PolarHBondContact O-N 2.78Å
123	I	90.9	Very high	91	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-70.8	-36.6	176.6	-63.4	164.2	0	0	0	110.5	L119 R120 Q121 E125 L126 I157 L159 L189	L119-I123 WeakPolarHBondContact O-CD1 3.34Å; L119-I123 WeakPolarHBondContact O-CG1 3.29Å; L119-I123 PolarHBondContact O-N 3.38Å; R120-I123 PolarHBondContact O-N 3.11Å; Q121-I123 VanDerWaalsContact C-N 3.32Å; Q121-I123 PolarHBondContact O-N 2.91Å; I123-E125 VanDerWaalsContact C-N 3.3Å; I123-E125 PolarHBondContact O-N 3.09Å; I123-L126 PolarHBondContact O-N 3.44Å; I123-I157 HydrophobicContact CB-CG2 3.93Å; I123-I157 HydrophobicContact CD1-CG2 3.89Å; I123-I157 HydrophobicContact CG2-CG2 3.78Å; I123-L159 HydrophobicContact CD1-CB 4.41Å; I123-L159 HydrophobicContact CD1-CD1 4.16Å; I123-L189 HydrophobicContact CD1-CD1 3.75Å
124	E	89.4	Confident	90.9	Very high	69 Å²	69	36.6 Å²	36.6	32%	0.322	18%	0.183	S	C	.	.	H	α-helix	trans	-60.9	-39	175.3	-74.5	-179.8	150.9	0	0	112.9	R120 Q121 L126 M145 I157	R120-E124 IonicContact CZ-OE1 3.66Å; R120-E124 IonicContact CZ-OE2 2.72Å; R120-E124 IonicContact NH1-OE1 3.45Å; R120-E124 PolarHBondContact NH1-OE1 3.14Å; R120-E124 IonicContact NH1-OE2 3.42Å; R120-E124 PolarHBondContact NH1-OE2 2.9Å; R120-E124 IonicContact NH2-OE2 2.76Å; R120-E124 PolarHBondContact NH2-OE2 3.19Å; R120-E124 WeakPolarHBondContact O-CG 3.23Å; R120-E124 PolarHBondContact O-N 3.49Å; Q121-E124 WeakPolarHBondContact O-CB 3.13Å; Q121-E124 PolarHBondContact O-N 2.86Å; E124-L126 PolarHBondContact O-N 2.95Å; E124-M145 HydrophobicContact CB-CE 4Å; E124-M145 HydrophobicContact CG-CE 3.88Å; E124-I157 HydrophobicContact CG-CD1 3.75Å; E124-I157 WeakPolarHBondContact OE1-CD1 3.43Å
125	E	88.6	Confident	90.6	Very high	100 Å²	100	36.9 Å²	36.9	47%	0.467	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	11.3	175.9	-65.3	-177.2	173.8	0	0	113.6	P51 Q121 I123 Y127	P51-E125 HydrophobicContact CB-CB 4.22Å; Q121-E125 PolarHBondContact O-N 2.73Å; I123-E125 VanDerWaalsContact C-N 3.3Å; I123-E125 PolarHBondContact O-N 3.09Å; E125-Y127 HydrophobicContact CB-CD1 3.79Å; E125-Y127 HydrophobicContact CB-CE1 3.62Å; E125-Y127 HydrophobicContact CG-CE1 4.5Å; E125-Y127 PolarHBondContact O-N 2.96Å; E125-Y127 WeakPolarHBondContact OE2-CE1 3.46Å; E125-Y127 PolarHBondContact OE2-OH 3.37Å
126	L	90	Very high	90.3	Very high	70 Å²	70	34 Å²	34	37%	0.366	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	48.7	-179.8	-64	171.5	0	0	0	112.9	Y52 A122 I123 E124 Y128 F141	Y52-L126 WeakPolarHBondContact CB-O 3.44Å; Y52-L126 PolarHBondContact N-O 2.93Å; A122-L126 PolarHBondContact O-N 3.03Å; I123-L126 PolarHBondContact O-N 3.44Å; E124-L126 PolarHBondContact O-N 2.95Å; L126-Y128 PolarHBondContact O-N 2.87Å; L126-F141 HydrophobicContact CB-CE1 4.45Å
127	Y	92.9	Very high	90.1	Very high	26 Å²	26	35.5 Å²	35.5	10%	0.102	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	131	179.3	-86.9	41.2	0	0	0	111.2	G50 P51 Y59 A122 E125 V142	G50-Y127 VanDerWaalsContact O-CA 3.29Å; G50-Y127 WeakPolarHBondContact O-CA 3.4Å; P51-Y127 HydrophobicContact CB-CD1 3.99Å; P51-Y127 HydrophobicContact CB-CE1 3.68Å; P51-Y127 HydrophobicContact CG-CE1 4.1Å; Y59-Y127 HydrophobicContact CD2-CE2 4.24Å; A122-Y127 HydrophobicContact CB-CD1 4.12Å; A122-Y127 HydrophobicContact CB-CD2 3.8Å; A122-Y127 HydrophobicContact CB-CE2 4.22Å; A122-Y127 HydrophobicContact CB-CG 3.74Å; A122-Y127 VanDerWaalsContact O-CB 3.23Å; A122-Y127 WeakPolarHBondContact O-CB 3.46Å; A122-Y127 WeakPolarHBondContact O-CD1 3.03Å; A122-Y127 PolarHBondContact O-N 2.78Å; E125-Y127 HydrophobicContact CB-CD1 3.79Å; E125-Y127 HydrophobicContact CB-CE1 3.62Å; E125-Y127 HydrophobicContact CG-CE1 4.5Å; E125-Y127 PolarHBondContact O-N 2.96Å; E125-Y127 WeakPolarHBondContact OE2-CE1 3.46Å; E125-Y127 PolarHBondContact OE2-OH 3.37Å; Y127-V142 PolarHBondContact O-N 3.39Å
128	Y	92.3	Very high	90	Very high	8 Å²	8	32.4 Å²	32.4	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	153.9	168.5	80.4	-71.1	0	0	0	109.3	V49 G50 L126 E130 G140 F227 F228 R492	V49-Y128 WeakPolarHBondContact CA-O 3.39Å; G50-Y128 PolarHBondContact N-O 2.83Å; G50-Y128 VanDerWaalsContact N-O 3.12Å; G50-Y128 WeakPolarHBondContact O-CD1 3.45Å; G50-Y128 WeakPolarHBondContact O-CE1 3.29Å; G50-Y128 PolarHBondContact O-N 3.31Å; L126-Y128 PolarHBondContact O-N 2.87Å; Y128-E130 HydrophobicContact CE2-CB 4.37Å; Y128-G140 CarbonylContact C-O 3.53Å; Y128-G140 WeakPolarHBondContact CA-O 3.39Å; Y128-G140 WeakPolarHBondContact CB-O 3.31Å; Y128-F227 HydrophobicContact CG-CE1 4.46Å; Y128-F228 HydrophobicContact CD2-CZ 4.16Å; Y128-F228 HydrophobicContact CE2-CZ 4.15Å; Y128-R492 PolarHBondContact OH-NH1 2.94Å
129	F	93.5	Very high	90	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.035	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	152.4	168.9	64.1	-95.8	0	0	0	110.3	V49 Y61 F131 R139 G140 V142 L163 V179	V49-F129 HydrophobicContact CG1-CB 3.7Å; Y61-F129 HydrophobicContact CD2-CB 3.95Å; Y61-F129 HydrophobicContact CE2-CB 4.01Å; Y61-F129 HydrophobicContact CE2-CG 4.38Å; F129-F131 HydrophobicContact CB-CE1 4.31Å; F129-F131 AromaticContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CD1 3.92Å; F129-F131 AromaticContact CD2-CD2 3.94Å; F129-F131 HydrophobicContact CD2-CD2 3.94Å; F129-F131 AromaticContact CD2-CE1 3.72Å; F129-F131 HydrophobicContact CD2-CE1 3.72Å; F129-F131 AromaticContact CD2-CE2 3.76Å; F129-F131 HydrophobicContact CD2-CE2 3.76Å; F129-F131 HydrophobicContact CD2-CG 4.02Å; F129-F131 AromaticContact CD2-CZ 3.64Å; F129-F131 HydrophobicContact CD2-CZ 3.64Å; F129-F131 AromaticContact CE2-CD2 3.81Å; F129-F131 HydrophobicContact CE2-CD2 3.81Å; F129-F131 HydrophobicContact CE2-CE1 4.43Å; F129-F131 AromaticContact CE2-CE2 3.62Å; F129-F131 HydrophobicContact CE2-CE2 3.62Å; F129-F131 HydrophobicContact CE2-CG 4.3Å; F129-F131 AromaticContact CE2-CZ 3.96Å; F129-F131 HydrophobicContact CE2-CZ 3.96Å; F129-F131 HydrophobicContact CG-CE1 4.29Å; F129-F131 HydrophobicContact CG-CZ 4.26Å; F129-F131 HydrophobicContact CZ-CE2 4.49Å; F129-R139 VanDerWaalsContact O-CA 3.28Å; F129-R139 WeakPolarHBondContact O-CA 3.35Å; F129-G140 WeakPolarHBondContact CD1-O 3.35Å; F129-G140 WeakPolarHBondContact CE1-O 3.03Å; F129-G140 PolarHBondContact N-O 3.41Å; F129-G140 PolarHBondContact O-N 3.4Å; F129-V142 HydrophobicContact CD1-CG2 4.2Å; F129-L163 HydrophobicContact CE1-CD2 4.38Å; F129-L163 HydrophobicContact CZ-CD1 4.07Å; F129-L163 HydrophobicContact CZ-CD2 4.05Å; F129-V179 HydrophobicContact CE2-CG1 4.06Å; F129-V179 HydrophobicContact CZ-CG1 4.01Å; F129-V179 HydrophobicContact CZ-CG2 4.42Å
130	E	92.4	Very high	89.9	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.019	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.5	170.3	-174	177.3	88	0	0	109.6	N47 K48 Y128 P137 I138 R139 H338	N47-E130 VanDerWaalsContact CB-O 3.26Å; N47-E130 WeakPolarHBondContact CB-O 3.49Å; N47-E130 PolarHBondContact N-O 3.27Å; N47-E130 PolarHBondContact ND2-OE1 3.46Å; K48-E130 WeakPolarHBondContact CE-OE1 3.39Å; K48-E130 HydrophobicContact CG-CB 4.33Å; K48-E130 PolarHBondContact N-O 3.2Å; K48-E130 PolarHBondContact O-N 2.96Å; Y128-E130 HydrophobicContact CE2-CB 4.37Å; E130-P137 HydrophobicContact CG-CB 4.34Å; E130-I138 CarbonylContact C-O 3.6Å; E130-I138 WeakPolarHBondContact CA-O 3.27Å; E130-R139 HydrophobicContact CB-CG 4.24Å; E130-R139 HydrophobicContact CG-CG 4.03Å; E130-R139 IonicContact OE2-CZ 2.67Å; E130-R139 IonicContact OE2-NE 2.82Å; E130-R139 PolarHBondContact OE2-NE 3.38Å; E130-R139 IonicContact OE2-NH2 3.6Å; E130-R139 PolarHBondContact OE2-NH2 3.05Å; E130-H338 IonicContact OE1-CE1 3.86Å
131	F	93.8	Very high	89.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	162	170.9	-61.9	-17.9	0	0	0	109.8	L44 Y45 V46 Y61 Y93 F129 P137 I138 L163 F165	L44-F131 HydrophobicContact CD1-CD2 4.36Å; L44-F131 HydrophobicContact CD2-CB 4.01Å; L44-F131 HydrophobicContact CD2-CD2 3.85Å; L44-F131 HydrophobicContact CD2-CE2 4.49Å; L44-F131 HydrophobicContact CD2-CG 3.96Å; L44-F131 HydrophobicContact CG-CB 4.41Å; Y45-F131 CarbonylContact O-C 3.57Å; Y45-F131 VanDerWaalsContact O-CA 3.3Å; Y45-F131 WeakPolarHBondContact O-CA 3.04Å; Y45-F131 WeakPolarHBondContact O-CB 3.16Å; V46-F131 HydrophobicContact CB-CD1 3.94Å; V46-F131 HydrophobicContact CB-CE1 3.88Å; V46-F131 HydrophobicContact CG1-CD1 3.85Å; V46-F131 HydrophobicContact CG1-CE1 3.57Å; V46-F131 HydrophobicContact CG1-CZ 4.08Å; Y61-F131 HydrophobicContact CD1-CE1 4.04Å; Y61-F131 HydrophobicContact CD1-CZ 4.43Å; Y61-F131 AromaticContact CD2-CE1 3.53Å; Y61-F131 HydrophobicContact CD2-CE1 3.53Å; Y61-F131 HydrophobicContact CD2-CZ 4.05Å; Y61-F131 HydrophobicContact CE1-CE1 4.04Å; Y61-F131 AromaticContact CE1-CZ 3.96Å; Y61-F131 HydrophobicContact CE1-CZ 3.96Å; Y61-F131 AromaticContact CE2-CE1 3.57Å; Y61-F131 HydrophobicContact CE2-CE1 3.57Å; Y61-F131 AromaticContact CE2-CZ 3.57Å; Y61-F131 HydrophobicContact CE2-CZ 3.57Å; Y61-F131 AromaticContact CG-CE1 3.8Å; Y61-F131 HydrophobicContact CG-CE1 3.8Å; Y61-F131 HydrophobicContact CG-CZ 4.47Å; Y61-F131 AromaticContact CZ-CE1 3.84Å; Y61-F131 AromaticContact CZ-CZ 3.53Å; Y93-F131 HydrophobicContact CE2-CE2 4.13Å; F129-F131 HydrophobicContact CB-CE1 4.31Å; F129-F131 AromaticContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CD1 3.92Å; F129-F131 AromaticContact CD2-CD2 3.94Å; F129-F131 HydrophobicContact CD2-CD2 3.94Å; F129-F131 AromaticContact CD2-CE1 3.72Å; F129-F131 HydrophobicContact CD2-CE1 3.72Å; F129-F131 AromaticContact CD2-CE2 3.76Å; F129-F131 HydrophobicContact CD2-CE2 3.76Å; F129-F131 HydrophobicContact CD2-CG 4.02Å; F129-F131 AromaticContact CD2-CZ 3.64Å; F129-F131 HydrophobicContact CD2-CZ 3.64Å; F129-F131 AromaticContact CE2-CD2 3.81Å; F129-F131 HydrophobicContact CE2-CD2 3.81Å; F129-F131 HydrophobicContact CE2-CE1 4.43Å; F129-F131 AromaticContact CE2-CE2 3.62Å; F129-F131 HydrophobicContact CE2-CE2 3.62Å; F129-F131 HydrophobicContact CE2-CG 4.3Å; F129-F131 AromaticContact CE2-CZ 3.96Å; F129-F131 HydrophobicContact CE2-CZ 3.96Å; F129-F131 HydrophobicContact CG-CE1 4.29Å; F129-F131 HydrophobicContact CG-CZ 4.26Å; F129-F131 HydrophobicContact CZ-CE2 4.49Å; F131-P137 CarbonylContact O-C 3.54Å; F131-P137 WeakPolarHBondContact O-CA 3.34Å; F131-I138 HydrophobicContact CB-CB 4.37Å; F131-I138 PolarHBondContact N-O 3.06Å; F131-I138 PolarHBondContact O-N 3.37Å; F131-L163 HydrophobicContact CE2-CD1 4.05Å; F131-F165 HydrophobicContact CD2-CE1 4.17Å; F131-F165 HydrophobicContact CD2-CZ 4.35Å; F131-F165 HydrophobicContact CE2-CZ 4.35Å
132	V	91.3	Very high	90	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.8	179.9	-177.2	0	0	0	0	109.9	Y45 N47 M88 L136	Y45-V132 PolarHBondContact N-O 3.14Å; Y45-V132 PolarHBondContact O-N 2.95Å; N47-V132 HydrophobicContact CB-CG2 4.39Å; M88-V132 HydrophobicContact CE-CB 4.48Å; M88-V132 HydrophobicContact CE-CG2 3.94Å; M88-V132 HydrophobicContact SD-CB 4.24Å; M88-V132 HydrophobicContact SD-CG1 4.4Å; M88-V132 HydrophobicContact SD-CG2 4.24Å; V132-L136 WeakPolarHBondContact CA-O 3.46Å
133	V	90.4	Very high	89.8	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.1	174	176.5	0	0	0	0	108	V42 L44 D135 L136 I138 L167 I174	V42-V133 HydrophobicContact CG1-CG1 3.53Å; L44-V133 HydrophobicContact CB-CG2 3.75Å; L44-V133 HydrophobicContact CD1-CG2 3.6Å; L44-V133 HydrophobicContact CG-CG2 3.54Å; V133-D135 PolarHBondContact O-N 3.24Å; V133-L136 PolarHBondContact N-O 3.33Å; V133-L136 WeakPolarHBondContact O-CA 3.38Å; V133-L136 WeakPolarHBondContact O-CB 3.03Å; V133-L136 WeakPolarHBondContact O-CG 2.92Å; V133-L136 PolarHBondContact O-N 3.05Å; V133-I138 HydrophobicContact CB-CD1 4.11Å; V133-I138 HydrophobicContact CG2-CD1 3.6Å; V133-L167 HydrophobicContact CG1-CD2 4.39Å; V133-I174 HydrophobicContact CG1-CD1 4.26Å
134	D	87.3	Confident	89.5	Confident	14 Å²	14	32.8 Å²	32.8	8%	0.075	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	47.5	179.9	-172.3	-6.3	0	0	0	112	T34 Y36 L136 I174 R216	T34-D134 PolarHBondContact OG1-OD1 2.88Å; T34-D134 PolarHBondContact OG1-OD2 3.33Å; T34-D134 VanDerWaalsContact OG1-OD2 3.12Å; Y36-D134 WeakPolarHBondContact CE2-OD2 3.43Å; D134-L136 PolarHBondContact O-N 3.44Å; D134-I174 HydrophobicContact CB-CD1 4.13Å; D134-R216 PolarHBondContact O-NH1 3.4Å; D134-R216 IonicContact OD1-CZ 3.49Å; D134-R216 IonicContact OD1-NH1 3.66Å; D134-R216 PolarHBondContact OD1-NH1 3.27Å; D134-R216 IonicContact OD1-NH2 2.94Å; D134-R216 PolarHBondContact OD1-NH2 2.94Å; D134-R216 IonicContact OD2-CZ 3.64Å; D134-R216 IonicContact OD2-NH2 2.79Å; D134-R216 PolarHBondContact OD2-NH2 2.95Å
135	D	82.6	Confident	89.2	Confident	79 Å²	79	31.8 Å²	31.8	42%	0.422	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	19.4	-175.6	-53.3	-30.6	0	0	0	114.9	K75 V133	K75-D135 IonicContact NZ-OD1 3.15Å; K75-D135 PolarHBondContact NZ-OD1 3.17Å; V133-D135 PolarHBondContact O-N 3.24Å
136	L	85	Confident	88.8	Confident	5 Å²	5	31 Å²	31	3%	0.026	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.8	169.9	-55.6	176.6	0	0	0	109.4	V132 V133 D134 I174 A177	V132-L136 WeakPolarHBondContact CA-O 3.46Å; V133-L136 PolarHBondContact N-O 3.33Å; V133-L136 WeakPolarHBondContact O-CA 3.38Å; V133-L136 WeakPolarHBondContact O-CB 3.03Å; V133-L136 WeakPolarHBondContact O-CG 2.92Å; V133-L136 PolarHBondContact O-N 3.05Å; D134-L136 PolarHBondContact O-N 3.44Å; L136-I174 HydrophobicContact CD1-CB 4.47Å; L136-I174 HydrophobicContact CD1-CG2 3.68Å; L136-A177 HydrophobicContact CB-CB 4.11Å; L136-A177 HydrophobicContact CD1-CB 3.94Å
137	P	86.4	Confident	88.1	Confident	41 Å²	41	34.7 Å²	34.7	27%	0.266	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.1	174.7	29.6	-33.3	0	0	0	110.5	E130 F131	E130-P137 HydrophobicContact CG-CB 4.34Å; F131-P137 CarbonylContact O-C 3.54Å; F131-P137 WeakPolarHBondContact O-CA 3.34Å
138	I	89.3	Confident	86.9	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.7	176.6	-56.3	172.3	0	0	0	107	E130 F131 V133 A177 V179	E130-I138 CarbonylContact C-O 3.6Å; E130-I138 WeakPolarHBondContact CA-O 3.27Å; F131-I138 HydrophobicContact CB-CB 4.37Å; F131-I138 PolarHBondContact N-O 3.06Å; F131-I138 PolarHBondContact O-N 3.37Å; V133-I138 HydrophobicContact CB-CD1 4.11Å; V133-I138 HydrophobicContact CG2-CD1 3.6Å; I138-A177 HydrophobicContact CD1-CB 3.65Å; I138-A177 HydrophobicContact CG1-CB 3.68Å; I138-V179 HydrophobicContact CG2-CB 3.45Å; I138-V179 VanDerWaalsContact CG2-CB 3.45Å; I138-V179 HydrophobicContact CG2-CG1 3.42Å; I138-V179 VanDerWaalsContact CG2-CG1 3.42Å
139	R	90	Very high	85.3	Confident	60 Å²	60	37.3 Å²	37.3	23%	0.226	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142	-173.3	-62.6	172.9	-177.9	151	-0.7	111.3	F129 E130 V179 F227	F129-R139 VanDerWaalsContact O-CA 3.28Å; F129-R139 WeakPolarHBondContact O-CA 3.35Å; E130-R139 HydrophobicContact CB-CG 4.24Å; E130-R139 HydrophobicContact CG-CG 4.03Å; E130-R139 IonicContact OE2-CZ 2.67Å; E130-R139 IonicContact OE2-NE 2.82Å; E130-R139 PolarHBondContact OE2-NE 3.38Å; E130-R139 IonicContact OE2-NH2 3.6Å; E130-R139 PolarHBondContact OE2-NH2 3.05Å; R139-V179 VanDerWaalsContact O-CG1 3.24Å; R139-V179 WeakPolarHBondContact O-CG1 3.49Å; R139-F227 HydrophobicContact CB-CB 4.13Å; R139-F227 HydrophobicContact CB-CD1 3.81Å; R139-F227 HydrophobicContact CB-CD2 4.27Å; R139-F227 HydrophobicContact CB-CE1 4.27Å; R139-F227 HydrophobicContact CB-CG 3.8Å; R139-F227 WeakPolarHBondContact O-CD2 3.28Å
140	G	89.9	Confident	83.9	Confident	7 Å²	7	45.5 Å²	45.5	7%	0.072	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	161.1	177.3	0	0	0	0	0	111.3	Y128 F129	Y128-G140 CarbonylContact C-O 3.53Å; Y128-G140 WeakPolarHBondContact CA-O 3.39Å; Y128-G140 WeakPolarHBondContact CB-O 3.31Å; F129-G140 WeakPolarHBondContact CD1-O 3.35Å; F129-G140 WeakPolarHBondContact CE1-O 3.03Å; F129-G140 PolarHBondContact N-O 3.41Å; F129-G140 PolarHBondContact O-N 3.4Å
141	F	90.9	Very high	82.5	Confident	70 Å²	70	52.2 Å²	52.2	31%	0.307	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	143.3	170.3	-69.9	-74.4	0	0	0	110.4	Y52 L126 G143 F227	Y52-F141 AromaticContact CD2-CE1 3.94Å; Y52-F141 HydrophobicContact CD2-CE1 3.94Å; Y52-F141 AromaticContact CD2-CZ 3.94Å; Y52-F141 HydrophobicContact CD2-CZ 3.94Å; Y52-F141 HydrophobicContact CE2-CZ 4.29Å; Y52-F141 HydrophobicContact CG-CE1 4.44Å; L126-F141 HydrophobicContact CB-CE1 4.45Å; F141-G143 VanDerWaalsContact C-N 3.32Å; F141-F227 HydrophobicContact CD1-CZ 4.14Å; F141-F227 AromaticContact CD2-CE2 3.67Å; F141-F227 HydrophobicContact CD2-CE2 3.67Å; F141-F227 AromaticContact CD2-CZ 3.45Å; F141-F227 HydrophobicContact CD2-CZ 3.45Å; F141-F227 VanDerWaalsContact CD2-CZ 3.45Å; F141-F227 HydrophobicContact CE1-CE1 4.46Å; F141-F227 AromaticContact CE1-CZ 4Å; F141-F227 HydrophobicContact CE1-CZ 4Å; F141-F227 HydrophobicContact CE2-CE1 4.13Å; F141-F227 AromaticContact CE2-CE2 3.65Å; F141-F227 HydrophobicContact CE2-CE2 3.65Å; F141-F227 AromaticContact CE2-CZ 3.27Å; F141-F227 HydrophobicContact CE2-CZ 3.27Å; F141-F227 HydrophobicContact CG-CE2 4.41Å; F141-F227 AromaticContact CG-CZ 3.89Å; F141-F227 HydrophobicContact CG-CZ 3.89Å; F141-F227 HydrophobicContact CZ-CE1 4.04Å; F141-F227 HydrophobicContact CZ-CE2 4.38Å; F141-F227 AromaticContact CZ-CZ 3.57Å; F141-F227 HydrophobicContact CZ-CZ 3.57Å
142	V	91.1	Very high	80.9	Confident	12 Å²	12	57.6 Å²	57.6	7%	0.073	31%	0.305	C	S	.	.	S	Bend	trans	-67.1	-36.5	179.4	175.4	0	0	0	0	111.3	L64 L119 Y127 F129 L159 W160	L64-V142 HydrophobicContact CD1-CG1 4.46Å; L64-V142 HydrophobicContact CD1-CG2 4.05Å; L119-V142 HydrophobicContact CD2-CG1 4.46Å; Y127-V142 PolarHBondContact O-N 3.39Å; F129-V142 HydrophobicContact CD1-CG2 4.2Å; V142-L159 HydrophobicContact CG1-CD1 3.93Å; V142-W160 PolarHBondContact O-N 2.58Å
143	G	88.4	Confident	79.7	Confident	11 Å²	11	63.3 Å²	63.3	11%	0.113	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	-165.7	178.6	0	0	0	0	0	112.9	F141 G158 W160	F141-G143 VanDerWaalsContact C-N 3.32Å; G143-G158 CarbonylContact C-O 3.53Å; G143-G158 WeakPolarHBondContact CA-O 3.2Å; G143-W160 VanDerWaalsContact C-NE1 3.31Å; G143-W160 VanDerWaalsContact CA-CD1 3.42Å; G143-W160 PolarHBondContact O-NE1 3.41Å
144	Y	84.7	Confident	78.6	Confident	101 Å²	101	65.6 Å²	65.6	40%	0.396	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.5	-179.7	176.3	-106.9	0	0	0	108.8	E146 G158 W160 P186	Y144-E146 HydrophobicContact CE1-CB 3.66Å; Y144-E146 HydrophobicContact CE1-CG 4.38Å; Y144-G158 PolarHBondContact N-O 3.18Å; Y144-G158 PolarHBondContact O-N 3.31Å; Y144-W160 HydrophobicContact CD2-CZ2 4.37Å; Y144-W160 HydrophobicContact CG-CZ2 4.08Å; Y144-P186 HydrophobicContact CD1-CG 4.18Å
145	M	83	Confident	77.9	Confident	47 Å²	47	69.1 Å²	69.1	23%	0.232	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.3	170.5	-175.1	-157	-67.7	0	0	108.4	E124 E147	E124-M145 HydrophobicContact CB-CE 4Å; E124-M145 HydrophobicContact CG-CE 3.88Å; M145-E147 HydrophobicContact SD-CG 3.94Å
146	E	79	Confident	77.7	Confident	85 Å²	85	70.9 Å²	70.9	40%	0.397	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.8	167.7	-164.3	174.8	-170.8	0	0	109.1	Y144 K156	Y144-E146 HydrophobicContact CE1-CB 3.66Å; Y144-E146 HydrophobicContact CE1-CG 4.38Å; E146-K156 PolarHBondContact N-O 2.94Å; E146-K156 PolarHBondContact O-N 2.84Å
147	E	75.1	Confident	77.7	Confident	146 Å²	146	70.9 Å²	70.9	68%	0.682	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.2	168.8	-66.6	-172	159.1	0	0	108.5	M145 H155	M145-E147 HydrophobicContact SD-CG 3.94Å; E147-H155 IonicContact OE1-CE1 3.22Å
148	S	69.6	Low	77.8	Confident	36 Å²	36	69.1 Å²	69.1	25%	0.252	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.2	177.9	-36.7	0	0	0	0	111.4	S154	S148-S154 PolarHBondContact N-O 3.4Å; S148-S154 PolarHBondContact O-N 3.46Å; S148-S154 PolarHBondContact O-OG 3.3Å
149	G	57.3	Low	77.8	Confident	54 Å²	54	69.4 Å²	69.4	56%	0.557	36%	0.358	S	S	*	.			trans	86	137.6	169.9	0	0	0	0	0	114.8	H153	G149-H153 PolarHBondContact O-ND1 2.87Å
150	F	65.3	Low	77.8	Confident	179 Å²	179	68.6 Å²	68.6	79%	0.785	36%	0.355	S	S	*	.	S	Bend	trans	-77.3	-32.7	170.4	-170	-104.4	0	0	0	111.1	H153	F150-H153 PolarHBondContact O-CE1 3.29Å; F150-H153 PolarHBondContact O-ND1 3.2Å; F150-H153 PolarHBondContact O-NE2 2.89Å
151	L	62.5	Low	77.8	Confident	146 Å²	146	69.3 Å²	69.3	76%	0.764	36%	0.358	S	S	*	.	S	Bend	trans	-159.8	127.8	171	-84.2	173.6	0	0	0	110.6
152	P	60	Low	77.8	Confident	113 Å²	113	66.7 Å²	66.7	73%	0.734	35%	0.347	S	S	*	.	S	Bend	cis	-69.5	141	-11.8	29.6	-32.4	0	0	0	111	S154	P152-S154 PolarHBondContact O-N 3.22Å
153	H	66.8	Low	77.9	Confident	120 Å²	120	66.8 Å²	66.8	56%	0.556	35%	0.346	S	S	*	.			trans	-64.9	113.5	170.2	-66.3	-57.3	0	0	0	108.7	G149 F150	G149-H153 PolarHBondContact O-ND1 2.87Å; F150-H153 PolarHBondContact O-CE1 3.29Å; F150-H153 PolarHBondContact O-ND1 3.2Å; F150-H153 PolarHBondContact O-NE2 2.89Å
154	S	66.3	Low	78.2	Confident	49 Å²	49	66.6 Å²	66.6	34%	0.343	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.3	171.2	68.9	0	0	0	0	109.2	S148 P152	S148-S154 PolarHBondContact N-O 3.4Å; S148-S154 PolarHBondContact O-N 3.46Å; S148-S154 PolarHBondContact O-OG 3.3Å; P152-S154 PolarHBondContact O-N 3.22Å
155	H	72.4	Confident	78.6	Confident	88 Å²	88	61.8 Å²	61.8	41%	0.407	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.2	172.9	-64.5	-111.8	0	0	0	106.7	E147	E147-H155 IonicContact OE1-CE1 3.22Å
156	K	79.6	Confident	79.1	Confident	116 Å²	116	62.6 Å²	62.6	50%	0.504	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117.8	172.5	-73.1	-177.8	-176.4	170.7	0	108.7	E146	E146-K156 PolarHBondContact N-O 2.94Å; E146-K156 PolarHBondContact O-N 2.84Å
157	I	85	Confident	79.7	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.3	-179	-59.7	170.9	0	0	0	108.1	R120 I123 E124 S188 L189	R120-I157 HydrophobicContact CG-CD1 3.45Å; R120-I157 VanDerWaalsContact CG-CD1 3.45Å; R120-I157 HydrophobicContact CG-CG2 4.23Å; I123-I157 HydrophobicContact CB-CG2 3.93Å; I123-I157 HydrophobicContact CD1-CG2 3.89Å; I123-I157 HydrophobicContact CG2-CG2 3.78Å; E124-I157 HydrophobicContact CG-CD1 3.75Å; E124-I157 WeakPolarHBondContact OE1-CD1 3.43Å; I157-S188 WeakPolarHBondContact O-CA 3.32Å; I157-L189 HydrophobicContact CG2-CD1 4.32Å; I157-L189 PolarHBondContact O-N 3.47Å
158	G	87	Confident	80.5	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.6	-176.6	0	0	0	0	0	112.6	G143 Y144 H187	G143-G158 CarbonylContact C-O 3.53Å; G143-G158 WeakPolarHBondContact CA-O 3.2Å; Y144-G158 PolarHBondContact N-O 3.18Å; Y144-G158 PolarHBondContact O-N 3.31Å; G158-H187 CarbonylContact C-O 3.58Å; G158-H187 VanDerWaalsContact CA-O 3.28Å; G158-H187 WeakPolarHBondContact CA-O 3.38Å
159	L	89.1	Confident	81.6	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.037	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	138.7	175.1	-176.2	71.2	0	0	0	111.2	L119 I123 V142 T161 P186 H187 L189 L200	L119-L159 HydrophobicContact CD1-CD1 4.48Å; L119-L159 HydrophobicContact CD1-CD2 4.11Å; L119-L159 HydrophobicContact CD2-CD1 4.39Å; I123-L159 HydrophobicContact CD1-CB 4.41Å; I123-L159 HydrophobicContact CD1-CD1 4.16Å; V142-L159 HydrophobicContact CG1-CD1 3.93Å; L159-T161 HydrophobicContact CD2-CG2 4.47Å; L159-T161 PolarHBondContact O-N 3.37Å; L159-P186 WeakPolarHBondContact O-CA 3.3Å; L159-H187 PolarHBondContact N-O 3.01Å; L159-H187 PolarHBondContact O-N 3.4Å; L159-L189 HydrophobicContact CB-CD1 4.25Å; L159-L189 HydrophobicContact CB-CD2 4.21Å; L159-L189 HydrophobicContact CB-CG 4.29Å; L159-L200 HydrophobicContact CD2-CD1 3.75Å
160	W	90.3	Very high	83.2	Confident	44 Å²	44	51.4 Å²	51.4	17%	0.167	26%	0.256	C	S	.	.			trans	-81	112.8	170	-64	123.1	0	0	0	111.2	V142 G143 Y144 V181 V184 P186	V142-W160 PolarHBondContact O-N 2.58Å; G143-W160 VanDerWaalsContact C-NE1 3.31Å; G143-W160 VanDerWaalsContact CA-CD1 3.42Å; G143-W160 PolarHBondContact O-NE1 3.41Å; Y144-W160 HydrophobicContact CD2-CZ2 4.37Å; Y144-W160 HydrophobicContact CG-CZ2 4.08Å; W160-V181 HydrophobicContact CB-CG1 3.62Å; W160-V181 HydrophobicContact CD2-CB 3.94Å; W160-V181 HydrophobicContact CD2-CG1 3.62Å; W160-V181 HydrophobicContact CD2-CG2 4.36Å; W160-V181 HydrophobicContact CE3-CB 4.11Å; W160-V181 HydrophobicContact CE3-CG1 3.84Å; W160-V181 HydrophobicContact CG-CB 4.24Å; W160-V181 HydrophobicContact CG-CG1 3.53Å; W160-V181 HydrophobicContact CG-CG2 4.42Å; W160-V184 VanDerWaalsContact CZ3-O 3.27Å; W160-V184 WeakPolarHBondContact CZ3-O 3.48Å; W160-P186 HydrophobicContact CD2-CB 4.29Å; W160-P186 HydrophobicContact CE3-CB 3.82Å; W160-P186 HydrophobicContact CH2-CB 4.02Å; W160-P186 HydrophobicContact CH2-CG 3.97Å; W160-P186 HydrophobicContact CZ2-CB 4.48Å; W160-P186 HydrophobicContact CZ3-CB 3.65Å; W160-P186 HydrophobicContact CZ3-CG 3.94Å
161	T	89.7	Confident	84.3	Confident	22 Å²	22	44.4 Å²	44.4	14%	0.135	23%	0.234	C	C	.	.			trans	-97.4	-11.7	179.5	56.9	0	0	0	0	113.5	L159 H187 L200 H202 T203	L159-T161 HydrophobicContact CD2-CG2 4.47Å; L159-T161 PolarHBondContact O-N 3.37Å; T161-H187 HydrophobicContact CG2-CB 4.03Å; T161-L200 HydrophobicContact CG2-CD2 4.29Å; T161-H202 VanDerWaalsContact O-CA 3.31Å; T161-H202 WeakPolarHBondContact O-CA 3.39Å; T161-T203 PolarHBondContact O-N 3.14Å
162	H	92.4	Very high	85.6	Confident	15 Å²	15	41 Å²	41	7%	0.069	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.8	178.5	-171.7	73.7	0	0	0	111.3	V181 V184 T203 Y204 S205	H162-V181 WeakPolarHBondContact O-CG1 3.4Å; H162-V184 HydrophobicContact CB-CB 4.1Å; H162-V184 HydrophobicContact CB-CG1 3.95Å; H162-V184 HydrophobicContact CB-CG2 3.67Å; H162-T203 VanDerWaalsContact CA-O 3.3Å; H162-T203 WeakPolarHBondContact CA-O 3.17Å; H162-T203 PolarHBondContact ND1-O 3.17Å; H162-T203 PolarHBondContact ND1-OG1 3.09Å; H162-Y204 VanDerWaalsContact CE1-C 3.48Å; H162-S205 PolarHBondContact CE1-OG 3Å; H162-S205 PolarHBondContact NE2-OG 3.11Å
163	L	93	Very high	86.9	Confident	13 Å²	13	39.3 Å²	39.3	7%	0.068	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.4	172	-60	-176	0	0	0	110.4	Y93 F129 F131 F165 V179 V181 T203 Y204 S205	Y93-L163 WeakPolarHBondContact OH-CD1 3.48Å; F129-L163 HydrophobicContact CE1-CD2 4.38Å; F129-L163 HydrophobicContact CZ-CD1 4.07Å; F129-L163 HydrophobicContact CZ-CD2 4.05Å; F131-L163 HydrophobicContact CE2-CD1 4.05Å; L163-F165 HydrophobicContact CB-CE2 4.1Å; L163-F165 HydrophobicContact CB-CZ 4.11Å; L163-F165 HydrophobicContact CD1-CZ 4.05Å; L163-V179 HydrophobicContact CB-CG2 3.96Å; L163-V179 HydrophobicContact CD1-CG2 4.47Å; L163-V179 HydrophobicContact CD2-CG2 4.17Å; L163-V179 HydrophobicContact CG-CG2 4.43Å; L163-V181 HydrophobicContact CD2-CG1 4.08Å; L163-T203 PolarHBondContact N-O 3.42Å; L163-Y204 CarbonylContact O-C 3.57Å; L163-Y204 WeakPolarHBondContact O-CA 3.28Å; L163-Y204 WeakPolarHBondContact O-CB 3.37Å; L163-S205 PolarHBondContact O-N 3.46Å
164	D	93.3	Very high	87.9	Confident	7 Å²	7	33.6 Å²	33.6	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.7	175.2	-174.7	21	0	0	0	110	V179 S180 S205 R207	D164-V179 CarbonylContact O-C 3.47Å; D164-V179 WeakPolarHBondContact O-CA 3.26Å; D164-S180 PolarHBondContact N-O 2.8Å; D164-S180 PolarHBondContact O-N 3Å; D164-S205 WeakPolarHBondContact OD1-CB 3.36Å; D164-R207 IonicContact OD1-NE 4Å; D164-R207 IonicContact OD2-CZ 3.34Å; D164-R207 IonicContact OD2-NE 2.68Å; D164-R207 IonicContact OD2-NH1 3.84Å; D164-R207 PolarHBondContact OD2-NH1 3.12Å
165	F	93.9	Very high	88.9	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121.8	179.9	-62.8	-75.2	0	0	0	110.7	L44 Y93 F131 L163 N178 V179 Y204 S205 V206 R207	L44-F165 HydrophobicContact CD1-CD1 4.22Å; L44-F165 HydrophobicContact CD1-CE1 3.73Å; L44-F165 HydrophobicContact CD1-CZ 3.92Å; Y93-F165 AromaticContact CD1-CE2 3.61Å; Y93-F165 HydrophobicContact CD1-CE2 3.61Å; Y93-F165 HydrophobicContact CD1-CZ 4.17Å; Y93-F165 HydrophobicContact CD2-CZ 4.43Å; Y93-F165 AromaticContact CE1-CE2 3.66Å; Y93-F165 HydrophobicContact CE1-CE2 3.66Å; Y93-F165 HydrophobicContact CE1-CZ 4.01Å; Y93-F165 HydrophobicContact CE2-CZ 4.29Å; Y93-F165 HydrophobicContact CG-CE2 4.11Å; Y93-F165 HydrophobicContact CG-CZ 4.38Å; F131-F165 HydrophobicContact CD2-CE1 4.17Å; F131-F165 HydrophobicContact CD2-CZ 4.35Å; F131-F165 HydrophobicContact CE2-CZ 4.35Å; L163-F165 HydrophobicContact CB-CE2 4.1Å; L163-F165 HydrophobicContact CB-CZ 4.11Å; L163-F165 HydrophobicContact CD1-CZ 4.05Å; F165-N178 WeakPolarHBondContact CA-O 3.33Å; F165-V179 HydrophobicContact CD1-CB 4.09Å; F165-V179 HydrophobicContact CD1-CG2 4Å; F165-V179 HydrophobicContact CE1-CB 4.16Å; F165-V179 HydrophobicContact CE1-CG2 3.86Å; F165-Y204 HydrophobicContact CD2-CD2 4.37Å; F165-Y204 HydrophobicContact CE2-CD2 4.44Å; F165-S205 PolarHBondContact N-O 2.81Å; F165-V206 HydrophobicContact CD2-CG2 4.49Å; F165-V206 CarbonylContact O-C 3.5Å; F165-V206 WeakPolarHBondContact O-CA 3.42Å; F165-R207 PolarHBondContact O-N 3.22Å
166	H	92.6	Very high	89.6	Confident	64 Å²	64	29.1 Å²	29.1	30%	0.296	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	115	175	-174.6	-84.2	0	0	0	110.1	E168 A177 N178 R207 S209	H166-E168 IonicContact CE1-OE1 3.42Å; H166-A177 CarbonylContact O-C 3.6Å; H166-A177 WeakPolarHBondContact O-CA 3.32Å; H166-N178 PolarHBondContact N-O 2.78Å; H166-N178 PolarHBondContact O-N 2.85Å; H166-R207 WeakPolarHBondContact CA-O 3.34Å; H166-S209 PolarHBondContact CE1-OG 2.84Å; H166-S209 PolarHBondContact NE2-OG 3Å
167	L	92.4	Very high	90.1	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.1	-175.9	-64.6	163	0	0	0	109.9	I95 V133 I174 A177 V206 R207 W208 S209	I95-L167 HydrophobicContact CG2-CD1 3.82Å; V133-L167 HydrophobicContact CG1-CD2 4.39Å; L167-I174 HydrophobicContact CD2-CG2 4.44Å; L167-A177 HydrophobicContact CD2-CB 3.48Å; L167-A177 VanDerWaalsContact CD2-CB 3.48Å; L167-V206 HydrophobicContact CD1-CG1 3.93Å; L167-R207 PolarHBondContact N-O 3.34Å; L167-W208 HydrophobicContact CB-CD2 3.88Å; L167-W208 HydrophobicContact CB-CE3 3.44Å; L167-W208 VanDerWaalsContact CB-CE3 3.44Å; L167-W208 HydrophobicContact CB-CH2 3.88Å; L167-W208 HydrophobicContact CB-CZ2 4.27Å; L167-W208 HydrophobicContact CB-CZ3 3.44Å; L167-W208 VanDerWaalsContact CB-CZ3 3.44Å; L167-W208 HydrophobicContact CD1-CD2 4.32Å; L167-W208 HydrophobicContact CD1-CE3 4.42Å; L167-W208 HydrophobicContact CD1-CH2 3.58Å; L167-W208 HydrophobicContact CD1-CZ2 3.42Å; L167-W208 VanDerWaalsContact CD1-CZ2 3.42Å; L167-W208 HydrophobicContact CD1-CZ3 4.09Å; L167-W208 HydrophobicContact CG-CH2 4.24Å; L167-W208 HydrophobicContact CG-CZ2 4.44Å; L167-W208 HydrophobicContact CG-CZ3 4.3Å; L167-W208 WeakPolarHBondContact O-CA 3.28Å; L167-S209 PolarHBondContact O-N 3.34Å
168	E	92	Very high	90.3	Very high	13 Å²	13	26.9 Å²	26.9	6%	0.061	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.5	174	-56.1	-177.5	-175	0	0	111	H166 I175 F176 S209 T211 R219	H166-E168 IonicContact CE1-OE1 3.42Å; E168-I175 PolarHBondContact O-N 3.38Å; E168-F176 HydrophobicContact CB-CB 3.99Å; E168-F176 HydrophobicContact CG-CB 4.14Å; E168-F176 HydrophobicContact CG-CD1 4.02Å; E168-F176 PolarHBondContact N-O 2.83Å; E168-F176 PolarHBondContact O-N 3.05Å; E168-S209 VanDerWaalsContact CA-O 3.24Å; E168-S209 WeakPolarHBondContact CA-O 3.24Å; E168-S209 WeakPolarHBondContact CG-OG 3.41Å; E168-T211 HydrophobicContact CB-CG2 4.08Å; E168-T211 PolarHBondContact OE2-OG1 3.39Å; E168-R219 IonicContact OE1-CZ 2.89Å; E168-R219 IonicContact OE1-NE 3.7Å; E168-R219 PolarHBondContact OE1-NE 3.11Å; E168-R219 IonicContact OE1-NH2 3.72Å; E168-R219 PolarHBondContact OE1-NH2 3.25Å; E168-R219 IonicContact OE2-CZ 2.78Å; E168-R219 IonicContact OE2-NE 4Å; E168-R219 PolarHBondContact OE2-NE 3.04Å; E168-R219 IonicContact OE2-NH2 3.69Å
169	F	91.8	Very high	90.5	Very high	22 Å²	22	27.3 Å²	27.3	10%	0.096	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.5	177.8	70.9	-85.2	0	0	0	112.1	F97 R98 G171 R173 W208 S209 E210 T211	F97-F169 HydrophobicContact CE2-CB 3.82Å; F97-F169 HydrophobicContact CE2-CG 4.31Å; F97-F169 HydrophobicContact CZ-CB 3.95Å; F97-F169 HydrophobicContact CZ-CD2 4.19Å; F97-F169 HydrophobicContact CZ-CG 4.17Å; R98-F169 HydrophobicContact CG-CD1 4.4Å; R98-F169 HydrophobicContact CG-CD2 4.38Å; R98-F169 HydrophobicContact CG-CE1 4.1Å; R98-F169 HydrophobicContact CG-CE2 4.09Å; R98-F169 HydrophobicContact CG-CZ 3.93Å; R98-F169 VanDerWaalsContact NE-CE2 3.29Å; F169-G171 WeakPolarHBondContact CD2-O 3.47Å; F169-R173 CarbonylContact C-O 3.59Å; F169-R173 WeakPolarHBondContact CA-O 3.45Å; F169-R173 WeakPolarHBondContact CB-O 3.3Å; F169-W208 HydrophobicContact CB-CE3 4.43Å; F169-W208 HydrophobicContact CB-CZ3 4.43Å; F169-W208 HydrophobicContact CD1-CB 4.32Å; F169-W208 AromaticContact CD1-CE3 3.86Å; F169-W208 HydrophobicContact CD1-CE3 3.86Å; F169-W208 HydrophobicContact CE1-CB 4.12Å; F169-S209 WeakPolarHBondContact CD1-O 3.31Å; F169-S209 PolarHBondContact N-O 2.97Å; F169-E210 HydrophobicContact CE1-CB 4.27Å; F169-E210 HydrophobicContact CE2-CB 4.16Å; F169-E210 HydrophobicContact CE2-CG 4.14Å; F169-E210 HydrophobicContact CZ-CB 3.87Å; F169-E210 HydrophobicContact CZ-CG 4.35Å; F169-E210 WeakPolarHBondContact O-CA 3.45Å; F169-T211 PolarHBondContact O-N 3.45Å
170	H	91.2	Very high	90.3	Very high	50 Å²	50	28.2 Å²	28.2	23%	0.231	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	113.1	170.8	176.1	-84.9	0	0	0	108.9	D172 R173 I175 T211 V213	H170-D172 PolarHBondContact O-N 3.22Å; H170-R173 PolarHBondContact N-O 3.19Å; H170-R173 PolarHBondContact O-N 3.39Å; H170-I175 HydrophobicContact CB-CD1 4.2Å; H170-I175 HydrophobicContact CB-CG1 3.73Å; H170-T211 HydrophobicContact CB-CG2 4.15Å; H170-T211 PolarHBondContact CD2-O 2.89Å; H170-V213 WeakPolarHBondContact CB-O 3.14Å
171	G	88.9	Confident	89.9	Confident	31 Å²	31	28 Å²	28	32%	0.32	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	-130.5	-166.7	0	0	0	0	0	110.4	R98 F169 R173	R98-G171 PolarHBondContact NH2-O 2.84Å; F169-G171 WeakPolarHBondContact CD2-O 3.47Å; G171-R173 VanDerWaalsContact C-N 3.28Å; G171-R173 PolarHBondContact O-N 2.79Å
172	D	89.3	Confident	88.7	Confident	75 Å²	75	36 Å²	36	40%	0.401	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	23.5	-174.3	-62.6	-16.7	0	0	0	113.4	H35 Y36 R98 H170	H35-D172 CarbonylContact C-O 3.48Å; H35-D172 WeakPolarHBondContact CA-O 3.17Å; H35-D172 HydrophobicContact CB-CB 4.48Å; Y36-D172 PolarHBondContact N-O 2.83Å; Y36-D172 VanDerWaalsContact O-CB 3.26Å; Y36-D172 WeakPolarHBondContact O-CB 3.46Å; R98-D172 IonicContact CZ-OD1 3.34Å; R98-D172 IonicContact NH2-OD1 3.61Å; R98-D172 PolarHBondContact NH2-OD1 3.42Å; H170-D172 PolarHBondContact O-N 3.22Å
173	R	88.3	Confident	87.4	Confident	77 Å²	77	42.7 Å²	42.7	29%	0.291	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.7	-172.9	-57.3	-174.4	-64.8	-157.5	4.3	112	V33 F169 H170 G171 I175 E214	V33-R173 HydrophobicContact CG1-CG 3.73Å; F169-R173 CarbonylContact C-O 3.59Å; F169-R173 WeakPolarHBondContact CA-O 3.45Å; F169-R173 WeakPolarHBondContact CB-O 3.3Å; H170-R173 PolarHBondContact N-O 3.19Å; H170-R173 PolarHBondContact O-N 3.39Å; G171-R173 VanDerWaalsContact C-N 3.28Å; G171-R173 PolarHBondContact O-N 2.79Å; R173-I175 HydrophobicContact CB-CD1 4.28Å; R173-E214 PolarHBondContact NH2-O 3.36Å
174	I	88.4	Confident	86.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.5	169.9	-50.8	177	0	0	0	108.4	Y36 V42 F97 V133 D134 L136 L167 W208 R216	Y36-I174 HydrophobicContact CD2-CD1 4.3Å; Y36-I174 HydrophobicContact CD2-CG1 4.14Å; Y36-I174 HydrophobicContact CE2-CD1 3.86Å; Y36-I174 HydrophobicContact CE2-CG1 4.01Å; V42-I174 HydrophobicContact CG1-CD1 3.72Å; V42-I174 HydrophobicContact CG2-CD1 4.24Å; F97-I174 HydrophobicContact CD2-CG1 4.26Å; F97-I174 HydrophobicContact CE2-CG1 4Å; V133-I174 HydrophobicContact CG1-CD1 4.26Å; D134-I174 HydrophobicContact CB-CD1 4.13Å; L136-I174 HydrophobicContact CD1-CB 4.47Å; L136-I174 HydrophobicContact CD1-CG2 3.68Å; L167-I174 HydrophobicContact CD2-CG2 4.44Å; I174-W208 HydrophobicContact CD1-CH2 3.89Å; I174-W208 HydrophobicContact CD1-CZ3 4.33Å; I174-W208 HydrophobicContact CG1-CH2 4.13Å; I174-W208 HydrophobicContact CG1-CZ3 4.09Å; I174-R216 VanDerWaalsContact O-CZ 3.31Å; I174-R216 PolarHBondContact O-NE 2.91Å; I174-R216 PolarHBondContact O-NH2 2.89Å
175	I	86.9	Confident	85.7	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-39.8	-175.5	-58.5	-58.4	0	0	0	111.1	E168 H170 R173 T211 R216 R219	E168-I175 PolarHBondContact O-N 3.38Å; H170-I175 HydrophobicContact CB-CD1 4.2Å; H170-I175 HydrophobicContact CB-CG1 3.73Å; R173-I175 HydrophobicContact CB-CD1 4.28Å; I175-T211 HydrophobicContact CB-CG2 3.99Å; I175-T211 HydrophobicContact CG1-CG2 4.01Å; I175-T211 HydrophobicContact CG2-CG2 4.15Å; I175-R216 HydrophobicContact CD1-CG 4.4Å; I175-R219 HydrophobicContact CG2-CB 3.88Å; I175-R219 HydrophobicContact CG2-CG 4.29Å
176	F	87.3	Confident	85.1	Confident	41 Å²	41	55.4 Å²	55.4	18%	0.18	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.6	-176.2	178.8	-103.6	0	0	0	110.6	E168 N178 R219	E168-F176 HydrophobicContact CB-CB 3.99Å; E168-F176 HydrophobicContact CG-CB 4.14Å; E168-F176 HydrophobicContact CG-CD1 4.02Å; E168-F176 PolarHBondContact N-O 2.83Å; E168-F176 PolarHBondContact O-N 3.05Å; F176-N178 HydrophobicContact CE1-CB 3.65Å; F176-N178 HydrophobicContact CZ-CB 3.88Å; F176-R219 HydrophobicContact CB-CG 4.31Å
177	A	88.6	Confident	84.7	Confident	7 Å²	7	56 Å²	56	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	133.2	178.8	0	0	0	0	0	108.7	L136 I138 H166 L167	L136-A177 HydrophobicContact CB-CB 4.11Å; L136-A177 HydrophobicContact CD1-CB 3.94Å; I138-A177 HydrophobicContact CD1-CB 3.65Å; I138-A177 HydrophobicContact CG1-CB 3.68Å; H166-A177 CarbonylContact O-C 3.6Å; H166-A177 WeakPolarHBondContact O-CA 3.32Å; L167-A177 HydrophobicContact CD2-CB 3.48Å; L167-A177 VanDerWaalsContact CD2-CB 3.48Å
178	N	90.1	Very high	84.3	Confident	67 Å²	67	59 Å²	59	36%	0.358	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	156.3	176.1	-164.9	13	0	0	0	110.2	F165 H166 F176	F165-N178 WeakPolarHBondContact CA-O 3.33Å; H166-N178 PolarHBondContact N-O 2.78Å; H166-N178 PolarHBondContact O-N 2.85Å; F176-N178 HydrophobicContact CE1-CB 3.65Å; F176-N178 HydrophobicContact CZ-CB 3.88Å
179	V	90.3	Very high	83.8	Confident	14 Å²	14	58.7 Å²	58.7	9%	0.085	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.8	170.5	66	0	0	0	0	108.4	F129 I138 R139 L163 D164 F165	F129-V179 HydrophobicContact CE2-CG1 4.06Å; F129-V179 HydrophobicContact CZ-CG1 4.01Å; F129-V179 HydrophobicContact CZ-CG2 4.42Å; I138-V179 HydrophobicContact CG2-CB 3.45Å; I138-V179 VanDerWaalsContact CG2-CB 3.45Å; I138-V179 HydrophobicContact CG2-CG1 3.42Å; I138-V179 VanDerWaalsContact CG2-CG1 3.42Å; R139-V179 VanDerWaalsContact O-CG1 3.24Å; R139-V179 WeakPolarHBondContact O-CG1 3.49Å; L163-V179 HydrophobicContact CB-CG2 3.96Å; L163-V179 HydrophobicContact CD1-CG2 4.47Å; L163-V179 HydrophobicContact CD2-CG2 4.17Å; L163-V179 HydrophobicContact CG-CG2 4.43Å; D164-V179 CarbonylContact O-C 3.47Å; D164-V179 WeakPolarHBondContact O-CA 3.26Å; F165-V179 HydrophobicContact CD1-CB 4.09Å; F165-V179 HydrophobicContact CD1-CG2 4Å; F165-V179 HydrophobicContact CE1-CB 4.16Å; F165-V179 HydrophobicContact CE1-CG2 3.86Å
180	S	86.9	Confident	83.1	Confident	27 Å²	27	61.1 Å²	61.1	19%	0.189	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.3	172.9	84.1	0	0	0	0	110.2	D164	D164-S180 PolarHBondContact N-O 2.8Å; D164-S180 PolarHBondContact O-N 3Å
181	V	81.8	Confident	82.1	Confident	38 Å²	38	62.6 Å²	62.6	23%	0.23	34%	0.341	C	S	.	.			trans	-117.5	20.6	176.8	-113.5	0	0	0	0	110.4	W160 H162 L163	W160-V181 HydrophobicContact CB-CG1 3.62Å; W160-V181 HydrophobicContact CD2-CB 3.94Å; W160-V181 HydrophobicContact CD2-CG1 3.62Å; W160-V181 HydrophobicContact CD2-CG2 4.36Å; W160-V181 HydrophobicContact CE3-CB 4.11Å; W160-V181 HydrophobicContact CE3-CG1 3.84Å; W160-V181 HydrophobicContact CG-CB 4.24Å; W160-V181 HydrophobicContact CG-CG1 3.53Å; W160-V181 HydrophobicContact CG-CG2 4.42Å; H162-V181 WeakPolarHBondContact O-CG1 3.4Å; L163-V181 HydrophobicContact CD2-CG1 4.08Å
182	R	64.7	Low	81.2	Confident	192 Å²	192	63.5 Å²	63.5	73%	0.725	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	143.9	-175.7	-69.5	-175	177.6	-174	0.8	110.1	V184	R182-V184 PolarHBondContact O-N 2.96Å
183	D	64.4	Low	80.4	Confident	155 Å²	155	68.9 Å²	68.9	83%	0.829	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	13.3	171	-46.5	-44.1	0	0	0	117.3
184	V	72.8	Confident	79.6	Confident	50 Å²	50	69.9 Å²	69.9	30%	0.303	37%	0.369	S	S	.	.			trans	-119.6	139.9	171.9	-176.8	0	0	0	0	109.8	W160 H162 R182	W160-V184 VanDerWaalsContact CZ3-O 3.27Å; W160-V184 WeakPolarHBondContact CZ3-O 3.48Å; H162-V184 HydrophobicContact CB-CB 4.1Å; H162-V184 HydrophobicContact CB-CG1 3.95Å; H162-V184 HydrophobicContact CB-CG2 3.67Å; R182-V184 PolarHBondContact O-N 2.96Å
185	K	78.5	Confident	78.9	Confident	194 Å²	194	77.1 Å²	77.1	84%	0.843	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-80.4	133.2	172.4	-72.1	-175.9	178.3	-178.8	0	109
186	P	81.3	Confident	78.6	Confident	43 Å²	43	82 Å²	82	28%	0.279	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-65	144.6	177	28.9	-32.6	0	0	0	109.7	Y144 L159 W160	Y144-P186 HydrophobicContact CD1-CG 4.18Å; L159-P186 WeakPolarHBondContact O-CA 3.3Å; W160-P186 HydrophobicContact CD2-CB 4.29Å; W160-P186 HydrophobicContact CE3-CB 3.82Å; W160-P186 HydrophobicContact CH2-CB 4.02Å; W160-P186 HydrophobicContact CH2-CG 3.97Å; W160-P186 HydrophobicContact CZ2-CB 4.48Å; W160-P186 HydrophobicContact CZ3-CB 3.65Å; W160-P186 HydrophobicContact CZ3-CG 3.94Å
187	H	82.7	Confident	78.5	Confident	77 Å²	77	86.2 Å²	86.2	36%	0.356	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119	178.3	-166.3	82	0	0	0	109.3	G158 L159 T161 L200	G158-H187 CarbonylContact C-O 3.58Å; G158-H187 VanDerWaalsContact CA-O 3.28Å; G158-H187 WeakPolarHBondContact CA-O 3.38Å; L159-H187 PolarHBondContact N-O 3.01Å; L159-H187 PolarHBondContact O-N 3.4Å; T161-H187 HydrophobicContact CG2-CB 4.03Å; H187-L200 HydrophobicContact CB-CD2 4.42Å; H187-L200 WeakPolarHBondContact CD2-CD2 3.42Å
188	S	84.3	Confident	78.3	Confident	64 Å²	64	87.1 Å²	87.1	45%	0.448	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	136.4	-179.5	174.3	0	0	0	0	110.6	I157 D190	I157-S188 WeakPolarHBondContact O-CA 3.32Å; S188-D190 PolarHBondContact OG-N 3.42Å; S188-D190 PolarHBondContact OG-OD2 3.36Å; S188-D190 VanDerWaalsContact OG-OD2 3.14Å
189	L	82.2	Confident	78.2	Confident	6 Å²	6	86.3 Å²	86.3	3%	0.031	46%	0.461	C	S	.	.			trans	-98.4	8.7	175.2	-61.4	-179.1	0	0	0	112.3	V116 L119 I123 I157 L159 L198	V116-L189 HydrophobicContact CG1-CB 4.14Å; V116-L189 HydrophobicContact CG1-CD2 4.27Å; L119-L189 HydrophobicContact CB-CD1 4.11Å; I123-L189 HydrophobicContact CD1-CD1 3.75Å; I157-L189 HydrophobicContact CG2-CD1 4.32Å; I157-L189 PolarHBondContact O-N 3.47Å; L159-L189 HydrophobicContact CB-CD1 4.25Å; L159-L189 HydrophobicContact CB-CD2 4.21Å; L159-L189 HydrophobicContact CB-CG 4.29Å; L189-L198 HydrophobicContact CD2-CD2 3.81Å
190	D	77.4	Confident	78.1	Confident	74 Å²	74	85.9 Å²	85.9	40%	0.396	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	142.5	-173.3	-57.3	-42.5	0	0	0	112	S188	S188-D190 PolarHBondContact OG-N 3.42Å; S188-D190 PolarHBondContact OG-OD2 3.36Å; S188-D190 VanDerWaalsContact OG-OD2 3.14Å
191	G	68.4	Low	78.4	Confident	81 Å²	81	87.4 Å²	87.4	84%	0.835	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	16	165.1	0	0	0	0	0	117.1
192	L	72	Confident	78.9	Confident	49 Å²	49	86.5 Å²	86.5	26%	0.257	46%	0.46	S	S	.	.			trans	-69.3	138.2	173.9	-100.9	102.8	0	0	0	112.7	V116 E196 L198	V116-L192 HydrophobicContact CG1-CD1 4.41Å; V116-L192 HydrophobicContact CG2-CD2 4.36Å; L192-E196 HydrophobicContact CD2-CB 4.33Å; L192-E196 WeakPolarHBondContact CD2-O 3.45Å; L192-L198 HydrophobicContact CD1-CB 4.21Å; L192-L198 HydrophobicContact CD1-CD1 4.18Å; L192-L198 HydrophobicContact CD1-CD2 4.02Å; L192-L198 HydrophobicContact CD1-CG 4.36Å; L192-L198 HydrophobicContact CD2-CB 3.95Å
193	R	72.5	Confident	80.3	Confident	188 Å²	188	78.3 Å²	78.3	71%	0.709	43%	0.431	S	S	*	.			trans	-79.7	153.6	168.8	-64.8	-179.8	-178.5	-178.6	2	110.5	D195 E196	R193-D195 PolarHBondContact O-N 2.93Å; R193-D195 VanDerWaalsContact O-N 3.09Å; R193-E196 HydrophobicContact CB-CB 4.31Å; R193-E196 PolarHBondContact O-N 2.8Å; R193-E196 VanDerWaalsContact O-N 3.14Å
194	P	69.9	Low	81.7	Confident	98 Å²	98	71 Å²	71	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.9	-175.4	-26.7	34.7	0	0	0	115.4	S113	S113-P194 WeakPolarHBondContact CB-O 3.39Å; S113-P194 PolarHBondContact OG-O 2.76Å
195	D	73.8	Confident	82.8	Confident	153 Å²	153	69.2 Å²	69.2	82%	0.818	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	6.9	-175.3	-56.5	-40.9	0	0	0	113.6	R193	R193-D195 PolarHBondContact O-N 2.93Å; R193-D195 VanDerWaalsContact O-N 3.09Å
196	E	81.8	Confident	83.6	Confident	103 Å²	103	60 Å²	60	48%	0.481	34%	0.341	S	S	.	.			trans	-95.2	135.9	-177.5	-168.6	169.1	-175.1	0	0	111	L192 R193	L192-E196 HydrophobicContact CD2-CB 4.33Å; L192-E196 WeakPolarHBondContact CD2-O 3.45Å; R193-E196 HydrophobicContact CB-CB 4.31Å; R193-E196 PolarHBondContact O-N 2.8Å; R193-E196 VanDerWaalsContact O-N 3.14Å
197	F	83.8	Confident	84.2	Confident	130 Å²	130	63.1 Å²	63.1	57%	0.57	35%	0.347	S	S	*	.			trans	-94.9	128.2	173.7	-69.7	-85.8	0	0	0	110	Q110 L111 G199	Q110-F197 HydrophobicContact CB-CB 4.43Å; L111-F197 CarbonylContact O-C 3.59Å; L111-F197 VanDerWaalsContact O-CA 3.32Å; L111-F197 WeakPolarHBondContact O-CA 3.35Å; F197-G199 PolarHBondContact O-N 2.77Å
198	L	85.4	Confident	84.8	Confident	27 Å²	27	60.6 Å²	60.6	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	111.5	174.6	-172.7	61.3	0	0	0	110	Q110 L111 V116 L189 L192 L200	Q110-L198 WeakPolarHBondContact CA-O 3.1Å; L111-L198 HydrophobicContact CB-CB 4.42Å; L111-L198 PolarHBondContact N-O 2.98Å; L111-L198 PolarHBondContact O-N 3.42Å; V116-L198 HydrophobicContact CG2-CB 4.22Å; V116-L198 HydrophobicContact CG2-CD2 4.29Å; L189-L198 HydrophobicContact CD2-CD2 3.81Å; L192-L198 HydrophobicContact CD1-CB 4.21Å; L192-L198 HydrophobicContact CD1-CD1 4.18Å; L192-L198 HydrophobicContact CD1-CD2 4.02Å; L192-L198 HydrophobicContact CD1-CG 4.36Å; L192-L198 HydrophobicContact CD2-CB 3.95Å; L198-L200 HydrophobicContact CD2-CD1 4.27Å; L198-L200 HydrophobicContact CD2-CD2 4.09Å; L198-L200 HydrophobicContact CD2-CG 4.2Å; L198-L200 HydrophobicContact CG-CD2 4.12Å; L198-L200 HydrophobicContact CG-CG 4.1Å
199	G	87.6	Confident	85.2	Confident	50 Å²	50	59.3 Å²	59.3	52%	0.515	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	116.9	173.2	0	0	0	0	0	111.6	M109 F197	M109-G199 WeakPolarHBondContact O-CA 3.4Å; F197-G199 PolarHBondContact O-N 2.77Å
200	L	89	Confident	85.7	Confident	4 Å²	4	66 Å²	66	2%	0.021	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.1	178.2	-66.3	176.2	0	0	0	111.2	M109 L111 L159 T161 H187 L198	M109-L200 PolarHBondContact N-O 2.82Å; M109-L200 PolarHBondContact O-N 2.82Å; L111-L200 HydrophobicContact CD1-CD1 3.45Å; L111-L200 VanDerWaalsContact CD1-CD1 3.45Å; L111-L200 HydrophobicContact CG-CD1 4.21Å; L159-L200 HydrophobicContact CD2-CD1 3.75Å; T161-L200 HydrophobicContact CG2-CD2 4.29Å; H187-L200 HydrophobicContact CB-CD2 4.42Å; H187-L200 WeakPolarHBondContact CD2-CD2 3.42Å; L198-L200 HydrophobicContact CD2-CD1 4.27Å; L198-L200 HydrophobicContact CD2-CD2 4.09Å; L198-L200 HydrophobicContact CD2-CG 4.2Å; L198-L200 HydrophobicContact CG-CD2 4.12Å; L198-L200 HydrophobicContact CG-CG 4.1Å
201	T	91.9	Very high	86.2	Confident	60 Å²	60	63.3 Å²	63.3	37%	0.368	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114	171.6	-58.7	0	0	0	0	108.6	I105 H108 T203	I105-T201 HydrophobicContact CG2-CG2 3.97Å; H108-T201 VanDerWaalsContact CE1-CG2 3.45Å; H108-T201 WeakPolarHBondContact CE1-CG2 3.48Å; H108-T201 PolarHBondContact CE1-OG1 2.95Å; H108-T201 WeakPolarHBondContact ND1-CG2 3.49Å; H108-T201 PolarHBondContact ND1-OG1 2.95Å; T201-T203 HydrophobicContact CG2-CG2 4.24Å
202	H	92.3	Very high	87	Confident	19 Å²	19	64.8 Å²	64.8	9%	0.088	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.7	174.6	-76.5	-86.4	0	0	0	110	C67 L106 C107 T161	C67-H202 VanDerWaalsContact SG-CB 3.57Å; L106-H202 HydrophobicContact CB-CB 4.21Å; L106-H202 HydrophobicContact CD2-CB 4.33Å; L106-H202 PolarHBondContact N-O 3.41Å; C107-H202 PolarHBondContact O-N 3.32Å; T161-H202 VanDerWaalsContact O-CA 3.31Å; T161-H202 WeakPolarHBondContact O-CA 3.39Å
203	T	93.9	Very high	87.4	Confident	19 Å²	19	64.1 Å²	64.1	12%	0.117	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	161.6	-179.9	54	0	0	0	0	110.3	R104 I105 T161 H162 L163 T201	R104-T203 CarbonylContact O-C 3.53Å; R104-T203 WeakPolarHBondContact O-CA 3.37Å; R104-T203 WeakPolarHBondContact O-CB 3.46Å; I105-T203 HydrophobicContact CG1-CG2 4.21Å; T161-T203 PolarHBondContact O-N 3.14Å; H162-T203 VanDerWaalsContact CA-O 3.3Å; H162-T203 WeakPolarHBondContact CA-O 3.17Å; H162-T203 PolarHBondContact ND1-O 3.17Å; H162-T203 PolarHBondContact ND1-OG1 3.09Å; L163-T203 PolarHBondContact N-O 3.42Å; T201-T203 HydrophobicContact CG2-CG2 4.24Å
204	Y	94.7	Very high	87.7	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	157.2	176.2	73.7	-80.4	0	0	0	112.4	Y93 E94 K103 R104 L106 H162 L163 F165 V206	Y93-Y204 AromaticContact CD1-CD1 3.8Å; Y93-Y204 HydrophobicContact CD1-CD1 3.8Å; Y93-Y204 AromaticContact CD1-CD2 3.84Å; Y93-Y204 HydrophobicContact CD1-CD2 3.84Å; Y93-Y204 HydrophobicContact CD1-CE1 4.24Å; Y93-Y204 HydrophobicContact CD1-CE2 4.27Å; Y93-Y204 AromaticContact CD1-CG 3.57Å; Y93-Y204 HydrophobicContact CD1-CG 3.57Å; Y93-Y204 HydrophobicContact CE1-CD1 4.16Å; Y93-Y204 AromaticContact CE1-CG 3.92Å; Y93-Y204 HydrophobicContact CE1-CG 3.92Å; E94-Y204 PolarHBondContact N-OH 3.31Å; E94-Y204 PolarHBondContact O-OH 3.05Å; K103-Y204 CarbonylContact C-O 3.6Å; K103-Y204 WeakPolarHBondContact CA-O 3.49Å; K103-Y204 PolarHBondContact N-O 3.33Å; R104-Y204 HydrophobicContact CB-CD1 4.24Å; R104-Y204 HydrophobicContact CB-CE1 3.85Å; R104-Y204 WeakPolarHBondContact CD-OH 3.33Å; R104-Y204 HydrophobicContact CG-CE1 3.87Å; R104-Y204 PolarHBondContact N-O 3.11Å; R104-Y204 WeakPolarHBondContact O-CD1 3.11Å; R104-Y204 PolarHBondContact O-N 2.76Å; L106-Y204 HydrophobicContact CB-CD1 4.09Å; L106-Y204 HydrophobicContact CD1-CD1 4.13Å; L106-Y204 HydrophobicContact CD1-CE1 4.12Å; H162-Y204 VanDerWaalsContact CE1-C 3.48Å; L163-Y204 CarbonylContact O-C 3.57Å; L163-Y204 WeakPolarHBondContact O-CA 3.28Å; L163-Y204 WeakPolarHBondContact O-CB 3.37Å; F165-Y204 HydrophobicContact CD2-CD2 4.37Å; F165-Y204 HydrophobicContact CE2-CD2 4.44Å; Y204-V206 HydrophobicContact CD2-CG2 3.86Å; Y204-V206 HydrophobicContact CE2-CG2 3.81Å
205	S	94.9	Very high	87.8	Confident	11 Å²	11	65 Å²	65	8%	0.077	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.5	171.8	-56.7	0	0	0	0	109.6	V101 K103 H162 L163 D164 F165	V101-S205 CarbonylContact O-C 3.4Å; V101-S205 WeakPolarHBondContact O-CA 3.36Å; V101-S205 WeakPolarHBondContact O-CB 3.28Å; K103-S205 PolarHBondContact N-OG 2.98Å; H162-S205 PolarHBondContact CE1-OG 3Å; H162-S205 PolarHBondContact NE2-OG 3.11Å; L163-S205 PolarHBondContact O-N 3.46Å; D164-S205 WeakPolarHBondContact OD1-CB 3.36Å; F165-S205 PolarHBondContact N-O 2.81Å
206	V	95.1	Very high	87.8	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.6	176.7	-176.1	0	0	0	0	108	I95 N100 V101 F165 L167 Y204	I95-V206 HydrophobicContact CG1-CG2 4.08Å; I95-V206 HydrophobicContact CG2-CG1 4.07Å; N100-V206 WeakPolarHBondContact CA-O 3.25Å; V101-V206 HydrophobicContact CB-CB 4.27Å; V101-V206 HydrophobicContact CB-CG2 4.42Å; V101-V206 PolarHBondContact N-O 3.2Å; V101-V206 PolarHBondContact O-N 2.81Å; F165-V206 HydrophobicContact CD2-CG2 4.49Å; F165-V206 CarbonylContact O-C 3.5Å; F165-V206 WeakPolarHBondContact O-CA 3.42Å; L167-V206 HydrophobicContact CD1-CG1 3.93Å; Y204-V206 HydrophobicContact CD2-CG2 3.86Å; Y204-V206 HydrophobicContact CE2-CG2 3.81Å
207	R	94.5	Very high	87	Confident	109 Å²	109	58 Å²	58	41%	0.411	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.9	177.1	-65.1	179.2	174.7	159.1	-7.7	109.6	D164 F165 H166 L167	D164-R207 IonicContact OD1-NE 4Å; D164-R207 IonicContact OD2-CZ 3.34Å; D164-R207 IonicContact OD2-NE 2.68Å; D164-R207 IonicContact OD2-NH1 3.84Å; D164-R207 PolarHBondContact OD2-NH1 3.12Å; F165-R207 PolarHBondContact O-N 3.22Å; H166-R207 WeakPolarHBondContact CA-O 3.34Å; L167-R207 PolarHBondContact N-O 3.34Å
208	W	94.4	Very high	85.8	Confident	23 Å²	23	55.4 Å²	55.4	9%	0.087	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.7	173.6	-68.2	95	0	0	0	110.6	V42 I95 R96 F97 E99 N100 L167 F169 I174	V42-W208 HydrophobicContact CG2-CH2 4.25Å; V42-W208 HydrophobicContact CG2-CZ2 4.29Å; I95-W208 HydrophobicContact CG2-CZ2 3.84Å; R96-W208 WeakPolarHBondContact O-CZ2 3.44Å; R96-W208 PolarHBondContact O-NE1 3.35Å; F97-W208 HydrophobicContact CD2-CE3 4.43Å; F97-W208 AromaticContact CD2-CH2 3.55Å; F97-W208 HydrophobicContact CD2-CH2 3.55Å; F97-W208 HydrophobicContact CD2-CZ2 4.19Å; F97-W208 AromaticContact CD2-CZ3 3.69Å; F97-W208 HydrophobicContact CD2-CZ3 3.69Å; F97-W208 HydrophobicContact CE2-CE3 4.5Å; F97-W208 HydrophobicContact CE2-CH2 4.16Å; F97-W208 AromaticContact CE2-CZ3 3.83Å; F97-W208 HydrophobicContact CE2-CZ3 3.83Å; E99-W208 PolarHBondContact O-NE1 3.46Å; N100-W208 WeakPolarHBondContact OD1-CB 3.13Å; N100-W208 PolarHBondContact OD1-N 3.21Å; L167-W208 HydrophobicContact CB-CD2 3.88Å; L167-W208 HydrophobicContact CB-CE3 3.44Å; L167-W208 VanDerWaalsContact CB-CE3 3.44Å; L167-W208 HydrophobicContact CB-CH2 3.88Å; L167-W208 HydrophobicContact CB-CZ2 4.27Å; L167-W208 HydrophobicContact CB-CZ3 3.44Å; L167-W208 VanDerWaalsContact CB-CZ3 3.44Å; L167-W208 HydrophobicContact CD1-CD2 4.32Å; L167-W208 HydrophobicContact CD1-CE3 4.42Å; L167-W208 HydrophobicContact CD1-CH2 3.58Å; L167-W208 HydrophobicContact CD1-CZ2 3.42Å; L167-W208 VanDerWaalsContact CD1-CZ2 3.42Å; L167-W208 HydrophobicContact CD1-CZ3 4.09Å; L167-W208 HydrophobicContact CG-CH2 4.24Å; L167-W208 HydrophobicContact CG-CZ2 4.44Å; L167-W208 HydrophobicContact CG-CZ3 4.3Å; L167-W208 WeakPolarHBondContact O-CA 3.28Å; F169-W208 HydrophobicContact CB-CE3 4.43Å; F169-W208 HydrophobicContact CB-CZ3 4.43Å; F169-W208 HydrophobicContact CD1-CB 4.32Å; F169-W208 AromaticContact CD1-CE3 3.86Å; F169-W208 HydrophobicContact CD1-CE3 3.86Å; F169-W208 HydrophobicContact CE1-CB 4.12Å; I174-W208 HydrophobicContact CD1-CH2 3.89Å; I174-W208 HydrophobicContact CD1-CZ3 4.33Å; I174-W208 HydrophobicContact CG1-CH2 4.13Å; I174-W208 HydrophobicContact CG1-CZ3 4.09Å
209	S	93.4	Very high	85	Confident	37 Å²	37	56.8 Å²	56.8	26%	0.259	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.3	172.4	59.9	0	0	0	0	110.9	H166 L167 E168 F169	H166-S209 PolarHBondContact CE1-OG 2.84Å; H166-S209 PolarHBondContact NE2-OG 3Å; L167-S209 PolarHBondContact O-N 3.34Å; E168-S209 VanDerWaalsContact CA-O 3.24Å; E168-S209 WeakPolarHBondContact CA-O 3.24Å; E168-S209 WeakPolarHBondContact CG-OG 3.41Å; F169-S209 WeakPolarHBondContact CD1-O 3.31Å; F169-S209 PolarHBondContact N-O 2.97Å
210	E	92.2	Very high	83.7	Confident	147 Å²	147	57.5 Å²	57.5	69%	0.687	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	134.6	173.5	-171.1	168.2	-157	0	0	110.1	F169	F169-E210 HydrophobicContact CE1-CB 4.27Å; F169-E210 HydrophobicContact CE2-CB 4.16Å; F169-E210 HydrophobicContact CE2-CG 4.14Å; F169-E210 HydrophobicContact CZ-CB 3.87Å; F169-E210 HydrophobicContact CZ-CG 4.35Å; F169-E210 WeakPolarHBondContact O-CA 3.45Å
211	T	88.4	Confident	82	Confident	17 Å²	17	67.1 Å²	67.1	10%	0.104	32%	0.319	C	S	.	.			trans	-115.7	143.6	177.5	-170	0	0	0	0	109.9	E168 F169 H170 I175 V213	E168-T211 HydrophobicContact CB-CG2 4.08Å; E168-T211 PolarHBondContact OE2-OG1 3.39Å; F169-T211 PolarHBondContact O-N 3.45Å; H170-T211 HydrophobicContact CB-CG2 4.15Å; H170-T211 PolarHBondContact CD2-O 2.89Å; I175-T211 HydrophobicContact CB-CG2 3.99Å; I175-T211 HydrophobicContact CG1-CG2 4.01Å; I175-T211 HydrophobicContact CG2-CG2 4.15Å; T211-V213 HydrophobicContact CG2-CB 4.43Å; T211-V213 PolarHBondContact O-N 3.22Å
212	S	85.4	Confident	79.9	Confident	113 Å²	113	67.4 Å²	67.4	79%	0.79	33%	0.334	S	S	*	.	S	Bend	trans	-77.4	-0.9	175.6	63.9	0	0	0	0	113.1
213	V	81.1	Confident	77.9	Confident	35 Å²	35	69.4 Å²	69.4	21%	0.212	35%	0.345	C	S	.	.			trans	-89.4	115.5	-176.5	-175.9	0	0	0	0	110.9	H170 T211 R215 D218 R219	H170-V213 WeakPolarHBondContact CB-O 3.14Å; T211-V213 HydrophobicContact CG2-CB 4.43Å; T211-V213 PolarHBondContact O-N 3.22Å; V213-R215 WeakPolarHBondContact CG1-O 3.37Å; V213-R215 PolarHBondContact O-N 2.86Å; V213-D218 HydrophobicContact CG1-CB 3.97Å; V213-R219 HydrophobicContact CB-CB 4.14Å; V213-R219 HydrophobicContact CG1-CB 3.78Å; V213-R219 HydrophobicContact CG2-CB 4.39Å
214	E	77.3	Confident	75.7	Confident	130 Å²	130	76 Å²	76	61%	0.607	38%	0.38	S	S	*	.			trans	-71.9	-32.3	-175.5	-58.3	-170.9	168.3	0	0	113.9	R173	R173-E214 PolarHBondContact NH2-O 3.36Å
215	R	72.3	Confident	73.5	Confident	173 Å²	173	78.3 Å²	78.3	65%	0.653	41%	0.405	S	S	*	.			trans	-120.6	131.1	-169.5	-159.1	177.8	179.8	113.5	2.6	111.8	V213 S217 D218 R219	V213-R215 WeakPolarHBondContact CG1-O 3.37Å; V213-R215 PolarHBondContact O-N 2.86Å; R215-S217 WeakPolarHBondContact CD-OG 3.41Å; R215-S217 WeakPolarHBondContact CG-OG 3.38Å; R215-S217 PolarHBondContact NE-OG 2.75Å; R215-S217 PolarHBondContact O-N 3.26Å; R215-S217 VanDerWaalsContact O-N 3.09Å; R215-D218 PolarHBondContact O-N 2.94Å; R215-R219 PolarHBondContact O-N 3.37Å
216	R	73.4	Confident	71.7	Confident	58 Å²	58	79.9 Å²	79.9	22%	0.219	42%	0.422	C	S	.	.	H	α-helix	trans	-49.2	-37.5	175.1	-71.2	-175.6	177.4	166.6	16.8	113.6	D134 I174 I175 D218 R220	D134-R216 PolarHBondContact O-NH1 3.4Å; D134-R216 IonicContact OD1-CZ 3.49Å; D134-R216 IonicContact OD1-NH1 3.66Å; D134-R216 PolarHBondContact OD1-NH1 3.27Å; D134-R216 IonicContact OD1-NH2 2.94Å; D134-R216 PolarHBondContact OD1-NH2 2.94Å; D134-R216 IonicContact OD2-CZ 3.64Å; D134-R216 IonicContact OD2-NH2 2.79Å; D134-R216 PolarHBondContact OD2-NH2 2.95Å; I174-R216 VanDerWaalsContact O-CZ 3.31Å; I174-R216 PolarHBondContact O-NE 2.91Å; I174-R216 PolarHBondContact O-NH2 2.89Å; I175-R216 HydrophobicContact CD1-CG 4.4Å; R216-D218 VanDerWaalsContact C-N 3.3Å; R216-D218 PolarHBondContact O-N 2.68Å; R216-R220 VanDerWaalsContact O-CG 3.31Å; R216-R220 WeakPolarHBondContact O-CG 3.41Å
217	S	66.1	Low	70.1	Confident	52 Å²	52	83 Å²	83	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-30.7	-179.1	54.2	0	0	0	0	113.4	R215	R215-S217 WeakPolarHBondContact CD-OG 3.41Å; R215-S217 WeakPolarHBondContact CG-OG 3.38Å; R215-S217 PolarHBondContact NE-OG 2.75Å; R215-S217 PolarHBondContact O-N 3.26Å; R215-S217 VanDerWaalsContact O-N 3.09Å
218	D	59.3	Low	68.6	Low	75 Å²	75	78.8 Å²	78.8	40%	0.401	42%	0.421	S	S	.	.	H	α-helix	trans	-86.6	-36.7	-173.3	-62.2	-27.4	0	0	0	111.2	V213 R215 R216 R220 R221 G222	V213-D218 HydrophobicContact CG1-CB 3.97Å; R215-D218 PolarHBondContact O-N 2.94Å; R216-D218 VanDerWaalsContact C-N 3.3Å; R216-D218 PolarHBondContact O-N 2.68Å; D218-R220 PolarHBondContact O-N 2.9Å; D218-R221 PolarHBondContact O-N 2.93Å; D218-R221 VanDerWaalsContact O-N 3.11Å; D218-R221 IonicContact OD1-NH1 3.04Å; D218-R221 PolarHBondContact OD1-NH1 2.73Å; D218-G222 PolarHBondContact O-N 2.82Å
219	R	67.9	Low	66.6	Low	57 Å²	57	81.1 Å²	81.1	22%	0.215	44%	0.439	C	S	.	.	H	α-helix	trans	-60.5	-35.3	175.7	-175.1	61.8	-179.5	105.5	-0.2	111.6	E168 I175 F176 V213 R215 G222	E168-R219 IonicContact OE1-CZ 2.89Å; E168-R219 IonicContact OE1-NE 3.7Å; E168-R219 PolarHBondContact OE1-NE 3.11Å; E168-R219 IonicContact OE1-NH2 3.72Å; E168-R219 PolarHBondContact OE1-NH2 3.25Å; E168-R219 IonicContact OE2-CZ 2.78Å; E168-R219 IonicContact OE2-NE 4Å; E168-R219 PolarHBondContact OE2-NE 3.04Å; E168-R219 IonicContact OE2-NH2 3.69Å; I175-R219 HydrophobicContact CG2-CB 3.88Å; I175-R219 HydrophobicContact CG2-CG 4.29Å; F176-R219 HydrophobicContact CB-CG 4.31Å; V213-R219 HydrophobicContact CB-CB 4.14Å; V213-R219 HydrophobicContact CG1-CB 3.78Å; V213-R219 HydrophobicContact CG2-CB 4.39Å; R215-R219 PolarHBondContact O-N 3.37Å; R219-G222 PolarHBondContact O-N 3.22Å
220	R	59.3	Low	64.7	Low	64 Å²	64	87 Å²	87	24%	0.242	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.5	179.4	-65.5	177.5	-168.1	-171.6	4.4	114.4	R216 D218	R216-R220 VanDerWaalsContact O-CG 3.31Å; R216-R220 WeakPolarHBondContact O-CG 3.41Å; D218-R220 PolarHBondContact O-N 2.9Å
221	R	53.3	Low	62.6	Low	206 Å²	206	85 Å²	85	78%	0.777	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-26.5	172.7	-80.4	176.9	175.4	155.1	-6.7	112.2	D218	D218-R221 PolarHBondContact O-N 2.93Å; D218-R221 VanDerWaalsContact O-N 3.11Å; D218-R221 IonicContact OD1-NH1 3.04Å; D218-R221 PolarHBondContact OD1-NH1 2.73Å
222	G	47.7	Very low	60.8	Low	66 Å²	66	85.9 Å²	85.9	68%	0.68	46%	0.457	S	S	*	.	S	Bend	trans	-91.2	-5.6	-176.3	0	0	0	0	0	115.9	D218 R219	D218-G222 PolarHBondContact O-N 2.82Å; R219-G222 PolarHBondContact O-N 3.22Å
223	D	51.7	Low	59.1	Low	62 Å²	62	88 Å²	88	33%	0.332	46%	0.455	S	S	.	.			trans	-114.7	115	-177.7	-154.2	50	0	0	0	111.1	G225	D223-G225 PolarHBondContact O-N 2.76Å
224	D	47.2	Very low	57.9	Low	156 Å²	156	88 Å²	88	83%	0.834	45%	0.453	S	S	*	.			trans	-75.7	1.9	173.3	-87	-27	0	0	0	112.7	G226	D224-G226 PolarHBondContact O-N 3.01Å
225	G	48.6	Very low	57.1	Low	53 Å²	53	87.4 Å²	87.4	55%	0.546	45%	0.45	S	S	.	.			trans	-97.7	38.1	-169.2	0	0	0	0	0	116.6	D223	D223-G225 PolarHBondContact O-N 2.76Å
226	G	57	Low	56.8	Low	43 Å²	43	85.7 Å²	85.7	44%	0.443	44%	0.443	S	S	.	.			trans	-58.7	142.8	171.9	0	0	0	0	0	111.9	D224 F228	D224-G226 PolarHBondContact O-N 3.01Å; G226-F228 CarbonylContact O-C 3.47Å; G226-F228 PolarHBondContact O-N 3.29Å; G226-F228 VanDerWaalsContact O-N 3.15Å
227	F	61.8	Low	56.5	Low	66 Å²	66	90 Å²	90	29%	0.289	47%	0.47	S	S	.	.	S	Bend	trans	-54.1	-35.2	179.9	176.7	-96.6	0	0	0	113.2	Y128 R139 F141	Y128-F227 HydrophobicContact CG-CE1 4.46Å; R139-F227 HydrophobicContact CB-CB 4.13Å; R139-F227 HydrophobicContact CB-CD1 3.81Å; R139-F227 HydrophobicContact CB-CD2 4.27Å; R139-F227 HydrophobicContact CB-CE1 4.27Å; R139-F227 HydrophobicContact CB-CG 3.8Å; R139-F227 WeakPolarHBondContact O-CD2 3.28Å; F141-F227 HydrophobicContact CD1-CZ 4.14Å; F141-F227 AromaticContact CD2-CE2 3.67Å; F141-F227 HydrophobicContact CD2-CE2 3.67Å; F141-F227 AromaticContact CD2-CZ 3.45Å; F141-F227 HydrophobicContact CD2-CZ 3.45Å; F141-F227 VanDerWaalsContact CD2-CZ 3.45Å; F141-F227 HydrophobicContact CE1-CE1 4.46Å; F141-F227 AromaticContact CE1-CZ 4Å; F141-F227 HydrophobicContact CE1-CZ 4Å; F141-F227 HydrophobicContact CE2-CE1 4.13Å; F141-F227 AromaticContact CE2-CE2 3.65Å; F141-F227 HydrophobicContact CE2-CE2 3.65Å; F141-F227 AromaticContact CE2-CZ 3.27Å; F141-F227 HydrophobicContact CE2-CZ 3.27Å; F141-F227 HydrophobicContact CG-CE2 4.41Å; F141-F227 AromaticContact CG-CZ 3.89Å; F141-F227 HydrophobicContact CG-CZ 3.89Å; F141-F227 HydrophobicContact CZ-CE1 4.04Å; F141-F227 HydrophobicContact CZ-CE2 4.38Å; F141-F227 AromaticContact CZ-CZ 3.57Å; F141-F227 HydrophobicContact CZ-CZ 3.57Å
228	F	62.8	Low	56.6	Low	22 Å²	22	90.6 Å²	90.6	10%	0.096	47%	0.474	C	S	.	.	S	Bend	trans	-88.5	124.8	169.9	-61.3	-66.4	0	0	0	109.1	Y52 Y128 G226 R230 R492	Y52-F228 HydrophobicContact CD2-CD1 4.19Å; Y52-F228 AromaticContact CD2-CE1 3.8Å; Y52-F228 HydrophobicContact CD2-CE1 3.8Å; Y52-F228 AromaticContact CE2-CD1 3.49Å; Y52-F228 HydrophobicContact CE2-CD1 3.49Å; Y52-F228 VanDerWaalsContact CE2-CD1 3.49Å; Y52-F228 AromaticContact CE2-CE1 3.6Å; Y52-F228 HydrophobicContact CE2-CE1 3.6Å; Y128-F228 HydrophobicContact CD2-CZ 4.16Å; Y128-F228 HydrophobicContact CE2-CZ 4.15Å; G226-F228 CarbonylContact O-C 3.47Å; G226-F228 PolarHBondContact O-N 3.29Å; G226-F228 VanDerWaalsContact O-N 3.15Å; F228-R230 PolarHBondContact O-N 2.93Å; F228-R492 HydrophobicContact CB-CB 4.36Å; F228-R492 HydrophobicContact CD1-CB 3.89Å; F228-R492 HydrophobicContact CD1-CG 3.98Å; F228-R492 HydrophobicContact CD2-CB 4.11Å; F228-R492 HydrophobicContact CE1-CB 4.32Å; F228-R492 HydrophobicContact CE1-CG 3.98Å; F228-R492 HydrophobicContact CE2-CB 4.48Å; F228-R492 HydrophobicContact CG-CB 3.84Å; F228-R492 HydrophobicContact CG-CG 4.4Å; F228-R492 HydrophobicContact CZ-CG 4.35Å
229	P	52.7	Low	57.2	Low	71 Å²	71	87.1 Å²	87.1	46%	0.461	46%	0.456	S	S	.	.			trans	-59.9	125.9	175.2	26.1	-32.7	0	0	0	108.6	T231	P229-T231 VanDerWaalsContact C-N 3.31Å; P229-T231 HydrophobicContact CB-CG2 3.98Å; P229-T231 HydrophobicContact CG-CG2 4.26Å; P229-T231 PolarHBondContact O-N 2.66Å
230	R	53.2	Low	57.5	Low	161 Å²	161	88.4 Å²	88.4	61%	0.608	47%	0.466	S	S	*	.			trans	-77.5	87.2	172.1	-65.9	-177.5	-179.9	165	4.1	107.1	F228 L232	F228-R230 PolarHBondContact O-N 2.93Å; R230-L232 VanDerWaalsContact C-N 3.34Å
231	T	47.4	Very low	58.2	Low	104 Å²	104	90.9 Å²	90.9	64%	0.638	48%	0.484	S	S	*	.			trans	-86.9	-7.4	-177.2	60.7	0	0	0	0	113.1	P229 E233 E493	P229-T231 VanDerWaalsContact C-N 3.31Å; P229-T231 HydrophobicContact CB-CG2 3.98Å; P229-T231 HydrophobicContact CG-CG2 4.26Å; P229-T231 PolarHBondContact O-N 2.66Å; T231-E233 PolarHBondContact O-N 3.01Å; T231-E493 PolarHBondContact N-OE1 3.42Å; T231-E493 PolarHBondContact OG1-OE1 2.88Å
232	L	52.1	Low	59.2	Low	37 Å²	37	82.6 Å²	82.6	19%	0.194	46%	0.458	C	S	.	.			trans	-72.2	78.1	163.4	-96.1	90.9	0	0	0	110.5	R230 I234 Y484 A487 E493	R230-L232 VanDerWaalsContact C-N 3.34Å; L232-I234 HydrophobicContact CB-CD1 4.31Å; L232-I234 HydrophobicContact CB-CG1 4.01Å; L232-I234 HydrophobicContact CD2-CD1 4.01Å; L232-I234 HydrophobicContact CD2-CG1 3.69Å; L232-I234 HydrophobicContact CG-CG1 4.35Å; L232-I234 PolarHBondContact O-N 3.43Å; L232-Y484 HydrophobicContact CD1-CD1 4.46Å; L232-Y484 HydrophobicContact CD2-CD1 3.28Å; L232-Y484 HydrophobicContact CD2-CE1 3.72Å; L232-Y484 HydrophobicContact CD2-CG 4.15Å; L232-Y484 HydrophobicContact CG-CD1 4.01Å; L232-Y484 HydrophobicContact CG-CE1 4.12Å; L232-A487 HydrophobicContact CD1-CB 4.39Å; L232-E493 WeakPolarHBondContact CB-OE2 3.36Å; L232-E493 WeakPolarHBondContact CD1-OE2 3.44Å; L232-E493 PolarHBondContact N-OE1 3.26Å; L232-E493 PolarHBondContact N-OE2 3.49Å
233	E	49.2	Very low	60.7	Low	157 Å²	157	80.8 Å²	80.8	73%	0.734	43%	0.432	S	S	*	.			trans	-62.3	85.6	144.6	-75.2	-170.7	179.9	0	0	106.8	T231 H235	T231-E233 PolarHBondContact O-N 3.01Å; E233-H235 PolarHBondContact O-N 3.47Å
234	I	56.4	Low	62.1	Low	34 Å²	34	81.5 Å²	81.5	17%	0.174	44%	0.438	C	S	.	.			trans	-62.1	108.4	174.2	-72.6	148.3	0	0	0	105.8	L232 W236 I239 L497	L232-I234 HydrophobicContact CB-CD1 4.31Å; L232-I234 HydrophobicContact CB-CG1 4.01Å; L232-I234 HydrophobicContact CD2-CD1 4.01Å; L232-I234 HydrophobicContact CD2-CG1 3.69Å; L232-I234 HydrophobicContact CG-CG1 4.35Å; L232-I234 PolarHBondContact O-N 3.43Å; I234-W236 HydrophobicContact CG2-CD2 4.26Å; I234-W236 HydrophobicContact CG2-CG 4.03Å; I234-W236 PolarHBondContact O-N 2.91Å; I234-W236 PolarHBondContact O-NE1 3.02Å; I234-I239 HydrophobicContact CG2-CD1 3.55Å; I234-L497 HydrophobicContact CD1-CD1 3.73Å; I234-L497 HydrophobicContact CD1-CG 4.39Å; I234-L497 HydrophobicContact CG2-CD1 4.13Å
235	H	60.1	Low	63.6	Low	118 Å²	118	79.8 Å²	79.8	55%	0.546	43%	0.428	S	S	.	.			trans	-72.2	82.3	167	-64.5	-56.6	0	0	0	107.4	E233 L237 S238 I239	E233-H235 PolarHBondContact O-N 3.47Å; H235-L237 PolarHBondContact O-N 3.21Å; H235-S238 WeakPolarHBondContact O-CA 3.45Å; H235-S238 WeakPolarHBondContact O-CB 3.35Å; H235-S238 PolarHBondContact O-N 3.4Å; H235-I239 PolarHBondContact O-N 2.93Å
236	W	66.1	Low	65.1	Low	137 Å²	137	78 Å²	78	52%	0.519	41%	0.407	S	S	.	.	H	α-helix	trans	-47.9	-35.9	178.6	-64.5	78.4	0	0	0	111.9	I234 I239 I240 L497 I500	I234-W236 HydrophobicContact CG2-CD2 4.26Å; I234-W236 HydrophobicContact CG2-CG 4.03Å; I234-W236 PolarHBondContact O-N 2.91Å; I234-W236 PolarHBondContact O-NE1 3.02Å; W236-I239 PolarHBondContact O-N 3.3Å; W236-I240 WeakPolarHBondContact O-CB 3.38Å; W236-I240 VanDerWaalsContact O-CG1 3.23Å; W236-I240 WeakPolarHBondContact O-CG1 3.29Å; W236-I240 PolarHBondContact O-N 3.23Å; W236-L497 HydrophobicContact CE3-CD1 4.43Å; W236-L497 HydrophobicContact CH2-CD1 3.7Å; W236-L497 HydrophobicContact CH2-CD2 3.28Å; W236-L497 HydrophobicContact CH2-CG 4.16Å; W236-L497 HydrophobicContact CZ2-CD1 3.74Å; W236-L497 HydrophobicContact CZ2-CD2 3.73Å; W236-L497 HydrophobicContact CZ2-CG 4.4Å; W236-L497 HydrophobicContact CZ3-CD1 4.04Å; W236-L497 HydrophobicContact CZ3-CD2 4.1Å; W236-I500 HydrophobicContact CE3-CD1 4.36Å; W236-I500 HydrophobicContact CZ3-CD1 4.46Å
237	L	66.8	Low	66.3	Low	150 Å²	150	82.8 Å²	82.8	79%	0.785	42%	0.416	S	S	*	.	H	α-helix	trans	-62.2	-39.8	175.2	-66.8	173.6	0	0	0	112.9	H235 N241	H235-L237 PolarHBondContact O-N 3.21Å; L237-N241 WeakPolarHBondContact O-CB 3.49Å; L237-N241 PolarHBondContact O-N 2.79Å
238	S	68	Low	67.3	Low	63 Å²	63	85 Å²	85	44%	0.441	43%	0.43	S	S	.	.	H	α-helix	trans	-69.5	-42.1	177.9	-176.1	0	0	0	0	111.7	H235 N241 S242	H235-S238 WeakPolarHBondContact O-CA 3.45Å; H235-S238 WeakPolarHBondContact O-CB 3.35Å; H235-S238 PolarHBondContact O-N 3.4Å; S238-N241 PolarHBondContact O-N 3.43Å; S238-S242 VanDerWaalsContact O-CB 3.28Å; S238-S242 WeakPolarHBondContact O-CB 3.24Å; S238-S242 PolarHBondContact O-N 2.87Å
239	I	71.9	Confident	68.1	Low	2 Å²	2	89.2 Å²	89.2	1%	0.01	45%	0.453	C	S	.	.	H	α-helix	trans	-66.3	-48.9	178.5	-66.1	179.5	0	0	0	110.8	I234 H235 W236 N241 S242 M243 E481 Y484 I500	I234-I239 HydrophobicContact CG2-CD1 3.55Å; H235-I239 PolarHBondContact O-N 2.93Å; W236-I239 PolarHBondContact O-N 3.3Å; I239-N241 VanDerWaalsContact C-N 3.35Å; I239-N241 PolarHBondContact O-N 2.78Å; I239-S242 PolarHBondContact O-N 2.81Å; I239-M243 HydrophobicContact CG2-CE 3.77Å; I239-M243 HydrophobicContact CG2-SD 4.38Å; I239-M243 WeakPolarHBondContact O-CG 3.45Å; I239-M243 PolarHBondContact O-N 3.34Å; I239-E481 VanDerWaalsContact CG2-OE1 3.26Å; I239-E481 WeakPolarHBondContact CG2-OE1 3.43Å; I239-Y484 HydrophobicContact CD1-CD2 4.12Å; I239-Y484 HydrophobicContact CD1-CE2 3.75Å; I239-Y484 HydrophobicContact CG1-CE2 3.98Å; I239-I500 HydrophobicContact CD1-CD1 4.47Å; I239-I500 HydrophobicContact CG2-CD1 4.02Å; I239-I500 HydrophobicContact CG2-CG2 3.72Å
240	I	74.9	Confident	69.5	Low	85 Å²	85	86.8 Å²	86.8	44%	0.436	44%	0.437	S	S	.	.	H	α-helix	trans	-61.7	-44.8	177.4	-67.4	167.5	0	0	0	110.6	W236 S242 M243 V244	W236-I240 WeakPolarHBondContact O-CB 3.38Å; W236-I240 VanDerWaalsContact O-CG1 3.23Å; W236-I240 WeakPolarHBondContact O-CG1 3.29Å; W236-I240 PolarHBondContact O-N 3.23Å; I240-S242 VanDerWaalsContact C-N 3.34Å; I240-S242 PolarHBondContact O-N 2.84Å; I240-M243 HydrophobicContact CG1-CE 4.13Å; I240-M243 PolarHBondContact O-N 3.36Å; I240-V244 HydrophobicContact CG2-CG2 4.32Å; I240-V244 VanDerWaalsContact O-CG2 3.3Å; I240-V244 WeakPolarHBondContact O-CG2 3.37Å; I240-V244 PolarHBondContact O-N 3.3Å
241	N	73.9	Confident	70.9	Confident	115 Å²	115	80.7 Å²	80.7	62%	0.615	43%	0.425	S	S	*	.	H	α-helix	trans	-62.2	-42.4	178.6	-172.5	41.6	0	0	0	111.9	L237 S238 I239 V244 L245	L237-N241 WeakPolarHBondContact O-CB 3.49Å; L237-N241 PolarHBondContact O-N 2.79Å; S238-N241 PolarHBondContact O-N 3.43Å; I239-N241 VanDerWaalsContact C-N 3.35Å; I239-N241 PolarHBondContact O-N 2.78Å; N241-V244 PolarHBondContact O-N 2.78Å; N241-L245 WeakPolarHBondContact O-CB 3.36Å; N241-L245 PolarHBondContact O-N 3.48Å
242	S	75.1	Confident	72.5	Confident	33 Å²	33	82 Å²	82	23%	0.231	42%	0.422	C	S	.	.	H	α-helix	trans	-61.7	-46.1	174.7	-173.8	0	0	0	0	111.6	S238 I239 I240 V244 L245 V246	S238-S242 VanDerWaalsContact O-CB 3.28Å; S238-S242 WeakPolarHBondContact O-CB 3.24Å; S238-S242 PolarHBondContact O-N 2.87Å; I239-S242 PolarHBondContact O-N 2.81Å; I240-S242 VanDerWaalsContact C-N 3.34Å; I240-S242 PolarHBondContact O-N 2.84Å; S242-V244 PolarHBondContact O-N 2.99Å; S242-L245 PolarHBondContact O-N 3.34Å; S242-V246 VanDerWaalsContact O-CG2 3.31Å; S242-V246 WeakPolarHBondContact O-CG2 3.24Å; S242-V246 PolarHBondContact O-N 3.44Å
243	M	77.9	Confident	73.8	Confident	28 Å²	28	83 Å²	83	14%	0.138	43%	0.429	C	S	.	.	H	α-helix	trans	-62.2	-43.2	177.9	-73.3	-171	-64.1	0	0	112.6	I239 I240 V246 F247 I500 F503 V504 I507	I239-M243 HydrophobicContact CG2-CE 3.77Å; I239-M243 HydrophobicContact CG2-SD 4.38Å; I239-M243 WeakPolarHBondContact O-CG 3.45Å; I239-M243 PolarHBondContact O-N 3.34Å; I240-M243 HydrophobicContact CG1-CE 4.13Å; I240-M243 PolarHBondContact O-N 3.36Å; M243-V246 PolarHBondContact O-N 3Å; M243-F247 WeakPolarHBondContact O-CB 3.38Å; M243-F247 PolarHBondContact O-N 3.35Å; M243-I500 HydrophobicContact CE-CG2 4.46Å; M243-I500 HydrophobicContact SD-CG2 4.28Å; M243-F503 HydrophobicContact SD-CB 3.95Å; M243-V504 HydrophobicContact SD-CG2 4.17Å; M243-I507 HydrophobicContact CB-CD1 4.14Å; M243-I507 HydrophobicContact CG-CD1 4.15Å
244	V	81.7	Confident	75.3	Confident	77 Å²	77	77 Å²	77	47%	0.467	41%	0.406	S	S	.	.	H	α-helix	trans	-63.4	-44.7	177.4	171.4	0	0	0	0	110.6	I240 N241 S242 V246 F247 L248	I240-V244 HydrophobicContact CG2-CG2 4.32Å; I240-V244 VanDerWaalsContact O-CG2 3.3Å; I240-V244 WeakPolarHBondContact O-CG2 3.37Å; I240-V244 PolarHBondContact O-N 3.3Å; N241-V244 PolarHBondContact O-N 2.78Å; S242-V244 PolarHBondContact O-N 2.99Å; V244-V246 PolarHBondContact O-N 3.03Å; V244-F247 PolarHBondContact O-N 3.01Å; V244-L248 HydrophobicContact CG1-CD1 4.1Å; V244-L248 HydrophobicContact CG1-CG 4.44Å; V244-L248 WeakPolarHBondContact O-CG 3.06Å; V244-L248 PolarHBondContact O-N 2.87Å
245	L	77.7	Confident	76.5	Confident	119 Å²	119	79.9 Å²	79.9	62%	0.623	43%	0.425	S	S	*	.	H	α-helix	trans	-59	-46.4	177.1	-175.6	74.7	0	0	0	111.5	N241 S242 L248 L249	N241-L245 WeakPolarHBondContact O-CB 3.36Å; N241-L245 PolarHBondContact O-N 3.48Å; S242-L245 PolarHBondContact O-N 3.34Å; L245-L248 PolarHBondContact O-N 2.89Å; L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 PolarHBondContact O-N 3.33Å
246	V	80.3	Confident	77.6	Confident	17 Å²	17	77.9 Å²	77.9	10%	0.103	42%	0.418	C	S	.	.	H	α-helix	trans	-63.7	-42.2	178.5	175	0	0	0	0	110.9	S242 M243 V244 L248 L249 V250 A477 I507 V511	S242-V246 VanDerWaalsContact O-CG2 3.31Å; S242-V246 WeakPolarHBondContact O-CG2 3.24Å; S242-V246 PolarHBondContact O-N 3.44Å; M243-V246 PolarHBondContact O-N 3Å; V244-V246 PolarHBondContact O-N 3.03Å; V246-L248 PolarHBondContact O-N 3.09Å; V246-L249 PolarHBondContact O-N 2.87Å; V246-V250 HydrophobicContact CG1-CG2 4.39Å; V246-V250 VanDerWaalsContact O-CG2 3.26Å; V246-V250 WeakPolarHBondContact O-CG2 3.4Å; V246-V250 PolarHBondContact O-N 3.09Å; V246-A477 HydrophobicContact CG1-CB 3.91Å; V246-A477 HydrophobicContact CG2-CB 4.38Å; V246-I507 HydrophobicContact CB-CG2 4.42Å; V246-I507 HydrophobicContact CG1-CG2 3.42Å; V246-I507 VanDerWaalsContact CG1-CG2 3.42Å; V246-V511 HydrophobicContact CG1-CG2 4.08Å
247	F	82.8	Confident	78.3	Confident	142 Å²	142	72.7 Å²	72.7	62%	0.623	40%	0.4	S	S	*	.	H	α-helix	trans	-61.7	-43.8	177.2	-171.5	-92.6	0	0	0	112.3	M243 V244 V250 G251	M243-F247 WeakPolarHBondContact O-CB 3.38Å; M243-F247 PolarHBondContact O-N 3.35Å; V244-F247 PolarHBondContact O-N 3.01Å; F247-V250 PolarHBondContact O-N 3.06Å; F247-G251 PolarHBondContact O-N 3.06Å
248	L	82.1	Confident	78.8	Confident	112 Å²	112	70.9 Å²	70.9	59%	0.586	39%	0.389	S	S	*	.	H	α-helix	trans	-63.2	-42.1	176.2	-70.6	175.7	0	0	0	111.9	V244 L245 V246 G251 F252	V244-L248 HydrophobicContact CG1-CD1 4.1Å; V244-L248 HydrophobicContact CG1-CG 4.44Å; V244-L248 WeakPolarHBondContact O-CG 3.06Å; V244-L248 PolarHBondContact O-N 2.87Å; L245-L248 PolarHBondContact O-N 2.89Å; V246-L248 PolarHBondContact O-N 3.09Å; L248-G251 PolarHBondContact O-N 3.16Å; L248-F252 WeakPolarHBondContact O-CB 3.32Å; L248-F252 PolarHBondContact O-N 3.24Å
249	L	80.8	Confident	79.6	Confident	111 Å²	111	77.1 Å²	77.1	58%	0.581	40%	0.403	S	S	*	.	H	α-helix	trans	-62.4	-44.8	177.1	-172	75.2	0	0	0	111.4	L245 V246 F252 V253	L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 PolarHBondContact O-N 3.33Å; V246-L249 PolarHBondContact O-N 2.87Å; L249-F252 PolarHBondContact O-N 2.79Å; L249-V253 WeakPolarHBondContact O-CG2 3.48Å; L249-V253 PolarHBondContact O-N 2.9Å
250	V	81.6	Confident	80	Confident	20 Å²	20	79.8 Å²	79.8	12%	0.121	42%	0.419	C	S	.	.	H	α-helix	trans	-62.1	-46	176.4	173.3	0	0	0	0	110.9	V246 F247 F252 V253 A254 V511	V246-V250 HydrophobicContact CG1-CG2 4.39Å; V246-V250 VanDerWaalsContact O-CG2 3.26Å; V246-V250 WeakPolarHBondContact O-CG2 3.4Å; V246-V250 PolarHBondContact O-N 3.09Å; F247-V250 PolarHBondContact O-N 3.06Å; V250-F252 VanDerWaalsContact C-N 3.3Å; V250-F252 PolarHBondContact O-N 3.16Å; V250-V253 PolarHBondContact O-N 2.86Å; V250-A254 VanDerWaalsContact O-CB 3.3Å; V250-A254 WeakPolarHBondContact O-CB 3.49Å; V250-A254 PolarHBondContact O-N 3.03Å; V250-V511 HydrophobicContact CG2-CB 4.27Å; V250-V511 HydrophobicContact CG2-CG2 3.27Å
251	G	83.2	Confident	80.1	Confident	34 Å²	34	76.2 Å²	76.2	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-57.9	-44.3	175.8	0	0	0	0	0	111.8	F247 L248 A254 V255	F247-G251 PolarHBondContact O-N 3.06Å; L248-G251 PolarHBondContact O-N 3.16Å; G251-A254 PolarHBondContact O-N 3.31Å; G251-V255 VanDerWaalsContact O-CG2 3.27Å; G251-V255 WeakPolarHBondContact O-CG2 3.29Å; G251-V255 PolarHBondContact O-N 3.35Å
252	F	81	Confident	80.4	Confident	132 Å²	132	80.2 Å²	80.2	58%	0.579	41%	0.407	S	S	*	.	H	α-helix	trans	-62.7	-48	177.3	-178.1	-108.6	0	0	0	112.5	L248 L249 V250 A254 V255 I256	L248-F252 WeakPolarHBondContact O-CB 3.32Å; L248-F252 PolarHBondContact O-N 3.24Å; L249-F252 PolarHBondContact O-N 2.79Å; V250-F252 VanDerWaalsContact C-N 3.3Å; V250-F252 PolarHBondContact O-N 3.16Å; F252-A254 VanDerWaalsContact C-N 3.35Å; F252-A254 PolarHBondContact O-N 2.85Å; F252-V255 PolarHBondContact O-N 3.45Å; F252-I256 HydrophobicContact CD1-CD1 3.73Å; F252-I256 HydrophobicContact CE1-CD1 3.26Å; F252-I256 HydrophobicContact CE1-CG1 4.39Å; F252-I256 HydrophobicContact CE2-CD1 4.11Å; F252-I256 HydrophobicContact CG-CD1 4.36Å; F252-I256 HydrophobicContact CZ-CD1 3.48Å; F252-I256 VanDerWaalsContact CZ-CD1 3.48Å; F252-I256 HydrophobicContact CZ-CG1 4.34Å; F252-I256 WeakPolarHBondContact O-CG1 3.41Å; F252-I256 PolarHBondContact O-N 3.49Å
253	V	79.7	Confident	80.6	Confident	56 Å²	56	82.2 Å²	82.2	34%	0.339	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-42.6	177.1	172.1	0	0	0	0	111.2	L249 V250 V255 I256 L257	L249-V253 WeakPolarHBondContact O-CG2 3.48Å; L249-V253 PolarHBondContact O-N 2.9Å; V250-V253 PolarHBondContact O-N 2.86Å; V253-V255 PolarHBondContact O-N 3.01Å; V253-I256 PolarHBondContact O-N 3.24Å; V253-L257 WeakPolarHBondContact O-CB 3.37Å; V253-L257 PolarHBondContact O-N 2.9Å
254	A	80	Confident	80.5	Confident	31 Å²	31	82.3 Å²	82.3	26%	0.256	42%	0.416	S	S	.	.	H	α-helix	trans	-62.8	-42.1	177.3	0	0	0	0	0	111.9	V250 G251 F252 L257 M258	V250-A254 VanDerWaalsContact O-CB 3.3Å; V250-A254 WeakPolarHBondContact O-CB 3.49Å; V250-A254 PolarHBondContact O-N 3.03Å; G251-A254 PolarHBondContact O-N 3.31Å; F252-A254 VanDerWaalsContact C-N 3.35Å; F252-A254 PolarHBondContact O-N 2.85Å; A254-L257 PolarHBondContact O-N 3.34Å; A254-M258 WeakPolarHBondContact O-CB 3.2Å; A254-M258 VanDerWaalsContact O-CG 3.25Å; A254-M258 WeakPolarHBondContact O-CG 3.48Å; A254-M258 PolarHBondContact O-N 3.18Å
255	V	81.9	Confident	80	Confident	95 Å²	95	80 Å²	80	58%	0.576	40%	0.401	S	S	*	.	H	α-helix	trans	-64.2	-43.7	175.6	169.4	0	0	0	0	111.3	G251 F252 V253 M258 R259	G251-V255 VanDerWaalsContact O-CG2 3.27Å; G251-V255 WeakPolarHBondContact O-CG2 3.29Å; G251-V255 PolarHBondContact O-N 3.35Å; F252-V255 PolarHBondContact O-N 3.45Å; V253-V255 PolarHBondContact O-N 3.01Å; V255-M258 PolarHBondContact O-N 2.91Å; V255-R259 WeakPolarHBondContact O-CB 3.4Å; V255-R259 PolarHBondContact O-N 2.68Å
256	I	82.2	Confident	79.9	Confident	77 Å²	77	76.5 Å²	76.5	40%	0.395	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-50.5	175.7	-72.1	172	0	0	0	110.1	F252 V253 M258 R259 V260	F252-I256 HydrophobicContact CD1-CD1 3.73Å; F252-I256 HydrophobicContact CE1-CD1 3.26Å; F252-I256 HydrophobicContact CE1-CG1 4.39Å; F252-I256 HydrophobicContact CE2-CD1 4.11Å; F252-I256 HydrophobicContact CG-CD1 4.36Å; F252-I256 HydrophobicContact CZ-CD1 3.48Å; F252-I256 VanDerWaalsContact CZ-CD1 3.48Å; F252-I256 HydrophobicContact CZ-CG1 4.34Å; F252-I256 WeakPolarHBondContact O-CG1 3.41Å; F252-I256 PolarHBondContact O-N 3.49Å; V253-I256 PolarHBondContact O-N 3.24Å; I256-M258 VanDerWaalsContact C-N 3.35Å; I256-M258 PolarHBondContact O-N 2.77Å; I256-R259 PolarHBondContact O-N 3.12Å; I256-R259 VanDerWaalsContact O-N 3.15Å; I256-V260 HydrophobicContact CG2-CG2 4.2Å; I256-V260 WeakPolarHBondContact O-CB 3.45Å; I256-V260 VanDerWaalsContact O-CG2 3.31Å; I256-V260 WeakPolarHBondContact O-CG2 3.32Å; I256-V260 PolarHBondContact O-N 3.29Å
257	L	80.4	Confident	79.7	Confident	28 Å²	28	82.2 Å²	82.2	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-59.4	-46	-179.3	-179.1	70	0	0	0	111.4	V253 A254 R259 V260 L261 I517 A518	V253-L257 WeakPolarHBondContact O-CB 3.37Å; V253-L257 PolarHBondContact O-N 2.9Å; A254-L257 PolarHBondContact O-N 3.34Å; L257-R259 VanDerWaalsContact C-N 3.33Å; L257-R259 PolarHBondContact O-N 2.91Å; L257-V260 PolarHBondContact O-N 2.86Å; L257-L261 VanDerWaalsContact O-CB 3.26Å; L257-L261 WeakPolarHBondContact O-CB 3.32Å; L257-L261 PolarHBondContact O-N 3.37Å; L257-I517 HydrophobicContact CD2-CB 4.13Å; L257-I517 HydrophobicContact CD2-CG2 3.67Å; L257-A518 HydrophobicContact CD1-CB 4.18Å; L257-A518 HydrophobicContact CD2-CB 4.5Å
258	M	78.8	Confident	78.8	Confident	111 Å²	111	77.6 Å²	77.6	55%	0.547	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-37.4	176.4	-73	-63.2	-66.9	0	0	112.2	A254 V255 I256 R262	A254-M258 WeakPolarHBondContact O-CB 3.2Å; A254-M258 VanDerWaalsContact O-CG 3.25Å; A254-M258 WeakPolarHBondContact O-CG 3.48Å; A254-M258 PolarHBondContact O-N 3.18Å; V255-M258 PolarHBondContact O-N 2.91Å; I256-M258 VanDerWaalsContact C-N 3.35Å; I256-M258 PolarHBondContact O-N 2.77Å; M258-R262 WeakPolarHBondContact O-CB 3.15Å; M258-R262 PolarHBondContact O-N 3.46Å
259	R	83.5	Confident	78.1	Confident	195 Å²	195	75.8 Å²	75.8	74%	0.736	38%	0.378	S	S	*	.	H	α-helix	trans	-68.1	-45.5	177.5	-176.7	178	179.2	172.1	0.1	111.4	V255 I256 L257 R262 N263	V255-R259 WeakPolarHBondContact O-CB 3.4Å; V255-R259 PolarHBondContact O-N 2.68Å; I256-R259 PolarHBondContact O-N 3.12Å; I256-R259 VanDerWaalsContact O-N 3.15Å; L257-R259 VanDerWaalsContact C-N 3.33Å; L257-R259 PolarHBondContact O-N 2.91Å; R259-R262 PolarHBondContact O-N 3.26Å; R259-N263 VanDerWaalsContact O-CB 3.23Å; R259-N263 WeakPolarHBondContact O-CB 3.46Å; R259-N263 PolarHBondContact O-N 3.47Å
260	V	80.1	Confident	77.5	Confident	57 Å²	57	75.6 Å²	75.6	35%	0.345	38%	0.378	S	S	.	.	H	α-helix	trans	-59.9	-51.2	175.3	170.2	0	0	0	0	109.3	I256 L257 R262 N263 D264 Y521	I256-V260 HydrophobicContact CG2-CG2 4.2Å; I256-V260 WeakPolarHBondContact O-CB 3.45Å; I256-V260 VanDerWaalsContact O-CG2 3.31Å; I256-V260 WeakPolarHBondContact O-CG2 3.32Å; I256-V260 PolarHBondContact O-N 3.29Å; L257-V260 PolarHBondContact O-N 2.86Å; V260-R262 PolarHBondContact O-N 3.21Å; V260-N263 PolarHBondContact O-N 2.99Å; V260-N263 VanDerWaalsContact O-N 3.17Å; V260-D264 WeakPolarHBondContact CG1-OD2 3.46Å; V260-D264 WeakPolarHBondContact O-CB 3.43Å; V260-D264 VanDerWaalsContact O-CG 3.24Å; V260-D264 PolarHBondContact O-N 3.03Å; V260-Y521 HydrophobicContact CG1-CE1 4.3Å
261	L	77.2	Confident	76.7	Confident	11 Å²	11	78.9 Å²	78.9	6%	0.058	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-45.8	178.7	-174.5	69.8	0	0	0	112.3	L257 N263 D264 L265 Y521 F595 Y598 I599	L257-L261 VanDerWaalsContact O-CB 3.26Å; L257-L261 WeakPolarHBondContact O-CB 3.32Å; L257-L261 PolarHBondContact O-N 3.37Å; L261-N263 VanDerWaalsContact C-N 3.33Å; L261-N263 PolarHBondContact O-N 2.87Å; L261-D264 PolarHBondContact O-N 3.34Å; L261-L265 HydrophobicContact CD1-CD1 4.48Å; L261-L265 HydrophobicContact CG-CD1 4.09Å; L261-L265 WeakPolarHBondContact O-CB 3.34Å; L261-L265 VanDerWaalsContact O-CG 3.27Å; L261-L265 WeakPolarHBondContact O-CG 3.45Å; L261-L265 PolarHBondContact O-N 3.2Å; L261-Y521 HydrophobicContact CD1-CE2 4.49Å; L261-F595 HydrophobicContact CD1-CE2 4.08Å; L261-F595 HydrophobicContact CD1-CZ 4.26Å; L261-F595 HydrophobicContact CD2-CE2 3.9Å; L261-Y598 HydrophobicContact CD2-CD1 4.41Å; L261-Y598 HydrophobicContact CD2-CE1 4.05Å; L261-I599 HydrophobicContact CD1-CG2 3.91Å
262	R	79.8	Confident	75.7	Confident	199 Å²	199	80.7 Å²	80.7	75%	0.751	39%	0.394	S	S	*	.	H	α-helix	trans	-64.9	-39	178.6	-173.8	178.2	-179.7	-175.6	0.2	111.6	M258 R259 V260 A266	M258-R262 WeakPolarHBondContact O-CB 3.15Å; M258-R262 PolarHBondContact O-N 3.46Å; R259-R262 PolarHBondContact O-N 3.26Å; V260-R262 PolarHBondContact O-N 3.21Å; R262-A266 WeakPolarHBondContact O-CB 3.3Å; R262-A266 PolarHBondContact O-N 2.92Å
263	N	80.8	Confident	74.8	Confident	74 Å²	74	80.8 Å²	80.8	40%	0.396	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-43.3	176.5	-173.1	50.4	0	0	0	111.3	R259 V260 L261 A266 R267	R259-N263 VanDerWaalsContact O-CB 3.23Å; R259-N263 WeakPolarHBondContact O-CB 3.46Å; R259-N263 PolarHBondContact O-N 3.47Å; V260-N263 PolarHBondContact O-N 2.99Å; V260-N263 VanDerWaalsContact O-N 3.17Å; L261-N263 VanDerWaalsContact C-N 3.33Å; L261-N263 PolarHBondContact O-N 2.87Å; N263-A266 PolarHBondContact O-N 3.4Å; N263-R267 WeakPolarHBondContact O-CB 3.47Å; N263-R267 WeakPolarHBondContact O-CG 3.38Å; N263-R267 PolarHBondContact O-N 2.83Å
264	D	74.4	Confident	73.8	Confident	30 Å²	30	82.5 Å²	82.5	16%	0.16	41%	0.407	C	S	.	.	H	α-helix	trans	-68.4	-34.8	179.4	-67.2	-8	0	0	0	111.9	V260 L261 Y268 Y521	V260-D264 WeakPolarHBondContact CG1-OD2 3.46Å; V260-D264 WeakPolarHBondContact O-CB 3.43Å; V260-D264 VanDerWaalsContact O-CG 3.24Å; V260-D264 PolarHBondContact O-N 3.03Å; L261-D264 PolarHBondContact O-N 3.34Å; D264-Y268 PolarHBondContact O-N 2.9Å; D264-Y521 PolarHBondContact OD2-OH 3.06Å
265	L	73	Confident	72.5	Confident	30 Å²	30	85.4 Å²	85.4	16%	0.157	42%	0.421	C	S	.	.	H	α-helix	trans	-72.1	-35.8	171	-70.9	172.6	0	0	0	112.7	L261 Y268 N269 W290	L261-L265 HydrophobicContact CD1-CD1 4.48Å; L261-L265 HydrophobicContact CG-CD1 4.09Å; L261-L265 WeakPolarHBondContact O-CB 3.34Å; L261-L265 VanDerWaalsContact O-CG 3.27Å; L261-L265 WeakPolarHBondContact O-CG 3.45Å; L261-L265 PolarHBondContact O-N 3.2Å; L265-Y268 WeakPolarHBondContact O-CB 3.14Å; L265-N269 PolarHBondContact O-N 2.69Å; L265-W290 HydrophobicContact CD2-CH2 4.22Å
266	A	75.5	Confident	71.2	Confident	44 Å²	44	85.9 Å²	85.9	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-73.2	-43.4	-179.8	0	0	0	0	0	112.4	R262 N263 Y268 N269 L270	R262-A266 WeakPolarHBondContact O-CB 3.3Å; R262-A266 PolarHBondContact O-N 2.92Å; N263-A266 PolarHBondContact O-N 3.4Å; A266-Y268 PolarHBondContact O-N 3.31Å; A266-N269 PolarHBondContact O-N 2.95Å; A266-L270 WeakPolarHBondContact O-CG 3.41Å; A266-L270 PolarHBondContact O-N 2.91Å
267	R	74.5	Confident	69.8	Low	137 Å²	137	86.6 Å²	86.6	52%	0.517	45%	0.446	S	S	.	.	H	α-helix	trans	-53.9	-42.7	172.4	-76	177.7	178.3	-169.1	-3.8	111	N263 L270 D271	N263-R267 WeakPolarHBondContact O-CB 3.47Å; N263-R267 WeakPolarHBondContact O-CG 3.38Å; N263-R267 PolarHBondContact O-N 2.83Å; R267-L270 WeakPolarHBondContact O-CB 3.4Å; R267-L270 PolarHBondContact O-N 2.94Å; R267-D271 VanDerWaalsContact O-CG 3.26Å; R267-D271 PolarHBondContact O-N 2.77Å
268	Y	63.7	Low	67.9	Low	45 Å²	45	87.3 Å²	87.3	18%	0.176	46%	0.461	C	S	.	.	H	α-helix	trans	-59.3	-50	177.6	174.6	-104	0	0	0	114.4	D264 L265 A266 L270 D271 E272 K291 K604	D264-Y268 PolarHBondContact O-N 2.9Å; L265-Y268 WeakPolarHBondContact O-CB 3.14Å; A266-Y268 PolarHBondContact O-N 3.31Å; Y268-L270 PolarHBondContact O-N 3.19Å; Y268-D271 PolarHBondContact O-N 3.1Å; Y268-D271 VanDerWaalsContact O-N 3.15Å; Y268-E272 WeakPolarHBondContact CE1-OE2 3.47Å; Y268-E272 PolarHBondContact O-N 3.4Å; Y268-E272 PolarHBondContact OH-OE2 2.92Å; Y268-K291 VanDerWaalsContact CB-NZ 3.31Å; Y268-K291 HydrophobicContact CD2-CD 4.25Å; Y268-K291 HydrophobicContact CE2-CD 4.44Å; Y268-K604 PolarHBondContact OH-O 3.42Å
269	N	67.4	Low	66.2	Low	74 Å²	74	88 Å²	88	40%	0.396	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-32.1	-179.2	-68.3	-21.7	0	0	0	111.4	L265 A266 E273	L265-N269 PolarHBondContact O-N 2.69Å; A266-N269 PolarHBondContact O-N 2.95Å; N269-E273 WeakPolarHBondContact O-CG 3.24Å; N269-E273 PolarHBondContact O-N 2.87Å
270	L	68.9	Low	64.7	Low	108 Å²	108	82 Å²	82	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-73.4	-41.5	176.3	-64.7	171.1	0	0	0	112.3	A266 R267 Y268 E273 T274	A266-L270 WeakPolarHBondContact O-CG 3.41Å; A266-L270 PolarHBondContact O-N 2.91Å; R267-L270 WeakPolarHBondContact O-CB 3.4Å; R267-L270 PolarHBondContact O-N 2.94Å; Y268-L270 PolarHBondContact O-N 3.19Å; L270-E273 PolarHBondContact O-N 3.08Å; L270-T274 WeakPolarHBondContact O-CB 3.43Å; L270-T274 PolarHBondContact O-N 3.15Å; L270-T274 PolarHBondContact O-OG1 3.44Å
271	D	64.8	Low	62.9	Low	88 Å²	88	86.7 Å²	86.7	47%	0.471	50%	0.498	S	S	.	.	H	α-helix	trans	-65.4	-39.2	177.5	-64.5	-22.3	0	0	0	111	R267 Y268 T274 T275	R267-D271 VanDerWaalsContact O-CG 3.26Å; R267-D271 PolarHBondContact O-N 2.77Å; Y268-D271 PolarHBondContact O-N 3.1Å; Y268-D271 VanDerWaalsContact O-N 3.15Å; D271-T274 WeakPolarHBondContact CA-OG1 3.34Å; D271-T274 PolarHBondContact O-N 2.8Å; D271-T274 PolarHBondContact O-OG1 2.92Å; D271-T274 VanDerWaalsContact O-OG1 3.13Å; D271-T275 VanDerWaalsContact O-CB 3.31Å; D271-T275 WeakPolarHBondContact O-CB 3.26Å; D271-T275 PolarHBondContact O-N 2.81Å; D271-T275 PolarHBondContact O-OG1 3.43Å
272	E	62.7	Low	61.3	Low	73 Å²	73	93.7 Å²	93.7	34%	0.341	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-44.2	176.2	-167.4	175.1	-176.9	0	0	111.9	Y268 S276	Y268-E272 WeakPolarHBondContact CE1-OE2 3.47Å; Y268-E272 PolarHBondContact O-N 3.4Å; Y268-E272 PolarHBondContact OH-OE2 2.92Å; E272-S276 PolarHBondContact O-N 3.2Å; E272-S276 VanDerWaalsContact O-N 3.12Å; E272-S276 PolarHBondContact O-OG 3.48Å
273	E	61	Low	59.5	Low	133 Å²	133	93.1 Å²	93.1	62%	0.621	54%	0.539	S	S	*	.	H	α-helix	trans	-63.9	-41	175.7	-76.6	177.2	-175.3	0	0	112.2	N269 L270 S276	N269-E273 WeakPolarHBondContact O-CG 3.24Å; N269-E273 PolarHBondContact O-N 2.87Å; L270-E273 PolarHBondContact O-N 3.08Å; E273-S276 PolarHBondContact O-OG 2.93Å
274	T	59.4	Low	57.8	Low	93 Å²	93	97.2 Å²	97.2	57%	0.571	56%	0.561	S	S	*	*	H	α-helix	trans	-72.9	-37	178.9	41.6	0	0	0	0	113.1	L270 D271 S276 A277 G278	L270-T274 WeakPolarHBondContact O-CB 3.43Å; L270-T274 PolarHBondContact O-N 3.15Å; L270-T274 PolarHBondContact O-OG1 3.44Å; D271-T274 WeakPolarHBondContact CA-OG1 3.34Å; D271-T274 PolarHBondContact O-N 2.8Å; D271-T274 PolarHBondContact O-OG1 2.92Å; D271-T274 VanDerWaalsContact O-OG1 3.13Å; T274-S276 VanDerWaalsContact C-N 3.29Å; T274-S276 PolarHBondContact O-N 3.17Å; T274-A277 PolarHBondContact O-N 3.01Å; T274-G278 PolarHBondContact O-N 3.48Å
275	T	52.9	Low	56.3	Low	91 Å²	91	103.8 Å²	103.8	56%	0.558	59%	0.591	S	S	*	*	H	α-helix	trans	-70.4	-26.7	177.2	-45	0	0	0	0	112	D271 A277	D271-T275 VanDerWaalsContact O-CB 3.31Å; D271-T275 WeakPolarHBondContact O-CB 3.26Å; D271-T275 PolarHBondContact O-N 2.81Å; D271-T275 PolarHBondContact O-OG1 3.43Å; T275-A277 PolarHBondContact O-N 3.49Å
276	S	53.3	Low	55	Low	106 Å²	106	105.4 Å²	105.4	74%	0.741	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-9.9	173.1	72.7	0	0	0	0	114.4	E272 E273 T274	E272-S276 PolarHBondContact O-N 3.2Å; E272-S276 VanDerWaalsContact O-N 3.12Å; E272-S276 PolarHBondContact O-OG 3.48Å; E273-S276 PolarHBondContact O-OG 2.93Å; T274-S276 VanDerWaalsContact C-N 3.29Å; T274-S276 PolarHBondContact O-N 3.17Å
277	A	53.8	Low	53.9	Low	91 Å²	91	109.8 Å²	109.8	75%	0.752	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-1.1	-176.1	0	0	0	0	0	115.1	T274 T275	T274-A277 PolarHBondContact O-N 3.01Å; T275-A277 PolarHBondContact O-N 3.49Å
278	G	41.4	Very low	53.3	Low	44 Å²	44	105.7 Å²	105.7	45%	0.454	62%	0.62	S	S	.	*	S	Bend	trans	-145.8	134.9	-177.4	0	0	0	0	0	112.9	T274	T274-G278 PolarHBondContact O-N 3.48Å
279	S	43.1	Very low	53.6	Low	124 Å²	124	104 Å²	104	87%	0.867	62%	0.616	S	S	*	*			trans	-47.7	135.9	178.8	46.7	0	0	0	0	113.5	D281	S279-D281 PolarHBondContact O-N 2.89Å
280	G	50.7	Low	54	Low	69 Å²	69	100.5 Å²	100.5	71%	0.711	60%	0.597	S	S	*	*	S	Bend	trans	-62.8	122.2	-178.2	0	0	0	0	0	113.9
281	D	43.3	Very low	54.4	Low	157 Å²	157	96.4 Å²	96.4	84%	0.84	58%	0.575	S	S	*	*			trans	178.9	85.4	144.4	-102.7	-11.1	0	0	0	106.6	S279	S279-D281 PolarHBondContact O-N 2.89Å
282	D	42.3	Very low	55	Low	158 Å²	158	95.2 Å²	95.2	85%	0.845	57%	0.568	S	S	*	*			trans	176.3	72.7	150.1	-92.1	-17.2	0	0	0	108	D284	D282-D284 PolarHBondContact O-N 3.24Å
283	F	43.6	Very low	56.1	Low	186 Å²	186	91.7 Å²	91.7	82%	0.816	55%	0.551	S	S	*	*			trans	-73.5	85.1	160.1	-93.9	-91.2	0	0	0	107.3	Q285	F283-Q285 PolarHBondContact O-N 3.05Å
284	D	43.3	Very low	57	Low	161 Å²	161	87.4 Å²	87.4	86%	0.861	53%	0.531	S	S	*	.			trans	-66.4	86.6	163.6	-112.2	-15.3	0	0	0	108	D282 G286	D282-D284 PolarHBondContact O-N 3.24Å; D284-G286 PolarHBondContact O-N 3.46Å
285	Q	44.7	Very low	58.1	Low	168 Å²	168	83.6 Å²	83.6	79%	0.785	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	32.2	-170	-158.4	162.5	44.9	0	0	112.5	F283	F283-Q285 PolarHBondContact O-N 3.05Å
286	G	45.2	Very low	59.6	Low	63 Å²	63	79.4 Å²	79.4	65%	0.649	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-38.2	-164	0	0	0	0	0	117	D284	D284-G286 PolarHBondContact O-N 3.46Å
287	D	51.8	Low	61.2	Low	137 Å²	137	74.4 Å²	74.4	73%	0.733	45%	0.447	S	S	*	.	S	Bend	trans	-124.8	-3.4	-154.9	-81.1	-16	0	0	0	117.5
288	N	61.3	Low	62.9	Low	51 Å²	51	70.3 Å²	70.3	27%	0.273	41%	0.412	S	S	.	.			trans	-121.9	47.4	-171.4	-69.7	-31	0	0	0	115	W290 K291	N288-W290 PolarHBondContact O-N 2.91Å; N288-W290 VanDerWaalsContact O-N 3.11Å; N288-K291 HydrophobicContact CB-CB 4.5Å; N288-K291 HydrophobicContact CB-CD 3.76Å; N288-K291 HydrophobicContact CB-CG 4.08Å; N288-K291 PolarHBondContact ND2-NZ 2.67Å; N288-K291 WeakPolarHBondContact O-CB 3.41Å; N288-K291 PolarHBondContact O-N 3.42Å
289	G	71.3	Confident	65.1	Low	8 Å²	8	73.3 Å²	73.3	8%	0.082	41%	0.41	C	S	.	.	H	α-helix	trans	-54.2	-30.8	-178.3	0	0	0	0	0	115.2	K291 I292 L524	G289-K291 VanDerWaalsContact C-N 3.27Å; G289-K291 PolarHBondContact O-N 3.46Å; G289-I292 PolarHBondContact O-N 3.33Å; G289-L524 CarbonylContact C-O 3.52Å
290	W	75.9	Confident	67.4	Low	1 Å²	1	71.7 Å²	71.7	0%	0.004	39%	0.387	C	S	.	.	H	α-helix	trans	-67.7	-24.3	177.3	64.9	-94.3	0	0	0	113.3	L265 N288 I293 Y521 L524 I599 Y600 L603	L265-W290 HydrophobicContact CD2-CH2 4.22Å; N288-W290 PolarHBondContact O-N 2.91Å; N288-W290 VanDerWaalsContact O-N 3.11Å; W290-I293 WeakPolarHBondContact O-CG1 3.33Å; W290-Y521 AromaticContact CD1-CE2 3.97Å; W290-Y521 AromaticContact NE1-CE2 3.92Å; W290-L524 VanDerWaalsContact CA-O 3.24Å; W290-L524 WeakPolarHBondContact CA-O 3.06Å; W290-L524 HydrophobicContact CB-CB 3.61Å; W290-L524 PolarHBondContact N-O 3.49Å; W290-L524 VanDerWaalsContact N-O 3.17Å; W290-I599 HydrophobicContact CE3-CD1 4.07Å; W290-I599 HydrophobicContact CZ3-CB 4.24Å; W290-I599 HydrophobicContact CZ3-CD1 4.35Å; W290-I599 HydrophobicContact CZ3-CG1 4.47Å; W290-Y600 HydrophobicContact CE3-CE1 4.27Å; W290-Y600 PolarHBondContact O-OH 3.32Å; W290-L603 HydrophobicContact CH2-CD1 4.22Å; W290-L603 HydrophobicContact CZ3-CD1 4.02Å
291	K	75.8	Confident	69.3	Low	23 Å²	23	69 Å²	69	10%	0.1	36%	0.358	C	S	.	.	H	α-helix	trans	-76.8	-38.3	179.3	-61.1	-176	-170.7	169	0	112	Y268 N288 G289 I293 H294 L603	Y268-K291 VanDerWaalsContact CB-NZ 3.31Å; Y268-K291 HydrophobicContact CD2-CD 4.25Å; Y268-K291 HydrophobicContact CE2-CD 4.44Å; N288-K291 HydrophobicContact CB-CB 4.5Å; N288-K291 HydrophobicContact CB-CD 3.76Å; N288-K291 HydrophobicContact CB-CG 4.08Å; N288-K291 PolarHBondContact ND2-NZ 2.67Å; N288-K291 WeakPolarHBondContact O-CB 3.41Å; N288-K291 PolarHBondContact O-N 3.42Å; G289-K291 VanDerWaalsContact C-N 3.27Å; G289-K291 PolarHBondContact O-N 3.46Å; K291-I293 PolarHBondContact O-N 2.89Å; K291-H294 WeakPolarHBondContact O-CB 3.29Å; K291-H294 PolarHBondContact O-N 3.47Å; K291-H294 PolarHBondContact O-ND1 3.46Å; K291-L603 HydrophobicContact CD-CD1 4.43Å; K291-L603 HydrophobicContact CG-CD1 4.24Å
292	I	78.9	Confident	71.4	Confident	62 Å²	62	65.8 Å²	65.8	32%	0.318	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-30.2	-178	-59.3	173	0	0	0	111.1	G289	G289-I292 PolarHBondContact O-N 3.33Å
293	I	85.3	Confident	73.7	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	9.5	-177.7	61.2	170.1	0	0	0	114.3	W290 K291 T295 D296 V297 L524 E527	W290-I293 WeakPolarHBondContact O-CG1 3.33Å; K291-I293 PolarHBondContact O-N 2.89Å; I293-T295 PolarHBondContact O-N 2.83Å; I293-D296 PolarHBondContact O-N 3.04Å; I293-V297 HydrophobicContact CB-CG2 4.16Å; I293-V297 HydrophobicContact CD1-CG2 3.79Å; I293-V297 HydrophobicContact CG1-CG2 3.66Å; I293-V297 WeakPolarHBondContact O-CG2 3.49Å; I293-V297 PolarHBondContact O-N 3.41Å; I293-L524 HydrophobicContact CD1-CB 4.3Å; I293-L524 HydrophobicContact CD1-CD2 3.58Å; I293-E527 HydrophobicContact CG2-CB 4.11Å
294	H	80.7	Confident	76	Confident	43 Å²	43	62.4 Å²	62.4	20%	0.199	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.2	-179	70.5	-88.1	0	0	0	113.2	K291 D296 C445 Y600 L603 M605	K291-H294 WeakPolarHBondContact O-CB 3.29Å; K291-H294 PolarHBondContact O-N 3.47Å; K291-H294 PolarHBondContact O-ND1 3.46Å; H294-D296 VanDerWaalsContact C-N 3.32Å; H294-D296 PolarHBondContact O-N 3.34Å; H294-C445 WeakPolarHBondContact O-CB 3.35Å; H294-Y600 HydrophobicContact CB-CD1 3.85Å; H294-Y600 HydrophobicContact CB-CE1 3.59Å; H294-L603 HydrophobicContact CB-CD2 4.23Å; H294-M605 WeakPolarHBondContact CD2-CE 3.49Å; H294-M605 VanDerWaalsContact NE2-CE 3.29Å; H294-M605 WeakPolarHBondContact NE2-CE 3.35Å
295	T	81.3	Confident	78.5	Confident	13 Å²	13	55.4 Å²	55.4	8%	0.08	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-8.6	176.5	56.2	0	0	0	0	115.1	I293 T447 K448	I293-T295 PolarHBondContact O-N 2.83Å; T295-T447 WeakPolarHBondContact O-CA 3.44Å; T295-T447 WeakPolarHBondContact O-CB 3.22Å; T295-K448 HydrophobicContact CG2-CD 4.1Å; T295-K448 HydrophobicContact CG2-CG 4.08Å; T295-K448 PolarHBondContact O-N 3.35Å
296	D	84.6	Confident	80.9	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-16.9	-173.5	-70	-70.2	0	0	0	113.1	I293 H294 F298 R299 Y529	I293-D296 PolarHBondContact O-N 3.04Å; H294-D296 VanDerWaalsContact C-N 3.32Å; H294-D296 PolarHBondContact O-N 3.34Å; D296-F298 VanDerWaalsContact C-N 3.35Å; D296-F298 PolarHBondContact O-N 3.49Å; D296-R299 WeakPolarHBondContact O-CB 3.41Å; D296-R299 PolarHBondContact O-N 3.06Å; D296-R299 VanDerWaalsContact O-N 3.12Å; D296-Y529 HydrophobicContact CB-CD1 3.89Å; D296-Y529 HydrophobicContact CB-CD2 4.21Å; D296-Y529 HydrophobicContact CB-CE1 4.28Å; D296-Y529 HydrophobicContact CB-CG 3.86Å; D296-Y529 WeakPolarHBondContact O-CD2 3.34Å
297	V	86.8	Confident	83.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-38.9	-177.2	174.6	0	0	0	0	113.6	I293 R299 L524 W531 W532 I596 Y600	I293-V297 HydrophobicContact CB-CG2 4.16Å; I293-V297 HydrophobicContact CD1-CG2 3.79Å; I293-V297 HydrophobicContact CG1-CG2 3.66Å; I293-V297 WeakPolarHBondContact O-CG2 3.49Å; I293-V297 PolarHBondContact O-N 3.41Å; V297-R299 VanDerWaalsContact C-N 3.26Å; V297-R299 PolarHBondContact O-N 2.88Å; V297-L524 HydrophobicContact CG2-CD2 4.18Å; V297-W531 PolarHBondContact O-NE1 3.43Å; V297-W532 PolarHBondContact O-NE1 2.83Å; V297-I596 HydrophobicContact CG1-CG2 3.58Å; V297-Y600 HydrophobicContact CB-CE2 4.11Å; V297-Y600 HydrophobicContact CG1-CD2 4.29Å; V297-Y600 HydrophobicContact CG1-CE2 3.7Å; V297-Y600 HydrophobicContact CG2-CE1 4.4Å; V297-Y600 HydrophobicContact CG2-CE2 3.89Å; V297-Y600 WeakPolarHBondContact CG2-OH 3.33Å
298	F	89.4	Confident	85.4	Confident	5 Å²	5	41.1 Å²	41.1	2%	0.022	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	9.8	-179.1	-64.2	-71.1	0	0	0	113.5	D296 F300 F441 A443 P444 C445 T447 I596 R597 Y600	D296-F298 VanDerWaalsContact C-N 3.35Å; D296-F298 PolarHBondContact O-N 3.49Å; F298-F300 PolarHBondContact O-N 3.31Å; F298-F441 AromaticContact CD1-CE1 3.75Å; F298-F441 HydrophobicContact CD1-CE1 3.75Å; F298-F441 HydrophobicContact CD1-CZ 4.02Å; F298-F441 HydrophobicContact CE1-CE1 4.46Å; F298-F441 HydrophobicContact CE1-CZ 4.46Å; F298-F441 HydrophobicContact CG-CE1 4.45Å; F298-A443 HydrophobicContact CB-CB 3.93Å; F298-A443 HydrophobicContact CD1-CB 4.41Å; F298-A443 HydrophobicContact CD2-CB 4.36Å; F298-A443 HydrophobicContact CG-CB 3.97Å; F298-P444 HydrophobicContact CE1-CG 4.45Å; F298-P444 HydrophobicContact CE2-CB 4.18Å; F298-P444 HydrophobicContact CE2-CG 4.05Å; F298-P444 HydrophobicContact CZ-CB 4.35Å; F298-P444 VanDerWaalsContact CZ-CD 3.44Å; F298-P444 HydrophobicContact CZ-CG 3.74Å; F298-C445 HydrophobicContact CD2-CB 4.38Å; F298-T447 HydrophobicContact CB-CG2 4.17Å; F298-I596 HydrophobicContact CE1-CG2 3.77Å; F298-I596 HydrophobicContact CZ-CG2 3.7Å; F298-R597 HydrophobicContact CE1-CG 4.32Å; F298-Y600 HydrophobicContact CE2-CD2 4.06Å; F298-Y600 HydrophobicContact CE2-CG 4.11Å; F298-Y600 HydrophobicContact CZ-CD2 4.05Å; F298-Y600 HydrophobicContact CZ-CG 4.4Å
299	R	88.7	Confident	87.1	Confident	107 Å²	107	38.7 Å²	38.7	40%	0.404	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-66.1	126.5	176.4	-169.7	173.2	-172.4	-158.6	3.2	110.4	D296 V297 W532	D296-R299 WeakPolarHBondContact O-CB 3.41Å; D296-R299 PolarHBondContact O-N 3.06Å; D296-R299 VanDerWaalsContact O-N 3.12Å; V297-R299 VanDerWaalsContact C-N 3.26Å; V297-R299 PolarHBondContact O-N 2.88Å; R299-W532 PolarHBondContact O-NE1 3.34Å
300	F	90.3	Very high	88.4	Confident	90 Å²	90	38.8 Å²	38.8	40%	0.395	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-63.3	139.7	-176.9	-59.7	-45.3	0	0	0	112	F298 I367 F441 W532	F298-F300 PolarHBondContact O-N 3.31Å; F300-I367 HydrophobicContact CD1-CB 3.73Å; F300-I367 HydrophobicContact CD1-CG2 3.77Å; F300-I367 HydrophobicContact CE1-CB 3.78Å; F300-I367 HydrophobicContact CE1-CG2 3.67Å; F300-I367 HydrophobicContact CG-CB 4.17Å; F300-I367 HydrophobicContact CZ-CB 4.24Å; F300-I367 HydrophobicContact CZ-CG2 4.48Å; F300-F441 HydrophobicContact CE1-CB 4.29Å; F300-F441 HydrophobicContact CE1-CD1 4.13Å; F300-F441 HydrophobicContact CE1-CG 4.21Å; F300-F441 HydrophobicContact CZ-CB 4.26Å; F300-W532 HydrophobicContact CD1-CH2 4.23Å; F300-W532 HydrophobicContact CD1-CZ2 4.32Å
301	P	90.1	Very high	89.4	Confident	14 Å²	14	38.8 Å²	38.8	9%	0.091	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-76.4	159.3	-174.7	30.8	-35.1	0	0	0	112.3	L307 W532	P301-L307 HydrophobicContact CG-CD2 3.66Å; P301-W532 HydrophobicContact CB-CB 3.73Å; P301-W532 HydrophobicContact CB-CG 3.94Å; P301-W532 HydrophobicContact CG-CB 3.77Å; P301-W532 HydrophobicContact CG-CD2 3.89Å; P301-W532 HydrophobicContact CG-CE3 4Å; P301-W532 HydrophobicContact CG-CG 3.78Å
302	P	87.7	Confident	90.4	Very high	89 Å²	89	37.7 Å²	37.7	58%	0.578	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	152.5	166	29.5	-35.1	0	0	0	110.1	R304 W533	P302-R304 PolarHBondContact O-N 3.35Å; P302-W533 PolarHBondContact O-NE1 3.03Å
303	Y	91.8	Very high	91.3	Very high	182 Å²	182	34.8 Å²	34.8	71%	0.714	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	41.7	179.5	-49.4	-70.6	0	0	0	114.7	G305 L306 L307	Y303-G305 PolarHBondContact O-N 3.49Å; Y303-L306 PolarHBondContact O-N 2.83Å; Y303-L307 PolarHBondContact O-N 3.04Å
304	R	91.9	Very high	91.9	Very high	90 Å²	90	34.8 Å²	34.8	34%	0.34	16%	0.163	S	C	.	.	H	α-helix	trans	-46	-35.9	178	59.5	177.8	176	-178.1	2.5	115.6	P302 C308 Y364 I367 G368	P302-R304 PolarHBondContact O-N 3.35Å; R304-C308 PolarHBondContact O-N 2.94Å; R304-C308 VanDerWaalsContact O-N 3.11Å; R304-C308 PolarHBondContact O-SG 3.32Å; R304-Y364 HydrophobicContact CG-CE2 4.08Å; R304-I367 HydrophobicContact CB-CD1 3.63Å; R304-I367 HydrophobicContact CB-CG1 4.25Å; R304-I367 PolarHBondContact NH1-O 3.35Å; R304-I367 VanDerWaalsContact NH1-O 3.11Å; R304-G368 PolarHBondContact NH1-O 3.27Å; R304-G368 PolarHBondContact NH2-O 2.96Å
305	G	94.3	Very high	92.7	Very high	15 Å²	15	33.4 Å²	33.4	16%	0.155	16%	0.159	C	C	.	.	H	α-helix	trans	-66.6	-41.3	177.1	0	0	0	0	0	113.3	Y303 C308 A309 N375	Y303-G305 PolarHBondContact O-N 3.49Å; G305-C308 PolarHBondContact O-N 2.84Å; G305-A309 WeakPolarHBondContact O-CB 3.4Å; G305-A309 PolarHBondContact O-N 3.35Å; G305-N375 WeakPolarHBondContact CA-OD1 3.49Å; G305-N375 PolarHBondContact O-OD1 3.05Å; G305-N375 VanDerWaalsContact O-OD1 3.07Å
306	L	95.8	Very high	93.4	Very high	68 Å²	68	33 Å²	33	36%	0.356	16%	0.156	S	C	.	.	H	α-helix	trans	-66.4	-40.9	177.5	-175.7	67.5	0	0	0	111.2	Y303 A309 V310 L378 L382 W533	Y303-L306 PolarHBondContact O-N 2.83Å; L306-A309 PolarHBondContact O-N 2.91Å; L306-V310 WeakPolarHBondContact O-CG2 3.05Å; L306-V310 PolarHBondContact O-N 2.97Å; L306-L378 HydrophobicContact CB-CD2 4.23Å; L306-L378 HydrophobicContact CD1-CD1 4.38Å; L306-L378 HydrophobicContact CD1-CD2 4.25Å; L306-L382 HydrophobicContact CD1-CD1 4Å; L306-W533 HydrophobicContact CB-CH2 3.95Å; L306-W533 HydrophobicContact CB-CZ2 4.26Å; L306-W533 HydrophobicContact CD2-CH2 3.79Å; L306-W533 HydrophobicContact CD2-CZ2 4.36Å; L306-W533 HydrophobicContact CG-CH2 3.77Å; L306-W533 HydrophobicContact CG-CZ2 4.48Å
307	L	96.2	Very high	94	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.7	-49.9	176.6	-176.2	67.7	0	0	0	110.7	P301 Y303 A309 V310 L311 W532 W533 V536 F589	P301-L307 HydrophobicContact CG-CD2 3.66Å; Y303-L307 PolarHBondContact O-N 3.04Å; L307-A309 VanDerWaalsContact C-N 3.32Å; L307-A309 PolarHBondContact O-N 3.38Å; L307-V310 PolarHBondContact O-N 3.33Å; L307-L311 HydrophobicContact CG-CD1 4.22Å; L307-L311 VanDerWaalsContact O-CG 3.28Å; L307-L311 WeakPolarHBondContact O-CG 3.09Å; L307-L311 PolarHBondContact O-N 3.21Å; L307-W532 HydrophobicContact CD2-CB 4.34Å; L307-W532 HydrophobicContact CD2-CE3 3.92Å; L307-W533 HydrophobicContact CB-CH2 3.83Å; L307-W533 HydrophobicContact CB-CZ2 3.68Å; L307-W533 HydrophobicContact CD1-CD2 4.21Å; L307-W533 HydrophobicContact CD1-CE3 4.02Å; L307-W533 HydrophobicContact CD1-CH2 4.17Å; L307-W533 HydrophobicContact CD1-CZ2 4.37Å; L307-W533 HydrophobicContact CD1-CZ3 4Å; L307-V536 HydrophobicContact CD1-CG2 3.75Å; L307-F589 HydrophobicContact CD2-CE2 4.12Å; L307-F589 HydrophobicContact CD2-CZ 4.42Å
308	C	96.1	Very high	94.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-41.1	177.6	-67.8	0	0	0	0	112.7	R304 G305 L311 G312 S360 Y364 I367	R304-C308 PolarHBondContact O-N 2.94Å; R304-C308 VanDerWaalsContact O-N 3.11Å; R304-C308 PolarHBondContact O-SG 3.32Å; G305-C308 PolarHBondContact O-N 2.84Å; C308-L311 PolarHBondContact O-N 3.17Å; C308-G312 PolarHBondContact O-N 3.22Å; C308-S360 WeakPolarHBondContact O-CA 3.36Å; C308-S360 WeakPolarHBondContact O-CB 2.94Å; C308-S360 PolarHBondContact O-OG 3.46Å; C308-Y364 HydrophobicContact CB-CD2 4.34Å; C308-Y364 WeakPolarHBondContact SG-CA 3.49Å; C308-Y364 PolarHBondContact SG-N 3Å; C308-I367 WeakPolarHBondContact SG-CD1 3.32Å
309	A	97.2	Very high	94.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-47	174.9	0	0	0	0	0	111.9	G305 L306 L307 L311 G312 V313 L378 T379 L382	G305-A309 WeakPolarHBondContact O-CB 3.4Å; G305-A309 PolarHBondContact O-N 3.35Å; L306-A309 PolarHBondContact O-N 2.91Å; L307-A309 VanDerWaalsContact C-N 3.32Å; L307-A309 PolarHBondContact O-N 3.38Å; A309-L311 VanDerWaalsContact C-N 3.33Å; A309-L311 PolarHBondContact O-N 3.5Å; A309-G312 PolarHBondContact O-N 3.16Å; A309-V313 WeakPolarHBondContact O-CG2 3.37Å; A309-V313 PolarHBondContact O-N 3.12Å; A309-L378 HydrophobicContact CB-CB 4.45Å; A309-L378 HydrophobicContact CB-CD2 4.09Å; A309-L378 HydrophobicContact CB-CG 3.9Å; A309-T379 WeakPolarHBondContact CA-OG1 3.44Å; A309-L382 HydrophobicContact CB-CD2 4.21Å
310	V	97.6	Very high	95	Very high	10 Å²	10	32.4 Å²	32.4	6%	0.061	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-46.2	175.4	168.1	0	0	0	0	110.9	L306 L307 G312 V313 G314 L382 V536 L582 T586	L306-V310 WeakPolarHBondContact O-CG2 3.05Å; L306-V310 PolarHBondContact O-N 2.97Å; L307-V310 PolarHBondContact O-N 3.33Å; V310-G312 PolarHBondContact O-N 3.2Å; V310-V313 PolarHBondContact O-N 2.83Å; V310-G314 PolarHBondContact O-N 2.92Å; V310-L382 HydrophobicContact CB-CD2 4.29Å; V310-L382 HydrophobicContact CG2-CD2 3.72Å; V310-V536 HydrophobicContact CG1-CG1 3.93Å; V310-L582 HydrophobicContact CB-CD2 4.37Å; V310-L582 HydrophobicContact CG1-CD2 3.84Å; V310-L582 HydrophobicContact CG2-CD2 4.2Å; V310-T586 PolarHBondContact O-OG1 3.15Å
311	L	97.3	Very high	95.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-41.3	179.4	-64.5	175.9	0	0	0	112.5	L307 C308 A309 A315 F363 V536 T586 F589	L307-L311 HydrophobicContact CG-CD1 4.22Å; L307-L311 VanDerWaalsContact O-CG 3.28Å; L307-L311 WeakPolarHBondContact O-CG 3.09Å; L307-L311 PolarHBondContact O-N 3.21Å; C308-L311 PolarHBondContact O-N 3.17Å; A309-L311 VanDerWaalsContact C-N 3.33Å; A309-L311 PolarHBondContact O-N 3.5Å; L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.26Å; L311-A315 PolarHBondContact O-N 3.23Å; L311-F363 HydrophobicContact CD1-CD1 3.82Å; L311-F363 HydrophobicContact CD1-CE1 3.96Å; L311-V536 HydrophobicContact CD2-CG2 4.44Å; L311-T586 WeakPolarHBondContact CA-OG1 3.15Å; L311-T586 HydrophobicContact CD2-CG2 4.23Å; L311-T586 PolarHBondContact O-OG1 2.82Å; L311-F589 HydrophobicContact CD1-CD1 3.47Å; L311-F589 VanDerWaalsContact CD1-CD1 3.47Å; L311-F589 HydrophobicContact CD1-CE1 3.41Å; L311-F589 VanDerWaalsContact CD1-CE1 3.41Å; L311-F589 HydrophobicContact CD1-CG 4.09Å; L311-F589 HydrophobicContact CD1-CZ 4Å; L311-F589 HydrophobicContact CD2-CB 3.59Å; L311-F589 HydrophobicContact CD2-CD1 3.51Å; L311-F589 HydrophobicContact CD2-CD2 4.45Å; L311-F589 HydrophobicContact CD2-CE1 4.35Å; L311-F589 HydrophobicContact CD2-CG 3.58Å; L311-F589 HydrophobicContact CG-CD1 4.14Å; L311-F589 HydrophobicContact CG-CG 4.45Å
312	G	97.2	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-52.8	175.9	0	0	0	0	0	112.2	C308 A309 V310 G314 A315 Q316 S356	C308-G312 PolarHBondContact O-N 3.22Å; A309-G312 PolarHBondContact O-N 3.16Å; V310-G312 PolarHBondContact O-N 3.2Å; G312-G314 PolarHBondContact O-N 2.84Å; G312-A315 PolarHBondContact O-N 3.01Å; G312-Q316 PolarHBondContact O-N 3.37Å; G312-S356 WeakPolarHBondContact CA-O 3.47Å; G312-S356 WeakPolarHBondContact O-CA 3.43Å; G312-S356 PolarHBondContact O-OG 3.09Å
313	V	97.7	Very high	95.3	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-41.5	-179.5	179.2	0	0	0	0	111.4	A309 V310 A315 Q316 F317 S356 T379 L382 F383 L582	A309-V313 WeakPolarHBondContact O-CG2 3.37Å; A309-V313 PolarHBondContact O-N 3.12Å; V310-V313 PolarHBondContact O-N 2.83Å; V313-A315 VanDerWaalsContact C-N 3.32Å; V313-A315 PolarHBondContact O-N 3.37Å; V313-Q316 WeakPolarHBondContact O-CB 3.33Å; V313-Q316 PolarHBondContact O-N 3.42Å; V313-F317 HydrophobicContact CG1-CD2 3.73Å; V313-F317 HydrophobicContact CG1-CE2 3.39Å; V313-F317 HydrophobicContact CG1-CZ 4.36Å; V313-F317 WeakPolarHBondContact O-CD2 3.49Å; V313-F317 PolarHBondContact O-N 3.08Å; V313-S356 PolarHBondContact N-OG 3.43Å; V313-T379 HydrophobicContact CG2-CG2 3.92Å; V313-T379 WeakPolarHBondContact CG2-O 3.38Å; V313-L382 HydrophobicContact CB-CD2 4.35Å; V313-L382 HydrophobicContact CG2-CB 4.27Å; V313-L382 HydrophobicContact CG2-CD2 4.07Å; V313-F383 HydrophobicContact CG1-CB 3.95Å; V313-L582 HydrophobicContact CB-CD1 4.38Å; V313-L582 HydrophobicContact CG1-CD1 3.65Å
314	G	97.3	Very high	95.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-35.2	175.6	0	0	0	0	0	113.1	V310 G312 F317 L318 L582 T586	V310-G314 PolarHBondContact O-N 2.92Å; G312-G314 PolarHBondContact O-N 2.84Å; G314-F317 PolarHBondContact O-N 2.99Å; G314-L318 WeakPolarHBondContact O-CB 3.36Å; G314-L318 PolarHBondContact O-N 3.31Å; G314-L582 WeakPolarHBondContact CA-O 3.27Å; G314-T586 WeakPolarHBondContact CA-OG1 3.38Å
315	A	97.5	Very high	95	Very high	13 Å²	13	17.9 Å²	17.9	11%	0.107	12%	0.115	C	C	.	.	H	α-helix	trans	-68.1	-37.3	173.8	0	0	0	0	0	112.4	L311 G312 V313 L318 A319 I355 V359 T586	L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.26Å; L311-A315 PolarHBondContact O-N 3.23Å; G312-A315 PolarHBondContact O-N 3.01Å; V313-A315 VanDerWaalsContact C-N 3.32Å; V313-A315 PolarHBondContact O-N 3.37Å; A315-L318 PolarHBondContact O-N 2.71Å; A315-A319 WeakPolarHBondContact O-CB 3.48Å; A315-A319 PolarHBondContact O-N 3.41Å; A315-I355 HydrophobicContact CB-CG2 4.38Å; A315-V359 HydrophobicContact CB-CB 4.29Å; A315-V359 HydrophobicContact CB-CG1 4.18Å; A315-V359 HydrophobicContact CB-CG2 4.05Å; A315-T586 HydrophobicContact CB-CG2 4.33Å
316	Q	96.9	Very high	94.7	Very high	6 Å²	6	20 Å²	20	3%	0.028	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-47.9	171.4	169.7	-177.7	7	0	0	111.5	G312 V313 L318 A319 L320 Y349 C353 S356	G312-Q316 PolarHBondContact O-N 3.37Å; V313-Q316 WeakPolarHBondContact O-CB 3.33Å; V313-Q316 PolarHBondContact O-N 3.42Å; Q316-L318 VanDerWaalsContact C-N 3.33Å; Q316-L318 PolarHBondContact O-N 2.97Å; Q316-A319 PolarHBondContact O-N 2.84Å; Q316-L320 WeakPolarHBondContact O-CB 3.18Å; Q316-L320 PolarHBondContact O-N 3.06Å; Q316-Y349 PolarHBondContact NE2-O 3.39Å; Q316-C353 PolarHBondContact NE2-SG 3.15Å; Q316-C353 VanDerWaalsContact NE2-SG 3.37Å; Q316-S356 VanDerWaalsContact OE1-CB 3.23Å; Q316-S356 PolarHBondContact OE1-OG 3.41Å
317	F	96.4	Very high	94.2	Very high	12 Å²	12	18.3 Å²	18.3	5%	0.053	12%	0.115	C	C	.	.	H	α-helix	trans	-65.7	-35.6	178.9	-76	-52.6	0	0	0	113.3	V313 G314 A319 L320 G321 Y349 F383 V579 L582 M583	V313-F317 HydrophobicContact CG1-CD2 3.73Å; V313-F317 HydrophobicContact CG1-CE2 3.39Å; V313-F317 HydrophobicContact CG1-CZ 4.36Å; V313-F317 WeakPolarHBondContact O-CD2 3.49Å; V313-F317 PolarHBondContact O-N 3.08Å; G314-F317 PolarHBondContact O-N 2.99Å; F317-A319 VanDerWaalsContact C-N 3.35Å; F317-L320 HydrophobicContact CD1-CD2 4.01Å; F317-L320 HydrophobicContact CE1-CD2 4.3Å; F317-L320 PolarHBondContact O-N 3.37Å; F317-G321 PolarHBondContact O-N 3.03Å; F317-Y349 HydrophobicContact CE1-CD2 4.5Å; F317-Y349 HydrophobicContact CE1-CE2 4.05Å; F317-Y349 HydrophobicContact CZ-CE2 4.4Å; F317-F383 HydrophobicContact CE1-CE1 4.32Å; F317-F383 HydrophobicContact CE1-CE2 4.49Å; F317-F383 HydrophobicContact CE1-CZ 4.29Å; F317-F383 HydrophobicContact CE2-CB 4.22Å; F317-F383 HydrophobicContact CE2-CD1 4.4Å; F317-F383 AromaticContact CE2-CD2 3.73Å; F317-F383 HydrophobicContact CE2-CD2 3.73Å; F317-F383 HydrophobicContact CE2-CE2 4.17Å; F317-F383 AromaticContact CE2-CG 3.85Å; F317-F383 HydrophobicContact CE2-CG 3.85Å; F317-F383 HydrophobicContact CZ-CB 4.26Å; F317-F383 AromaticContact CZ-CD1 3.62Å; F317-F383 HydrophobicContact CZ-CD1 3.62Å; F317-F383 AromaticContact CZ-CD2 3.49Å; F317-F383 HydrophobicContact CZ-CD2 3.49Å; F317-F383 VanDerWaalsContact CZ-CD2 3.49Å; F317-F383 AromaticContact CZ-CE1 3.71Å; F317-F383 HydrophobicContact CZ-CE1 3.71Å; F317-F383 AromaticContact CZ-CE2 3.6Å; F317-F383 HydrophobicContact CZ-CE2 3.6Å; F317-F383 AromaticContact CZ-CG 3.5Å; F317-F383 HydrophobicContact CZ-CG 3.5Å; F317-F383 VanDerWaalsContact CZ-CG 3.5Å; F317-F383 AromaticContact CZ-CZ 3.7Å; F317-F383 HydrophobicContact CZ-CZ 3.7Å; F317-V579 HydrophobicContact CB-CG1 4.11Å; F317-V579 HydrophobicContact CD1-CG1 3.84Å; F317-V579 HydrophobicContact CD1-CG2 4.45Å; F317-V579 HydrophobicContact CD2-CG1 4.07Å; F317-V579 HydrophobicContact CD2-CG2 4.44Å; F317-V579 HydrophobicContact CE1-CG1 4.28Å; F317-V579 HydrophobicContact CE1-CG2 4.06Å; F317-V579 HydrophobicContact CE2-CG1 4.46Å; F317-V579 HydrophobicContact CE2-CG2 4.03Å; F317-V579 HydrophobicContact CG-CG1 3.76Å; F317-V579 HydrophobicContact CZ-CG2 3.85Å; F317-L582 HydrophobicContact CD2-CB 4.5Å; F317-L582 HydrophobicContact CD2-CD1 4.39Å; F317-L582 HydrophobicContact CE2-CD1 4.09Å; F317-M583 HydrophobicContact CB-CB 4.35Å
318	L	95.9	Very high	93.5	Very high	39 Å²	39	18.6 Å²	18.6	20%	0.204	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-45.9	172.3	-173.8	72.5	0	0	0	111.4	G314 A315 Q316 T322 F505 L509 M583 I587	G314-L318 WeakPolarHBondContact O-CB 3.36Å; G314-L318 PolarHBondContact O-N 3.31Å; A315-L318 PolarHBondContact O-N 2.71Å; Q316-L318 VanDerWaalsContact C-N 3.33Å; Q316-L318 PolarHBondContact O-N 2.97Å; L318-T322 WeakPolarHBondContact O-CB 3.41Å; L318-T322 PolarHBondContact O-N 3.03Å; L318-T322 PolarHBondContact O-OG1 2.94Å; L318-F505 HydrophobicContact CD1-CZ 4.06Å; L318-L509 HydrophobicContact CD1-CD1 3.73Å; L318-L509 HydrophobicContact CD1-CD2 3.76Å; L318-L509 HydrophobicContact CD1-CG 4.42Å; L318-M583 HydrophobicContact CB-CG 4.1Å; L318-M583 HydrophobicContact CD1-CG 3.97Å; L318-M583 HydrophobicContact CD1-SD 4.22Å; L318-I587 HydrophobicContact CD1-CD1 3.91Å; L318-I587 HydrophobicContact CD1-CG1 4.16Å; L318-I587 HydrophobicContact CD2-CD1 3.61Å; L318-I587 HydrophobicContact CD2-CG1 4.35Å; L318-I587 HydrophobicContact CG-CD1 4.42Å
319	A	95.6	Very high	92.9	Very high	29 Å²	29	22.3 Å²	22.3	24%	0.24	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-41.6	177.2	0	0	0	0	0	112.1	A315 Q316 F317 G323 T352 I355	A315-A319 WeakPolarHBondContact O-CB 3.48Å; A315-A319 PolarHBondContact O-N 3.41Å; Q316-A319 PolarHBondContact O-N 2.84Å; F317-A319 VanDerWaalsContact C-N 3.35Å; A319-G323 PolarHBondContact O-N 3.4Å; A319-T352 HydrophobicContact CB-CG2 4.13Å; A319-I355 HydrophobicContact CB-CD1 3.51Å
320	L	94.1	Very high	92.3	Very high	21 Å²	21	28.2 Å²	28.2	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-52.4	176	179.9	65.8	0	0	0	111.3	Q316 F317 T322 G323 I324 L348 Y349	Q316-L320 WeakPolarHBondContact O-CB 3.18Å; Q316-L320 PolarHBondContact O-N 3.06Å; F317-L320 HydrophobicContact CD1-CD2 4.01Å; F317-L320 HydrophobicContact CE1-CD2 4.3Å; F317-L320 PolarHBondContact O-N 3.37Å; L320-T322 PolarHBondContact O-N 3.5Å; L320-G323 PolarHBondContact O-N 2.87Å; L320-I324 HydrophobicContact CD1-CD1 3.98Å; L320-I324 HydrophobicContact CD1-CG1 4.31Å; L320-I324 HydrophobicContact CG-CD1 3.99Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.17Å; L320-L348 HydrophobicContact CD1-CB 3.85Å; L320-L348 HydrophobicContact CD1-CD2 3.74Å; L320-L348 HydrophobicContact CD1-CG 3.66Å; L320-Y349 HydrophobicContact CD2-CD2 3.94Å
321	G	91.9	Very high	91.2	Very high	20 Å²	20	30.5 Å²	30.5	21%	0.206	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-45.8	179.5	0	0	0	0	0	111.9	F317 G323 I324 I325	F317-G321 PolarHBondContact O-N 3.03Å; G321-G323 PolarHBondContact O-N 2.91Å; G321-I324 PolarHBondContact O-N 2.79Å; G321-I325 VanDerWaalsContact O-CG1 3.28Å; G321-I325 WeakPolarHBondContact O-CG1 3.24Å; G321-I325 PolarHBondContact O-N 3.48Å; G321-I325 VanDerWaalsContact O-N 3.08Å
322	T	92.4	Very high	90	Very high	56 Å²	56	35.9 Å²	35.9	34%	0.344	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-44.8	175.4	-52.7	0	0	0	0	111.3	L318 L320 I325 V326	L318-T322 WeakPolarHBondContact O-CB 3.41Å; L318-T322 PolarHBondContact O-N 3.03Å; L318-T322 PolarHBondContact O-OG1 2.94Å; L320-T322 PolarHBondContact O-N 3.5Å; T322-I325 PolarHBondContact O-N 2.88Å; T322-V326 HydrophobicContact CG2-CG2 4.36Å; T322-V326 WeakPolarHBondContact O-CB 3.23Å; T322-V326 VanDerWaalsContact O-CG2 3.27Å; T322-V326 WeakPolarHBondContact O-CG2 3.38Å; T322-V326 PolarHBondContact O-N 3.11Å
323	G	91.1	Very high	88.6	Confident	20 Å²	20	37 Å²	37	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-44.7	179.9	0	0	0	0	0	113.1	A319 L320 G321 V326 M327	A319-G323 PolarHBondContact O-N 3.4Å; L320-G323 PolarHBondContact O-N 2.87Å; G321-G323 PolarHBondContact O-N 2.91Å; G323-V326 PolarHBondContact O-N 3.38Å; G323-M327 WeakPolarHBondContact O-CB 3.37Å; G323-M327 WeakPolarHBondContact O-CE 3.49Å; G323-M327 WeakPolarHBondContact O-CG 3.33Å; G323-M327 PolarHBondContact O-N 3.27Å
324	I	88.3	Confident	86.8	Confident	51 Å²	51	40.6 Å²	40.6	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-47.3	176.8	-67	173.1	0	0	0	110.2	L320 G321 V326 M327 A328 A345 L348	L320-I324 HydrophobicContact CD1-CD1 3.98Å; L320-I324 HydrophobicContact CD1-CG1 4.31Å; L320-I324 HydrophobicContact CG-CD1 3.99Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.17Å; G321-I324 PolarHBondContact O-N 2.79Å; I324-V326 PolarHBondContact O-N 3.36Å; I324-M327 PolarHBondContact O-N 3.17Å; I324-A328 WeakPolarHBondContact O-CB 3.39Å; I324-A328 PolarHBondContact O-N 3.48Å; I324-A345 HydrophobicContact CD1-CB 4.25Å; I324-L348 HydrophobicContact CG1-CD2 3.84Å
325	I	87.8	Confident	84.8	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.072	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-44.4	-179.4	-65.1	168.1	0	0	0	110.8	G321 T322 A328 L329 L501 F502 F505	G321-I325 VanDerWaalsContact O-CG1 3.28Å; G321-I325 WeakPolarHBondContact O-CG1 3.24Å; G321-I325 PolarHBondContact O-N 3.48Å; G321-I325 VanDerWaalsContact O-N 3.08Å; T322-I325 PolarHBondContact O-N 2.88Å; I325-A328 WeakPolarHBondContact O-CB 3.5Å; I325-A328 PolarHBondContact O-N 3.12Å; I325-L329 HydrophobicContact CG2-CD1 4.27Å; I325-L329 HydrophobicContact CG2-CG 4.39Å; I325-L329 WeakPolarHBondContact O-CG 3.22Å; I325-L329 PolarHBondContact O-N 3.17Å; I325-L501 HydrophobicContact CD1-CG 4.41Å; I325-L501 HydrophobicContact CG1-CD2 4.28Å; I325-L501 HydrophobicContact CG1-CG 4.46Å; I325-F502 HydrophobicContact CG2-CB 3.6Å; I325-F502 HydrophobicContact CG2-CD2 3.69Å; I325-F502 HydrophobicContact CG2-CG 4.13Å; I325-F505 HydrophobicContact CD1-CB 3.79Å; I325-F505 HydrophobicContact CD1-CD1 3.89Å; I325-F505 HydrophobicContact CD1-CD2 4.12Å; I325-F505 HydrophobicContact CD1-CE1 4.49Å; I325-F505 HydrophobicContact CD1-CG 3.67Å
326	V	88.4	Confident	82.6	Confident	60 Å²	60	45.4 Å²	45.4	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-44	178.3	170.3	0	0	0	0	111.6	T322 G323 I324 A328 L329 L330	T322-V326 HydrophobicContact CG2-CG2 4.36Å; T322-V326 WeakPolarHBondContact O-CB 3.23Å; T322-V326 VanDerWaalsContact O-CG2 3.27Å; T322-V326 WeakPolarHBondContact O-CG2 3.38Å; T322-V326 PolarHBondContact O-N 3.11Å; G323-V326 PolarHBondContact O-N 3.38Å; I324-V326 PolarHBondContact O-N 3.36Å; V326-A328 VanDerWaalsContact C-N 3.27Å; V326-A328 PolarHBondContact O-N 3.47Å; V326-L329 PolarHBondContact O-N 2.71Å; V326-L330 HydrophobicContact CG1-CD1 4.17Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.37Å
327	M	85.3	Confident	80.8	Confident	32 Å²	32	51.6 Å²	51.6	16%	0.158	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-36.6	175.2	-73.4	-171.9	-69.1	0	0	112.1	G323 I324 L330 G331 M332 F333 L348	G323-M327 WeakPolarHBondContact O-CB 3.37Å; G323-M327 WeakPolarHBondContact O-CE 3.49Å; G323-M327 WeakPolarHBondContact O-CG 3.33Å; G323-M327 PolarHBondContact O-N 3.27Å; I324-M327 PolarHBondContact O-N 3.17Å; M327-L330 PolarHBondContact O-N 2.87Å; M327-G331 PolarHBondContact O-N 3.31Å; M327-M332 HydrophobicContact CB-CB 4.42Å; M327-M332 HydrophobicContact CB-SD 4.06Å; M327-M332 HydrophobicContact CG-CE 4.45Å; M327-M332 HydrophobicContact CG-SD 3.79Å; M327-M332 WeakPolarHBondContact O-CB 3.47Å; M327-M332 PolarHBondContact O-N 2.99Å; M327-M332 VanDerWaalsContact O-N 3.1Å; M327-M332 HydrophobicContact SD-CE 4.46Å; M327-F333 HydrophobicContact CB-CE2 3.65Å; M327-F333 HydrophobicContact CB-CZ 3.67Å; M327-F333 HydrophobicContact CE-CZ 4Å; M327-F333 HydrophobicContact SD-CZ 4.34Å; M327-L348 HydrophobicContact CE-CB 4.36Å; M327-L348 HydrophobicContact CE-CD1 4.47Å; M327-L348 HydrophobicContact CE-CD2 3.45Å; M327-L348 VanDerWaalsContact CE-CD2 3.45Å; M327-L348 HydrophobicContact CE-CG 4.3Å
328	A	81.5	Confident	78.9	Confident	6 Å²	6	52.8 Å²	52.8	5%	0.05	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-41.2	175.8	0	0	0	0	0	112.3	I324 I325 V326 L330 G331 F333 Y498	I324-A328 WeakPolarHBondContact O-CB 3.39Å; I324-A328 PolarHBondContact O-N 3.48Å; I325-A328 WeakPolarHBondContact O-CB 3.5Å; I325-A328 PolarHBondContact O-N 3.12Å; V326-A328 VanDerWaalsContact C-N 3.27Å; V326-A328 PolarHBondContact O-N 3.47Å; A328-L330 VanDerWaalsContact C-N 3.31Å; A328-L330 PolarHBondContact O-N 3.15Å; A328-G331 PolarHBondContact O-N 2.97Å; A328-F333 HydrophobicContact CB-CD2 3.74Å; A328-F333 HydrophobicContact CB-CE2 3.96Å; A328-Y498 HydrophobicContact CB-CD1 3.6Å; A328-Y498 HydrophobicContact CB-CD2 3.98Å; A328-Y498 HydrophobicContact CB-CE1 3.99Å; A328-Y498 HydrophobicContact CB-CE2 4.33Å; A328-Y498 HydrophobicContact CB-CG 3.6Å
329	L	83.3	Confident	77.4	Confident	77 Å²	77	51.3 Å²	51.3	40%	0.403	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-36.8	174.5	-71.4	174.8	0	0	0	112.8	I325 V326 G331 F502	I325-L329 HydrophobicContact CG2-CD1 4.27Å; I325-L329 HydrophobicContact CG2-CG 4.39Å; I325-L329 WeakPolarHBondContact O-CG 3.22Å; I325-L329 PolarHBondContact O-N 3.17Å; V326-L329 PolarHBondContact O-N 2.71Å; L329-G331 PolarHBondContact O-N 3.47Å; L329-F502 HydrophobicContact CD1-CB 3.93Å; L329-F502 HydrophobicContact CD1-CD1 4.43Å; L329-F502 HydrophobicContact CD1-CD2 3.89Å; L329-F502 HydrophobicContact CD1-CG 3.82Å; L329-F502 HydrophobicContact CD2-CB 4.47Å
330	L	84	Confident	76.3	Confident	125 Å²	125	51.6 Å²	51.6	65%	0.654	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-1.3	175.7	-66.5	175	0	0	0	113.2	V326 M327 A328 M332	V326-L330 HydrophobicContact CG1-CD1 4.17Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.37Å; M327-L330 PolarHBondContact O-N 2.87Å; A328-L330 VanDerWaalsContact C-N 3.31Å; A328-L330 PolarHBondContact O-N 3.15Å; L330-M332 HydrophobicContact CB-CG 4.01Å; L330-M332 HydrophobicContact CB-SD 4.39Å; L330-M332 HydrophobicContact CD1-SD 4.33Å; L330-M332 PolarHBondContact O-N 3.04Å
331	G	74.8	Confident	75.4	Confident	57 Å²	57	53.6 Å²	53.6	59%	0.588	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	21.1	-179.8	0	0	0	0	0	113.7	M327 A328 L329 F333	M327-G331 PolarHBondContact O-N 3.31Å; A328-G331 PolarHBondContact O-N 2.97Å; L329-G331 PolarHBondContact O-N 3.47Å; G331-F333 PolarHBondContact O-N 2.91Å
332	M	73.2	Confident	74.7	Confident	114 Å²	114	55.5 Å²	55.5	56%	0.562	31%	0.307	S	S	*	.			trans	-68.6	-21.4	-179.5	-64.2	179.5	65.2	0	0	112.3	M327 L330	M327-M332 HydrophobicContact CB-CB 4.42Å; M327-M332 HydrophobicContact CB-SD 4.06Å; M327-M332 HydrophobicContact CG-CE 4.45Å; M327-M332 HydrophobicContact CG-SD 3.79Å; M327-M332 WeakPolarHBondContact O-CB 3.47Å; M327-M332 PolarHBondContact O-N 2.99Å; M327-M332 VanDerWaalsContact O-N 3.1Å; M327-M332 HydrophobicContact SD-CE 4.46Å; L330-M332 HydrophobicContact CB-CG 4.01Å; L330-M332 HydrophobicContact CB-SD 4.39Å; L330-M332 HydrophobicContact CD1-SD 4.33Å; L330-M332 PolarHBondContact O-N 3.04Å
333	F	67.4	Low	74.1	Confident	23 Å²	23	55 Å²	55	10%	0.101	31%	0.306	C	S	.	.	S	Bend	trans	-93.1	118.2	175.4	-56.2	-53.6	0	0	0	111	M327 A328 G331 V335 I341 A344	M327-F333 HydrophobicContact CB-CE2 3.65Å; M327-F333 HydrophobicContact CB-CZ 3.67Å; M327-F333 HydrophobicContact CE-CZ 4Å; M327-F333 HydrophobicContact SD-CZ 4.34Å; A328-F333 HydrophobicContact CB-CD2 3.74Å; A328-F333 HydrophobicContact CB-CE2 3.96Å; G331-F333 PolarHBondContact O-N 2.91Å; F333-V335 PolarHBondContact O-N 3.43Å; F333-I341 HydrophobicContact CB-CD1 4.4Å; F333-I341 HydrophobicContact CB-CG1 3.94Å; F333-I341 HydrophobicContact CD1-CG1 4.01Å; F333-I341 HydrophobicContact CD2-CG1 4.48Å; F333-I341 HydrophobicContact CG-CG1 3.88Å; F333-A344 HydrophobicContact CD1-CB 4.45Å; F333-A344 HydrophobicContact CE1-CB 3.44Å; F333-A344 VanDerWaalsContact CE1-CB 3.44Å; F333-A344 HydrophobicContact CZ-CB 4.08Å
334	N	60.7	Low	73.5	Confident	78 Å²	78	55.2 Å²	55.2	42%	0.417	31%	0.306	S	S	.	.			trans	-79.9	103	161.8	-165.6	-14	0	0	0	107.4	H336 R337	N334-H336 PolarHBondContact O-N 3.32Å; N334-R337 HydrophobicContact CB-CB 4.29Å; N334-R337 HydrophobicContact CB-CG 4.25Å; N334-R337 PolarHBondContact O-N 3.45Å
335	V	55.3	Low	73.3	Confident	38 Å²	38	54.2 Å²	54.2	23%	0.23	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-21.6	-176.4	-175	0	0	0	0	113.2	F333 Q494 Y498	F333-V335 PolarHBondContact O-N 3.43Å; V335-Q494 HydrophobicContact CG1-CB 4.37Å; V335-Y498 HydrophobicContact CG2-CE2 4.16Å; V335-Y498 VanDerWaalsContact CG2-OH 3.29Å; V335-Y498 WeakPolarHBondContact CG2-OH 3.48Å
336	H	50.8	Low	73.2	Confident	75 Å²	75	56 Å²	56	35%	0.347	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	1.6	-176	-53.4	82.4	0	0	0	114.1	N334	N334-H336 PolarHBondContact O-N 3.32Å
337	R	59.6	Low	73	Confident	137 Å²	137	58.4 Å²	58.4	52%	0.517	33%	0.325	S	S	.	.	S	Bend	trans	-83.4	112.4	165.8	-86.4	-165.6	-88.3	-168.4	-5.4	107.6	N334 G339 A340	N334-R337 HydrophobicContact CB-CB 4.29Å; N334-R337 HydrophobicContact CB-CG 4.25Å; N334-R337 PolarHBondContact O-N 3.45Å; R337-G339 PolarHBondContact O-N 2.87Å; R337-A340 HydrophobicContact CB-CB 4.15Å; R337-A340 PolarHBondContact O-N 3.24Å
338	H	55.6	Low	73.1	Confident	37 Å²	37	58.2 Å²	58.2	17%	0.171	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	126.6	177.7	-73.4	-96.1	0	0	0	110.1	E81 D84 D86 E130 A340	E81-H338 HydrophobicContact CG-CB 3.82Å; D84-H338 IonicContact OD2-ND1 3.58Å; D86-H338 IonicContact OD2-CG 3Å; D86-H338 IonicContact OD2-ND1 3.17Å; D86-H338 PolarHBondContact OD2-ND1 2.86Å; E130-H338 IonicContact OE1-CE1 3.86Å; H338-A340 VanDerWaalsContact C-N 3.32Å; H338-A340 PolarHBondContact O-N 3.2Å; H338-A340 VanDerWaalsContact O-N 3.16Å
339	G	65	Low	73.6	Confident	8 Å²	8	60.3 Å²	60.3	8%	0.082	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	1.3	171.6	0	0	0	0	0	118.8	G80 R337 I341 N342 S343	G80-G339 VanDerWaalsContact C-CA 3.44Å; G80-G339 WeakPolarHBondContact CA-O 3.41Å; G80-G339 WeakPolarHBondContact O-CA 3.5Å; R337-G339 PolarHBondContact O-N 2.87Å; G339-I341 PolarHBondContact O-N 2.87Å; G339-N342 PolarHBondContact O-N 3.46Å; G339-S343 PolarHBondContact O-N 3.23Å; G339-S343 PolarHBondContact O-OG 2.97Å
340	A	71	Confident	73.9	Confident	34 Å²	34	57 Å²	57	28%	0.281	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-40	-178	0	0	0	0	0	112.8	R337 H338 A344	R337-A340 HydrophobicContact CB-CB 4.15Å; R337-A340 PolarHBondContact O-N 3.24Å; H338-A340 VanDerWaalsContact C-N 3.32Å; H338-A340 PolarHBondContact O-N 3.2Å; H338-A340 VanDerWaalsContact O-N 3.16Å; A340-A344 WeakPolarHBondContact O-CB 3.37Å; A340-A344 PolarHBondContact O-N 2.97Å; A340-A344 VanDerWaalsContact O-N 3.08Å
341	I	75.7	Confident	74.1	Confident	63 Å²	63	55.4 Å²	55.4	32%	0.323	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-45.5	177.5	-63.6	173.3	0	0	0	110.2	F333 G339 S343 A344 A345	F333-I341 HydrophobicContact CB-CD1 4.4Å; F333-I341 HydrophobicContact CB-CG1 3.94Å; F333-I341 HydrophobicContact CD1-CG1 4.01Å; F333-I341 HydrophobicContact CD2-CG1 4.48Å; F333-I341 HydrophobicContact CG-CG1 3.88Å; G339-I341 PolarHBondContact O-N 2.87Å; I341-S343 PolarHBondContact O-N 3.31Å; I341-A344 PolarHBondContact O-N 3.1Å; I341-A345 WeakPolarHBondContact O-CB 3.48Å; I341-A345 PolarHBondContact O-N 3.22Å
342	N	78.3	Confident	75.1	Confident	60 Å²	60	53.1 Å²	53.1	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-44.2	179.2	-66.3	-19.3	0	0	0	111.7	G339 A344 A345 I346	G339-N342 PolarHBondContact O-N 3.46Å; N342-A344 PolarHBondContact O-N 3.36Å; N342-A345 PolarHBondContact O-N 3.17Å; N342-I346 WeakPolarHBondContact O-CG1 3.47Å; N342-I346 PolarHBondContact O-N 3.01Å
343	S	78.1	Confident	76.1	Confident	46 Å²	46	47.8 Å²	47.8	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-63	-43.5	177.8	-57.2	0	0	0	0	112.1	G80 G339 I341 I346 L347	G80-S343 WeakPolarHBondContact CA-OG 3.16Å; G80-S343 PolarHBondContact N-OG 2.76Å; G339-S343 PolarHBondContact O-N 3.23Å; G339-S343 PolarHBondContact O-OG 2.97Å; I341-S343 PolarHBondContact O-N 3.31Å; S343-I346 PolarHBondContact O-N 2.94Å; S343-L347 PolarHBondContact O-N 2.91Å; S343-L347 VanDerWaalsContact O-N 3.12Å
344	A	80.1	Confident	77.4	Confident	25 Å²	25	48.9 Å²	48.9	21%	0.207	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-37.2	177.3	0	0	0	0	0	112.7	F333 A340 I341 N342 I346 L347 L348	F333-A344 HydrophobicContact CD1-CB 4.45Å; F333-A344 HydrophobicContact CE1-CB 3.44Å; F333-A344 VanDerWaalsContact CE1-CB 3.44Å; F333-A344 HydrophobicContact CZ-CB 4.08Å; A340-A344 WeakPolarHBondContact O-CB 3.37Å; A340-A344 PolarHBondContact O-N 2.97Å; A340-A344 VanDerWaalsContact O-N 3.08Å; I341-A344 PolarHBondContact O-N 3.1Å; N342-A344 PolarHBondContact O-N 3.36Å; A344-I346 VanDerWaalsContact C-N 3.35Å; A344-L347 PolarHBondContact O-N 3.24Å; A344-L348 WeakPolarHBondContact O-CB 3.27Å; A344-L348 PolarHBondContact O-N 3.25Å
345	A	83.8	Confident	79.1	Confident	30 Å²	30	48.4 Å²	48.4	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-41.9	175.1	0	0	0	0	0	111.6	I324 I341 N342 L348 Y349	I324-A345 HydrophobicContact CD1-CB 4.25Å; I341-A345 WeakPolarHBondContact O-CB 3.48Å; I341-A345 PolarHBondContact O-N 3.22Å; N342-A345 PolarHBondContact O-N 3.17Å; A345-L348 PolarHBondContact O-N 3.4Å; A345-Y349 VanDerWaalsContact O-CB 3.23Å; A345-Y349 WeakPolarHBondContact O-CB 3.35Å; A345-Y349 PolarHBondContact O-N 3.25Å
346	I	84.8	Confident	81.1	Confident	51 Å²	51	46.6 Å²	46.6	26%	0.262	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-46.4	175.8	-69.6	166.2	0	0	0	111.2	L83 N342 S343 A344 Y349 A350 L415	L83-I346 HydrophobicContact CD1-CD1 3.3Å; N342-I346 WeakPolarHBondContact O-CG1 3.47Å; N342-I346 PolarHBondContact O-N 3.01Å; S343-I346 PolarHBondContact O-N 2.94Å; A344-I346 VanDerWaalsContact C-N 3.35Å; I346-Y349 PolarHBondContact O-N 3.02Å; I346-A350 PolarHBondContact O-N 3.34Å; I346-L415 HydrophobicContact CD1-CD2 4.12Å
347	L	83.7	Confident	83.2	Confident	110 Å²	110	43 Å²	43	58%	0.576	24%	0.235	S	C	*	.	H	α-helix	trans	-62.4	-46.8	178.5	-178.8	64.1	0	0	0	111.4	S343 A344 Y349 A350 L351	S343-L347 PolarHBondContact O-N 2.91Å; S343-L347 VanDerWaalsContact O-N 3.12Å; A344-L347 PolarHBondContact O-N 3.24Å; L347-Y349 VanDerWaalsContact C-N 3.33Å; L347-Y349 PolarHBondContact O-N 2.79Å; L347-A350 WeakPolarHBondContact O-CB 3.41Å; L347-A350 PolarHBondContact O-N 3.07Å; L347-L351 HydrophobicContact CG-CD1 4.39Å; L347-L351 WeakPolarHBondContact O-CG 3.49Å; L347-L351 PolarHBondContact O-N 3.32Å
348	L	88.9	Confident	85	Confident	29 Å²	29	40.7 Å²	40.7	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-66.8	-36	179.3	-171.4	65.1	0	0	0	111.7	L320 I324 M327 A344 A345 A350 L351 T352	L320-L348 HydrophobicContact CD1-CB 3.85Å; L320-L348 HydrophobicContact CD1-CD2 3.74Å; L320-L348 HydrophobicContact CD1-CG 3.66Å; I324-L348 HydrophobicContact CG1-CD2 3.84Å; M327-L348 HydrophobicContact CE-CB 4.36Å; M327-L348 HydrophobicContact CE-CD1 4.47Å; M327-L348 HydrophobicContact CE-CD2 3.45Å; M327-L348 VanDerWaalsContact CE-CD2 3.45Å; M327-L348 HydrophobicContact CE-CG 4.3Å; A344-L348 WeakPolarHBondContact O-CB 3.27Å; A344-L348 PolarHBondContact O-N 3.25Å; A345-L348 PolarHBondContact O-N 3.4Å; L348-A350 VanDerWaalsContact C-N 3.34Å; L348-A350 PolarHBondContact O-N 3.43Å; L348-L351 PolarHBondContact O-N 3.47Å; L348-T352 HydrophobicContact CD1-CG2 4.24Å; L348-T352 HydrophobicContact CG-CG2 4.24Å; L348-T352 WeakPolarHBondContact O-CB 3.43Å; L348-T352 VanDerWaalsContact O-CG2 3.27Å; L348-T352 WeakPolarHBondContact O-CG2 3.22Å; L348-T352 PolarHBondContact O-N 2.95Å; L348-T352 PolarHBondContact O-OG1 3.41Å
349	Y	91.4	Very high	87	Confident	49 Å²	49	40.2 Å²	40.2	19%	0.192	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-45.8	172.7	179.8	-88.6	0	0	0	111	Q316 F317 L320 A345 I346 L347 L351 T352 C353 F383	Q316-Y349 PolarHBondContact NE2-O 3.39Å; F317-Y349 HydrophobicContact CE1-CD2 4.5Å; F317-Y349 HydrophobicContact CE1-CE2 4.05Å; F317-Y349 HydrophobicContact CZ-CE2 4.4Å; L320-Y349 HydrophobicContact CD2-CD2 3.94Å; A345-Y349 VanDerWaalsContact O-CB 3.23Å; A345-Y349 WeakPolarHBondContact O-CB 3.35Å; A345-Y349 PolarHBondContact O-N 3.25Å; I346-Y349 PolarHBondContact O-N 3.02Å; L347-Y349 VanDerWaalsContact C-N 3.33Å; L347-Y349 PolarHBondContact O-N 2.79Å; Y349-L351 PolarHBondContact O-N 3.37Å; Y349-T352 WeakPolarHBondContact CA-OG1 3.38Å; Y349-T352 PolarHBondContact O-N 2.72Å; Y349-T352 PolarHBondContact O-OG1 3.44Å; Y349-T352 VanDerWaalsContact O-OG1 3.07Å; Y349-C353 PolarHBondContact O-N 3.36Å; Y349-C353 PolarHBondContact O-SG 3.5Å; Y349-F383 HydrophobicContact CE2-CD1 4.4Å; Y349-F383 HydrophobicContact CE2-CE1 4.27Å
350	A	89.3	Confident	88.5	Confident	9 Å²	9	39.9 Å²	39.9	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-61.4	-44	177.3	0	0	0	0	0	112.1	I346 L347 L348 C353 V422 L426	I346-A350 PolarHBondContact O-N 3.34Å; L347-A350 WeakPolarHBondContact O-CB 3.41Å; L347-A350 PolarHBondContact O-N 3.07Å; L348-A350 VanDerWaalsContact C-N 3.34Å; L348-A350 PolarHBondContact O-N 3.43Å; A350-C353 VanDerWaalsContact O-CB 3.3Å; A350-C353 WeakPolarHBondContact O-CB 3.29Å; A350-C353 PolarHBondContact O-N 2.97Å; A350-V422 HydrophobicContact CB-CG1 4.05Å; A350-L426 VanDerWaalsContact O-CD2 3.31Å; A350-L426 WeakPolarHBondContact O-CD2 3.29Å
351	L	89.2	Confident	89.7	Confident	91 Å²	91	38.2 Å²	38.2	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-40.5	178.7	-67.8	174.1	0	0	0	112.8	L347 L348 Y349 C353	L347-L351 HydrophobicContact CG-CD1 4.39Å; L347-L351 WeakPolarHBondContact O-CG 3.49Å; L347-L351 PolarHBondContact O-N 3.32Å; L348-L351 PolarHBondContact O-N 3.47Å; Y349-L351 PolarHBondContact O-N 3.37Å; L351-C353 PolarHBondContact O-N 3.3Å
352	T	94.3	Very high	90.6	Very high	8 Å²	8	37.2 Å²	37.2	5%	0.049	20%	0.203	C	C	.	.	H	α-helix	trans	-73.3	-12.1	-179	53.6	0	0	0	0	113.6	A319 L348 Y349 C354 I355 S356	A319-T352 HydrophobicContact CB-CG2 4.13Å; L348-T352 HydrophobicContact CD1-CG2 4.24Å; L348-T352 HydrophobicContact CG-CG2 4.24Å; L348-T352 WeakPolarHBondContact O-CB 3.43Å; L348-T352 VanDerWaalsContact O-CG2 3.27Å; L348-T352 WeakPolarHBondContact O-CG2 3.22Å; L348-T352 PolarHBondContact O-N 2.95Å; L348-T352 PolarHBondContact O-OG1 3.41Å; Y349-T352 WeakPolarHBondContact CA-OG1 3.38Å; Y349-T352 PolarHBondContact O-N 2.72Å; Y349-T352 PolarHBondContact O-OG1 3.44Å; Y349-T352 VanDerWaalsContact O-OG1 3.07Å; T352-C354 PolarHBondContact O-N 3.26Å; T352-I355 HydrophobicContact CG2-CD1 4.32Å; T352-I355 WeakPolarHBondContact O-CB 3.5Å; T352-I355 PolarHBondContact O-N 2.81Å; T352-S356 PolarHBondContact O-N 2.98Å
353	C	94.9	Very high	91.4	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.02	19%	0.189	C	C	.	.	H	α-helix	trans	-55.6	-32.8	173.4	-73.1	0	0	0	0	113	Q316 Y349 A350 L351 I355 S356 G357 G423 L426 T427	Q316-C353 PolarHBondContact NE2-SG 3.15Å; Q316-C353 VanDerWaalsContact NE2-SG 3.37Å; Y349-C353 PolarHBondContact O-N 3.36Å; Y349-C353 PolarHBondContact O-SG 3.5Å; A350-C353 VanDerWaalsContact O-CB 3.3Å; A350-C353 WeakPolarHBondContact O-CB 3.29Å; A350-C353 PolarHBondContact O-N 2.97Å; L351-C353 PolarHBondContact O-N 3.3Å; C353-I355 VanDerWaalsContact C-N 3.3Å; C353-I355 PolarHBondContact O-N 3.37Å; C353-S356 WeakPolarHBondContact O-CB 3.42Å; C353-S356 PolarHBondContact O-N 3.23Å; C353-G357 PolarHBondContact O-N 2.98Å; C353-G423 WeakPolarHBondContact CB-O 3.46Å; C353-L426 HydrophobicContact CB-CB 4.28Å; C353-T427 WeakPolarHBondContact CB-OG1 3.4Å
354	C	95.6	Very high	92.2	Very high	45 Å²	45	33.2 Å²	33.2	30%	0.304	18%	0.176	S	C	.	.	H	α-helix	trans	-61.6	-37.5	176.3	-175.7	0	0	0	0	112.4	T352 S356 G357 Y358 L426 G430	T352-C354 PolarHBondContact O-N 3.26Å; C354-S356 VanDerWaalsContact C-N 3.33Å; C354-S356 PolarHBondContact O-N 3.42Å; C354-G357 PolarHBondContact O-N 3.31Å; C354-Y358 WeakPolarHBondContact O-CB 3.44Å; C354-Y358 PolarHBondContact O-N 2.93Å; C354-L426 WeakPolarHBondContact CA-O 3.43Å; C354-G430 WeakPolarHBondContact O-CA 3.4Å; C354-G430 VanDerWaalsContact SG-CA 3.54Å
355	I	96.6	Very high	92.8	Very high	68 Å²	68	38.1 Å²	38.1	35%	0.349	19%	0.19	S	C	.	.	H	α-helix	trans	-64.1	-41.7	178	-59.5	172.3	0	0	0	110.1	A315 A319 T352 C353 Y358 V359	A315-I355 HydrophobicContact CB-CG2 4.38Å; A319-I355 HydrophobicContact CB-CD1 3.51Å; T352-I355 HydrophobicContact CG2-CD1 4.32Å; T352-I355 WeakPolarHBondContact O-CB 3.5Å; T352-I355 PolarHBondContact O-N 2.81Å; C353-I355 VanDerWaalsContact C-N 3.3Å; C353-I355 PolarHBondContact O-N 3.37Å; I355-Y358 PolarHBondContact O-N 2.95Å; I355-V359 HydrophobicContact CG2-CG2 4.2Å; I355-V359 WeakPolarHBondContact O-CG2 3.26Å; I355-V359 PolarHBondContact O-N 3.42Å
356	S	96.4	Very high	93.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-57.7	-52.1	177.5	-164.9	0	0	0	0	112	G312 V313 Q316 T352 C353 C354 Y358 S360 T379	G312-S356 WeakPolarHBondContact CA-O 3.47Å; G312-S356 WeakPolarHBondContact O-CA 3.43Å; G312-S356 PolarHBondContact O-OG 3.09Å; V313-S356 PolarHBondContact N-OG 3.43Å; Q316-S356 VanDerWaalsContact OE1-CB 3.23Å; Q316-S356 PolarHBondContact OE1-OG 3.41Å; T352-S356 PolarHBondContact O-N 2.98Å; C353-S356 WeakPolarHBondContact O-CB 3.42Å; C353-S356 PolarHBondContact O-N 3.23Å; C354-S356 VanDerWaalsContact C-N 3.33Å; C354-S356 PolarHBondContact O-N 3.42Å; S356-Y358 PolarHBondContact O-N 2.91Å; S356-S360 WeakPolarHBondContact O-CB 3.3Å; S356-S360 PolarHBondContact O-N 3.26Å; S356-T379 VanDerWaalsContact OG-CG2 3.24Å; S356-T379 WeakPolarHBondContact OG-CG2 3.35Å
357	G	96.1	Very high	93.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-44.1	178.3	0	0	0	0	0	112.5	C353 C354 S361 T427 G431	C353-G357 PolarHBondContact O-N 2.98Å; C354-G357 PolarHBondContact O-N 3.31Å; G357-S361 VanDerWaalsContact O-CB 3.27Å; G357-S361 WeakPolarHBondContact O-CB 3.34Å; G357-S361 PolarHBondContact O-N 3.19Å; G357-S361 PolarHBondContact O-OG 3.5Å; G357-T427 WeakPolarHBondContact CA-O 3.35Å; G357-G431 VanDerWaalsContact O-CA 3.24Å; G357-G431 WeakPolarHBondContact O-CA 3.26Å
358	Y	96.9	Very high	93.8	Very high	88 Å²	88	32.6 Å²	32.6	35%	0.345	17%	0.165	S	C	.	.	H	α-helix	trans	-60.8	-57.3	179.1	179.7	-92.9	0	0	0	111.8	C354 I355 S356 S360 S361 H362 G430 F433	C354-Y358 WeakPolarHBondContact O-CB 3.44Å; C354-Y358 PolarHBondContact O-N 2.93Å; I355-Y358 PolarHBondContact O-N 2.95Å; S356-Y358 PolarHBondContact O-N 2.91Å; Y358-S360 PolarHBondContact O-N 3.22Å; Y358-S361 PolarHBondContact O-N 3.24Å; Y358-H362 WeakPolarHBondContact O-CB 3.46Å; Y358-H362 PolarHBondContact O-N 3.47Å; Y358-G430 WeakPolarHBondContact CA-O 3.5Å; Y358-G430 VanDerWaalsContact N-C 3.35Å; Y358-G430 PolarHBondContact N-O 2.98Å; Y358-F433 HydrophobicContact CD2-CB 4.17Å
359	V	96.8	Very high	93.9	Very high	27 Å²	27	31.2 Å²	31.2	16%	0.164	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-44.1	-175.9	172.5	0	0	0	0	110.9	A315 I355 F363 F590	A315-V359 HydrophobicContact CB-CB 4.29Å; A315-V359 HydrophobicContact CB-CG1 4.18Å; A315-V359 HydrophobicContact CB-CG2 4.05Å; I355-V359 HydrophobicContact CG2-CG2 4.2Å; I355-V359 WeakPolarHBondContact O-CG2 3.26Å; I355-V359 PolarHBondContact O-N 3.42Å; V359-F363 WeakPolarHBondContact O-CB 3.47Å; V359-F363 PolarHBondContact O-N 3.32Å; V359-F363 VanDerWaalsContact O-N 3.1Å; V359-F590 HydrophobicContact CG1-CE2 4.43Å; V359-F590 HydrophobicContact CG1-CZ 4.09Å
360	S	96.8	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-52.7	178.6	180	0	0	0	0	111.9	C308 S356 Y358 Y364 N375 T379	C308-S360 WeakPolarHBondContact O-CA 3.36Å; C308-S360 WeakPolarHBondContact O-CB 2.94Å; C308-S360 PolarHBondContact O-OG 3.46Å; S356-S360 WeakPolarHBondContact O-CB 3.3Å; S356-S360 PolarHBondContact O-N 3.26Å; Y358-S360 PolarHBondContact O-N 3.22Å; S360-Y364 WeakPolarHBondContact O-CB 3.18Å; S360-Y364 PolarHBondContact O-N 3.02Å; S360-N375 PolarHBondContact OG-ND2 3.04Å; S360-T379 WeakPolarHBondContact CB-OG1 3.42Å; S360-T379 PolarHBondContact OG-OG1 2.89Å
361	S	95.9	Very high	93.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-72.3	-34.6	-175.2	-55.6	0	0	0	0	112.9	G357 Y358 R365 I376 G431	G357-S361 VanDerWaalsContact O-CB 3.27Å; G357-S361 WeakPolarHBondContact O-CB 3.34Å; G357-S361 PolarHBondContact O-N 3.19Å; G357-S361 PolarHBondContact O-OG 3.5Å; Y358-S361 PolarHBondContact O-N 3.24Å; S361-R365 WeakPolarHBondContact O-CB 3.4Å; S361-R365 PolarHBondContact O-N 3.19Å; S361-I376 WeakPolarHBondContact OG-CG1 3.39Å; S361-G431 VanDerWaalsContact CB-O 3.27Å; S361-G431 WeakPolarHBondContact CB-O 3.3Å; S361-G431 VanDerWaalsContact OG-CA 3.22Å; S361-G431 WeakPolarHBondContact OG-CA 3.23Å
362	H	95.2	Very high	94	Very high	41 Å²	41	43.6 Å²	43.6	19%	0.19	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-51	175	178.9	-90.5	0	0	0	111.1	Y358 R365 Q366 G434	Y358-H362 WeakPolarHBondContact O-CB 3.46Å; Y358-H362 PolarHBondContact O-N 3.47Å; H362-R365 PolarHBondContact O-N 3.07Å; H362-Q366 VanDerWaalsContact CE1-CD 3.48Å; H362-Q366 PolarHBondContact CE1-NE2 3.39Å; H362-Q366 PolarHBondContact O-N 2.92Å; H362-G434 WeakPolarHBondContact CA-O 3.42Å
363	F	94.3	Very high	94	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-69	-36	179.5	-157.3	-110.3	0	0	0	112.1	L311 V359 R365 Q366 I367 F441 W532 F589 L593	L311-F363 HydrophobicContact CD1-CD1 3.82Å; L311-F363 HydrophobicContact CD1-CE1 3.96Å; V359-F363 WeakPolarHBondContact O-CB 3.47Å; V359-F363 PolarHBondContact O-N 3.32Å; V359-F363 VanDerWaalsContact O-N 3.1Å; F363-R365 VanDerWaalsContact C-N 3.33Å; F363-R365 PolarHBondContact O-N 2.8Å; F363-Q366 VanDerWaalsContact CD2-OE1 3.27Å; F363-Q366 WeakPolarHBondContact O-CB 3.27Å; F363-Q366 PolarHBondContact O-N 3.41Å; F363-I367 HydrophobicContact CD1-CD1 4.34Å; F363-I367 HydrophobicContact CE1-CD1 4.47Å; F363-I367 HydrophobicContact CE1-CG2 4.17Å; F363-I367 HydrophobicContact CZ-CG2 4.36Å; F363-I367 WeakPolarHBondContact O-CG1 3.44Å; F363-I367 PolarHBondContact O-N 3.26Å; F363-I367 VanDerWaalsContact O-N 3.16Å; F363-F441 HydrophobicContact CE2-CE2 4.44Å; F363-W532 AromaticContact CE1-CZ3 3.89Å; F363-W532 HydrophobicContact CE1-CZ3 3.89Å; F363-W532 HydrophobicContact CZ-CH2 4.5Å; F363-W532 AromaticContact CZ-CZ3 3.75Å; F363-W532 HydrophobicContact CZ-CZ3 3.75Å; F363-F589 AromaticContact CE1-CE1 3.75Å; F363-F589 HydrophobicContact CE1-CE1 3.75Å; F363-F589 AromaticContact CE1-CZ 3.63Å; F363-F589 HydrophobicContact CE1-CZ 3.63Å; F363-F589 HydrophobicContact CE2-CE1 4.31Å; F363-F589 AromaticContact CZ-CE1 3.57Å; F363-F589 HydrophobicContact CZ-CE1 3.57Å; F363-F589 AromaticContact CZ-CZ 3.57Å; F363-F589 HydrophobicContact CZ-CZ 3.57Å; F363-L593 HydrophobicContact CE2-CD2 4.03Å; F363-L593 HydrophobicContact CZ-CD2 4.22Å
364	Y	95.3	Very high	93.9	Very high	16 Å²	16	54.6 Å²	54.6	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-41.2	176.5	-175	-108.4	0	0	0	112	R304 C308 S360 I367 G369 N375	R304-Y364 HydrophobicContact CG-CE2 4.08Å; C308-Y364 HydrophobicContact CB-CD2 4.34Å; C308-Y364 WeakPolarHBondContact SG-CA 3.49Å; C308-Y364 PolarHBondContact SG-N 3Å; S360-Y364 WeakPolarHBondContact O-CB 3.18Å; S360-Y364 PolarHBondContact O-N 3.02Å; Y364-I367 WeakPolarHBondContact O-CG1 3.33Å; Y364-G369 VanDerWaalsContact CE1-CA 3.45Å; Y364-G369 VanDerWaalsContact O-CA 3.22Å; Y364-G369 WeakPolarHBondContact O-CA 3.34Å; Y364-G369 PolarHBondContact O-N 3.03Å; Y364-N375 HydrophobicContact CD1-CB 3.93Å; Y364-N375 HydrophobicContact CD2-CB 4.26Å; Y364-N375 WeakPolarHBondContact CD2-OD1 3.43Å; Y364-N375 HydrophobicContact CE1-CB 4.04Å; Y364-N375 HydrophobicContact CE2-CB 4.35Å; Y364-N375 HydrophobicContact CG-CB 4.04Å
365	R	93.4	Very high	93.9	Very high	128 Å²	128	52.6 Å²	52.6	48%	0.483	24%	0.237	S	C	.	.	H	α-helix	trans	-70.2	-37.9	176.5	-171.7	59.3	170.2	165.9	2.2	112	S361 H362 F363 I367 G368 G369 A438	S361-R365 WeakPolarHBondContact O-CB 3.4Å; S361-R365 PolarHBondContact O-N 3.19Å; H362-R365 PolarHBondContact O-N 3.07Å; F363-R365 VanDerWaalsContact C-N 3.33Å; F363-R365 PolarHBondContact O-N 2.8Å; R365-I367 VanDerWaalsContact C-N 3.32Å; R365-I367 PolarHBondContact O-N 3.41Å; R365-G368 PolarHBondContact O-N 3.47Å; R365-G368 VanDerWaalsContact O-N 3.17Å; R365-G369 WeakPolarHBondContact CD-O 3.31Å; R365-G369 PolarHBondContact NH1-O 3.5Å; R365-A438 HydrophobicContact CB-CB 3.59Å; R365-A438 HydrophobicContact CG-CB 3.69Å
366	Q	92	Very high	93.8	Very high	37 Å²	37	49.5 Å²	49.5	17%	0.173	22%	0.221	C	C	.	.	H	α-helix	trans	-54.7	-45	174.6	-88.2	179.3	-18.4	0	0	112.6	H362 F363 G368 S439 F441	H362-Q366 VanDerWaalsContact CE1-CD 3.48Å; H362-Q366 PolarHBondContact CE1-NE2 3.39Å; H362-Q366 PolarHBondContact O-N 2.92Å; F363-Q366 VanDerWaalsContact CD2-OE1 3.27Å; F363-Q366 WeakPolarHBondContact O-CB 3.27Å; F363-Q366 PolarHBondContact O-N 3.41Å; Q366-G368 PolarHBondContact O-N 2.87Å; Q366-S439 WeakPolarHBondContact CG-O 3.43Å; Q366-F441 HydrophobicContact CB-CB 4.19Å; Q366-F441 WeakPolarHBondContact O-CB 3.2Å; Q366-F441 PolarHBondContact O-N 3.48Å; Q366-F441 VanDerWaalsContact O-N 3.12Å
367	I	91.4	Very high	93.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	24.8	-178.7	68	-171.6	0	0	0	113.6	F300 R304 C308 F363 Y364 R365 W532	F300-I367 HydrophobicContact CD1-CB 3.73Å; F300-I367 HydrophobicContact CD1-CG2 3.77Å; F300-I367 HydrophobicContact CE1-CB 3.78Å; F300-I367 HydrophobicContact CE1-CG2 3.67Å; F300-I367 HydrophobicContact CG-CB 4.17Å; F300-I367 HydrophobicContact CZ-CB 4.24Å; F300-I367 HydrophobicContact CZ-CG2 4.48Å; R304-I367 HydrophobicContact CB-CD1 3.63Å; R304-I367 HydrophobicContact CB-CG1 4.25Å; R304-I367 PolarHBondContact NH1-O 3.35Å; R304-I367 VanDerWaalsContact NH1-O 3.11Å; C308-I367 WeakPolarHBondContact SG-CD1 3.32Å; F363-I367 HydrophobicContact CD1-CD1 4.34Å; F363-I367 HydrophobicContact CE1-CD1 4.47Å; F363-I367 HydrophobicContact CE1-CG2 4.17Å; F363-I367 HydrophobicContact CZ-CG2 4.36Å; F363-I367 WeakPolarHBondContact O-CG1 3.44Å; F363-I367 PolarHBondContact O-N 3.26Å; F363-I367 VanDerWaalsContact O-N 3.16Å; Y364-I367 WeakPolarHBondContact O-CG1 3.33Å; R365-I367 VanDerWaalsContact C-N 3.32Å; R365-I367 PolarHBondContact O-N 3.41Å; I367-W532 HydrophobicContact CG2-CH2 4.46Å; I367-W532 HydrophobicContact CG2-CZ3 4.42Å
368	G	88.8	Confident	93.7	Very high	38 Å²	38	55.5 Å²	55.5	39%	0.392	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	23.9	174	0	0	0	0	0	115	R304 R365 Q366	R304-G368 PolarHBondContact NH1-O 3.27Å; R304-G368 PolarHBondContact NH2-O 2.96Å; R365-G368 PolarHBondContact O-N 3.47Å; R365-G368 VanDerWaalsContact O-N 3.17Å; Q366-G368 PolarHBondContact O-N 2.87Å
369	G	90.6	Very high	93.7	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	24%	0.236	C	C	.	.			trans	-73.2	136	175.3	0	0	0	0	0	112.8	Y364 R365	Y364-G369 VanDerWaalsContact CE1-CA 3.45Å; Y364-G369 VanDerWaalsContact O-CA 3.22Å; Y364-G369 WeakPolarHBondContact O-CA 3.34Å; Y364-G369 PolarHBondContact O-N 3.03Å; R365-G369 WeakPolarHBondContact CD-O 3.31Å; R365-G369 PolarHBondContact NH1-O 3.5Å
370	E	89.4	Confident	93.5	Very high	150 Å²	150	50.7 Å²	50.7	70%	0.701	23%	0.232	S	C	*	.			trans	-110.8	-38.2	-179.9	-62.7	-174.6	159.6	0	0	112.5	W372	E370-W372 PolarHBondContact O-N 3.14Å
371	R	93.1	Very high	93.4	Very high	178 Å²	178	52.5 Å²	52.5	67%	0.672	25%	0.245	S	C	*	.			trans	-82.3	60	-177.5	-66.7	-172.6	-72.8	171.9	-4.2	112.2	V373 W374 N375	R371-V373 VanDerWaalsContact C-N 3.3Å; R371-V373 PolarHBondContact O-N 2.86Å; R371-W374 HydrophobicContact CB-CB 4.48Å; R371-W374 PolarHBondContact O-N 3.12Å; R371-N375 PolarHBondContact O-N 3.49Å
372	W	90.6	Very high	93.4	Very high	80 Å²	80	53.7 Å²	53.7	30%	0.303	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-32.6	-174.7	69.5	-86.8	0	0	0	113.6	E370 N375 I376 I432 K435	E370-W372 PolarHBondContact O-N 3.14Å; W372-N375 WeakPolarHBondContact O-CB 3.47Å; W372-N375 PolarHBondContact O-N 3.46Å; W372-I376 HydrophobicContact CE3-CD1 3.56Å; W372-I376 HydrophobicContact CE3-CG1 4.37Å; W372-I376 HydrophobicContact CZ3-CD1 3.58Å; W372-I376 PolarHBondContact O-N 2.89Å; W372-I432 HydrophobicContact CH2-CG1 3.94Å; W372-I432 HydrophobicContact CZ3-CG1 3.98Å; W372-K435 HydrophobicContact CD2-CD 3.63Å; W372-K435 HydrophobicContact CE3-CD 3.97Å; W372-K435 HydrophobicContact CG-CD 3.96Å; W372-K435 HydrophobicContact CH2-CD 4.49Å; W372-K435 HydrophobicContact CZ2-CD 4.2Å; W372-K435 HydrophobicContact CZ3-CD 4.38Å
373	V	93.2	Very high	93.3	Very high	72 Å²	72	52.7 Å²	52.7	44%	0.436	25%	0.246	S	C	.	.	H	α-helix	trans	-61.3	-48.4	177.5	179.9	0	0	0	0	111	R371 N375 I376 I377	R371-V373 VanDerWaalsContact C-N 3.3Å; R371-V373 PolarHBondContact O-N 2.86Å; V373-N375 VanDerWaalsContact C-N 3.27Å; V373-N375 PolarHBondContact O-N 2.92Å; V373-I376 PolarHBondContact O-N 2.9Å; V373-I376 VanDerWaalsContact O-N 3.16Å; V373-I377 HydrophobicContact CG1-CD1 4.2Å; V373-I377 WeakPolarHBondContact O-CG1 3.24Å; V373-I377 PolarHBondContact O-N 3.39Å
374	W	94	Very high	93.2	Very high	170 Å²	170	52.6 Å²	52.6	64%	0.644	25%	0.246	S	C	*	.	H	α-helix	trans	-64.2	-33.5	176.4	-74.8	111.9	0	0	0	112.4	R371 I377 L378	R371-W374 HydrophobicContact CB-CB 4.48Å; R371-W374 PolarHBondContact O-N 3.12Å; W374-I377 HydrophobicContact CE3-CD1 3.94Å; W374-I377 HydrophobicContact CZ3-CD1 4.08Å; W374-I377 PolarHBondContact O-N 2.93Å; W374-L378 WeakPolarHBondContact O-CB 3.41Å; W374-L378 PolarHBondContact O-N 3.3Å
375	N	95	Very high	93.1	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-40.3	173.6	-175.7	74.7	0	0	0	112	G305 S360 Y364 R371 W372 V373 L378 T379	G305-N375 WeakPolarHBondContact CA-OD1 3.49Å; G305-N375 PolarHBondContact O-OD1 3.05Å; G305-N375 VanDerWaalsContact O-OD1 3.07Å; S360-N375 PolarHBondContact OG-ND2 3.04Å; Y364-N375 HydrophobicContact CD1-CB 3.93Å; Y364-N375 HydrophobicContact CD2-CB 4.26Å; Y364-N375 WeakPolarHBondContact CD2-OD1 3.43Å; Y364-N375 HydrophobicContact CE1-CB 4.04Å; Y364-N375 HydrophobicContact CE2-CB 4.35Å; Y364-N375 HydrophobicContact CG-CB 4.04Å; R371-N375 PolarHBondContact O-N 3.49Å; W372-N375 WeakPolarHBondContact O-CB 3.47Å; W372-N375 PolarHBondContact O-N 3.46Å; V373-N375 VanDerWaalsContact C-N 3.27Å; V373-N375 PolarHBondContact O-N 2.92Å; N375-L378 PolarHBondContact O-N 3.36Å; N375-T379 WeakPolarHBondContact O-CB 3.37Å; N375-T379 PolarHBondContact O-N 3.4Å; N375-T379 PolarHBondContact O-OG1 3.46Å
376	I	95.1	Very high	93.2	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-46.7	175.1	-68.7	-178.6	0	0	0	111.2	S361 W372 V373 L378 T379 T380 T427 V428	S361-I376 WeakPolarHBondContact OG-CG1 3.39Å; W372-I376 HydrophobicContact CE3-CD1 3.56Å; W372-I376 HydrophobicContact CE3-CG1 4.37Å; W372-I376 HydrophobicContact CZ3-CD1 3.58Å; W372-I376 PolarHBondContact O-N 2.89Å; V373-I376 PolarHBondContact O-N 2.9Å; V373-I376 VanDerWaalsContact O-N 3.16Å; I376-L378 VanDerWaalsContact C-N 3.25Å; I376-L378 PolarHBondContact O-N 2.76Å; I376-T379 WeakPolarHBondContact O-CA 3.37Å; I376-T379 WeakPolarHBondContact O-CB 3.43Å; I376-T379 PolarHBondContact O-N 3.11Å; I376-T380 PolarHBondContact O-N 2.98Å; I376-T380 PolarHBondContact O-OG1 2.95Å; I376-T427 HydrophobicContact CG2-CG2 4.22Å; I376-V428 HydrophobicContact CG2-CG2 4.05Å
377	I	95.4	Very high	93.2	Very high	70 Å²	70	53.8 Å²	53.8	36%	0.359	27%	0.267	S	S	.	.	H	α-helix	trans	-56	-45.8	176.6	-66.4	168.9	0	0	0	110	V373 W374 T379 T380 S381	V373-I377 HydrophobicContact CG1-CD1 4.2Å; V373-I377 WeakPolarHBondContact O-CG1 3.24Å; V373-I377 PolarHBondContact O-N 3.39Å; W374-I377 HydrophobicContact CE3-CD1 3.94Å; W374-I377 HydrophobicContact CZ3-CD1 4.08Å; W374-I377 PolarHBondContact O-N 2.93Å; I377-T379 PolarHBondContact O-N 3.13Å; I377-T380 PolarHBondContact O-N 3.02Å; I377-S381 VanDerWaalsContact O-CB 3.29Å; I377-S381 WeakPolarHBondContact O-CB 3.22Å; I377-S381 PolarHBondContact O-N 3.3Å; I377-S381 PolarHBondContact O-OG 3.1Å; I377-S381 VanDerWaalsContact O-OG 3.06Å
378	L	95.6	Very high	93.2	Very high	56 Å²	56	56.4 Å²	56.4	29%	0.293	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-47.1	175.4	-176.1	62.4	0	0	0	111.4	L306 A309 W374 N375 I376 T380 S381 L382	L306-L378 HydrophobicContact CB-CD2 4.23Å; L306-L378 HydrophobicContact CD1-CD1 4.38Å; L306-L378 HydrophobicContact CD1-CD2 4.25Å; A309-L378 HydrophobicContact CB-CB 4.45Å; A309-L378 HydrophobicContact CB-CD2 4.09Å; A309-L378 HydrophobicContact CB-CG 3.9Å; W374-L378 WeakPolarHBondContact O-CB 3.41Å; W374-L378 PolarHBondContact O-N 3.3Å; N375-L378 PolarHBondContact O-N 3.36Å; I376-L378 VanDerWaalsContact C-N 3.25Å; I376-L378 PolarHBondContact O-N 2.76Å; L378-T380 PolarHBondContact O-N 2.66Å; L378-S381 WeakPolarHBondContact CA-OG 3.2Å; L378-S381 PolarHBondContact O-N 3.28Å; L378-S381 PolarHBondContact O-OG 2.84Å; L378-L382 WeakPolarHBondContact O-CB 3.24Å; L378-L382 PolarHBondContact O-N 3.31Å
379	T	95.8	Very high	93.4	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-47.7	179	-55	0	0	0	0	111.7	A309 V313 S356 S360 N375 I376 I377	A309-T379 WeakPolarHBondContact CA-OG1 3.44Å; V313-T379 HydrophobicContact CG2-CG2 3.92Å; V313-T379 WeakPolarHBondContact CG2-O 3.38Å; S356-T379 VanDerWaalsContact OG-CG2 3.24Å; S356-T379 WeakPolarHBondContact OG-CG2 3.35Å; S360-T379 WeakPolarHBondContact CB-OG1 3.42Å; S360-T379 PolarHBondContact OG-OG1 2.89Å; N375-T379 WeakPolarHBondContact O-CB 3.37Å; N375-T379 PolarHBondContact O-N 3.4Å; N375-T379 PolarHBondContact O-OG1 3.46Å; I376-T379 WeakPolarHBondContact O-CA 3.37Å; I376-T379 WeakPolarHBondContact O-CB 3.43Å; I376-T379 PolarHBondContact O-N 3.11Å; I377-T379 PolarHBondContact O-N 3.13Å
380	T	93.6	Very high	93.5	Very high	14 Å²	14	61.3 Å²	61.3	9%	0.086	30%	0.295	C	S	.	.	H	α-helix	trans	-68.1	-40.3	178	-49.1	0	0	0	0	111.5	I376 I377 L378 L382 S384 W419 F424	I376-T380 PolarHBondContact O-N 2.98Å; I376-T380 PolarHBondContact O-OG1 2.95Å; I377-T380 PolarHBondContact O-N 3.02Å; L378-T380 PolarHBondContact O-N 2.66Å; T380-L382 VanDerWaalsContact C-N 3.34Å; T380-L382 PolarHBondContact O-N 3.34Å; T380-S384 VanDerWaalsContact O-CB 3.32Å; T380-S384 WeakPolarHBondContact O-CB 3.27Å; T380-S384 PolarHBondContact O-OG 3.33Å; T380-W419 HydrophobicContact CG2-CH2 4.23Å; T380-W419 HydrophobicContact CG2-CZ2 3.41Å; T380-W419 VanDerWaalsContact CG2-CZ2 3.41Å; T380-F424 HydrophobicContact CG2-CD2 3.78Å
381	S	93.8	Very high	93.6	Very high	38 Å²	38	55.8 Å²	55.8	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-71.4	-25.9	-178.4	68.8	0	0	0	0	114.1	I377 L378 F383 S384 V385	I377-S381 VanDerWaalsContact O-CB 3.29Å; I377-S381 WeakPolarHBondContact O-CB 3.22Å; I377-S381 PolarHBondContact O-N 3.3Å; I377-S381 PolarHBondContact O-OG 3.1Å; I377-S381 VanDerWaalsContact O-OG 3.06Å; L378-S381 WeakPolarHBondContact CA-OG 3.2Å; L378-S381 PolarHBondContact O-N 3.28Å; L378-S381 PolarHBondContact O-OG 2.84Å; S381-F383 PolarHBondContact O-N 3.49Å; S381-S384 PolarHBondContact O-N 3.49Å; S381-V385 WeakPolarHBondContact O-CB 3.33Å; S381-V385 WeakPolarHBondContact O-CG2 3.43Å; S381-V385 PolarHBondContact O-N 3.26Å
382	L	95.4	Very high	93.5	Very high	24 Å²	24	50.1 Å²	50.1	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-43.8	-169.4	-175.1	68.1	0	0	0	112.8	L306 A309 V310 V313 L378 T380 P386 Y578 L582	L306-L382 HydrophobicContact CD1-CD1 4Å; A309-L382 HydrophobicContact CB-CD2 4.21Å; V310-L382 HydrophobicContact CB-CD2 4.29Å; V310-L382 HydrophobicContact CG2-CD2 3.72Å; V313-L382 HydrophobicContact CB-CD2 4.35Å; V313-L382 HydrophobicContact CG2-CB 4.27Å; V313-L382 HydrophobicContact CG2-CD2 4.07Å; L378-L382 WeakPolarHBondContact O-CB 3.24Å; L378-L382 PolarHBondContact O-N 3.31Å; T380-L382 VanDerWaalsContact C-N 3.34Å; T380-L382 PolarHBondContact O-N 3.34Å; L382-P386 VanDerWaalsContact O-CD 3.24Å; L382-P386 WeakPolarHBondContact O-CD 3.47Å; L382-P386 WeakPolarHBondContact O-CG 3.37Å; L382-Y578 WeakPolarHBondContact CG-OH 3.35Å; L382-Y578 PolarHBondContact O-OH 2.76Å; L382-Y578 VanDerWaalsContact O-OH 3.1Å; L382-L582 HydrophobicContact CD2-CD2 4.26Å
383	F	94.4	Very high	93.6	Very high	21 Å²	21	50.3 Å²	50.3	9%	0.092	27%	0.265	C	S	.	.	H	α-helix	trans	-95.7	-39.7	174.2	175.9	-102.4	0	0	0	112.9	V313 F317 Y349 S381 V385 P386 F387 Y578 V579	V313-F383 HydrophobicContact CG1-CB 3.95Å; F317-F383 HydrophobicContact CE1-CE1 4.32Å; F317-F383 HydrophobicContact CE1-CE2 4.49Å; F317-F383 HydrophobicContact CE1-CZ 4.29Å; F317-F383 HydrophobicContact CE2-CB 4.22Å; F317-F383 HydrophobicContact CE2-CD1 4.4Å; F317-F383 AromaticContact CE2-CD2 3.73Å; F317-F383 HydrophobicContact CE2-CD2 3.73Å; F317-F383 HydrophobicContact CE2-CE2 4.17Å; F317-F383 AromaticContact CE2-CG 3.85Å; F317-F383 HydrophobicContact CE2-CG 3.85Å; F317-F383 HydrophobicContact CZ-CB 4.26Å; F317-F383 AromaticContact CZ-CD1 3.62Å; F317-F383 HydrophobicContact CZ-CD1 3.62Å; F317-F383 AromaticContact CZ-CD2 3.49Å; F317-F383 HydrophobicContact CZ-CD2 3.49Å; F317-F383 VanDerWaalsContact CZ-CD2 3.49Å; F317-F383 AromaticContact CZ-CE1 3.71Å; F317-F383 HydrophobicContact CZ-CE1 3.71Å; F317-F383 AromaticContact CZ-CE2 3.6Å; F317-F383 HydrophobicContact CZ-CE2 3.6Å; F317-F383 AromaticContact CZ-CG 3.5Å; F317-F383 HydrophobicContact CZ-CG 3.5Å; F317-F383 VanDerWaalsContact CZ-CG 3.5Å; F317-F383 AromaticContact CZ-CZ 3.7Å; F317-F383 HydrophobicContact CZ-CZ 3.7Å; Y349-F383 HydrophobicContact CE2-CD1 4.4Å; Y349-F383 HydrophobicContact CE2-CE1 4.27Å; S381-F383 PolarHBondContact O-N 3.49Å; F383-V385 PolarHBondContact O-N 2.86Å; F383-P386 WeakPolarHBondContact O-CD 3.4Å; F383-F387 HydrophobicContact CD1-CB 4.39Å; F383-F387 HydrophobicContact CE1-CB 4.02Å; F383-F387 HydrophobicContact CE1-CD2 4.33Å; F383-F387 HydrophobicContact CE1-CG 4.22Å; F383-F387 HydrophobicContact CZ-CB 4.12Å; F383-F387 HydrophobicContact CZ-CD2 4.12Å; F383-F387 HydrophobicContact CZ-CG 4.36Å; F383-F387 VanDerWaalsContact O-CB 3.24Å; F383-F387 WeakPolarHBondContact O-CB 3.27Å; F383-F387 PolarHBondContact O-N 3.34Å; F383-Y578 HydrophobicContact CD2-CD1 4.04Å; F383-Y578 HydrophobicContact CD2-CE1 4.09Å; F383-V579 HydrophobicContact CD2-CG2 4.29Å; F383-V579 HydrophobicContact CE2-CG2 3.56Å; F383-V579 HydrophobicContact CZ-CG2 4.18Å
384	S	91.6	Very high	93.7	Very high	4 Å²	4	47 Å²	47	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-38.2	-173.8	-63.6	0	0	0	0	112.8	T380 S381 F387 F388 W419	T380-S384 VanDerWaalsContact O-CB 3.32Å; T380-S384 WeakPolarHBondContact O-CB 3.27Å; T380-S384 PolarHBondContact O-OG 3.33Å; S381-S384 PolarHBondContact O-N 3.49Å; S384-F387 PolarHBondContact O-N 3.49Å; S384-F388 WeakPolarHBondContact O-CB 3.33Å; S384-F388 WeakPolarHBondContact O-CD2 3.39Å; S384-F388 PolarHBondContact O-N 3.15Å; S384-W419 PolarHBondContact OG-NE1 3.33Å
385	V	92.8	Very high	93.5	Very high	93 Å²	93	39.6 Å²	39.6	56%	0.564	22%	0.218	S	C	*	.	H	α-helix	trans	-66.9	-52.6	179.7	173.2	0	0	0	0	111.9	S381 F383 F387 F388 L389	S381-V385 WeakPolarHBondContact O-CB 3.33Å; S381-V385 WeakPolarHBondContact O-CG2 3.43Å; S381-V385 PolarHBondContact O-N 3.26Å; F383-V385 PolarHBondContact O-N 2.86Å; V385-F387 VanDerWaalsContact C-N 3.27Å; V385-F387 PolarHBondContact O-N 2.99Å; V385-F388 PolarHBondContact O-N 3.21Å; V385-L389 WeakPolarHBondContact O-CB 3.42Å; V385-L389 PolarHBondContact O-N 3.03Å
386	P	95.2	Very high	93.4	Very high	44 Å²	44	42.5 Å²	42.5	29%	0.286	24%	0.239	S	C	.	.	H	α-helix	trans	-58.4	-36.9	173.7	-26.5	34.8	0	0	0	113.8	L382 F383 T390 Y578	L382-P386 VanDerWaalsContact O-CD 3.24Å; L382-P386 WeakPolarHBondContact O-CD 3.47Å; L382-P386 WeakPolarHBondContact O-CG 3.37Å; F383-P386 WeakPolarHBondContact O-CD 3.4Å; P386-T390 WeakPolarHBondContact O-CB 3.3Å; P386-T390 PolarHBondContact O-N 2.92Å; P386-T390 PolarHBondContact O-OG1 2.88Å; P386-Y578 HydrophobicContact CB-CE1 4.46Å; P386-Y578 HydrophobicContact CG-CE1 4.27Å
387	F	93.3	Very high	93.4	Very high	68 Å²	68	44 Å²	44	30%	0.298	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-54.2	176	171.7	-98.8	0	0	0	111.3	F383 S384 V385 L389 T390 W391 L575	F383-F387 HydrophobicContact CD1-CB 4.39Å; F383-F387 HydrophobicContact CE1-CB 4.02Å; F383-F387 HydrophobicContact CE1-CD2 4.33Å; F383-F387 HydrophobicContact CE1-CG 4.22Å; F383-F387 HydrophobicContact CZ-CB 4.12Å; F383-F387 HydrophobicContact CZ-CD2 4.12Å; F383-F387 HydrophobicContact CZ-CG 4.36Å; F383-F387 VanDerWaalsContact O-CB 3.24Å; F383-F387 WeakPolarHBondContact O-CB 3.27Å; F383-F387 PolarHBondContact O-N 3.34Å; S384-F387 PolarHBondContact O-N 3.49Å; V385-F387 VanDerWaalsContact C-N 3.27Å; V385-F387 PolarHBondContact O-N 2.99Å; F387-L389 VanDerWaalsContact C-N 3.32Å; F387-L389 PolarHBondContact O-N 2.95Å; F387-T390 PolarHBondContact O-N 2.82Å; F387-W391 WeakPolarHBondContact O-CB 3.47Å; F387-W391 PolarHBondContact O-N 3.21Å; F387-L575 HydrophobicContact CD2-CD1 3.98Å
388	F	90.6	Very high	93.2	Very high	55 Å²	55	40.9 Å²	40.9	24%	0.241	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-34.6	-179.4	-78.1	-61.7	0	0	0	112.6	S384 V385 W391 S392 L416 W419	S384-F388 WeakPolarHBondContact O-CB 3.33Å; S384-F388 WeakPolarHBondContact O-CD2 3.39Å; S384-F388 PolarHBondContact O-N 3.15Å; V385-F388 PolarHBondContact O-N 3.21Å; F388-W391 HydrophobicContact CD1-CE3 4.37Å; F388-S392 WeakPolarHBondContact O-CB 3.27Å; F388-S392 PolarHBondContact O-N 2.9Å; F388-L416 HydrophobicContact CD1-CD2 4.3Å; F388-L416 HydrophobicContact CE1-CD2 3.52Å; F388-L416 HydrophobicContact CE1-CG 4.36Å; F388-L416 HydrophobicContact CE2-CD2 4.19Å; F388-L416 HydrophobicContact CZ-CD2 3.47Å; F388-L416 VanDerWaalsContact CZ-CD2 3.47Å; F388-W419 HydrophobicContact CE2-CD2 4.43Å
389	L	92.4	Very high	93	Very high	120 Å²	120	45.2 Å²	45.2	63%	0.628	25%	0.245	S	C	*	.	H	α-helix	trans	-62.1	-54	174.1	-173.7	87.8	0	0	0	111	V385 F387 S392 V393	V385-L389 WeakPolarHBondContact O-CB 3.42Å; V385-L389 PolarHBondContact O-N 3.03Å; F387-L389 VanDerWaalsContact C-N 3.32Å; F387-L389 PolarHBondContact O-N 2.95Å; L389-S392 PolarHBondContact O-N 3.02Å; L389-V393 WeakPolarHBondContact O-CG2 3.44Å; L389-V393 PolarHBondContact O-N 3.36Å; L389-V393 VanDerWaalsContact O-N 3.11Å
390	T	93.9	Very high	92.8	Very high	22 Å²	22	49.3 Å²	49.3	14%	0.135	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-47.5	-179.4	-54.2	0	0	0	0	110.7	P386 F387 S392 V393 V394 G571 L575	P386-T390 WeakPolarHBondContact O-CB 3.3Å; P386-T390 PolarHBondContact O-N 2.92Å; P386-T390 PolarHBondContact O-OG1 2.88Å; F387-T390 PolarHBondContact O-N 2.82Å; T390-S392 VanDerWaalsContact C-N 3.31Å; T390-S392 PolarHBondContact O-N 2.89Å; T390-V393 PolarHBondContact O-N 3.43Å; T390-V394 HydrophobicContact CG2-CG2 4.41Å; T390-V394 WeakPolarHBondContact O-CG2 3.39Å; T390-V394 PolarHBondContact O-N 2.96Å; T390-G571 WeakPolarHBondContact CG2-O 3.26Å; T390-L575 HydrophobicContact CG2-CD1 3.76Å; T390-L575 HydrophobicContact CG2-CG 4.03Å
391	W	91.2	Very high	92.7	Very high	35 Å²	35	52.4 Å²	52.4	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-40.6	176.9	173.2	82.2	0	0	0	111.7	F387 F388 V393 V394 N395 L407 I412	F387-W391 WeakPolarHBondContact O-CB 3.47Å; F387-W391 PolarHBondContact O-N 3.21Å; F388-W391 HydrophobicContact CD1-CE3 4.37Å; W391-V393 VanDerWaalsContact C-N 3.35Å; W391-V393 PolarHBondContact O-N 3.47Å; W391-V394 PolarHBondContact O-N 3.04Å; W391-N395 HydrophobicContact CD2-CB 4.41Å; W391-N395 HydrophobicContact CH2-CB 4.39Å; W391-N395 HydrophobicContact CZ2-CB 3.94Å; W391-N395 WeakPolarHBondContact O-CB 3.42Å; W391-N395 PolarHBondContact O-N 3.43Å; W391-L407 HydrophobicContact CZ2-CB 4.34Å; W391-L407 HydrophobicContact CZ2-CD1 4.05Å; W391-I412 HydrophobicContact CH2-CB 4.19Å; W391-I412 HydrophobicContact CH2-CD1 3.47Å; W391-I412 VanDerWaalsContact CH2-CD1 3.47Å; W391-I412 HydrophobicContact CH2-CG1 3.47Å; W391-I412 VanDerWaalsContact CH2-CG1 3.47Å; W391-I412 HydrophobicContact CH2-CG2 3.64Å; W391-I412 HydrophobicContact CZ2-CD1 3.79Å; W391-I412 HydrophobicContact CZ2-CG1 3.58Å; W391-I412 HydrophobicContact CZ2-CG2 4.44Å; W391-I412 HydrophobicContact CZ3-CG2 4.22Å
392	S	90.7	Very high	92.5	Very high	59 Å²	59	52.3 Å²	52.3	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-40.7	177.7	176.8	0	0	0	0	112	F388 L389 T390 S396	F388-S392 WeakPolarHBondContact O-CB 3.27Å; F388-S392 PolarHBondContact O-N 2.9Å; L389-S392 PolarHBondContact O-N 3.02Å; T390-S392 VanDerWaalsContact C-N 3.31Å; T390-S392 PolarHBondContact O-N 2.89Å; S392-S396 VanDerWaalsContact O-CB 3.3Å; S392-S396 WeakPolarHBondContact O-CB 3.31Å; S392-S396 PolarHBondContact O-N 3.32Å; S392-S396 PolarHBondContact O-OG 2.88Å
393	V	93.6	Very high	92.3	Very high	83 Å²	83	51.3 Å²	51.3	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-51.6	175.3	174.1	0	0	0	0	110.6	L389 T390 W391 N395 S396 V397 V567	L389-V393 WeakPolarHBondContact O-CG2 3.44Å; L389-V393 PolarHBondContact O-N 3.36Å; L389-V393 VanDerWaalsContact O-N 3.11Å; T390-V393 PolarHBondContact O-N 3.43Å; W391-V393 VanDerWaalsContact C-N 3.35Å; W391-V393 PolarHBondContact O-N 3.47Å; V393-N395 PolarHBondContact O-N 2.93Å; V393-S396 PolarHBondContact O-N 3.21Å; V393-V397 PolarHBondContact O-N 3.41Å; V393-V397 VanDerWaalsContact O-N 3.15Å; V393-V567 HydrophobicContact CG1-CG1 4.25Å
394	V	93.6	Very high	92.1	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-51.4	179.3	172.9	0	0	0	0	110.7	T390 W391 S396 V397 H398 V567 E568 Y572	T390-V394 HydrophobicContact CG2-CG2 4.41Å; T390-V394 WeakPolarHBondContact O-CG2 3.39Å; T390-V394 PolarHBondContact O-N 2.96Å; W391-V394 PolarHBondContact O-N 3.04Å; V394-S396 VanDerWaalsContact C-N 3.31Å; V394-S396 PolarHBondContact O-N 3.05Å; V394-V397 PolarHBondContact O-N 3.46Å; V394-V397 VanDerWaalsContact O-N 3.11Å; V394-H398 PolarHBondContact O-CD2 3.48Å; V394-H398 PolarHBondContact O-N 3.49Å; V394-H398 VanDerWaalsContact O-N 3.07Å; V394-V567 HydrophobicContact CG2-CG1 4.08Å; V394-E568 HydrophobicContact CG1-CB 4.16Å; V394-E568 HydrophobicContact CG1-CG 4.13Å; V394-Y572 HydrophobicContact CG1-CE2 3.98Å
395	N	91.6	Very high	91.9	Very high	15 Å²	15	51.7 Å²	51.7	8%	0.08	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-37.1	179.9	-175.3	74.8	0	0	0	112.1	W391 V393 V397 H398 W399 L407	W391-N395 HydrophobicContact CD2-CB 4.41Å; W391-N395 HydrophobicContact CH2-CB 4.39Å; W391-N395 HydrophobicContact CZ2-CB 3.94Å; W391-N395 WeakPolarHBondContact O-CB 3.42Å; W391-N395 PolarHBondContact O-N 3.43Å; V393-N395 PolarHBondContact O-N 2.93Å; N395-V397 VanDerWaalsContact C-N 3.32Å; N395-V397 PolarHBondContact O-N 3.44Å; N395-H398 PolarHBondContact O-N 3.41Å; N395-W399 PolarHBondContact ND2-NE1 3.47Å; N395-W399 WeakPolarHBondContact O-CB 3.42Å; N395-W399 VanDerWaalsContact O-CD1 3.28Å; N395-W399 PolarHBondContact O-N 2.96Å; N395-L407 PolarHBondContact OD1-N 3.44Å
396	S	92.3	Very high	91.7	Very high	65 Å²	65	47.9 Å²	47.9	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-37.7	175.8	-60	0	0	0	0	112.2	S392 V393 V394 W399 A400	S392-S396 VanDerWaalsContact O-CB 3.3Å; S392-S396 WeakPolarHBondContact O-CB 3.31Å; S392-S396 PolarHBondContact O-N 3.32Å; S392-S396 PolarHBondContact O-OG 2.88Å; V393-S396 PolarHBondContact O-N 3.21Å; V394-S396 VanDerWaalsContact C-N 3.31Å; V394-S396 PolarHBondContact O-N 3.05Å; S396-W399 PolarHBondContact O-N 3.11Å; S396-A400 WeakPolarHBondContact O-CB 3.26Å; S396-A400 PolarHBondContact O-N 3.11Å
397	V	94.3	Very high	91.3	Very high	34 Å²	34	46.5 Å²	46.5	21%	0.206	27%	0.265	C	S	.	.	H	α-helix	trans	-66.7	-42.7	174.9	174	0	0	0	0	111	V393 V394 N395 W399 A400 N401 V564 V567	V393-V397 PolarHBondContact O-N 3.41Å; V393-V397 VanDerWaalsContact O-N 3.15Å; V394-V397 PolarHBondContact O-N 3.46Å; V394-V397 VanDerWaalsContact O-N 3.11Å; N395-V397 VanDerWaalsContact C-N 3.32Å; N395-V397 PolarHBondContact O-N 3.44Å; V397-W399 VanDerWaalsContact C-N 3.35Å; V397-W399 PolarHBondContact O-N 3.33Å; V397-A400 PolarHBondContact O-N 2.79Å; V397-N401 PolarHBondContact O-N 3.2Å; V397-N401 PolarHBondContact O-ND2 3.5Å; V397-V564 HydrophobicContact CG1-CG2 4.21Å; V397-V567 HydrophobicContact CG2-CB 4.46Å; V397-V567 HydrophobicContact CG2-CG1 4.08Å; V397-V567 HydrophobicContact CG2-CG2 4.35Å
398	H	92.3	Very high	90.9	Very high	5 Å²	5	45 Å²	45	2%	0.023	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-42.1	174.3	-70.8	-71.9	0	0	0	112.5	V394 N395 N401 G402 S403 A406 V564 E568	V394-H398 PolarHBondContact O-CD2 3.48Å; V394-H398 PolarHBondContact O-N 3.49Å; V394-H398 VanDerWaalsContact O-N 3.07Å; N395-H398 PolarHBondContact O-N 3.41Å; H398-N401 PolarHBondContact O-N 3.35Å; H398-G402 PolarHBondContact O-N 2.98Å; H398-S403 PolarHBondContact ND1-OG 3.39Å; H398-S403 PolarHBondContact O-N 3.03Å; H398-A406 HydrophobicContact CB-CB 3.84Å; H398-V564 VanDerWaalsContact CE1-CG1 3.43Å; H398-V564 WeakPolarHBondContact CE1-CG1 3.05Å; H398-V564 WeakPolarHBondContact ND1-CG1 3.38Å; H398-E568 IonicContact CE1-OE2 2.9Å; H398-E568 PolarHBondContact CE1-OE2 2.92Å; H398-E568 IonicContact NE2-OE2 3.57Å; H398-E568 PolarHBondContact NE2-OE2 3.3Å
399	W	90.9	Very high	90.5	Very high	148 Å²	148	45.5 Å²	45.5	56%	0.561	28%	0.277	S	S	*	.	H	α-helix	trans	-62.4	-43.2	176.1	-92.7	93.4	0	0	0	112.2	N395 S396 V397 N401 G402 A406 L407	N395-W399 PolarHBondContact ND2-NE1 3.47Å; N395-W399 WeakPolarHBondContact O-CB 3.42Å; N395-W399 VanDerWaalsContact O-CD1 3.28Å; N395-W399 PolarHBondContact O-N 2.96Å; S396-W399 PolarHBondContact O-N 3.11Å; V397-W399 VanDerWaalsContact C-N 3.35Å; V397-W399 PolarHBondContact O-N 3.33Å; W399-N401 PolarHBondContact O-N 3.11Å; W399-G402 PolarHBondContact O-N 3.2Å; W399-A406 HydrophobicContact CD2-CB 4.31Å; W399-A406 HydrophobicContact CG-CB 4Å; W399-L407 PolarHBondContact NE1-O 3.42Å; W399-L407 VanDerWaalsContact NE1-O 3.11Å
400	A	92.3	Very high	90.1	Very high	86 Å²	86	44.8 Å²	44.8	71%	0.711	28%	0.277	S	S	*	.	H	α-helix	trans	-63.8	-28.8	178.8	0	0	0	0	0	113.1	S396 V397	S396-A400 WeakPolarHBondContact O-CB 3.26Å; S396-A400 PolarHBondContact O-N 3.11Å; V397-A400 PolarHBondContact O-N 2.79Å
401	N	90.8	Very high	89.7	Confident	80 Å²	80	44.4 Å²	44.4	43%	0.428	28%	0.275	S	S	.	.	H	α-helix	trans	-99.7	-0.5	-179.8	-67	-82	0	0	0	113.6	Y59 V397 H398 W399 S403 V564	Y59-N401 WeakPolarHBondContact CE1-O 3.47Å; V397-N401 PolarHBondContact O-N 3.2Å; V397-N401 PolarHBondContact O-ND2 3.5Å; H398-N401 PolarHBondContact O-N 3.35Å; W399-N401 PolarHBondContact O-N 3.11Å; N401-S403 VanDerWaalsContact C-N 3.3Å; N401-S403 PolarHBondContact O-N 2.88Å; N401-V564 HydrophobicContact CB-CG2 3.73Å
402	G	89.8	Confident	89.4	Confident	35 Å²	35	44.3 Å²	44.3	36%	0.361	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	20.3	179.8	0	0	0	0	0	115.1	Q63 H398 W399	Q63-G402 PolarHBondContact NE2-O 2.97Å; Q63-G402 VanDerWaalsContact NE2-O 3.07Å; H398-G402 PolarHBondContact O-N 2.98Å; W399-G402 PolarHBondContact O-N 3.2Å
403	S	91.9	Very high	89.2	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.028	28%	0.284	C	S	.	.			trans	-70	142.2	-178.5	164.1	0	0	0	0	112.1	T58 H398 N401 Q405 A406	T58-S403 CarbonylContact O-C 3.59Å; T58-S403 WeakPolarHBondContact O-CA 3.49Å; T58-S403 PolarHBondContact O-OG 2.83Å; H398-S403 PolarHBondContact ND1-OG 3.39Å; H398-S403 PolarHBondContact O-N 3.03Å; N401-S403 VanDerWaalsContact C-N 3.3Å; N401-S403 PolarHBondContact O-N 2.88Å; S403-Q405 VanDerWaalsContact C-N 3.27Å; S403-Q405 PolarHBondContact O-N 3.47Å; S403-Q405 PolarHBondContact OG-N 2.83Å; S403-A406 WeakPolarHBondContact O-CB 3.32Å; S403-A406 PolarHBondContact O-N 3.2Å
404	T	89.4	Confident	88.9	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-21.6	178.6	51	0	0	0	0	113.5	T58 H60 G85 R87 A406	T58-T404 VanDerWaalsContact C-OG1 3.24Å; T58-T404 VanDerWaalsContact CB-OG1 3.32Å; T58-T404 WeakPolarHBondContact CB-OG1 3.22Å; T58-T404 PolarHBondContact O-N 2.87Å; T58-T404 PolarHBondContact O-OG1 3.21Å; T58-T404 VanDerWaalsContact O-OG1 3.14Å; T58-T404 PolarHBondContact OG1-OG1 3.45Å; H60-T404 HydrophobicContact CB-CG2 3.95Å; G85-T404 WeakPolarHBondContact O-CB 3.26Å; G85-T404 PolarHBondContact O-OG1 3.47Å; R87-T404 HydrophobicContact CB-CG2 4.18Å; R87-T404 HydrophobicContact CG-CG2 3.72Å; R87-T404 PolarHBondContact NH2-O 2.79Å; T404-A406 PolarHBondContact O-N 3.45Å
405	Q	86.8	Confident	88.4	Confident	24 Å²	24	48.9 Å²	48.9	11%	0.112	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-15	167.7	-66.3	-55.7	-22.5	0	0	113.7	Q56 T58 D84 S403 L407	Q56-Q405 WeakPolarHBondContact O-CG 3.21Å; T58-Q405 PolarHBondContact OG1-NE2 2.9Å; D84-Q405 PolarHBondContact O-NE2 3.47Å; S403-Q405 VanDerWaalsContact C-N 3.27Å; S403-Q405 PolarHBondContact O-N 3.47Å; S403-Q405 PolarHBondContact OG-N 2.83Å; Q405-L407 PolarHBondContact O-N 3.08Å; Q405-L407 VanDerWaalsContact O-N 3.14Å
406	A	89.5	Confident	88.2	Confident	13 Å²	13	50.8 Å²	50.8	11%	0.107	30%	0.302	C	S	.	.	S	Bend	trans	-61.3	118.6	171.3	0	0	0	0	0	109.6	R87 H398 W399 S403 T404	R87-A406 PolarHBondContact NH2-O 3.01Å; H398-A406 HydrophobicContact CB-CB 3.84Å; W399-A406 HydrophobicContact CD2-CB 4.31Å; W399-A406 HydrophobicContact CG-CB 4Å; S403-A406 WeakPolarHBondContact O-CB 3.32Å; S403-A406 PolarHBondContact O-N 3.2Å; T404-A406 PolarHBondContact O-N 3.45Å
407	L	85.8	Confident	87.9	Confident	14 Å²	14	51 Å²	51	7%	0.073	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-75.3	133	179.2	-67.1	-179.3	0	0	0	109.8	L83 W391 N395 W399 Q405 I412 L415	L83-L407 HydrophobicContact CD2-CD1 4.1Å; L83-L407 HydrophobicContact CD2-CD2 4.03Å; W391-L407 HydrophobicContact CZ2-CB 4.34Å; W391-L407 HydrophobicContact CZ2-CD1 4.05Å; N395-L407 PolarHBondContact OD1-N 3.44Å; W399-L407 PolarHBondContact NE1-O 3.42Å; W399-L407 VanDerWaalsContact NE1-O 3.11Å; Q405-L407 PolarHBondContact O-N 3.08Å; Q405-L407 VanDerWaalsContact O-N 3.14Å; L407-I412 HydrophobicContact CB-CD1 4.3Å; L407-I412 HydrophobicContact CB-CG1 3.99Å; L407-I412 WeakPolarHBondContact O-CD1 3.41Å; L407-L415 HydrophobicContact CD1-CD1 4.35Å
408	P	84.5	Confident	87.5	Confident	38 Å²	38	51.9 Å²	51.9	25%	0.247	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-63.9	149.6	174.2	-20.1	33.2	0	0	0	110.9	T410 T411 I412	P408-T410 PolarHBondContact O-N 2.95Å; P408-T410 VanDerWaalsContact O-N 3.09Å; P408-T411 PolarHBondContact O-N 3.5Å; P408-I412 WeakPolarHBondContact O-CG1 3.36Å; P408-I412 PolarHBondContact O-N 3.19Å; P408-I412 VanDerWaalsContact O-N 3.11Å
409	A	83	Confident	87.3	Confident	65 Å²	65	54.5 Å²	54.5	54%	0.537	32%	0.316	S	S	.	.	H	α-helix	trans	-54	-33.6	178.3	0	0	0	0	0	113.1	I412 L413	A409-I412 PolarHBondContact O-N 3.38Å; A409-L413 WeakPolarHBondContact O-CG 3.39Å; A409-L413 PolarHBondContact O-N 3.4Å
410	T	85	Confident	87.2	Confident	104 Å²	104	52 Å²	52	64%	0.638	31%	0.313	S	S	*	.	H	α-helix	trans	-63.3	-46	176.8	50.1	0	0	0	0	112.3	P408 I412 L413 L414	P408-T410 PolarHBondContact O-N 2.95Å; P408-T410 VanDerWaalsContact O-N 3.09Å; T410-I412 VanDerWaalsContact C-N 3.32Å; T410-I412 PolarHBondContact O-N 3.42Å; T410-L413 PolarHBondContact O-N 3.17Å; T410-L414 WeakPolarHBondContact O-CB 3.3Å; T410-L414 PolarHBondContact O-N 3.38Å
411	T	84.1	Confident	87.1	Confident	15 Å²	15	53.8 Å²	53.8	9%	0.092	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-38.6	177	-51.5	0	0	0	0	111	L79 V82 P408 L414 L415	L79-T411 HydrophobicContact CD1-CG2 3.85Å; V82-T411 HydrophobicContact CG1-CG2 4.03Å; P408-T411 PolarHBondContact O-N 3.5Å; T411-L414 WeakPolarHBondContact O-CB 3.33Å; T411-L414 PolarHBondContact O-N 3.43Å; T411-L415 HydrophobicContact CG2-CD1 4.42Å; T411-L415 WeakPolarHBondContact O-CG 3.43Å; T411-L415 PolarHBondContact O-N 3.4Å
412	I	85.7	Confident	87.1	Confident	32 Å²	32	52.8 Å²	52.8	16%	0.164	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-49.3	177	-62.3	163.9	0	0	0	110.6	W391 L407 P408 A409 T410 L414 L415 L416	W391-I412 HydrophobicContact CH2-CB 4.19Å; W391-I412 HydrophobicContact CH2-CD1 3.47Å; W391-I412 VanDerWaalsContact CH2-CD1 3.47Å; W391-I412 HydrophobicContact CH2-CG1 3.47Å; W391-I412 VanDerWaalsContact CH2-CG1 3.47Å; W391-I412 HydrophobicContact CH2-CG2 3.64Å; W391-I412 HydrophobicContact CZ2-CD1 3.79Å; W391-I412 HydrophobicContact CZ2-CG1 3.58Å; W391-I412 HydrophobicContact CZ2-CG2 4.44Å; W391-I412 HydrophobicContact CZ3-CG2 4.22Å; L407-I412 HydrophobicContact CB-CD1 4.3Å; L407-I412 HydrophobicContact CB-CG1 3.99Å; L407-I412 WeakPolarHBondContact O-CD1 3.41Å; P408-I412 WeakPolarHBondContact O-CG1 3.36Å; P408-I412 PolarHBondContact O-N 3.19Å; P408-I412 VanDerWaalsContact O-N 3.11Å; A409-I412 PolarHBondContact O-N 3.38Å; T410-I412 VanDerWaalsContact C-N 3.32Å; T410-I412 PolarHBondContact O-N 3.42Å; I412-L414 VanDerWaalsContact C-N 3.29Å; I412-L414 PolarHBondContact O-N 3.41Å; I412-L415 PolarHBondContact O-N 3.2Å; I412-L416 HydrophobicContact CG2-CD1 4.03Å; I412-L416 WeakPolarHBondContact O-CB 3.35Å; I412-L416 WeakPolarHBondContact O-CG 3.44Å; I412-L416 PolarHBondContact O-N 2.84Å
413	L	87.1	Confident	87.1	Confident	111 Å²	111	51.2 Å²	51.2	58%	0.581	29%	0.29	S	S	*	.	H	α-helix	trans	-60.7	-39.4	176.1	-72.9	170.6	0	0	0	111.7	A409 T410 T417	A409-L413 WeakPolarHBondContact O-CG 3.39Å; A409-L413 PolarHBondContact O-N 3.4Å; T410-L413 PolarHBondContact O-N 3.17Å; L413-T417 VanDerWaalsContact O-CB 3.28Å; L413-T417 WeakPolarHBondContact O-CB 2.92Å; L413-T417 PolarHBondContact O-N 2.89Å; L413-T417 PolarHBondContact O-OG1 3.23Å
414	L	85.8	Confident	87.1	Confident	85 Å²	85	54.5 Å²	54.5	45%	0.445	30%	0.304	S	S	.	.	H	α-helix	trans	-62.6	-48.4	176.2	-177.3	122.5	0	0	0	111.7	L79 T410 T411 I412 T417 V418	L79-L414 HydrophobicContact CD1-CD2 3.75Å; L79-L414 HydrophobicContact CD2-CD2 3.94Å; L79-L414 HydrophobicContact CG-CD2 4.46Å; T410-L414 WeakPolarHBondContact O-CB 3.3Å; T410-L414 PolarHBondContact O-N 3.38Å; T411-L414 WeakPolarHBondContact O-CB 3.33Å; T411-L414 PolarHBondContact O-N 3.43Å; I412-L414 VanDerWaalsContact C-N 3.29Å; I412-L414 PolarHBondContact O-N 3.41Å; L414-T417 PolarHBondContact O-N 3.45Å; L414-V418 WeakPolarHBondContact O-CG2 3.11Å; L414-V418 PolarHBondContact O-N 3.01Å
415	L	84.6	Confident	87.4	Confident	44 Å²	44	56.1 Å²	56.1	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-42.4	178.3	-67.5	174.9	0	0	0	112.1	L83 I346 L407 T411 I412 T417 V418 W419	L83-L415 HydrophobicContact CD2-CD1 4.15Å; I346-L415 HydrophobicContact CD1-CD2 4.12Å; L407-L415 HydrophobicContact CD1-CD1 4.35Å; T411-L415 HydrophobicContact CG2-CD1 4.42Å; T411-L415 WeakPolarHBondContact O-CG 3.43Å; T411-L415 PolarHBondContact O-N 3.4Å; I412-L415 PolarHBondContact O-N 3.2Å; L415-T417 VanDerWaalsContact C-N 3.31Å; L415-T417 PolarHBondContact O-N 3.44Å; L415-V418 PolarHBondContact O-N 2.9Å; L415-W419 WeakPolarHBondContact O-CB 3.37Å; L415-W419 PolarHBondContact O-N 3.25Å
416	L	85.9	Confident	87.8	Confident	56 Å²	56	57.2 Å²	57.2	29%	0.293	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-41.3	174	-76.2	171.2	0	0	0	111.6	F388 I412 W419 L420	F388-L416 HydrophobicContact CD1-CD2 4.3Å; F388-L416 HydrophobicContact CE1-CD2 3.52Å; F388-L416 HydrophobicContact CE1-CG 4.36Å; F388-L416 HydrophobicContact CE2-CD2 4.19Å; F388-L416 HydrophobicContact CZ-CD2 3.47Å; F388-L416 VanDerWaalsContact CZ-CD2 3.47Å; I412-L416 HydrophobicContact CG2-CD1 4.03Å; I412-L416 WeakPolarHBondContact O-CB 3.35Å; I412-L416 WeakPolarHBondContact O-CG 3.44Å; I412-L416 PolarHBondContact O-N 2.84Å; L416-W419 PolarHBondContact O-N 3.16Å; L416-L420 WeakPolarHBondContact O-CB 3.25Å; L416-L420 WeakPolarHBondContact O-CG 3.41Å; L416-L420 PolarHBondContact O-N 3.1Å
417	T	87.1	Confident	88.1	Confident	68 Å²	68	56.8 Å²	56.8	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-66.3	-43.7	178	-58.2	0	0	0	0	111.3	L413 L414 L415 W419 L420 L421	L413-T417 VanDerWaalsContact O-CB 3.28Å; L413-T417 WeakPolarHBondContact O-CB 2.92Å; L413-T417 PolarHBondContact O-N 2.89Å; L413-T417 PolarHBondContact O-OG1 3.23Å; L414-T417 PolarHBondContact O-N 3.45Å; L415-T417 VanDerWaalsContact C-N 3.31Å; L415-T417 PolarHBondContact O-N 3.44Å; T417-W419 VanDerWaalsContact C-N 3.32Å; T417-W419 PolarHBondContact O-N 3.41Å; T417-L420 PolarHBondContact O-N 3.32Å; T417-L421 HydrophobicContact CG2-CD1 3.49Å; T417-L421 VanDerWaalsContact CG2-CD1 3.49Å; T417-L421 HydrophobicContact CG2-CG 3.95Å; T417-L421 VanDerWaalsContact O-CB 3.28Å; T417-L421 WeakPolarHBondContact O-CB 3.37Å; T417-L421 WeakPolarHBondContact O-CG 3.39Å; T417-L421 PolarHBondContact O-N 2.93Å
418	V	86	Confident	88.6	Confident	53 Å²	53	58 Å²	58	32%	0.321	33%	0.325	S	S	.	.	H	α-helix	trans	-61	-42.8	174.7	171.5	0	0	0	0	110.8	L414 L415 V422 G423	L414-V418 WeakPolarHBondContact O-CG2 3.11Å; L414-V418 PolarHBondContact O-N 3.01Å; L415-V418 PolarHBondContact O-N 2.9Å; V418-V422 WeakPolarHBondContact O-CA 3.32Å; V418-V422 VanDerWaalsContact O-CB 3.24Å; V418-V422 WeakPolarHBondContact O-CB 3.26Å; V418-V422 PolarHBondContact O-N 3.1Å; V418-G423 PolarHBondContact O-N 3.35Å
419	W	87.3	Confident	89.1	Confident	61 Å²	61	59.9 Å²	59.9	23%	0.231	33%	0.332	C	S	.	.	I	π-helix	trans	-64.6	-43.8	176.5	179.4	84.6	0	0	0	112.3	T380 S384 F388 L415 L416 T417 G423 F424	T380-W419 HydrophobicContact CG2-CH2 4.23Å; T380-W419 HydrophobicContact CG2-CZ2 3.41Å; T380-W419 VanDerWaalsContact CG2-CZ2 3.41Å; S384-W419 PolarHBondContact OG-NE1 3.33Å; F388-W419 HydrophobicContact CE2-CD2 4.43Å; L415-W419 WeakPolarHBondContact O-CB 3.37Å; L415-W419 PolarHBondContact O-N 3.25Å; L416-W419 PolarHBondContact O-N 3.16Å; T417-W419 VanDerWaalsContact C-N 3.32Å; T417-W419 PolarHBondContact O-N 3.41Å; W419-G423 CarbonylContact O-C 3.46Å; W419-G423 WeakPolarHBondContact O-CA 3.39Å; W419-G423 PolarHBondContact O-N 2.97Å; W419-F424 PolarHBondContact O-N 2.95Å
420	L	89	Confident	89.7	Confident	94 Å²	94	56.8 Å²	56.8	49%	0.492	31%	0.307	S	S	.	.	I	π-helix	trans	-71.3	-37.7	179.7	-78.5	174	0	0	0	113.9	L416 T417 P425	L416-L420 WeakPolarHBondContact O-CB 3.25Å; L416-L420 WeakPolarHBondContact O-CG 3.41Å; L416-L420 PolarHBondContact O-N 3.1Å; T417-L420 PolarHBondContact O-N 3.32Å; L420-P425 WeakPolarHBondContact O-CD 3.43Å
421	L	90.5	Very high	90.2	Very high	125 Å²	125	51.8 Å²	51.8	65%	0.654	28%	0.276	S	S	*	.	I	π-helix	trans	-94.3	-24	-174.3	-62.9	-173.7	0	0	0	113.6	T417 P425	T417-L421 HydrophobicContact CG2-CD1 3.49Å; T417-L421 VanDerWaalsContact CG2-CD1 3.49Å; T417-L421 HydrophobicContact CG2-CG 3.95Å; T417-L421 VanDerWaalsContact O-CB 3.28Å; T417-L421 WeakPolarHBondContact O-CB 3.37Å; T417-L421 WeakPolarHBondContact O-CG 3.39Å; T417-L421 PolarHBondContact O-N 2.93Å; L421-P425 WeakPolarHBondContact O-CG 3.28Å
422	V	90	Very high	90.7	Very high	59 Å²	59	54.1 Å²	54.1	36%	0.358	29%	0.287	S	S	.	.	I	π-helix	trans	-113.7	-61.8	-179.4	-171.4	0	0	0	0	110.2	A350 V418 F424 P425 L426	A350-V422 HydrophobicContact CB-CG1 4.05Å; V418-V422 WeakPolarHBondContact O-CA 3.32Å; V418-V422 VanDerWaalsContact O-CB 3.24Å; V418-V422 WeakPolarHBondContact O-CB 3.26Å; V418-V422 PolarHBondContact O-N 3.1Å; V422-F424 PolarHBondContact O-N 3.36Å; V422-P425 WeakPolarHBondContact O-CD 3.4Å; V422-L426 HydrophobicContact CG1-CD1 4.15Å; V422-L426 HydrophobicContact CG1-CD2 4.48Å; V422-L426 WeakPolarHBondContact O-CB 3.5Å; V422-L426 VanDerWaalsContact O-CD1 3.22Å; V422-L426 WeakPolarHBondContact O-CD1 3.42Å; V422-L426 PolarHBondContact O-N 2.84Å
423	G	90.1	Very high	91.2	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.021	30%	0.303	C	S	.	.	I	π-helix	trans	-60.3	-51.8	-172.7	0	0	0	0	0	113.9	C353 V418 W419 L426 T427	C353-G423 WeakPolarHBondContact CB-O 3.46Å; V418-G423 PolarHBondContact O-N 3.35Å; W419-G423 CarbonylContact O-C 3.46Å; W419-G423 WeakPolarHBondContact O-CA 3.39Å; W419-G423 PolarHBondContact O-N 2.97Å; G423-L426 PolarHBondContact O-N 3.34Å; G423-T427 PolarHBondContact O-N 3.36Å; G423-T427 PolarHBondContact O-OG1 3.18Å
424	F	92.9	Very high	91.5	Very high	72 Å²	72	52.6 Å²	52.6	32%	0.316	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-49.7	-178.8	176.8	-100.9	0	0	0	112.6	T380 W419 V422 L426 T427 V428	T380-F424 HydrophobicContact CG2-CD2 3.78Å; W419-F424 PolarHBondContact O-N 2.95Å; V422-F424 PolarHBondContact O-N 3.36Å; F424-L426 VanDerWaalsContact C-N 3.34Å; F424-L426 PolarHBondContact O-N 3.43Å; F424-T427 WeakPolarHBondContact O-CA 3.49Å; F424-T427 WeakPolarHBondContact O-CB 3.47Å; F424-T427 PolarHBondContact O-N 3.45Å; F424-V428 HydrophobicContact CD1-CG2 4.33Å; F424-V428 HydrophobicContact CE1-CG2 3.92Å; F424-V428 HydrophobicContact CE2-CG2 4.23Å; F424-V428 HydrophobicContact CZ-CG2 3.87Å; F424-V428 WeakPolarHBondContact O-CG2 3.45Å; F424-V428 PolarHBondContact O-N 3.08Å
425	P	95.1	Very high	91.8	Very high	44 Å²	44	51.3 Å²	51.3	29%	0.286	27%	0.266	S	S	.	.	H	α-helix	trans	-59.2	-40.7	175.7	-29.3	39	0	0	0	113.2	L420 L421 V422 T427 V428 I429	L420-P425 WeakPolarHBondContact O-CD 3.43Å; L421-P425 WeakPolarHBondContact O-CG 3.28Å; V422-P425 WeakPolarHBondContact O-CD 3.4Å; P425-T427 VanDerWaalsContact C-N 3.29Å; P425-T427 PolarHBondContact O-N 3.46Å; P425-V428 PolarHBondContact O-N 2.94Å; P425-V428 VanDerWaalsContact O-N 3.15Å; P425-I429 VanDerWaalsContact O-CG1 3.27Å; P425-I429 WeakPolarHBondContact O-CG1 3.33Å; P425-I429 PolarHBondContact O-N 3.25Å
426	L	94.4	Very high	92.2	Very high	46 Å²	46	54 Å²	54	24%	0.241	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-38.1	174.8	-94.9	66.9	0	0	0	111.8	A350 C353 C354 V422 G423 F424 I429 G430	A350-L426 VanDerWaalsContact O-CD2 3.31Å; A350-L426 WeakPolarHBondContact O-CD2 3.29Å; C353-L426 HydrophobicContact CB-CB 4.28Å; C354-L426 WeakPolarHBondContact CA-O 3.43Å; V422-L426 HydrophobicContact CG1-CD1 4.15Å; V422-L426 HydrophobicContact CG1-CD2 4.48Å; V422-L426 WeakPolarHBondContact O-CB 3.5Å; V422-L426 VanDerWaalsContact O-CD1 3.22Å; V422-L426 WeakPolarHBondContact O-CD1 3.42Å; V422-L426 PolarHBondContact O-N 2.84Å; G423-L426 PolarHBondContact O-N 3.34Å; F424-L426 VanDerWaalsContact C-N 3.34Å; F424-L426 PolarHBondContact O-N 3.43Å; L426-I429 PolarHBondContact O-N 3.22Å; L426-G430 PolarHBondContact O-N 2.76Å
427	T	95.4	Very high	92.5	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-43.1	173.8	-48.4	0	0	0	0	111.2	C353 G357 I376 G423 F424 P425 G430 G431	C353-T427 WeakPolarHBondContact CB-OG1 3.4Å; G357-T427 WeakPolarHBondContact CA-O 3.35Å; I376-T427 HydrophobicContact CG2-CG2 4.22Å; G423-T427 PolarHBondContact O-N 3.36Å; G423-T427 PolarHBondContact O-OG1 3.18Å; F424-T427 WeakPolarHBondContact O-CA 3.49Å; F424-T427 WeakPolarHBondContact O-CB 3.47Å; F424-T427 PolarHBondContact O-N 3.45Å; P425-T427 VanDerWaalsContact C-N 3.29Å; P425-T427 PolarHBondContact O-N 3.46Å; T427-G430 PolarHBondContact O-N 3.11Å; T427-G431 PolarHBondContact O-N 2.81Å
428	V	96.1	Very high	92.6	Very high	39 Å²	39	53.6 Å²	53.6	24%	0.236	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-46.8	177.2	176.8	0	0	0	0	111.2	I376 F424 P425 G430 G431 I432	I376-V428 HydrophobicContact CG2-CG2 4.05Å; F424-V428 HydrophobicContact CD1-CG2 4.33Å; F424-V428 HydrophobicContact CE1-CG2 3.92Å; F424-V428 HydrophobicContact CE2-CG2 4.23Å; F424-V428 HydrophobicContact CZ-CG2 3.87Å; F424-V428 WeakPolarHBondContact O-CG2 3.45Å; F424-V428 PolarHBondContact O-N 3.08Å; P425-V428 PolarHBondContact O-N 2.94Å; P425-V428 VanDerWaalsContact O-N 3.15Å; V428-G430 PolarHBondContact O-N 3.44Å; V428-G431 CarbonylContact O-C 3.2Å; V428-G431 PolarHBondContact O-N 2.95Å; V428-G431 VanDerWaalsContact O-N 3.12Å; V428-I432 HydrophobicContact CG1-CD1 4.02Å; V428-I432 HydrophobicContact CG1-CG1 4.47Å; V428-I432 WeakPolarHBondContact O-CG1 3.39Å; V428-I432 PolarHBondContact O-N 3.35Å
429	I	96.1	Very high	92.7	Very high	78 Å²	78	54.8 Å²	54.8	40%	0.4	29%	0.29	S	S	.	.	H	α-helix	trans	-57.5	-50.8	177	-69.6	165.5	0	0	0	109.9	P425 L426 G431 I432 F433	P425-I429 VanDerWaalsContact O-CG1 3.27Å; P425-I429 WeakPolarHBondContact O-CG1 3.33Å; P425-I429 PolarHBondContact O-N 3.25Å; L426-I429 PolarHBondContact O-N 3.22Å; I429-G431 VanDerWaalsContact C-N 3.25Å; I429-G431 PolarHBondContact O-N 2.76Å; I429-I432 PolarHBondContact O-N 3.17Å; I429-I432 VanDerWaalsContact O-N 3.14Å; I429-F433 HydrophobicContact CG2-CD2 3.8Å; I429-F433 HydrophobicContact CG2-CE2 3.63Å; I429-F433 VanDerWaalsContact O-CD2 3.26Å; I429-F433 WeakPolarHBondContact O-CD2 3.37Å; I429-F433 PolarHBondContact O-N 3.36Å
430	G	95.4	Very high	92.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-54.8	-43	175.4	0	0	0	0	0	112	C354 Y358 L426 T427 V428 F433 G434	C354-G430 WeakPolarHBondContact O-CA 3.4Å; C354-G430 VanDerWaalsContact SG-CA 3.54Å; Y358-G430 WeakPolarHBondContact CA-O 3.5Å; Y358-G430 VanDerWaalsContact N-C 3.35Å; Y358-G430 PolarHBondContact N-O 2.98Å; L426-G430 PolarHBondContact O-N 2.76Å; T427-G430 PolarHBondContact O-N 3.11Å; V428-G430 PolarHBondContact O-N 3.44Å; G430-F433 PolarHBondContact O-N 3.37Å; G430-G434 PolarHBondContact O-N 2.86Å
431	G	95.4	Very high	92.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-34.2	177.5	0	0	0	0	0	115.1	G357 S361 T427 V428 I429 G434 K435	G357-G431 VanDerWaalsContact O-CA 3.24Å; G357-G431 WeakPolarHBondContact O-CA 3.26Å; S361-G431 VanDerWaalsContact CB-O 3.27Å; S361-G431 WeakPolarHBondContact CB-O 3.3Å; S361-G431 VanDerWaalsContact OG-CA 3.22Å; S361-G431 WeakPolarHBondContact OG-CA 3.23Å; T427-G431 PolarHBondContact O-N 2.81Å; V428-G431 CarbonylContact O-C 3.2Å; V428-G431 PolarHBondContact O-N 2.95Å; V428-G431 VanDerWaalsContact O-N 3.12Å; I429-G431 VanDerWaalsContact C-N 3.25Å; I429-G431 PolarHBondContact O-N 2.76Å; G431-G434 PolarHBondContact O-N 3.13Å; G431-K435 PolarHBondContact O-N 3.35Å
432	I	95.7	Very high	92.1	Very high	63 Å²	63	54.3 Å²	54.3	32%	0.323	30%	0.298	S	S	.	.	H	α-helix	trans	-65.2	-43.5	172.5	-67.2	165.9	0	0	0	110.5	W372 V428 I429 K435 N436	W372-I432 HydrophobicContact CH2-CG1 3.94Å; W372-I432 HydrophobicContact CZ3-CG1 3.98Å; V428-I432 HydrophobicContact CG1-CD1 4.02Å; V428-I432 HydrophobicContact CG1-CG1 4.47Å; V428-I432 WeakPolarHBondContact O-CG1 3.39Å; V428-I432 PolarHBondContact O-N 3.35Å; I429-I432 PolarHBondContact O-N 3.17Å; I429-I432 VanDerWaalsContact O-N 3.14Å; I432-K435 WeakPolarHBondContact O-CG 3.46Å; I432-N436 WeakPolarHBondContact O-CB 3.18Å; I432-N436 PolarHBondContact O-N 2.89Å
433	F	95.6	Very high	91.7	Very high	111 Å²	111	53.2 Å²	53.2	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-43.5	174	-78.3	-70.3	0	0	0	111.6	Y358 I429 G430 K435 N436 N437	Y358-F433 HydrophobicContact CD2-CB 4.17Å; I429-F433 HydrophobicContact CG2-CD2 3.8Å; I429-F433 HydrophobicContact CG2-CE2 3.63Å; I429-F433 VanDerWaalsContact O-CD2 3.26Å; I429-F433 WeakPolarHBondContact O-CD2 3.37Å; I429-F433 PolarHBondContact O-N 3.36Å; G430-F433 PolarHBondContact O-N 3.37Å; F433-K435 PolarHBondContact O-N 2.85Å; F433-N436 PolarHBondContact O-N 3.22Å; F433-N437 WeakPolarHBondContact O-CB 3.49Å; F433-N437 PolarHBondContact O-N 3.48Å; F433-N437 VanDerWaalsContact O-N 3.08Å
434	G	92.8	Very high	91.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-45.7	178.3	0	0	0	0	0	112.7	H362 G430 G431 A438	H362-G434 WeakPolarHBondContact CA-O 3.42Å; G430-G434 PolarHBondContact O-N 2.86Å; G431-G434 PolarHBondContact O-N 3.13Å; G434-A438 WeakPolarHBondContact O-CB 3.38Å; G434-A438 PolarHBondContact O-N 3.37Å
435	K	92.6	Very high	90.4	Very high	58 Å²	58	52.7 Å²	52.7	25%	0.252	30%	0.299	S	S	.	.	H	α-helix	trans	-68.3	-36.4	-179.7	87.7	-172.2	171	65.4	0	112.8	W372 G431 I432 F433	W372-K435 HydrophobicContact CD2-CD 3.63Å; W372-K435 HydrophobicContact CE3-CD 3.97Å; W372-K435 HydrophobicContact CG-CD 3.96Å; W372-K435 HydrophobicContact CH2-CD 4.49Å; W372-K435 HydrophobicContact CZ2-CD 4.2Å; W372-K435 HydrophobicContact CZ3-CD 4.38Å; G431-K435 PolarHBondContact O-N 3.35Å; I432-K435 WeakPolarHBondContact O-CG 3.46Å; F433-K435 PolarHBondContact O-N 2.85Å
436	N	92.6	Very high	89.5	Confident	101 Å²	101	61.5 Å²	61.5	54%	0.54	33%	0.326	S	S	.	.	H	α-helix	trans	-75.9	-31.6	-175.9	-72.4	-3.2	0	0	0	111.7	I432 F433	I432-N436 WeakPolarHBondContact O-CB 3.18Å; I432-N436 PolarHBondContact O-N 2.89Å; F433-N436 PolarHBondContact O-N 3.22Å
437	N	92.4	Very high	88.9	Confident	94 Å²	94	62.1 Å²	62.1	50%	0.503	33%	0.332	S	S	.	.	H	α-helix	trans	-88.4	-7.7	179.6	-65.9	-0.4	0	0	0	113.2	F433 S439	F433-N437 WeakPolarHBondContact O-CB 3.49Å; F433-N437 PolarHBondContact O-N 3.48Å; F433-N437 VanDerWaalsContact O-N 3.08Å; N437-S439 PolarHBondContact O-N 3.39Å
438	A	88.6	Confident	88.2	Confident	21 Å²	21	68.4 Å²	68.4	17%	0.174	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-72.4	119	-176.7	0	0	0	0	0	111.6	R365 G434	R365-A438 HydrophobicContact CB-CB 3.59Å; R365-A438 HydrophobicContact CG-CB 3.69Å; G434-A438 WeakPolarHBondContact O-CB 3.38Å; G434-A438 PolarHBondContact O-N 3.37Å
439	S	88.1	Confident	87.3	Confident	79 Å²	79	74.2 Å²	74.2	55%	0.552	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-83.2	159.7	164	-60.3	0	0	0	0	110.4	Q366 N437	Q366-S439 WeakPolarHBondContact CG-O 3.43Å; N437-S439 PolarHBondContact O-N 3.39Å
440	P	86.4	Confident	86.5	Confident	114 Å²	114	77.3 Å²	77.3	74%	0.74	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-53.8	148.4	171.2	-24.6	34.7	0	0	0	111.7	D442	P440-D442 PolarHBondContact O-N 2.77Å
441	F	86.6	Confident	85.8	Confident	22 Å²	22	79.1 Å²	79.1	10%	0.096	42%	0.42	C	S	.	.			trans	-63.8	112.1	176	-176.4	-91.8	0	0	0	110.2	F298 F300 F363 Q366 A443 W532 L593	F298-F441 AromaticContact CD1-CE1 3.75Å; F298-F441 HydrophobicContact CD1-CE1 3.75Å; F298-F441 HydrophobicContact CD1-CZ 4.02Å; F298-F441 HydrophobicContact CE1-CE1 4.46Å; F298-F441 HydrophobicContact CE1-CZ 4.46Å; F298-F441 HydrophobicContact CG-CE1 4.45Å; F300-F441 HydrophobicContact CE1-CB 4.29Å; F300-F441 HydrophobicContact CE1-CD1 4.13Å; F300-F441 HydrophobicContact CE1-CG 4.21Å; F300-F441 HydrophobicContact CZ-CB 4.26Å; F363-F441 HydrophobicContact CE2-CE2 4.44Å; Q366-F441 HydrophobicContact CB-CB 4.19Å; Q366-F441 WeakPolarHBondContact O-CB 3.2Å; Q366-F441 PolarHBondContact O-N 3.48Å; Q366-F441 VanDerWaalsContact O-N 3.12Å; F441-A443 HydrophobicContact CD1-CB 3.94Å; F441-A443 HydrophobicContact CE1-CB 3.88Å; F441-A443 PolarHBondContact O-N 2.89Å; F441-W532 HydrophobicContact CE2-CH2 4.24Å; F441-W532 HydrophobicContact CZ-CH2 4.11Å; F441-L593 HydrophobicContact CE2-CD1 4.14Å; F441-L593 HydrophobicContact CZ-CD1 4Å
442	D	81.3	Confident	85.2	Confident	134 Å²	134	84.1 Å²	84.1	72%	0.717	44%	0.439	S	S	*	.			trans	-76.5	104.9	174.1	-167.3	19.3	0	0	0	109.5	P440 R597	P440-D442 PolarHBondContact O-N 2.77Å; D442-R597 PolarHBondContact O-NH2 3.15Å
443	A	81.5	Confident	84.7	Confident	36 Å²	36	89.6 Å²	89.6	30%	0.298	46%	0.463	S	S	.	.			trans	-99.1	122.1	178.2	0	0	0	0	0	108.9	F298 F441 C445	F298-A443 HydrophobicContact CB-CB 3.93Å; F298-A443 HydrophobicContact CD1-CB 4.41Å; F298-A443 HydrophobicContact CD2-CB 4.36Å; F298-A443 HydrophobicContact CG-CB 3.97Å; F441-A443 HydrophobicContact CD1-CB 3.94Å; F441-A443 HydrophobicContact CE1-CB 3.88Å; F441-A443 PolarHBondContact O-N 2.89Å; A443-C445 PolarHBondContact O-N 2.74Å; A443-C445 VanDerWaalsContact O-N 3.13Å
444	P	78.8	Confident	84.2	Confident	49 Å²	49	86 Å²	86	32%	0.318	45%	0.448	S	S	.	.	S	Bend	trans	-54.7	-30.3	177.8	-27.8	33.1	0	0	0	114.6	F298 R597 V601	F298-P444 HydrophobicContact CE1-CG 4.45Å; F298-P444 HydrophobicContact CE2-CB 4.18Å; F298-P444 HydrophobicContact CE2-CG 4.05Å; F298-P444 HydrophobicContact CZ-CB 4.35Å; F298-P444 VanDerWaalsContact CZ-CD 3.44Å; F298-P444 HydrophobicContact CZ-CG 3.74Å; P444-R597 HydrophobicContact CG-CG 4.39Å; P444-V601 HydrophobicContact CB-CG2 3.94Å; P444-V601 HydrophobicContact CG-CG2 3.69Å
445	C	77.1	Confident	83.8	Confident	13 Å²	13	88.1 Å²	88.1	9%	0.088	46%	0.462	C	S	.	.	S	Bend	trans	-126.3	140.9	-179.1	-53.9	0	0	0	0	110.8	H294 F298 A443	H294-C445 WeakPolarHBondContact O-CB 3.35Å; F298-C445 HydrophobicContact CD2-CB 4.38Å; A443-C445 PolarHBondContact O-N 2.74Å; A443-C445 VanDerWaalsContact O-N 3.13Å
446	R	77.6	Confident	83.3	Confident	229 Å²	229	91.5 Å²	91.5	86%	0.864	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-71.6	137.2	174.5	-173.6	176.6	178.7	177	1	110.4
447	T	81.1	Confident	82.7	Confident	60 Å²	60	89.4 Å²	89.4	37%	0.368	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-85.5	143.7	178.6	49.9	0	0	0	0	112.8	T295 F298	T295-T447 WeakPolarHBondContact O-CA 3.44Å; T295-T447 WeakPolarHBondContact O-CB 3.22Å; F298-T447 HydrophobicContact CB-CG2 4.17Å
448	K	80.6	Confident	82.4	Confident	136 Å²	136	87.4 Å²	87.4	59%	0.591	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-79.4	154.4	171.1	-78	177.9	-180	172.7	0	110.5	T295	T295-K448 HydrophobicContact CG2-CD 4.1Å; T295-K448 HydrophobicContact CG2-CG 4.08Å; T295-K448 PolarHBondContact O-N 3.35Å
449	N	77.6	Confident	82.2	Confident	161 Å²	161	95.7 Å²	95.7	86%	0.861	50%	0.496	S	S	*	.	S	Bend	trans	-71.9	-30.9	-179.5	-71.2	-15.9	0	0	0	113
450	I	79.5	Confident	82	Confident	142 Å²	142	98 Å²	98	73%	0.728	49%	0.494	S	S	*	.	S	Bend	trans	-104.9	130	-178.5	-60.9	169.4	0	0	0	108.3
451	A	80.9	Confident	81.8	Confident	38 Å²	38	95.4 Å²	95.4	31%	0.314	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-68	135.9	176.2	0	0	0	0	0	110.9
452	R	82.1	Confident	81.8	Confident	106 Å²	106	96.4 Å²	96.4	40%	0.4	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-66.2	140.3	163.7	-173.9	179	168.5	108.4	-6.1	110.5	E527	R452-E527 IonicContact CZ-OE2 3.58Å; R452-E527 IonicContact NE-OE2 3.49Å; R452-E527 PolarHBondContact NE-OE2 3.14Å; R452-E527 IonicContact NH2-OE1 3.88Å; R452-E527 IonicContact NH2-OE2 2.82Å; R452-E527 PolarHBondContact NH2-OE2 3.04Å
453	E	84.4	Confident	82.1	Confident	177 Å²	177	92.1 Å²	92.1	83%	0.827	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-69.5	135.2	171.2	-172.8	171.1	-172.4	0	0	110.3
454	I	85.2	Confident	82.4	Confident	35 Å²	35	95.2 Å²	95.2	18%	0.179	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-86.6	125.1	-178.5	-61.8	166	0	0	0	108.1	D528 Y529 R530	I454-D528 HydrophobicContact CG2-CB 4.08Å; I454-Y529 HydrophobicContact CD1-CD1 4.34Å; I454-Y529 HydrophobicContact CD1-CE1 3.91Å; I454-Y529 HydrophobicContact CG1-CD1 4.16Å; I454-Y529 HydrophobicContact CG1-CE1 3.77Å; I454-R530 HydrophobicContact CD1-CG 3.99Å; I454-R530 VanDerWaalsContact CD1-CZ 3.45Å
455	P	84.7	Confident	82.9	Confident	45 Å²	45	95.3 Å²	95.3	29%	0.292	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-62.6	148	-179.7	23.3	-31.1	0	0	0	111.3	Q457 E527	P455-Q457 PolarHBondContact O-N 2.92Å; P455-Q457 VanDerWaalsContact O-N 3.1Å; P455-Q457 PolarHBondContact O-NE2 3.01Å; P455-E527 HydrophobicContact CG-CB 3.87Å; P455-E527 HydrophobicContact CG-CG 4.41Å
456	P	82.7	Confident	83.4	Confident	129 Å²	129	95.9 Å²	95.9	84%	0.838	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-59.3	118.6	-179.9	24.8	-33.4	0	0	0	109.9
457	Q	80.2	Confident	84.1	Confident	58 Å²	58	87.4 Å²	87.4	27%	0.271	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-87.8	140.6	-178.9	-63.6	-58.8	-55.7	0	0	110.7	P455 K461 G526	P455-Q457 PolarHBondContact O-N 2.92Å; P455-Q457 VanDerWaalsContact O-N 3.1Å; P455-Q457 PolarHBondContact O-NE2 3.01Å; Q457-K461 HydrophobicContact CB-CB 4.15Å; Q457-G526 PolarHBondContact NE2-O 3.38Å
458	P	85.9	Confident	84.6	Confident	52 Å²	52	87.3 Å²	87.3	34%	0.338	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-55.7	154.1	168.1	-25	34.4	0	0	0	112.3	Y460 K461	P458-Y460 HydrophobicContact CB-CD1 3.58Å; P458-Y460 HydrophobicContact CB-CE1 3.16Å; P458-Y460 HydrophobicContact CB-CE2 4.35Å; P458-Y460 HydrophobicContact CB-CG 4.31Å; P458-Y460 HydrophobicContact CG-CE1 3.81Å; P458-Y460 PolarHBondContact O-N 3.24Å; P458-Y460 VanDerWaalsContact O-N 3.08Å; P458-K461 PolarHBondContact O-N 3.28Å
459	W	84.6	Confident	85	Confident	195 Å²	195	83.7 Å²	83.7	74%	0.739	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-54.6	-33.8	-176.5	70.6	-93.5	0	0	0	113.6	K461 S462 I465	W459-K461 VanDerWaalsContact C-N 3.27Å; W459-K461 PolarHBondContact O-N 3.08Å; W459-S462 WeakPolarHBondContact O-CB 3.18Å; W459-S462 PolarHBondContact O-N 3.38Å; W459-S462 VanDerWaalsContact O-N 3.13Å; W459-S462 PolarHBondContact O-OG 2.86Å; W459-I465 HydrophobicContact CE3-CD1 4.44Å; W459-I465 HydrophobicContact CE3-CG1 4.25Å; W459-I465 HydrophobicContact CZ3-CD1 4.06Å; W459-I465 HydrophobicContact CZ3-CG1 4.25Å
460	Y	83.6	Confident	85.6	Confident	127 Å²	127	76 Å²	76	50%	0.498	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-72.1	-16.2	-179.3	61.9	-98.1	0	0	0	113.6	P458 I465	P458-Y460 HydrophobicContact CB-CD1 3.58Å; P458-Y460 HydrophobicContact CB-CE1 3.16Å; P458-Y460 HydrophobicContact CB-CE2 4.35Å; P458-Y460 HydrophobicContact CB-CG 4.31Å; P458-Y460 HydrophobicContact CG-CE1 3.81Å; P458-Y460 PolarHBondContact O-N 3.24Å; P458-Y460 VanDerWaalsContact O-N 3.08Å; Y460-I465 VanDerWaalsContact O-CG2 3.3Å; Y460-I465 WeakPolarHBondContact O-CG2 3.42Å
461	K	81.8	Confident	86.2	Confident	59 Å²	59	69.2 Å²	69.2	26%	0.257	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-94.9	5	172.1	-66.7	-173.7	-179.8	-177.5	0	112.8	Q457 P458 W459 H466	Q457-K461 HydrophobicContact CB-CB 4.15Å; P458-K461 PolarHBondContact O-N 3.28Å; W459-K461 VanDerWaalsContact C-N 3.27Å; W459-K461 PolarHBondContact O-N 3.08Å; K461-H466 PolarHBondContact O-CE1 3.28Å; K461-H466 PolarHBondContact O-ND1 2.88Å; K461-H466 VanDerWaalsContact O-ND1 3.12Å
462	S	86.8	Confident	86.7	Confident	44 Å²	44	72.6 Å²	72.6	31%	0.308	36%	0.364	S	S	.	.	S	Bend	trans	-62.3	158.5	178.6	67.8	0	0	0	0	112.1	W459 V464 I465 H466	W459-S462 WeakPolarHBondContact O-CB 3.18Å; W459-S462 PolarHBondContact O-N 3.38Å; W459-S462 VanDerWaalsContact O-N 3.13Å; W459-S462 PolarHBondContact O-OG 2.86Å; S462-V464 VanDerWaalsContact C-N 3.28Å; S462-V464 PolarHBondContact O-N 3.2Å; S462-I465 PolarHBondContact O-N 3.31Å; S462-I465 WeakPolarHBondContact OG-CG1 3.37Å; S462-H466 PolarHBondContact O-N 3.41Å; S462-H466 VanDerWaalsContact O-N 3.08Å; S462-H466 PolarHBondContact O-ND1 2.91Å
463	T	86.6	Confident	86.9	Confident	44 Å²	44	71.1 Å²	71.1	27%	0.27	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-35.7	179.6	-56.2	0	0	0	0	112.3	H466 M467 R534	T463-H466 PolarHBondContact O-N 3.45Å; T463-M467 HydrophobicContact CG2-CG 4.45Å; T463-M467 HydrophobicContact CG2-SD 4.17Å; T463-M467 VanDerWaalsContact O-CG 3.26Å; T463-M467 WeakPolarHBondContact O-CG 3.5Å; T463-M467 PolarHBondContact O-N 3.36Å; T463-R534 HydrophobicContact CG2-CG 4.24Å; T463-R534 PolarHBondContact OG1-NE 3.35Å; T463-R534 PolarHBondContact OG1-NH2 3.05Å
464	V	89.6	Confident	87.1	Confident	101 Å²	101	62.7 Å²	62.7	61%	0.612	33%	0.325	S	S	*	.	H	α-helix	trans	-64.3	-46.1	179	-179.9	0	0	0	0	110.8	S462 H466 M467 T468	S462-V464 VanDerWaalsContact C-N 3.28Å; S462-V464 PolarHBondContact O-N 3.2Å; V464-H466 PolarHBondContact O-N 3.35Å; V464-M467 WeakPolarHBondContact O-CB 3.4Å; V464-M467 PolarHBondContact O-N 3.32Å; V464-T468 WeakPolarHBondContact O-CG2 3.35Å; V464-T468 PolarHBondContact O-N 2.81Å; V464-T468 PolarHBondContact O-OG1 3.29Å
465	I	89.3	Confident	87.4	Confident	51 Å²	51	62.5 Å²	62.5	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-65.1	-40.8	178.3	-61.2	-61.5	0	0	0	111.2	W459 Y460 S462 M467 T468 V469	W459-I465 HydrophobicContact CE3-CD1 4.44Å; W459-I465 HydrophobicContact CE3-CG1 4.25Å; W459-I465 HydrophobicContact CZ3-CD1 4.06Å; W459-I465 HydrophobicContact CZ3-CG1 4.25Å; Y460-I465 VanDerWaalsContact O-CG2 3.3Å; Y460-I465 WeakPolarHBondContact O-CG2 3.42Å; S462-I465 PolarHBondContact O-N 3.31Å; S462-I465 WeakPolarHBondContact OG-CG1 3.37Å; I465-M467 VanDerWaalsContact C-N 3.3Å; I465-M467 PolarHBondContact O-N 3Å; I465-T468 VanDerWaalsContact CA-OG1 3.3Å; I465-T468 WeakPolarHBondContact CA-OG1 3.36Å; I465-T468 PolarHBondContact O-N 3.07Å; I465-T468 PolarHBondContact O-OG1 3.23Å; I465-V469 HydrophobicContact CG2-CG2 4.28Å; I465-V469 WeakPolarHBondContact O-CG2 3.04Å; I465-V469 PolarHBondContact O-N 3.38Å
466	H	86.3	Confident	87.5	Confident	25 Å²	25	62.9 Å²	62.9	12%	0.116	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-39.7	172.8	-81.6	127.1	0	0	0	113	K461 S462 T463 V464 G470	K461-H466 PolarHBondContact O-CE1 3.28Å; K461-H466 PolarHBondContact O-ND1 2.88Å; K461-H466 VanDerWaalsContact O-ND1 3.12Å; S462-H466 PolarHBondContact O-N 3.41Å; S462-H466 VanDerWaalsContact O-N 3.08Å; S462-H466 PolarHBondContact O-ND1 2.91Å; T463-H466 PolarHBondContact O-N 3.45Å; V464-H466 PolarHBondContact O-N 3.35Å; H466-G470 WeakPolarHBondContact O-CA 3.47Å; H466-G470 PolarHBondContact O-N 2.83Å
467	M	92.3	Very high	87.5	Confident	50 Å²	50	57.9 Å²	57.9	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-47.7	173.7	-69.3	174.5	73.2	0	0	110.6	T463 V464 I465 V469 G470 G471 L537 S541	T463-M467 HydrophobicContact CG2-CG 4.45Å; T463-M467 HydrophobicContact CG2-SD 4.17Å; T463-M467 VanDerWaalsContact O-CG 3.26Å; T463-M467 WeakPolarHBondContact O-CG 3.5Å; T463-M467 PolarHBondContact O-N 3.36Å; V464-M467 WeakPolarHBondContact O-CB 3.4Å; V464-M467 PolarHBondContact O-N 3.32Å; I465-M467 VanDerWaalsContact C-N 3.3Å; I465-M467 PolarHBondContact O-N 3Å; M467-V469 PolarHBondContact O-N 2.91Å; M467-G470 PolarHBondContact O-N 3.04Å; M467-G471 PolarHBondContact O-N 3.44Å; M467-L537 HydrophobicContact CE-CB 4.03Å; M467-L537 HydrophobicContact CE-CD2 4.04Å; M467-L537 HydrophobicContact CE-CG 4.48Å; M467-L537 HydrophobicContact CG-CB 3.98Å; M467-L537 HydrophobicContact SD-CB 3.97Å; M467-L537 HydrophobicContact SD-CD1 4.29Å; M467-S541 PolarHBondContact O-OG 3.46Å
468	T	92.5	Very high	87.7	Confident	59 Å²	59	55.5 Å²	55.5	36%	0.362	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-44	-179.3	53.8	0	0	0	0	112.4	V464 I465 F472 F545	V464-T468 WeakPolarHBondContact O-CG2 3.35Å; V464-T468 PolarHBondContact O-N 2.81Å; V464-T468 PolarHBondContact O-OG1 3.29Å; I465-T468 VanDerWaalsContact CA-OG1 3.3Å; I465-T468 WeakPolarHBondContact CA-OG1 3.36Å; I465-T468 PolarHBondContact O-N 3.07Å; I465-T468 PolarHBondContact O-OG1 3.23Å; T468-F472 WeakPolarHBondContact O-CB 3.43Å; T468-F472 PolarHBondContact O-N 3.08Å; T468-F545 WeakPolarHBondContact O-CZ 3.39Å
469	V	89.6	Confident	87.7	Confident	59 Å²	59	54.9 Å²	54.9	36%	0.358	28%	0.282	S	S	.	.	H	α-helix	trans	-69.2	-44.1	177.3	177.2	0	0	0	0	110.7	I465 M467 G471 L473 L519	I465-V469 HydrophobicContact CG2-CG2 4.28Å; I465-V469 WeakPolarHBondContact O-CG2 3.04Å; I465-V469 PolarHBondContact O-N 3.38Å; M467-V469 PolarHBondContact O-N 2.91Å; V469-G471 VanDerWaalsContact C-N 3.28Å; V469-G471 PolarHBondContact O-N 3.06Å; V469-L473 HydrophobicContact CG1-CD1 3.88Å; V469-L473 HydrophobicContact CG1-CG 4.46Å; V469-L473 WeakPolarHBondContact O-CG 3.37Å; V469-L473 PolarHBondContact O-N 3.18Å; V469-L519 HydrophobicContact CG1-CD2 4.34Å
470	G	88.8	Confident	87.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-30.6	-179.5	0	0	0	0	0	114.1	H466 M467 P474 S538	H466-G470 WeakPolarHBondContact O-CA 3.47Å; H466-G470 PolarHBondContact O-N 2.83Å; M467-G470 PolarHBondContact O-N 3.04Å; G470-P474 WeakPolarHBondContact O-CD 3.4Å; G470-P474 WeakPolarHBondContact O-CG 3.42Å; G470-S538 CarbonylContact C-O 3.49Å
471	G	91.8	Very high	87.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-95.3	-34.3	178.2	0	0	0	0	0	114.9	M467 V469 P474 F475 S538 S541 F545	M467-G471 PolarHBondContact O-N 3.44Å; V469-G471 VanDerWaalsContact C-N 3.28Å; V469-G471 PolarHBondContact O-N 3.06Å; G471-P474 WeakPolarHBondContact O-CD 3.41Å; G471-F475 WeakPolarHBondContact O-CB 3.4Å; G471-F475 PolarHBondContact O-N 3.2Å; G471-S538 PolarHBondContact N-O 3.3Å; G471-S541 VanDerWaalsContact CA-OG 3.22Å; G471-S541 WeakPolarHBondContact CA-OG 3.23Å; G471-S541 PolarHBondContact N-OG 3.4Å; G471-F545 VanDerWaalsContact C-CD2 3.41Å; G471-F545 VanDerWaalsContact C-CE2 3.47Å
472	F	91.3	Very high	87.4	Confident	109 Å²	109	40.3 Å²	40.3	48%	0.478	23%	0.231	S	C	.	.	H	α-helix	trans	-67.7	-41.4	-178.4	178	-102.2	0	0	0	111.9	T468 F475 S476 F545	T468-F472 WeakPolarHBondContact O-CB 3.43Å; T468-F472 PolarHBondContact O-N 3.08Å; F472-F475 PolarHBondContact O-N 3.31Å; F472-S476 WeakPolarHBondContact O-CB 3.17Å; F472-S476 PolarHBondContact O-N 2.93Å; F472-S476 PolarHBondContact O-OG 2.89Å; F472-F545 HydrophobicContact CB-CE1 4.01Å; F472-F545 HydrophobicContact CB-CE2 4.3Å; F472-F545 HydrophobicContact CB-CZ 3.83Å; F472-F545 HydrophobicContact CD2-CD1 4.4Å; F472-F545 HydrophobicContact CD2-CE1 4.07Å; F472-F545 VanDerWaalsContact N-CE2 3.34Å
473	L	86.5	Confident	87.3	Confident	75 Å²	75	42 Å²	42	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-65.9	-50.2	-176.9	-69	176.5	0	0	0	112.7	V469 F475 S476 A477 I515	V469-L473 HydrophobicContact CG1-CD1 3.88Å; V469-L473 HydrophobicContact CG1-CG 4.46Å; V469-L473 WeakPolarHBondContact O-CG 3.37Å; V469-L473 PolarHBondContact O-N 3.18Å; L473-F475 VanDerWaalsContact C-N 3.3Å; L473-F475 PolarHBondContact O-N 2.94Å; L473-S476 PolarHBondContact O-N 2.82Å; L473-S476 PolarHBondContact O-OG 2.91Å; L473-A477 PolarHBondContact O-N 2.97Å; L473-I515 HydrophobicContact CB-CD1 3.51Å; L473-I515 HydrophobicContact CD1-CD1 4.27Å; L473-I515 HydrophobicContact CD1-CG1 4.46Å
474	P	89.1	Confident	86.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-37.1	173.6	-17.2	29.3	0	0	0	112.6	G470 G471 A477 I478 L508 V511 I515 V539 T542	G470-P474 WeakPolarHBondContact O-CD 3.4Å; G470-P474 WeakPolarHBondContact O-CG 3.42Å; G471-P474 WeakPolarHBondContact O-CD 3.41Å; P474-A477 PolarHBondContact O-N 2.54Å; P474-I478 PolarHBondContact O-N 2.63Å; P474-L508 HydrophobicContact CB-CD1 4.01Å; P474-V511 HydrophobicContact CB-CG1 4.16Å; P474-V511 HydrophobicContact CG-CG1 4.38Å; P474-I515 HydrophobicContact CG-CD1 3.76Å; P474-V539 HydrophobicContact CG-CG1 3.99Å; P474-T542 HydrophobicContact CB-CG2 4.17Å
475	F	91.4	Very high	86.6	Confident	30 Å²	30	38.9 Å²	38.9	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-46.9	174.8	167.9	-101.8	0	0	0	112	G471 F472 L473 A477 I478 S479 L482 T542 F545 I546 Y549	G471-F475 WeakPolarHBondContact O-CB 3.4Å; G471-F475 PolarHBondContact O-N 3.2Å; F472-F475 PolarHBondContact O-N 3.31Å; L473-F475 VanDerWaalsContact C-N 3.3Å; L473-F475 PolarHBondContact O-N 2.94Å; F475-A477 PolarHBondContact O-N 3.49Å; F475-I478 CarbonylContact O-C 3.53Å; F475-I478 WeakPolarHBondContact O-CG1 3.42Å; F475-I478 PolarHBondContact O-N 2.67Å; F475-S479 PolarHBondContact O-N 3.4Å; F475-L482 HydrophobicContact CD2-CD2 4.27Å; F475-L482 HydrophobicContact CE2-CD2 3.76Å; F475-T542 HydrophobicContact CB-CG2 4.17Å; F475-F545 HydrophobicContact CB-CB 3.84Å; F475-F545 HydrophobicContact CB-CG 4.39Å; F475-F545 HydrophobicContact CD1-CB 4.16Å; F475-F545 HydrophobicContact CD2-CB 3.83Å; F475-F545 HydrophobicContact CE2-CB 4.46Å; F475-F545 HydrophobicContact CG-CB 3.66Å; F475-F545 HydrophobicContact CG-CG 4.43Å; F475-I546 HydrophobicContact CD2-CG1 4.38Å; F475-Y549 HydrophobicContact CE2-CD2 4.3Å; F475-Y549 HydrophobicContact CE2-CG 4.08Å; F475-Y549 AromaticContact CZ-CD2 3.92Å; F475-Y549 HydrophobicContact CZ-CD2 3.92Å; F475-Y549 HydrophobicContact CZ-CG 4.12Å
476	S	86.6	Confident	86.4	Confident	54 Å²	54	36.9 Å²	36.9	38%	0.378	20%	0.197	S	C	.	.	H	α-helix	trans	-61.6	-34.2	179.8	72.6	0	0	0	0	112.4	F472 L473 I478 S479	F472-S476 WeakPolarHBondContact O-CB 3.17Å; F472-S476 PolarHBondContact O-N 2.93Å; F472-S476 PolarHBondContact O-OG 2.89Å; L473-S476 PolarHBondContact O-N 2.82Å; L473-S476 PolarHBondContact O-OG 2.91Å; S476-I478 VanDerWaalsContact C-N 3.26Å; S476-I478 PolarHBondContact O-N 3.45Å; S476-S479 PolarHBondContact O-OG 2.9Å
477	A	82.6	Confident	86.2	Confident	23 Å²	23	36.2 Å²	36.2	19%	0.19	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-24.9	176.7	0	0	0	0	0	113.4	V246 L473 P474 F475 V511	V246-A477 HydrophobicContact CG1-CB 3.91Å; V246-A477 HydrophobicContact CG2-CB 4.38Å; L473-A477 PolarHBondContact O-N 2.97Å; P474-A477 PolarHBondContact O-N 2.54Å; F475-A477 PolarHBondContact O-N 3.49Å; A477-V511 HydrophobicContact CB-CG1 4.39Å; A477-V511 HydrophobicContact CB-CG2 4.32Å
478	I	85.5	Confident	85.5	Confident	8 Å²	8	35 Å²	35	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-111.5	0.5	-177.8	66.5	168.1	0	0	0	113.7	P474 F475 S476 V480 E481 L482 V504 L508 I546	P474-I478 PolarHBondContact O-N 2.63Å; F475-I478 CarbonylContact O-C 3.53Å; F475-I478 WeakPolarHBondContact O-CG1 3.42Å; F475-I478 PolarHBondContact O-N 2.67Å; S476-I478 VanDerWaalsContact C-N 3.26Å; S476-I478 PolarHBondContact O-N 3.45Å; I478-V480 VanDerWaalsContact C-N 3.3Å; I478-V480 PolarHBondContact O-N 3.45Å; I478-E481 PolarHBondContact O-N 2.94Å; I478-E481 VanDerWaalsContact O-N 3.08Å; I478-L482 WeakPolarHBondContact O-CB 3.16Å; I478-L482 PolarHBondContact O-N 3.33Å; I478-V504 HydrophobicContact CG2-CG1 4.24Å; I478-L508 HydrophobicContact CD1-CD1 4.05Å; I478-L508 HydrophobicContact CD1-CD2 4.16Å; I478-L508 HydrophobicContact CG2-CB 4.02Å; I478-L508 HydrophobicContact CG2-CD1 3.9Å; I478-L508 HydrophobicContact CG2-CG 4.37Å; I478-I546 HydrophobicContact CD1-CD1 4.45Å
479	S	84.4	Confident	85	Confident	40 Å²	40	36.1 Å²	36.1	28%	0.28	20%	0.197	S	C	.	.	H	α-helix	trans	-62.5	-34.5	-167.2	63.2	0	0	0	0	113.9	F475 S476 Y483	F475-S479 PolarHBondContact O-N 3.4Å; S476-S479 PolarHBondContact O-OG 2.9Å; S479-Y483 PolarHBondContact O-N 3.45Å
480	V	79.8	Confident	84.8	Confident	59 Å²	59	34 Å²	34	36%	0.358	18%	0.183	S	C	.	.	H	α-helix	trans	-67.4	-43.9	175.9	176	0	0	0	0	110.7	I478 Y483 Y484	I478-V480 VanDerWaalsContact C-N 3.3Å; I478-V480 PolarHBondContact O-N 3.45Å; V480-Y483 WeakPolarHBondContact O-CB 3.31Å; V480-Y483 PolarHBondContact O-N 3.45Å; V480-Y484 HydrophobicContact CG1-CE2 3.96Å; V480-Y484 WeakPolarHBondContact O-CD2 3.49Å
481	E	80.6	Confident	84.2	Confident	9 Å²	9	35.2 Å²	35.2	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-72.4	-34.8	-179	-57.2	-59.6	145.4	0	0	111.5	I239 I478 Y483 Y484 I485 V504	I239-E481 VanDerWaalsContact CG2-OE1 3.26Å; I239-E481 WeakPolarHBondContact CG2-OE1 3.43Å; I478-E481 PolarHBondContact O-N 2.94Å; I478-E481 VanDerWaalsContact O-N 3.08Å; E481-Y483 PolarHBondContact O-N 3.38Å; E481-Y484 PolarHBondContact O-N 3.32Å; E481-Y484 VanDerWaalsContact O-N 3.1Å; E481-I485 WeakPolarHBondContact O-CG1 3.3Å; E481-I485 PolarHBondContact O-N 3.05Å; E481-V504 HydrophobicContact CB-CG1 3.79Å; E481-V504 HydrophobicContact CB-CG2 4.11Å; E481-V504 HydrophobicContact CG-CB 4.42Å; E481-V504 HydrophobicContact CG-CG1 3.95Å; E481-V504 HydrophobicContact CG-CG2 3.54Å
482	L	84.7	Confident	83	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-36.6	174.7	-167.3	66.3	0	0	0	111.5	F475 I478 Y484 I485 F486 I546 Y549	F475-L482 HydrophobicContact CD2-CD2 4.27Å; F475-L482 HydrophobicContact CE2-CD2 3.76Å; I478-L482 WeakPolarHBondContact O-CB 3.16Å; I478-L482 PolarHBondContact O-N 3.33Å; L482-Y484 PolarHBondContact O-N 3.02Å; L482-I485 PolarHBondContact O-N 2.99Å; L482-F486 HydrophobicContact CD1-CD2 3.87Å; L482-F486 HydrophobicContact CD1-CE2 3.63Å; L482-F486 HydrophobicContact CD2-CE2 4.45Å; L482-F486 HydrophobicContact CG-CD2 3.87Å; L482-F486 HydrophobicContact CG-CE2 3.87Å; L482-F486 WeakPolarHBondContact O-CB 3.3Å; L482-F486 VanDerWaalsContact O-CD2 3.26Å; L482-F486 WeakPolarHBondContact O-CD2 3.47Å; L482-F486 PolarHBondContact O-N 3.19Å; L482-I546 HydrophobicContact CD1-CG2 4.37Å; L482-I546 HydrophobicContact CD2-CG1 4.09Å; L482-I546 HydrophobicContact CD2-CG2 4.35Å; L482-Y549 HydrophobicContact CD2-CD1 3.53Å; L482-Y549 HydrophobicContact CD2-CE1 4.06Å; L482-Y549 HydrophobicContact CD2-CG 3.94Å; L482-Y549 HydrophobicContact CG-CD1 3.99Å; L482-Y549 HydrophobicContact CG-CE1 4.07Å
483	Y	84.4	Confident	81.6	Confident	78 Å²	78	34 Å²	34	31%	0.306	19%	0.189	S	C	.	.	H	α-helix	trans	-58	-47.8	172.9	172.7	-99.7	0	0	0	111.8	S479 V480 E481 F486 A487 Y549 Y553	S479-Y483 PolarHBondContact O-N 3.45Å; V480-Y483 WeakPolarHBondContact O-CB 3.31Å; V480-Y483 PolarHBondContact O-N 3.45Å; E481-Y483 PolarHBondContact O-N 3.38Å; Y483-F486 PolarHBondContact O-N 2.93Å; Y483-A487 WeakPolarHBondContact O-CB 3.4Å; Y483-A487 PolarHBondContact O-N 3.47Å; Y483-Y549 WeakPolarHBondContact CA-OH 3.42Å; Y483-Y549 VanDerWaalsContact CB-OH 3.3Å; Y483-Y549 WeakPolarHBondContact CB-OH 3.36Å; Y483-Y553 HydrophobicContact CD2-CD2 4.24Å; Y483-Y553 AromaticContact CD2-CE2 3.89Å; Y483-Y553 HydrophobicContact CD2-CE2 3.89Å; Y483-Y553 AromaticContact CE2-CE2 3.94Å; Y483-Y553 HydrophobicContact CE2-CE2 3.94Å
484	Y	78.7	Confident	80.5	Confident	32 Å²	32	35.2 Å²	35.2	13%	0.125	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-37.1	179.9	-63.5	-57	0	0	0	112.1	L232 I239 V480 E481 L482 A487 T488	L232-Y484 HydrophobicContact CD1-CD1 4.46Å; L232-Y484 HydrophobicContact CD2-CD1 3.28Å; L232-Y484 HydrophobicContact CD2-CE1 3.72Å; L232-Y484 HydrophobicContact CD2-CG 4.15Å; L232-Y484 HydrophobicContact CG-CD1 4.01Å; L232-Y484 HydrophobicContact CG-CE1 4.12Å; I239-Y484 HydrophobicContact CD1-CD2 4.12Å; I239-Y484 HydrophobicContact CD1-CE2 3.75Å; I239-Y484 HydrophobicContact CG1-CE2 3.98Å; V480-Y484 HydrophobicContact CG1-CE2 3.96Å; V480-Y484 WeakPolarHBondContact O-CD2 3.49Å; E481-Y484 PolarHBondContact O-N 3.32Å; E481-Y484 VanDerWaalsContact O-N 3.1Å; L482-Y484 PolarHBondContact O-N 3.02Å; Y484-A487 PolarHBondContact O-N 3.34Å; Y484-T488 WeakPolarHBondContact O-CB 3.43Å; Y484-T488 VanDerWaalsContact O-CG2 3.23Å; Y484-T488 WeakPolarHBondContact O-CG2 3.02Å; Y484-T488 PolarHBondContact O-N 3.38Å; Y484-T488 VanDerWaalsContact O-N 3.1Å; Y484-T488 PolarHBondContact O-OG1 3.11Å
485	I	82	Confident	79.2	Confident	49 Å²	49	36.7 Å²	36.7	25%	0.251	20%	0.198	S	C	.	.	H	α-helix	trans	-62	-46.4	172.9	-65.9	168	0	0	0	110.1	E481 L482 T488 V489 L501	E481-I485 WeakPolarHBondContact O-CG1 3.3Å; E481-I485 PolarHBondContact O-N 3.05Å; L482-I485 PolarHBondContact O-N 2.99Å; I485-T488 PolarHBondContact O-N 3.43Å; I485-T488 PolarHBondContact O-OG1 3.33Å; I485-V489 HydrophobicContact CG2-CG2 4.06Å; I485-V489 WeakPolarHBondContact O-CB 3.42Å; I485-V489 VanDerWaalsContact O-CG2 3.3Å; I485-V489 WeakPolarHBondContact O-CG2 3.14Å; I485-V489 PolarHBondContact O-N 3.34Å; I485-L501 HydrophobicContact CD1-CD1 3.88Å; I485-L501 HydrophobicContact CG1-CD1 4.3Å
486	F	85.8	Confident	77.9	Confident	9 Å²	9	39.2 Å²	39.2	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-64.5	-43	177.9	-90.7	-113	0	0	0	112.3	L482 Y483 T488 W490 I546 Y549 S550 Y553 F569	L482-F486 HydrophobicContact CD1-CD2 3.87Å; L482-F486 HydrophobicContact CD1-CE2 3.63Å; L482-F486 HydrophobicContact CD2-CE2 4.45Å; L482-F486 HydrophobicContact CG-CD2 3.87Å; L482-F486 HydrophobicContact CG-CE2 3.87Å; L482-F486 WeakPolarHBondContact O-CB 3.3Å; L482-F486 VanDerWaalsContact O-CD2 3.26Å; L482-F486 WeakPolarHBondContact O-CD2 3.47Å; L482-F486 PolarHBondContact O-N 3.19Å; Y483-F486 PolarHBondContact O-N 2.93Å; F486-T488 PolarHBondContact O-N 3.03Å; F486-W490 AromaticContact CD1-CD1 3.57Å; F486-W490 AromaticContact CD1-NE1 3.88Å; F486-W490 AromaticContact CE1-NE1 3.83Å; F486-W490 VanDerWaalsContact O-CB 3.26Å; F486-W490 WeakPolarHBondContact O-CB 3.32Å; F486-W490 PolarHBondContact O-N 3.18Å; F486-I546 HydrophobicContact CE2-CG2 4.35Å; F486-I546 HydrophobicContact CZ-CG2 4.37Å; F486-Y549 HydrophobicContact CD2-CE1 4.42Å; F486-Y549 HydrophobicContact CG-CE1 4.32Å; F486-S550 VanDerWaalsContact CE1-CB 3.46Å; F486-Y553 HydrophobicContact CB-CD2 4.1Å; F486-Y553 HydrophobicContact CB-CE1 4.36Å; F486-Y553 HydrophobicContact CB-CE2 3.91Å; F486-Y553 HydrophobicContact CB-CG 4.41Å; F486-Y553 HydrophobicContact CD1-CD1 4.1Å; F486-Y553 HydrophobicContact CD1-CG 4.11Å; F486-F569 HydrophobicContact CD1-CE2 4.29Å; F486-F569 HydrophobicContact CD1-CZ 4.18Å; F486-F569 HydrophobicContact CE1-CE2 4.38Å; F486-F569 HydrophobicContact CE1-CZ 4.01Å
487	A	80.9	Confident	77.1	Confident	10 Å²	10	37.9 Å²	37.9	8%	0.083	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-26.4	176.8	0	0	0	0	0	113.1	L232 Y483 Y484 G491 Y553	L232-A487 HydrophobicContact CD1-CB 4.39Å; Y483-A487 WeakPolarHBondContact O-CB 3.4Å; Y483-A487 PolarHBondContact O-N 3.47Å; Y484-A487 PolarHBondContact O-N 3.34Å; A487-G491 WeakPolarHBondContact O-CA 3.37Å; A487-G491 PolarHBondContact O-N 2.71Å; A487-G491 VanDerWaalsContact O-N 3.08Å; A487-Y553 WeakPolarHBondContact CA-OH 3.35Å
488	T	78.4	Confident	76.9	Confident	25 Å²	25	39 Å²	39	15%	0.153	21%	0.205	C	C	.	.	H	α-helix	trans	-97.2	-35.3	-178.3	55.5	0	0	0	0	114.1	Y484 I485 F486 E493 Y495	Y484-T488 WeakPolarHBondContact O-CB 3.43Å; Y484-T488 VanDerWaalsContact O-CG2 3.23Å; Y484-T488 WeakPolarHBondContact O-CG2 3.02Å; Y484-T488 PolarHBondContact O-N 3.38Å; Y484-T488 VanDerWaalsContact O-N 3.1Å; Y484-T488 PolarHBondContact O-OG1 3.11Å; I485-T488 PolarHBondContact O-N 3.43Å; I485-T488 PolarHBondContact O-OG1 3.33Å; F486-T488 PolarHBondContact O-N 3.03Å; T488-E493 WeakPolarHBondContact CA-O 3.06Å; T488-E493 VanDerWaalsContact CB-O 3.27Å; T488-E493 WeakPolarHBondContact CB-O 3.45Å; T488-E493 HydrophobicContact CG2-CB 4.38Å; T488-E493 WeakPolarHBondContact CG2-O 3.2Å; T488-Y495 HydrophobicContact CG2-CD2 3.91Å; T488-Y495 HydrophobicContact CG2-CG 4.25Å
489	V	81.4	Confident	76.6	Confident	83 Å²	83	40.1 Å²	40.1	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-72.7	-41.7	174.6	172.3	0	0	0	0	110.9	I485	I485-V489 HydrophobicContact CG2-CG2 4.06Å; I485-V489 WeakPolarHBondContact O-CB 3.42Å; I485-V489 VanDerWaalsContact O-CG2 3.3Å; I485-V489 WeakPolarHBondContact O-CG2 3.14Å; I485-V489 PolarHBondContact O-N 3.34Å
490	W	85.3	Confident	76.3	Confident	14 Å²	14	39 Å²	39	5%	0.053	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-20	-175.7	-62.1	113.6	0	0	0	113.4	P55 Q56 F486 M560 E568 F569 Y572	P55-W490 VanDerWaalsContact CG-O 3.29Å; P55-W490 WeakPolarHBondContact CG-O 3.38Å; Q56-W490 HydrophobicContact CG-CE3 4.45Å; Q56-W490 HydrophobicContact CG-CZ3 4.31Å; F486-W490 AromaticContact CD1-CD1 3.57Å; F486-W490 AromaticContact CD1-NE1 3.88Å; F486-W490 AromaticContact CE1-NE1 3.83Å; F486-W490 VanDerWaalsContact O-CB 3.26Å; F486-W490 WeakPolarHBondContact O-CB 3.32Å; F486-W490 PolarHBondContact O-N 3.18Å; W490-M560 HydrophobicContact CB-CE 3.71Å; W490-M560 WeakPolarHBondContact O-CE 3.47Å; W490-E568 HydrophobicContact CZ3-CG 4.47Å; W490-F569 HydrophobicContact CB-CD2 4.32Å; W490-F569 HydrophobicContact CB-CE2 4.19Å; W490-F569 AromaticContact CD1-CE2 3.54Å; W490-F569 AromaticContact CD2-CD2 3.46Å; W490-F569 HydrophobicContact CD2-CD2 3.46Å; W490-F569 VanDerWaalsContact CD2-CD2 3.46Å; W490-F569 AromaticContact CD2-CE2 3.81Å; W490-F569 HydrophobicContact CD2-CE2 3.81Å; W490-F569 AromaticContact CE2-CD2 3.68Å; W490-F569 AromaticContact CE2-CE2 3.88Å; W490-F569 AromaticContact CE3-CD2 3.8Å; W490-F569 HydrophobicContact CE3-CD2 3.8Å; W490-F569 AromaticContact CG-CD2 3.71Å; W490-F569 HydrophobicContact CG-CD2 3.71Å; W490-F569 AromaticContact CG-CE2 3.59Å; W490-F569 HydrophobicContact CG-CE2 3.59Å; W490-F569 HydrophobicContact CH2-CB 4.49Å; W490-F569 HydrophobicContact CH2-CD2 4.46Å; W490-F569 HydrophobicContact CZ2-CD2 4.19Å; W490-F569 HydrophobicContact CZ3-CB 4.37Å; W490-F569 HydrophobicContact CZ3-CD2 4.29Å; W490-F569 AromaticContact NE1-CE2 3.69Å; W490-Y572 HydrophobicContact CH2-CD2 4.3Å
491	G	76.8	Confident	76.3	Confident	25 Å²	25	38.5 Å²	38.5	26%	0.258	20%	0.204	S	C	.	.	S	Bend	trans	-92	-166.2	175.8	0	0	0	0	0	113.4	A487	A487-G491 WeakPolarHBondContact O-CA 3.37Å; A487-G491 PolarHBondContact O-N 2.71Å; A487-G491 VanDerWaalsContact O-N 3.08Å
492	R	67.6	Low	76.6	Confident	46 Å²	46	41.7 Å²	41.7	17%	0.174	22%	0.218	C	C	.	.	S	Bend	trans	-96.6	-2.5	178.1	-60.7	-67.1	-179	91.6	3.2	113	P51 Y52 P55 Y128 F228	P51-R492 PolarHBondContact O-NH2 3.35Å; Y52-R492 PolarHBondContact O-NH2 3.04Å; P55-R492 VanDerWaalsContact CB-NE 3.27Å; P55-R492 HydrophobicContact CG-CG 4.17Å; Y128-R492 PolarHBondContact OH-NH1 2.94Å; F228-R492 HydrophobicContact CB-CB 4.36Å; F228-R492 HydrophobicContact CD1-CB 3.89Å; F228-R492 HydrophobicContact CD1-CG 3.98Å; F228-R492 HydrophobicContact CD2-CB 4.11Å; F228-R492 HydrophobicContact CE1-CB 4.32Å; F228-R492 HydrophobicContact CE1-CG 3.98Å; F228-R492 HydrophobicContact CE2-CB 4.48Å; F228-R492 HydrophobicContact CG-CB 3.84Å; F228-R492 HydrophobicContact CG-CG 4.4Å; F228-R492 HydrophobicContact CZ-CG 4.35Å
493	E	62.1	Low	76.6	Confident	37 Å²	37	47 Å²	47	17%	0.173	24%	0.241	C	C	.	.			trans	-87.8	132.3	-175.5	-61.1	-156.2	-169.8	0	0	111.1	T231 L232 T488	T231-E493 PolarHBondContact N-OE1 3.42Å; T231-E493 PolarHBondContact OG1-OE1 2.88Å; L232-E493 WeakPolarHBondContact CB-OE2 3.36Å; L232-E493 WeakPolarHBondContact CD1-OE2 3.44Å; L232-E493 PolarHBondContact N-OE1 3.26Å; L232-E493 PolarHBondContact N-OE2 3.49Å; T488-E493 WeakPolarHBondContact CA-O 3.06Å; T488-E493 VanDerWaalsContact CB-O 3.27Å; T488-E493 WeakPolarHBondContact CB-O 3.45Å; T488-E493 HydrophobicContact CG2-CB 4.38Å; T488-E493 WeakPolarHBondContact CG2-O 3.2Å
494	Q	62.3	Low	76.7	Confident	101 Å²	101	43.9 Å²	43.9	47%	0.472	23%	0.23	S	C	.	.			trans	-90.8	121.5	-179.9	-72.4	156.3	-20.7	0	0	110.1	V335 T496	V335-Q494 HydrophobicContact CG1-CB 4.37Å; Q494-T496 PolarHBondContact O-N 3.26Å
495	Y	62.1	Low	77.2	Confident	31 Å²	31	43.7 Å²	43.7	12%	0.122	23%	0.23	C	C	.	.			trans	-76.3	106.7	175.1	-163.1	-97.9	0	0	0	110.4	T488 L497 I500 L501	T488-Y495 HydrophobicContact CG2-CD2 3.91Å; T488-Y495 HydrophobicContact CG2-CG 4.25Å; Y495-L497 HydrophobicContact CE1-CB 3.88Å; Y495-L497 WeakPolarHBondContact CE1-O 3.29Å; Y495-I500 WeakPolarHBondContact OH-CG2 3.49Å; Y495-L501 HydrophobicContact CE1-CB 4.04Å
496	T	64.3	Low	77.6	Confident	83 Å²	83	43.3 Å²	43.3	51%	0.509	23%	0.234	S	C	.	.			trans	-97.6	-4.4	-178.2	54.9	0	0	0	0	113.4	Q494 Y498	Q494-T496 PolarHBondContact O-N 3.26Å; T496-Y498 PolarHBondContact O-N 3.12Å
497	L	70.4	Confident	77.6	Confident	26 Å²	26	44.2 Å²	44.2	14%	0.136	24%	0.239	C	C	.	.			trans	-93.2	58.7	-173.6	-58.7	-170.6	0	0	0	113.3	I234 W236 Y495 G499 I500 L501	I234-L497 HydrophobicContact CD1-CD1 3.73Å; I234-L497 HydrophobicContact CD1-CG 4.39Å; I234-L497 HydrophobicContact CG2-CD1 4.13Å; W236-L497 HydrophobicContact CE3-CD1 4.43Å; W236-L497 HydrophobicContact CH2-CD1 3.7Å; W236-L497 HydrophobicContact CH2-CD2 3.28Å; W236-L497 HydrophobicContact CH2-CG 4.16Å; W236-L497 HydrophobicContact CZ2-CD1 3.74Å; W236-L497 HydrophobicContact CZ2-CD2 3.73Å; W236-L497 HydrophobicContact CZ2-CG 4.4Å; W236-L497 HydrophobicContact CZ3-CD1 4.04Å; W236-L497 HydrophobicContact CZ3-CD2 4.1Å; Y495-L497 HydrophobicContact CE1-CB 3.88Å; Y495-L497 WeakPolarHBondContact CE1-O 3.29Å; L497-G499 PolarHBondContact O-N 3.06Å; L497-I500 HydrophobicContact CB-CB 4.4Å; L497-I500 HydrophobicContact CB-CD1 4.16Å; L497-I500 HydrophobicContact CB-CG1 4.31Å; L497-I500 HydrophobicContact CD1-CD1 3.6Å; L497-I500 PolarHBondContact O-N 3.44Å; L497-L501 PolarHBondContact O-N 3.03Å
498	Y	78.4	Confident	78.1	Confident	46 Å²	46	44 Å²	44	18%	0.18	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-28.5	179.7	-57	-57	0	0	0	114	A328 V335 T496 L501 F502	A328-Y498 HydrophobicContact CB-CD1 3.6Å; A328-Y498 HydrophobicContact CB-CD2 3.98Å; A328-Y498 HydrophobicContact CB-CE1 3.99Å; A328-Y498 HydrophobicContact CB-CE2 4.33Å; A328-Y498 HydrophobicContact CB-CG 3.6Å; V335-Y498 HydrophobicContact CG2-CE2 4.16Å; V335-Y498 VanDerWaalsContact CG2-OH 3.29Å; V335-Y498 WeakPolarHBondContact CG2-OH 3.48Å; T496-Y498 PolarHBondContact O-N 3.12Å; Y498-L501 PolarHBondContact O-N 3.3Å; Y498-F502 PolarHBondContact O-N 3.35Å; Y498-F502 VanDerWaalsContact O-N 3.11Å
499	G	78.6	Confident	78.8	Confident	32 Å²	32	44.3 Å²	44.3	33%	0.33	24%	0.237	S	C	.	.	H	α-helix	trans	-58.3	-48.2	173.3	0	0	0	0	0	113.6	L497 F502 F503	L497-G499 PolarHBondContact O-N 3.06Å; G499-F502 PolarHBondContact O-N 3.07Å; G499-F503 WeakPolarHBondContact O-CD2 3.37Å; G499-F503 PolarHBondContact O-N 3.03Å
500	I	77.1	Confident	79.2	Confident	16 Å²	16	43 Å²	43	8%	0.082	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-44.7	179.8	-63.2	-179	0	0	0	109.7	W236 I239 M243 Y495 L497 F502 F503 V504	W236-I500 HydrophobicContact CE3-CD1 4.36Å; W236-I500 HydrophobicContact CZ3-CD1 4.46Å; I239-I500 HydrophobicContact CD1-CD1 4.47Å; I239-I500 HydrophobicContact CG2-CD1 4.02Å; I239-I500 HydrophobicContact CG2-CG2 3.72Å; M243-I500 HydrophobicContact CE-CG2 4.46Å; M243-I500 HydrophobicContact SD-CG2 4.28Å; Y495-I500 WeakPolarHBondContact OH-CG2 3.49Å; L497-I500 HydrophobicContact CB-CB 4.4Å; L497-I500 HydrophobicContact CB-CD1 4.16Å; L497-I500 HydrophobicContact CB-CG1 4.31Å; L497-I500 HydrophobicContact CD1-CD1 3.6Å; L497-I500 PolarHBondContact O-N 3.44Å; I500-F502 PolarHBondContact O-N 3.06Å; I500-F503 PolarHBondContact O-N 3.11Å; I500-V504 HydrophobicContact CG2-CG2 4.01Å; I500-V504 VanDerWaalsContact O-CG2 3.31Å; I500-V504 WeakPolarHBondContact O-CG2 3.24Å; I500-V504 PolarHBondContact O-N 3.39Å
501	L	80.9	Confident	79.4	Confident	49 Å²	49	42.8 Å²	42.8	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-55.1	-38.8	177.7	-174.9	64.4	0	0	0	112.4	I325 I485 Y495 L497 Y498 F505	I325-L501 HydrophobicContact CD1-CG 4.41Å; I325-L501 HydrophobicContact CG1-CD2 4.28Å; I325-L501 HydrophobicContact CG1-CG 4.46Å; I485-L501 HydrophobicContact CD1-CD1 3.88Å; I485-L501 HydrophobicContact CG1-CD1 4.3Å; Y495-L501 HydrophobicContact CE1-CB 4.04Å; L497-L501 PolarHBondContact O-N 3.03Å; Y498-L501 PolarHBondContact O-N 3.3Å; L501-F505 VanDerWaalsContact O-CB 3.25Å; L501-F505 WeakPolarHBondContact O-CB 3.37Å; L501-F505 PolarHBondContact O-N 3.08Å
502	F	87.3	Confident	80.2	Confident	76 Å²	76	41.6 Å²	41.6	33%	0.333	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-46.9	174.9	177.9	-101	0	0	0	112.9	I325 L329 Y498 G499 I500 F505 A506	I325-F502 HydrophobicContact CG2-CB 3.6Å; I325-F502 HydrophobicContact CG2-CD2 3.69Å; I325-F502 HydrophobicContact CG2-CG 4.13Å; L329-F502 HydrophobicContact CD1-CB 3.93Å; L329-F502 HydrophobicContact CD1-CD1 4.43Å; L329-F502 HydrophobicContact CD1-CD2 3.89Å; L329-F502 HydrophobicContact CD1-CG 3.82Å; L329-F502 HydrophobicContact CD2-CB 4.47Å; Y498-F502 PolarHBondContact O-N 3.35Å; Y498-F502 VanDerWaalsContact O-N 3.11Å; G499-F502 PolarHBondContact O-N 3.07Å; I500-F502 PolarHBondContact O-N 3.06Å; F502-F505 PolarHBondContact O-N 3.1Å; F502-A506 WeakPolarHBondContact O-CB 3.31Å; F502-A506 PolarHBondContact O-N 3.02Å
503	F	84.9	Confident	81.4	Confident	119 Å²	119	40.4 Å²	40.4	52%	0.522	22%	0.22	S	C	.	.	H	α-helix	trans	-64.6	-43.3	178.2	-72.8	-66	0	0	0	111.9	M243 G499 I500 F505 A506 I507	M243-F503 HydrophobicContact SD-CB 3.95Å; G499-F503 WeakPolarHBondContact O-CD2 3.37Å; G499-F503 PolarHBondContact O-N 3.03Å; I500-F503 PolarHBondContact O-N 3.11Å; F503-F505 VanDerWaalsContact C-N 3.32Å; F503-F505 PolarHBondContact O-N 2.96Å; F503-A506 PolarHBondContact O-N 3.38Å; F503-I507 WeakPolarHBondContact O-CB 3.18Å; F503-I507 VanDerWaalsContact O-CG1 3.24Å; F503-I507 WeakPolarHBondContact O-CG1 3.49Å; F503-I507 PolarHBondContact O-N 2.75Å
504	V	85.1	Confident	82.7	Confident	13 Å²	13	39.8 Å²	39.8	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-43.4	176.7	175.6	0	0	0	0	110.9	M243 I478 E481 I500 I507 L508	M243-V504 HydrophobicContact SD-CG2 4.17Å; I478-V504 HydrophobicContact CG2-CG1 4.24Å; E481-V504 HydrophobicContact CB-CG1 3.79Å; E481-V504 HydrophobicContact CB-CG2 4.11Å; E481-V504 HydrophobicContact CG-CB 4.42Å; E481-V504 HydrophobicContact CG-CG1 3.95Å; E481-V504 HydrophobicContact CG-CG2 3.54Å; I500-V504 HydrophobicContact CG2-CG2 4.01Å; I500-V504 VanDerWaalsContact O-CG2 3.31Å; I500-V504 WeakPolarHBondContact O-CG2 3.24Å; I500-V504 PolarHBondContact O-N 3.39Å; V504-I507 PolarHBondContact O-N 3.22Å; V504-L508 WeakPolarHBondContact O-CB 3.18Å; V504-L508 PolarHBondContact O-N 3.19Å
505	F	90.2	Very high	84.1	Confident	27 Å²	27	35.9 Å²	35.9	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-47.6	175	-176.1	-107.7	0	0	0	111.6	L318 I325 L501 F502 F503 I507 L508 L509 M583	L318-F505 HydrophobicContact CD1-CZ 4.06Å; I325-F505 HydrophobicContact CD1-CB 3.79Å; I325-F505 HydrophobicContact CD1-CD1 3.89Å; I325-F505 HydrophobicContact CD1-CD2 4.12Å; I325-F505 HydrophobicContact CD1-CE1 4.49Å; I325-F505 HydrophobicContact CD1-CG 3.67Å; L501-F505 VanDerWaalsContact O-CB 3.25Å; L501-F505 WeakPolarHBondContact O-CB 3.37Å; L501-F505 PolarHBondContact O-N 3.08Å; F502-F505 PolarHBondContact O-N 3.1Å; F503-F505 VanDerWaalsContact C-N 3.32Å; F503-F505 PolarHBondContact O-N 2.96Å; F505-I507 PolarHBondContact O-N 3.12Å; F505-L508 PolarHBondContact O-N 3.37Å; F505-L509 HydrophobicContact CD1-CD1 4.19Å; F505-L509 HydrophobicContact CE1-CD1 3.73Å; F505-L509 HydrophobicContact CE1-CG 4.44Å; F505-L509 HydrophobicContact CZ-CD1 4.07Å; F505-L509 HydrophobicContact CZ-CD2 4.49Å; F505-L509 WeakPolarHBondContact O-CG 3.14Å; F505-L509 PolarHBondContact O-N 2.74Å; F505-L509 VanDerWaalsContact O-N 3.13Å; F505-M583 HydrophobicContact CE2-CE 3.86Å; F505-M583 HydrophobicContact CE2-SD 3.72Å; F505-M583 HydrophobicContact CZ-SD 4.02Å
506	A	89.8	Confident	85.6	Confident	42 Å²	42	34.4 Å²	34.4	35%	0.347	20%	0.195	S	C	.	.	H	α-helix	trans	-62.6	-41.2	177.9	0	0	0	0	0	112.7	F502 F503 L509 S510	F502-A506 WeakPolarHBondContact O-CB 3.31Å; F502-A506 PolarHBondContact O-N 3.02Å; F503-A506 PolarHBondContact O-N 3.38Å; A506-L509 PolarHBondContact O-N 3.43Å; A506-S510 WeakPolarHBondContact O-CB 3.5Å; A506-S510 PolarHBondContact O-N 3.49Å
507	I	86.3	Confident	86.9	Confident	27 Å²	27	32.2 Å²	32.2	14%	0.138	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-47.3	175.9	-72.5	167.4	0	0	0	110.2	M243 V246 F503 V504 F505 L509 S510 V511	M243-I507 HydrophobicContact CB-CD1 4.14Å; M243-I507 HydrophobicContact CG-CD1 4.15Å; V246-I507 HydrophobicContact CB-CG2 4.42Å; V246-I507 HydrophobicContact CG1-CG2 3.42Å; V246-I507 VanDerWaalsContact CG1-CG2 3.42Å; F503-I507 WeakPolarHBondContact O-CB 3.18Å; F503-I507 VanDerWaalsContact O-CG1 3.24Å; F503-I507 WeakPolarHBondContact O-CG1 3.49Å; F503-I507 PolarHBondContact O-N 2.75Å; V504-I507 PolarHBondContact O-N 3.22Å; F505-I507 PolarHBondContact O-N 3.12Å; I507-L509 VanDerWaalsContact C-N 3.31Å; I507-L509 PolarHBondContact O-N 3.23Å; I507-S510 PolarHBondContact O-N 2.89Å; I507-S510 VanDerWaalsContact O-N 3.14Å; I507-V511 HydrophobicContact CG2-CG2 3.85Å; I507-V511 WeakPolarHBondContact O-CB 3.47Å; I507-V511 WeakPolarHBondContact O-CG2 3.27Å; I507-V511 PolarHBondContact O-N 2.78Å
508	L	90.3	Very high	87.8	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-56.6	-44.6	178.6	177.3	60.5	0	0	0	112	P474 I478 V504 F505 G512 F580 L584	P474-L508 HydrophobicContact CB-CD1 4.01Å; I478-L508 HydrophobicContact CD1-CD1 4.05Å; I478-L508 HydrophobicContact CD1-CD2 4.16Å; I478-L508 HydrophobicContact CG2-CB 4.02Å; I478-L508 HydrophobicContact CG2-CD1 3.9Å; I478-L508 HydrophobicContact CG2-CG 4.37Å; V504-L508 WeakPolarHBondContact O-CB 3.18Å; V504-L508 PolarHBondContact O-N 3.19Å; F505-L508 PolarHBondContact O-N 3.37Å; L508-G512 PolarHBondContact O-N 2.92Å; L508-F580 HydrophobicContact CD2-CD1 4.17Å; L508-F580 HydrophobicContact CD2-CE1 3.74Å; L508-L584 HydrophobicContact CD1-CD1 4.26Å; L508-L584 HydrophobicContact CD1-CD2 4.35Å; L508-L584 HydrophobicContact CD2-CD1 4.39Å; L508-L584 HydrophobicContact CD2-CD2 4.15Å; L508-L584 HydrophobicContact CG-CD1 4.49Å; L508-L584 HydrophobicContact CG-CD2 3.9Å
509	L	93.1	Very high	88.3	Confident	32 Å²	32	30.5 Å²	30.5	17%	0.168	18%	0.177	C	C	.	.	H	α-helix	trans	-64.5	-41.8	177.6	-61.6	-175.4	0	0	0	112	L318 F505 A506 I507 A513 L584 I587	L318-L509 HydrophobicContact CD1-CD1 3.73Å; L318-L509 HydrophobicContact CD1-CD2 3.76Å; L318-L509 HydrophobicContact CD1-CG 4.42Å; F505-L509 HydrophobicContact CD1-CD1 4.19Å; F505-L509 HydrophobicContact CE1-CD1 3.73Å; F505-L509 HydrophobicContact CE1-CG 4.44Å; F505-L509 HydrophobicContact CZ-CD1 4.07Å; F505-L509 HydrophobicContact CZ-CD2 4.49Å; F505-L509 WeakPolarHBondContact O-CG 3.14Å; F505-L509 PolarHBondContact O-N 2.74Å; F505-L509 VanDerWaalsContact O-N 3.13Å; A506-L509 PolarHBondContact O-N 3.43Å; I507-L509 VanDerWaalsContact C-N 3.31Å; I507-L509 PolarHBondContact O-N 3.23Å; L509-A513 WeakPolarHBondContact O-CB 3.3Å; L509-A513 PolarHBondContact O-N 2.93Å; L509-L584 HydrophobicContact CD2-CD2 4.13Å; L509-I587 HydrophobicContact CD2-CD1 4.2Å; L509-I587 HydrophobicContact CD2-CG1 3.95Å
510	S	90.4	Very high	89	Confident	56 Å²	56	29.1 Å²	29.1	39%	0.392	16%	0.162	S	C	.	.	H	α-helix	trans	-66.4	-50	179	-174.2	0	0	0	0	112.1	A506 I507 G512 A513 C514	A506-S510 WeakPolarHBondContact O-CB 3.5Å; A506-S510 PolarHBondContact O-N 3.49Å; I507-S510 PolarHBondContact O-N 2.89Å; I507-S510 VanDerWaalsContact O-N 3.14Å; S510-G512 VanDerWaalsContact C-N 3.31Å; S510-G512 PolarHBondContact O-N 3.36Å; S510-A513 WeakPolarHBondContact O-CB 3.44Å; S510-A513 PolarHBondContact O-N 3.38Å; S510-A513 VanDerWaalsContact O-N 3.16Å; S510-C514 PolarHBondContact O-N 3.4Å; S510-C514 PolarHBondContact O-SG 3.5Å
511	V	89.6	Confident	89.5	Confident	9 Å²	9	29.1 Å²	29.1	6%	0.055	16%	0.161	C	C	.	.	H	α-helix	trans	-55.4	-48.8	175.2	172.6	0	0	0	0	110.1	V246 V250 P474 A477 I507 A513 C514 I515	V246-V511 HydrophobicContact CG1-CG2 4.08Å; V250-V511 HydrophobicContact CG2-CB 4.27Å; V250-V511 HydrophobicContact CG2-CG2 3.27Å; P474-V511 HydrophobicContact CB-CG1 4.16Å; P474-V511 HydrophobicContact CG-CG1 4.38Å; A477-V511 HydrophobicContact CB-CG1 4.39Å; A477-V511 HydrophobicContact CB-CG2 4.32Å; I507-V511 HydrophobicContact CG2-CG2 3.85Å; I507-V511 WeakPolarHBondContact O-CB 3.47Å; I507-V511 WeakPolarHBondContact O-CG2 3.27Å; I507-V511 PolarHBondContact O-N 2.78Å; V511-A513 PolarHBondContact O-N 3.03Å; V511-C514 PolarHBondContact O-N 3.17Å; V511-I515 HydrophobicContact CG1-CD1 3.5Å; V511-I515 VanDerWaalsContact CG1-CD1 3.5Å; V511-I515 WeakPolarHBondContact O-CD1 3.18Å; V511-I515 WeakPolarHBondContact O-CG1 3.25Å; V511-I515 PolarHBondContact O-N 3.48Å
512	G	92.6	Very high	89.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-45.4	177.1	0	0	0	0	0	112.5	L508 S510 S516 V539	L508-G512 PolarHBondContact O-N 2.92Å; S510-G512 VanDerWaalsContact C-N 3.31Å; S510-G512 PolarHBondContact O-N 3.36Å; G512-S516 VanDerWaalsContact O-CB 3.23Å; G512-S516 WeakPolarHBondContact O-CB 3.48Å; G512-S516 PolarHBondContact O-N 3.27Å; G512-V539 WeakPolarHBondContact O-CG2 3.48Å
513	A	93.2	Very high	89.9	Confident	21 Å²	21	29.5 Å²	29.5	17%	0.174	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-46.9	177	0	0	0	0	0	112.4	L509 S510 V511 S516 I517 I587 S591	L509-A513 WeakPolarHBondContact O-CB 3.3Å; L509-A513 PolarHBondContact O-N 2.93Å; S510-A513 WeakPolarHBondContact O-CB 3.44Å; S510-A513 PolarHBondContact O-N 3.38Å; S510-A513 VanDerWaalsContact O-N 3.16Å; V511-A513 PolarHBondContact O-N 3.03Å; A513-S516 WeakPolarHBondContact O-CB 3.29Å; A513-S516 PolarHBondContact O-N 3.4Å; A513-I517 VanDerWaalsContact O-CG1 3.29Å; A513-I517 WeakPolarHBondContact O-CG1 3.28Å; A513-I517 PolarHBondContact O-N 3.34Å; A513-I517 VanDerWaalsContact O-N 3.09Å; A513-I587 HydrophobicContact CB-CG2 4.38Å; A513-S591 WeakPolarHBondContact CB-OG 3.41Å
514	C	90	Very high	90.1	Very high	24 Å²	24	23.8 Å²	23.8	16%	0.162	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-46.2	179.7	-70.5	0	0	0	0	112.5	S510 V511 I517 A518	S510-C514 PolarHBondContact O-N 3.4Å; S510-C514 PolarHBondContact O-SG 3.5Å; V511-C514 PolarHBondContact O-N 3.17Å; C514-I517 PolarHBondContact O-N 3.49Å; C514-A518 PolarHBondContact O-N 3.46Å
515	I	90.8	Very high	90	Very high	18 Å²	18	24.9 Å²	24.9	9%	0.092	14%	0.144	C	C	.	.	H	α-helix	trans	-65.4	-41.9	179	-69.2	162.2	0	0	0	110.5	L473 P474 V511 I517 A518 L519 V539	L473-I515 HydrophobicContact CB-CD1 3.51Å; L473-I515 HydrophobicContact CD1-CD1 4.27Å; L473-I515 HydrophobicContact CD1-CG1 4.46Å; P474-I515 HydrophobicContact CG-CD1 3.76Å; V511-I515 HydrophobicContact CG1-CD1 3.5Å; V511-I515 VanDerWaalsContact CG1-CD1 3.5Å; V511-I515 WeakPolarHBondContact O-CD1 3.18Å; V511-I515 WeakPolarHBondContact O-CG1 3.25Å; V511-I515 PolarHBondContact O-N 3.48Å; I515-I517 VanDerWaalsContact C-N 3.32Å; I515-I517 PolarHBondContact O-N 3.01Å; I515-A518 PolarHBondContact O-N 3.4Å; I515-L519 HydrophobicContact CG2-CD1 3.8Å; I515-L519 HydrophobicContact CG2-CG 4.08Å; I515-L519 WeakPolarHBondContact O-CB 3.39Å; I515-L519 WeakPolarHBondContact O-CG 3.34Å; I515-L519 PolarHBondContact O-N 2.93Å; I515-V539 HydrophobicContact CG2-CG2 4.46Å
516	S	93.4	Very high	89.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-54.6	-48.8	175.2	-176.5	0	0	0	0	112	G512 A513 L519 T520 S588 S592	G512-S516 VanDerWaalsContact O-CB 3.23Å; G512-S516 WeakPolarHBondContact O-CB 3.48Å; G512-S516 PolarHBondContact O-N 3.27Å; A513-S516 WeakPolarHBondContact O-CB 3.29Å; A513-S516 PolarHBondContact O-N 3.4Å; S516-L519 PolarHBondContact O-N 2.91Å; S516-T520 VanDerWaalsContact O-CB 3.27Å; S516-T520 WeakPolarHBondContact O-CB 3.47Å; S516-T520 PolarHBondContact O-N 2.83Å; S516-T520 PolarHBondContact O-OG1 3.01Å; S516-S588 WeakPolarHBondContact CB-OG 3.31Å; S516-S588 VanDerWaalsContact OG-CA 3.3Å; S516-S588 WeakPolarHBondContact OG-CA 3.28Å; S516-S588 PolarHBondContact OG-O 3.46Å; S516-S588 PolarHBondContact OG-OG 3.02Å; S516-S592 PolarHBondContact OG-OG 3.24Å
517	I	92.2	Very high	89.6	Confident	38 Å²	38	24 Å²	24	20%	0.195	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-46.9	179.6	-64.7	166.3	0	0	0	110.6	L257 A513 C514 I515 L519 T520 Y521 F595	L257-I517 HydrophobicContact CD2-CB 4.13Å; L257-I517 HydrophobicContact CD2-CG2 3.67Å; A513-I517 VanDerWaalsContact O-CG1 3.29Å; A513-I517 WeakPolarHBondContact O-CG1 3.28Å; A513-I517 PolarHBondContact O-N 3.34Å; A513-I517 VanDerWaalsContact O-N 3.09Å; C514-I517 PolarHBondContact O-N 3.49Å; I515-I517 VanDerWaalsContact C-N 3.32Å; I515-I517 PolarHBondContact O-N 3.01Å; I517-L519 PolarHBondContact O-N 2.9Å; I517-T520 PolarHBondContact O-N 3.12Å; I517-Y521 WeakPolarHBondContact O-CB 3.46Å; I517-Y521 PolarHBondContact O-N 3.33Å; I517-F595 HydrophobicContact CG1-CB 4.1Å; I517-F595 HydrophobicContact CG2-CB 3.93Å; I517-F595 HydrophobicContact CG2-CD1 3.9Å; I517-F595 HydrophobicContact CG2-CD2 3.47Å; I517-F595 VanDerWaalsContact CG2-CD2 3.47Å; I517-F595 HydrophobicContact CG2-CE1 4.25Å; I517-F595 HydrophobicContact CG2-CE2 3.85Å; I517-F595 HydrophobicContact CG2-CG 3.49Å; I517-F595 VanDerWaalsContact CG2-CG 3.49Å; I517-F595 HydrophobicContact CG2-CZ 4.22Å
518	A	89.4	Confident	89.7	Confident	16 Å²	16	22.8 Å²	22.8	13%	0.132	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-46.2	-179.6	0	0	0	0	0	112.4	L257 C514 I515 Y521 F522	L257-A518 HydrophobicContact CD1-CB 4.18Å; L257-A518 HydrophobicContact CD2-CB 4.5Å; C514-A518 PolarHBondContact O-N 3.46Å; I515-A518 PolarHBondContact O-N 3.4Å; A518-Y521 WeakPolarHBondContact O-CB 3.27Å; A518-Y521 PolarHBondContact O-N 2.86Å; A518-F522 WeakPolarHBondContact O-CD2 3.35Å; A518-F522 PolarHBondContact O-N 2.87Å
519	L	90.2	Very high	89.6	Confident	20 Å²	20	24 Å²	24	11%	0.105	13%	0.132	C	C	.	.	H	α-helix	trans	-68.5	-38.2	178.9	-64.8	-176.2	0	0	0	112	V469 I515 S516 I517 Y521 F522 Q523	V469-L519 HydrophobicContact CG1-CD2 4.34Å; I515-L519 HydrophobicContact CG2-CD1 3.8Å; I515-L519 HydrophobicContact CG2-CG 4.08Å; I515-L519 WeakPolarHBondContact O-CB 3.39Å; I515-L519 WeakPolarHBondContact O-CG 3.34Å; I515-L519 PolarHBondContact O-N 2.93Å; S516-L519 PolarHBondContact O-N 2.91Å; I517-L519 PolarHBondContact O-N 2.9Å; L519-Y521 VanDerWaalsContact C-N 3.32Å; L519-Y521 PolarHBondContact O-N 2.92Å; L519-F522 PolarHBondContact O-N 3.49Å; L519-Q523 WeakPolarHBondContact O-CB 3.19Å; L519-Q523 PolarHBondContact O-N 2.74Å
520	T	91.9	Very high	89.5	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-63.2	-39.3	173.5	-68	0	0	0	0	111.2	S516 I517 Q523 L524 W531 S592 F595 I596	S516-T520 VanDerWaalsContact O-CB 3.27Å; S516-T520 WeakPolarHBondContact O-CB 3.47Å; S516-T520 PolarHBondContact O-N 2.83Å; S516-T520 PolarHBondContact O-OG1 3.01Å; I517-T520 PolarHBondContact O-N 3.12Å; T520-Q523 PolarHBondContact O-N 3.2Å; T520-L524 HydrophobicContact CG2-CD1 4.01Å; T520-L524 HydrophobicContact CG2-CG 4.48Å; T520-L524 VanDerWaalsContact O-CG 3.25Å; T520-L524 WeakPolarHBondContact O-CG 3.36Å; T520-L524 PolarHBondContact O-N 2.84Å; T520-W531 HydrophobicContact CG2-CB 4.4Å; T520-S592 PolarHBondContact OG1-OG 2.9Å; T520-F595 HydrophobicContact CG2-CD1 4.42Å; T520-I596 HydrophobicContact CG2-CD1 3.73Å; T520-I596 HydrophobicContact CG2-CG1 4.01Å
521	Y	88.6	Confident	89.6	Confident	16 Å²	16	25.7 Å²	25.7	6%	0.063	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-53.1	173.4	-178.7	-112.2	0	0	0	111.7	V260 L261 D264 W290 I517 A518 L519 Q523 L524 S525 F595	V260-Y521 HydrophobicContact CG1-CE1 4.3Å; L261-Y521 HydrophobicContact CD1-CE2 4.49Å; D264-Y521 PolarHBondContact OD2-OH 3.06Å; W290-Y521 AromaticContact CD1-CE2 3.97Å; W290-Y521 AromaticContact NE1-CE2 3.92Å; I517-Y521 WeakPolarHBondContact O-CB 3.46Å; I517-Y521 PolarHBondContact O-N 3.33Å; A518-Y521 WeakPolarHBondContact O-CB 3.27Å; A518-Y521 PolarHBondContact O-N 2.86Å; L519-Y521 VanDerWaalsContact C-N 3.32Å; L519-Y521 PolarHBondContact O-N 2.92Å; Y521-Q523 PolarHBondContact O-N 2.79Å; Y521-L524 PolarHBondContact O-N 3.37Å; Y521-L524 VanDerWaalsContact O-N 3.08Å; Y521-S525 PolarHBondContact O-N 2.89Å; Y521-S525 PolarHBondContact O-OG 3.47Å; Y521-S525 VanDerWaalsContact O-OG 3.13Å; Y521-F595 HydrophobicContact CD2-CE1 4.21Å; Y521-F595 AromaticContact CD2-CZ 3.77Å; Y521-F595 HydrophobicContact CD2-CZ 3.77Å; Y521-F595 HydrophobicContact CG-CZ 4.22Å
522	F	86.9	Confident	89.8	Confident	123 Å²	123	25.5 Å²	25.5	54%	0.539	13%	0.127	S	C	.	.	H	α-helix	trans	-59.4	-35.4	178.4	-71.1	-50.7	0	0	0	113.3	A518 L519 G526	A518-F522 WeakPolarHBondContact O-CD2 3.35Å; A518-F522 PolarHBondContact O-N 2.87Å; L519-F522 PolarHBondContact O-N 3.49Å; F522-G526 PolarHBondContact O-N 2.95Å
523	Q	89.1	Confident	89.9	Confident	10 Å²	10	28.2 Å²	28.2	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-48.7	174	179.5	-174.4	-32	0	0	111.5	L519 T520 Y521 G526 D528 R530 R534	L519-Q523 WeakPolarHBondContact O-CB 3.19Å; L519-Q523 PolarHBondContact O-N 2.74Å; T520-Q523 PolarHBondContact O-N 3.2Å; Y521-Q523 PolarHBondContact O-N 2.79Å; Q523-G526 WeakPolarHBondContact O-CA 3.28Å; Q523-G526 PolarHBondContact O-N 3.16Å; Q523-G526 VanDerWaalsContact O-N 3.1Å; Q523-D528 HydrophobicContact CG-CB 4.03Å; Q523-D528 WeakPolarHBondContact CG-O 3.33Å; Q523-D528 PolarHBondContact NE2-O 3.4Å; Q523-D528 PolarHBondContact O-N 3.34Å; Q523-R530 PolarHBondContact NE2-O 2.86Å; Q523-R534 VanDerWaalsContact CD-CD 3.46Å; Q523-R534 VanDerWaalsContact OE1-CB 3.31Å
524	L	88.4	Confident	89.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.8	-38	-179	-67.5	168.9	0	0	0	111.4	G289 W290 I293 V297 T520 Y521 G526 E527 I596 I599	G289-L524 CarbonylContact C-O 3.52Å; W290-L524 VanDerWaalsContact CA-O 3.24Å; W290-L524 WeakPolarHBondContact CA-O 3.06Å; W290-L524 HydrophobicContact CB-CB 3.61Å; W290-L524 PolarHBondContact N-O 3.49Å; W290-L524 VanDerWaalsContact N-O 3.17Å; I293-L524 HydrophobicContact CD1-CB 4.3Å; I293-L524 HydrophobicContact CD1-CD2 3.58Å; V297-L524 HydrophobicContact CG2-CD2 4.18Å; T520-L524 HydrophobicContact CG2-CD1 4.01Å; T520-L524 HydrophobicContact CG2-CG 4.48Å; T520-L524 VanDerWaalsContact O-CG 3.25Å; T520-L524 WeakPolarHBondContact O-CG 3.36Å; T520-L524 PolarHBondContact O-N 2.84Å; Y521-L524 PolarHBondContact O-N 3.37Å; Y521-L524 VanDerWaalsContact O-N 3.08Å; L524-G526 PolarHBondContact O-N 3.4Å; L524-E527 PolarHBondContact O-N 2.82Å; L524-I596 HydrophobicContact CD1-CD1 4.19Å; L524-I596 HydrophobicContact CD1-CG1 3.89Å; L524-I599 HydrophobicContact CD1-CD1 4.06Å
525	S	84.4	Confident	90.1	Very high	36 Å²	36	27.7 Å²	27.7	25%	0.252	13%	0.127	S	C	.	.	H	α-helix	trans	-62.8	-20.7	173.3	-57.5	0	0	0	0	112.7	Y521 E527	Y521-S525 PolarHBondContact O-N 2.89Å; Y521-S525 PolarHBondContact O-OG 3.47Å; Y521-S525 VanDerWaalsContact O-OG 3.13Å; S525-E527 VanDerWaalsContact C-N 3.3Å
526	G	83.8	Confident	90.3	Very high	6 Å²	6	27 Å²	27	6%	0.062	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	12.6	169.5	0	0	0	0	0	115	Q457 F522 Q523 L524 D528	Q457-G526 PolarHBondContact NE2-O 3.38Å; F522-G526 PolarHBondContact O-N 2.95Å; Q523-G526 WeakPolarHBondContact O-CA 3.28Å; Q523-G526 PolarHBondContact O-N 3.16Å; Q523-G526 VanDerWaalsContact O-N 3.1Å; L524-G526 PolarHBondContact O-N 3.4Å; G526-D528 PolarHBondContact O-N 2.96Å
527	E	86.7	Confident	90.4	Very high	43 Å²	43	29.3 Å²	29.3	20%	0.201	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	16.6	-175.8	-54.7	-170.1	-169.9	0	0	115	I293 R452 P455 L524 S525 Y529	I293-E527 HydrophobicContact CG2-CB 4.11Å; R452-E527 IonicContact CZ-OE2 3.58Å; R452-E527 IonicContact NE-OE2 3.49Å; R452-E527 PolarHBondContact NE-OE2 3.14Å; R452-E527 IonicContact NH2-OE1 3.88Å; R452-E527 IonicContact NH2-OE2 2.82Å; R452-E527 PolarHBondContact NH2-OE2 3.04Å; P455-E527 HydrophobicContact CG-CB 3.87Å; P455-E527 HydrophobicContact CG-CG 4.41Å; L524-E527 PolarHBondContact O-N 2.82Å; S525-E527 VanDerWaalsContact C-N 3.3Å; E527-Y529 PolarHBondContact O-N 3.45Å
528	D	88.3	Confident	90.5	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.011	13%	0.128	C	C	.	.			trans	-96.2	97	178.2	-164.6	-28.8	0	0	0	111.6	I454 Q523 G526 R530 R534	I454-D528 HydrophobicContact CG2-CB 4.08Å; Q523-D528 HydrophobicContact CG-CB 4.03Å; Q523-D528 WeakPolarHBondContact CG-O 3.33Å; Q523-D528 PolarHBondContact NE2-O 3.4Å; Q523-D528 PolarHBondContact O-N 3.34Å; G526-D528 PolarHBondContact O-N 2.96Å; D528-R530 PolarHBondContact O-N 3.39Å; D528-R530 VanDerWaalsContact O-N 3.17Å; D528-R530 VanDerWaalsContact OD1-CB 3.29Å; D528-R530 WeakPolarHBondContact OD1-CB 3.49Å; D528-R530 WeakPolarHBondContact OD1-CG 3.28Å; D528-R530 IonicContact OD1-CZ 2.78Å; D528-R530 PolarHBondContact OD1-N 3.13Å; D528-R530 IonicContact OD1-NE 2.78Å; D528-R530 PolarHBondContact OD1-NE 3.24Å; D528-R530 IonicContact OD1-NH2 3.22Å; D528-R530 IonicContact OD2-CZ 2.77Å; D528-R530 IonicContact OD2-NE 2.74Å; D528-R530 IonicContact OD2-NH2 2.76Å; D528-R530 PolarHBondContact OD2-NH2 2.91Å; D528-R534 IonicContact OD1-NH1 3.22Å; D528-R534 IonicContact OD2-CZ 3.83Å; D528-R534 IonicContact OD2-NH1 3.04Å; D528-R534 PolarHBondContact OD2-NH1 3.3Å; D528-R534 IonicContact OD2-NH2 3.84Å; D528-R534 PolarHBondContact OD2-NH2 2.92Å
529	Y	89.1	Confident	90.7	Very high	31 Å²	31	27 Å²	27	12%	0.122	12%	0.121	C	C	.	.			trans	-72.3	-1.5	-178.8	66.6	-96.1	0	0	0	114.8	D296 I454 E527 W531	D296-Y529 HydrophobicContact CB-CD1 3.89Å; D296-Y529 HydrophobicContact CB-CD2 4.21Å; D296-Y529 HydrophobicContact CB-CE1 4.28Å; D296-Y529 HydrophobicContact CB-CG 3.86Å; D296-Y529 WeakPolarHBondContact O-CD2 3.34Å; I454-Y529 HydrophobicContact CD1-CD1 4.34Å; I454-Y529 HydrophobicContact CD1-CE1 3.91Å; I454-Y529 HydrophobicContact CG1-CD1 4.16Å; I454-Y529 HydrophobicContact CG1-CE1 3.77Å; E527-Y529 PolarHBondContact O-N 3.45Å; Y529-W531 PolarHBondContact O-N 3.03Å
530	R	90.9	Very high	91	Very high	124 Å²	124	26 Å²	26	47%	0.468	12%	0.117	S	C	.	.			trans	-81.9	51.5	-175.8	-59.9	175.3	-65.5	-170.4	-6.7	113.2	I454 Q523 D528 R534	I454-R530 HydrophobicContact CD1-CG 3.99Å; I454-R530 VanDerWaalsContact CD1-CZ 3.45Å; Q523-R530 PolarHBondContact NE2-O 2.86Å; D528-R530 PolarHBondContact O-N 3.39Å; D528-R530 VanDerWaalsContact O-N 3.17Å; D528-R530 VanDerWaalsContact OD1-CB 3.29Å; D528-R530 WeakPolarHBondContact OD1-CB 3.49Å; D528-R530 WeakPolarHBondContact OD1-CG 3.28Å; D528-R530 IonicContact OD1-CZ 2.78Å; D528-R530 PolarHBondContact OD1-N 3.13Å; D528-R530 IonicContact OD1-NE 2.78Å; D528-R530 PolarHBondContact OD1-NE 3.24Å; D528-R530 IonicContact OD1-NH2 3.22Å; D528-R530 IonicContact OD2-CZ 2.77Å; D528-R530 IonicContact OD2-NE 2.74Å; D528-R530 IonicContact OD2-NH2 2.76Å; D528-R530 PolarHBondContact OD2-NH2 2.91Å; R530-R534 WeakPolarHBondContact O-CG 3.41Å
531	W	92.4	Very high	91.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-78.5	-24.5	-173.2	67.5	-92.5	0	0	0	113.7	V297 T520 Y529 W533 R534 S535 F589 L593 I596	V297-W531 PolarHBondContact O-NE1 3.43Å; T520-W531 HydrophobicContact CG2-CB 4.4Å; Y529-W531 PolarHBondContact O-N 3.03Å; W531-W533 PolarHBondContact O-N 3.46Å; W531-R534 PolarHBondContact O-N 2.95Å; W531-S535 VanDerWaalsContact O-CB 3.31Å; W531-S535 WeakPolarHBondContact O-CB 3.35Å; W531-S535 PolarHBondContact O-N 3.2Å; W531-S535 PolarHBondContact O-OG 3.19Å; W531-F589 HydrophobicContact CH2-CE2 4.06Å; W531-F589 HydrophobicContact CH2-CZ 4.21Å; W531-F589 HydrophobicContact CZ3-CD2 4.11Å; W531-F589 AromaticContact CZ3-CE2 3.71Å; W531-F589 HydrophobicContact CZ3-CE2 3.71Å; W531-F589 HydrophobicContact CZ3-CZ 4.25Å; W531-L593 HydrophobicContact CH2-CB 3.93Å; W531-L593 HydrophobicContact CH2-CD1 3.74Å; W531-L593 HydrophobicContact CH2-CG 4.4Å; W531-L593 HydrophobicContact CZ2-CD1 4.27Å; W531-L593 HydrophobicContact CZ3-CB 4.17Å; W531-I596 HydrophobicContact CB-CD1 4.17Å; W531-I596 HydrophobicContact CD2-CD1 3.13Å; W531-I596 HydrophobicContact CE3-CD1 3.52Å; W531-I596 HydrophobicContact CG-CD1 3.42Å; W531-I596 VanDerWaalsContact CG-CD1 3.42Å; W531-I596 HydrophobicContact CH2-CD1 4.21Å; W531-I596 HydrophobicContact CZ2-CD1 3.88Å; W531-I596 HydrophobicContact CZ3-CD1 4.05Å
532	W	94	Very high	91.5	Very high	6 Å²	6	25.3 Å²	25.3	2%	0.023	11%	0.114	C	C	.	.	H	α-helix	trans	-52.4	-57.2	-173.8	-64.2	84.7	0	0	0	113.8	V297 R299 F300 P301 L307 F363 I367 F441 S535 F589	V297-W532 PolarHBondContact O-NE1 2.83Å; R299-W532 PolarHBondContact O-NE1 3.34Å; F300-W532 HydrophobicContact CD1-CH2 4.23Å; F300-W532 HydrophobicContact CD1-CZ2 4.32Å; P301-W532 HydrophobicContact CB-CB 3.73Å; P301-W532 HydrophobicContact CB-CG 3.94Å; P301-W532 HydrophobicContact CG-CB 3.77Å; P301-W532 HydrophobicContact CG-CD2 3.89Å; P301-W532 HydrophobicContact CG-CE3 4Å; P301-W532 HydrophobicContact CG-CG 3.78Å; L307-W532 HydrophobicContact CD2-CB 4.34Å; L307-W532 HydrophobicContact CD2-CE3 3.92Å; F363-W532 AromaticContact CE1-CZ3 3.89Å; F363-W532 HydrophobicContact CE1-CZ3 3.89Å; F363-W532 HydrophobicContact CZ-CH2 4.5Å; F363-W532 AromaticContact CZ-CZ3 3.75Å; F363-W532 HydrophobicContact CZ-CZ3 3.75Å; I367-W532 HydrophobicContact CG2-CH2 4.46Å; I367-W532 HydrophobicContact CG2-CZ3 4.42Å; F441-W532 HydrophobicContact CE2-CH2 4.24Å; F441-W532 HydrophobicContact CZ-CH2 4.11Å; W532-S535 PolarHBondContact O-OG 3.23Å; W532-F589 HydrophobicContact CD2-CE2 4.42Å; W532-F589 AromaticContact CE3-CE2 3.63Å; W532-F589 HydrophobicContact CE3-CE2 3.63Å; W532-F589 AromaticContact CE3-CZ 3.6Å; W532-F589 HydrophobicContact CE3-CZ 3.6Å; W532-F589 HydrophobicContact CZ3-CE2 4.28Å; W532-F589 AromaticContact CZ3-CZ 3.78Å; W532-F589 HydrophobicContact CZ3-CZ 3.78Å
533	W	94.7	Very high	91.9	Very high	57 Å²	57	19.6 Å²	19.6	22%	0.216	9%	0.09	C	C	.	.	H	α-helix	trans	-77.5	-35.7	177.7	-78.2	109.8	0	0	0	112.6	P302 L306 L307 W531 S535 V536 L537	P302-W533 PolarHBondContact O-NE1 3.03Å; L306-W533 HydrophobicContact CB-CH2 3.95Å; L306-W533 HydrophobicContact CB-CZ2 4.26Å; L306-W533 HydrophobicContact CD2-CH2 3.79Å; L306-W533 HydrophobicContact CD2-CZ2 4.36Å; L306-W533 HydrophobicContact CG-CH2 3.77Å; L306-W533 HydrophobicContact CG-CZ2 4.48Å; L307-W533 HydrophobicContact CB-CH2 3.83Å; L307-W533 HydrophobicContact CB-CZ2 3.68Å; L307-W533 HydrophobicContact CD1-CD2 4.21Å; L307-W533 HydrophobicContact CD1-CE3 4.02Å; L307-W533 HydrophobicContact CD1-CH2 4.17Å; L307-W533 HydrophobicContact CD1-CZ2 4.37Å; L307-W533 HydrophobicContact CD1-CZ3 4Å; W531-W533 PolarHBondContact O-N 3.46Å; W533-S535 VanDerWaalsContact C-N 3.33Å; W533-S535 PolarHBondContact O-N 2.69Å; W533-V536 PolarHBondContact O-N 3Å; W533-L537 WeakPolarHBondContact O-CG 3.27Å; W533-L537 PolarHBondContact O-N 2.72Å
534	R	92.4	Very high	92.3	Very high	34 Å²	34	23.9 Å²	23.9	13%	0.128	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-37.3	-178.3	-76.5	-175.2	173.6	177.6	9.4	112.8	T463 Q523 D528 R530 W531 L537 S538	T463-R534 HydrophobicContact CG2-CG 4.24Å; T463-R534 PolarHBondContact OG1-NE 3.35Å; T463-R534 PolarHBondContact OG1-NH2 3.05Å; Q523-R534 VanDerWaalsContact CD-CD 3.46Å; Q523-R534 VanDerWaalsContact OE1-CB 3.31Å; D528-R534 IonicContact OD1-NH1 3.22Å; D528-R534 IonicContact OD2-CZ 3.83Å; D528-R534 IonicContact OD2-NH1 3.04Å; D528-R534 PolarHBondContact OD2-NH1 3.3Å; D528-R534 IonicContact OD2-NH2 3.84Å; D528-R534 PolarHBondContact OD2-NH2 2.92Å; R530-R534 WeakPolarHBondContact O-CG 3.41Å; W531-R534 PolarHBondContact O-N 2.95Å; R534-L537 PolarHBondContact O-N 2.82Å; R534-S538 WeakPolarHBondContact O-CB 3.44Å; R534-S538 PolarHBondContact O-N 3.33Å
535	S	94.6	Very high	92.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.8	-42.7	173.9	59	0	0	0	0	111.4	W531 W532 W533 L537 S538 S588 F589	W531-S535 VanDerWaalsContact O-CB 3.31Å; W531-S535 WeakPolarHBondContact O-CB 3.35Å; W531-S535 PolarHBondContact O-N 3.2Å; W531-S535 PolarHBondContact O-OG 3.19Å; W532-S535 PolarHBondContact O-OG 3.23Å; W533-S535 VanDerWaalsContact C-N 3.33Å; W533-S535 PolarHBondContact O-N 2.69Å; S535-L537 PolarHBondContact O-N 3.49Å; S535-S538 PolarHBondContact O-OG 3.2Å; S535-S588 WeakPolarHBondContact O-CB 3.35Å; S535-S588 PolarHBondContact O-OG 3.05Å; S535-F589 WeakPolarHBondContact OG-CD2 3.49Å
536	V	95.8	Very high	93.1	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-46.4	174.9	175.8	0	0	0	0	111.1	L307 V310 L311 W533 S538 G540 G585 F589	L307-V536 HydrophobicContact CD1-CG2 3.75Å; V310-V536 HydrophobicContact CG1-CG1 3.93Å; L311-V536 HydrophobicContact CD2-CG2 4.44Å; W533-V536 PolarHBondContact O-N 3Å; V536-S538 PolarHBondContact O-N 2.92Å; V536-G540 WeakPolarHBondContact O-CA 3.17Å; V536-G540 PolarHBondContact O-N 3.1Å; V536-G585 WeakPolarHBondContact O-CA 3.36Å; V536-F589 HydrophobicContact CG2-CB 3.89Å; V536-F589 HydrophobicContact CG2-CD2 4.02Å; V536-F589 HydrophobicContact CG2-CG 4.27Å
537	L	95.2	Very high	93.7	Very high	49 Å²	49	26 Å²	26	26%	0.257	12%	0.115	S	C	.	.	H	α-helix	trans	-70.4	-29.3	-176	-68.5	175.3	0	0	0	113.8	M467 W533 R534 S535 S541 F581	M467-L537 HydrophobicContact CE-CB 4.03Å; M467-L537 HydrophobicContact CE-CD2 4.04Å; M467-L537 HydrophobicContact CE-CG 4.48Å; M467-L537 HydrophobicContact CG-CB 3.98Å; M467-L537 HydrophobicContact SD-CB 3.97Å; M467-L537 HydrophobicContact SD-CD1 4.29Å; W533-L537 WeakPolarHBondContact O-CG 3.27Å; W533-L537 PolarHBondContact O-N 2.72Å; R534-L537 PolarHBondContact O-N 2.82Å; S535-L537 PolarHBondContact O-N 3.49Å; L537-S541 WeakPolarHBondContact O-CB 3.37Å; L537-S541 PolarHBondContact O-N 3.25Å; L537-S541 VanDerWaalsContact O-N 3.15Å; L537-F581 HydrophobicContact CD2-CE2 4.04Å; L537-F581 HydrophobicContact CD2-CZ 3.77Å
538	S	93.2	Very high	94	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.035	13%	0.13	C	C	.	.	H	α-helix	trans	-61.2	-70.6	-174.1	62.2	0	0	0	0	111.8	G470 G471 R534 S535 V536 S541 S588	G470-S538 CarbonylContact C-O 3.49Å; G471-S538 PolarHBondContact N-O 3.3Å; R534-S538 WeakPolarHBondContact O-CB 3.44Å; R534-S538 PolarHBondContact O-N 3.33Å; S535-S538 PolarHBondContact O-OG 3.2Å; V536-S538 PolarHBondContact O-N 2.92Å; S538-S541 PolarHBondContact O-OG 2.98Å; S538-S588 PolarHBondContact OG-OG 3.2Å
539	V	95.3	Very high	94.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-79.6	-27.7	-179.7	-172.3	0	0	0	0	111.2	P474 G512 I515 S541 T542 L584 S588	P474-V539 HydrophobicContact CG-CG1 3.99Å; G512-V539 WeakPolarHBondContact O-CG2 3.48Å; I515-V539 HydrophobicContact CG2-CG2 4.46Å; V539-S541 PolarHBondContact O-N 3.25Å; V539-T542 VanDerWaalsContact O-CB 3.24Å; V539-T542 WeakPolarHBondContact O-CB 3.37Å; V539-T542 PolarHBondContact O-N 3.37Å; V539-T542 PolarHBondContact O-OG1 3.32Å; V539-L584 HydrophobicContact CG1-CB 4.1Å; V539-S588 WeakPolarHBondContact CG2-OG 3.37Å
540	G	95.4	Very high	94.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-55.6	-35.6	173.4	0	0	0	0	0	112	V536 T542 G543 F581	V536-G540 WeakPolarHBondContact O-CA 3.17Å; V536-G540 PolarHBondContact O-N 3.1Å; G540-T542 PolarHBondContact O-N 2.96Å; G540-G543 PolarHBondContact O-N 2.98Å; G540-F581 VanDerWaalsContact O-CA 3.25Å; G540-F581 WeakPolarHBondContact O-CA 3.4Å; G540-F581 WeakPolarHBondContact O-CB 3.26Å; G540-F581 WeakPolarHBondContact O-CD2 3.37Å
541	S	96.3	Very high	94.8	Very high	4 Å²	4	25.4 Å²	25.4	3%	0.028	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.7	176.9	73.2	0	0	0	0	115	M467 G471 L537 S538 V539 G543 L544 F545	M467-S541 PolarHBondContact O-OG 3.46Å; G471-S541 VanDerWaalsContact CA-OG 3.22Å; G471-S541 WeakPolarHBondContact CA-OG 3.23Å; G471-S541 PolarHBondContact N-OG 3.4Å; L537-S541 WeakPolarHBondContact O-CB 3.37Å; L537-S541 PolarHBondContact O-N 3.25Å; L537-S541 VanDerWaalsContact O-N 3.15Å; S538-S541 PolarHBondContact O-OG 2.98Å; V539-S541 PolarHBondContact O-N 3.25Å; S541-G543 PolarHBondContact O-N 3.41Å; S541-G543 VanDerWaalsContact O-N 3.13Å; S541-L544 VanDerWaalsContact O-CB 3.29Å; S541-L544 WeakPolarHBondContact O-CB 3.33Å; S541-L544 PolarHBondContact O-N 2.92Å; S541-F545 WeakPolarHBondContact O-CD2 3.23Å; S541-F545 PolarHBondContact O-N 2.95Å
542	T	95.4	Very high	94.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-50.4	-35.4	168.6	-52.7	0	0	0	0	111.4	P474 F475 V539 G540 L544 F545 I546 L584	P474-T542 HydrophobicContact CB-CG2 4.17Å; F475-T542 HydrophobicContact CB-CG2 4.17Å; V539-T542 VanDerWaalsContact O-CB 3.24Å; V539-T542 WeakPolarHBondContact O-CB 3.37Å; V539-T542 PolarHBondContact O-N 3.37Å; V539-T542 PolarHBondContact O-OG1 3.32Å; G540-T542 PolarHBondContact O-N 2.96Å; T542-L544 VanDerWaalsContact C-N 3.27Å; T542-L544 PolarHBondContact O-N 3.46Å; T542-F545 PolarHBondContact O-N 3.45Å; T542-F545 VanDerWaalsContact O-N 3.11Å; T542-I546 HydrophobicContact CG2-CD1 4.31Å; T542-I546 WeakPolarHBondContact O-CG1 3.45Å; T542-I546 PolarHBondContact O-N 3.17Å; T542-L584 HydrophobicContact CG2-CD1 3.78Å
543	G	95.6	Very high	94.7	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-59.3	-34.1	175.2	0	0	0	0	0	114.1	G540 S541 I546 F547 G577	G540-G543 PolarHBondContact O-N 2.98Å; S541-G543 PolarHBondContact O-N 3.41Å; S541-G543 VanDerWaalsContact O-N 3.13Å; G543-I546 PolarHBondContact O-N 3.33Å; G543-F547 PolarHBondContact O-N 2.89Å; G543-F547 VanDerWaalsContact O-N 3.15Å; G543-G577 VanDerWaalsContact CA-O 3.26Å; G543-G577 WeakPolarHBondContact CA-O 3.42Å; G543-G577 WeakPolarHBondContact O-CA 3.19Å
544	L	95.5	Very high	94.6	Very high	100 Å²	100	30.2 Å²	30.2	52%	0.524	15%	0.146	S	C	.	.	H	α-helix	trans	-69	-41.3	174.2	179.4	64.5	0	0	0	111.2	S541 T542 I546 F547 L548	S541-L544 VanDerWaalsContact O-CB 3.29Å; S541-L544 WeakPolarHBondContact O-CB 3.33Å; S541-L544 PolarHBondContact O-N 2.92Å; T542-L544 VanDerWaalsContact C-N 3.27Å; T542-L544 PolarHBondContact O-N 3.46Å; L544-I546 VanDerWaalsContact C-N 3.32Å; L544-I546 PolarHBondContact O-N 3.45Å; L544-F547 PolarHBondContact O-N 3.3Å; L544-L548 HydrophobicContact CG-CD1 4.49Å; L544-L548 WeakPolarHBondContact O-CG 3.36Å; L544-L548 PolarHBondContact O-N 3.46Å
545	F	95.6	Very high	94.6	Very high	36 Å²	36	31.9 Å²	31.9	16%	0.158	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-36.9	176.1	-72.6	-83.1	0	0	0	112.2	T468 G471 F472 F475 S541 T542 F547 L548 Y549	T468-F545 WeakPolarHBondContact O-CZ 3.39Å; G471-F545 VanDerWaalsContact C-CD2 3.41Å; G471-F545 VanDerWaalsContact C-CE2 3.47Å; F472-F545 HydrophobicContact CB-CE1 4.01Å; F472-F545 HydrophobicContact CB-CE2 4.3Å; F472-F545 HydrophobicContact CB-CZ 3.83Å; F472-F545 HydrophobicContact CD2-CD1 4.4Å; F472-F545 HydrophobicContact CD2-CE1 4.07Å; F472-F545 VanDerWaalsContact N-CE2 3.34Å; F475-F545 HydrophobicContact CB-CB 3.84Å; F475-F545 HydrophobicContact CB-CG 4.39Å; F475-F545 HydrophobicContact CD1-CB 4.16Å; F475-F545 HydrophobicContact CD2-CB 3.83Å; F475-F545 HydrophobicContact CE2-CB 4.46Å; F475-F545 HydrophobicContact CG-CB 3.66Å; F475-F545 HydrophobicContact CG-CG 4.43Å; S541-F545 WeakPolarHBondContact O-CD2 3.23Å; S541-F545 PolarHBondContact O-N 2.95Å; T542-F545 PolarHBondContact O-N 3.45Å; T542-F545 VanDerWaalsContact O-N 3.11Å; F545-F547 VanDerWaalsContact C-N 3.31Å; F545-F547 PolarHBondContact O-N 3.08Å; F545-L548 PolarHBondContact O-N 3.13Å; F545-Y549 WeakPolarHBondContact O-CB 3.44Å; F545-Y549 PolarHBondContact O-N 3.3Å
546	I	95	Very high	94.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-41.5	172.1	-67.5	168.9	0	0	0	110.8	F475 I478 L482 F486 T542 G543 L544 Y549 S550 F580	F475-I546 HydrophobicContact CD2-CG1 4.38Å; I478-I546 HydrophobicContact CD1-CD1 4.45Å; L482-I546 HydrophobicContact CD1-CG2 4.37Å; L482-I546 HydrophobicContact CD2-CG1 4.09Å; L482-I546 HydrophobicContact CD2-CG2 4.35Å; F486-I546 HydrophobicContact CE2-CG2 4.35Å; F486-I546 HydrophobicContact CZ-CG2 4.37Å; T542-I546 HydrophobicContact CG2-CD1 4.31Å; T542-I546 WeakPolarHBondContact O-CG1 3.45Å; T542-I546 PolarHBondContact O-N 3.17Å; G543-I546 PolarHBondContact O-N 3.33Å; L544-I546 VanDerWaalsContact C-N 3.32Å; L544-I546 PolarHBondContact O-N 3.45Å; I546-Y549 WeakPolarHBondContact O-CB 3.5Å; I546-Y549 PolarHBondContact O-N 2.88Å; I546-S550 PolarHBondContact O-N 3.45Å; I546-F580 HydrophobicContact CD1-CB 3.89Å; I546-F580 HydrophobicContact CD1-CD1 3.83Å; I546-F580 HydrophobicContact CD1-CD2 3.85Å; I546-F580 HydrophobicContact CD1-CE1 4.32Å; I546-F580 HydrophobicContact CD1-CE2 4.34Å; I546-F580 HydrophobicContact CD1-CG 3.58Å
547	F	95.4	Very high	93.9	Very high	50 Å²	50	48.3 Å²	48.3	22%	0.219	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-40.3	175.5	-177.7	-103.4	0	0	0	112.8	G543 L544 F545 Y549 S550 V551 F570 L574	G543-F547 PolarHBondContact O-N 2.89Å; G543-F547 VanDerWaalsContact O-N 3.15Å; L544-F547 PolarHBondContact O-N 3.3Å; F545-F547 VanDerWaalsContact C-N 3.31Å; F545-F547 PolarHBondContact O-N 3.08Å; F547-Y549 VanDerWaalsContact C-N 3.26Å; F547-Y549 PolarHBondContact O-N 3.5Å; F547-S550 PolarHBondContact O-N 3.01Å; F547-S550 VanDerWaalsContact O-N 3.12Å; F547-S550 PolarHBondContact O-OG 3.05Å; F547-V551 HydrophobicContact CE1-CG2 4.47Å; F547-V551 PolarHBondContact O-N 3.35Å; F547-F570 HydrophobicContact CE2-CD1 4.28Å; F547-F570 HydrophobicContact CZ-CD1 4.44Å; F547-L574 HydrophobicContact CD2-CB 4.06Å; F547-L574 HydrophobicContact CD2-CD1 4.03Å; F547-L574 HydrophobicContact CE2-CB 3.78Å; F547-L574 HydrophobicContact CE2-CD1 3.97Å; F547-L574 HydrophobicContact CE2-CG 4.47Å; F547-L574 HydrophobicContact CG-CD1 4.35Å; F547-L574 HydrophobicContact CZ-CD1 4.25Å
548	L	94.8	Very high	93.5	Very high	96 Å²	96	46.8 Å²	46.8	50%	0.503	22%	0.223	S	C	.	.	H	α-helix	trans	-63	-36.5	173.5	-68.4	175	0	0	0	111.8	L544 F545 S550 V551 F552	L544-L548 HydrophobicContact CG-CD1 4.49Å; L544-L548 WeakPolarHBondContact O-CG 3.36Å; L544-L548 PolarHBondContact O-N 3.46Å; F545-L548 PolarHBondContact O-N 3.13Å; L548-S550 VanDerWaalsContact C-N 3.34Å; L548-V551 WeakPolarHBondContact O-CB 3.24Å; L548-V551 PolarHBondContact O-N 3.28Å; L548-F552 PolarHBondContact O-N 3.01Å; L548-F552 VanDerWaalsContact O-N 3.17Å
549	Y	94.1	Very high	93.1	Very high	30 Å²	30	52.1 Å²	52.1	12%	0.118	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-37.5	172.5	179.7	-96	0	0	0	112.1	F475 L482 Y483 F486 F545 I546 F547 V551 F552 Y553	F475-Y549 HydrophobicContact CE2-CD2 4.3Å; F475-Y549 HydrophobicContact CE2-CG 4.08Å; F475-Y549 AromaticContact CZ-CD2 3.92Å; F475-Y549 HydrophobicContact CZ-CD2 3.92Å; F475-Y549 HydrophobicContact CZ-CG 4.12Å; L482-Y549 HydrophobicContact CD2-CD1 3.53Å; L482-Y549 HydrophobicContact CD2-CE1 4.06Å; L482-Y549 HydrophobicContact CD2-CG 3.94Å; L482-Y549 HydrophobicContact CG-CD1 3.99Å; L482-Y549 HydrophobicContact CG-CE1 4.07Å; Y483-Y549 WeakPolarHBondContact CA-OH 3.42Å; Y483-Y549 VanDerWaalsContact CB-OH 3.3Å; Y483-Y549 WeakPolarHBondContact CB-OH 3.36Å; F486-Y549 HydrophobicContact CD2-CE1 4.42Å; F486-Y549 HydrophobicContact CG-CE1 4.32Å; F545-Y549 WeakPolarHBondContact O-CB 3.44Å; F545-Y549 PolarHBondContact O-N 3.3Å; I546-Y549 WeakPolarHBondContact O-CB 3.5Å; I546-Y549 PolarHBondContact O-N 2.88Å; F547-Y549 VanDerWaalsContact C-N 3.26Å; F547-Y549 PolarHBondContact O-N 3.5Å; Y549-V551 VanDerWaalsContact C-N 3.29Å; Y549-V551 PolarHBondContact O-N 2.95Å; Y549-F552 HydrophobicContact CD2-CD1 4.34Å; Y549-F552 HydrophobicContact CE2-CD1 4.17Å; Y549-F552 WeakPolarHBondContact O-CB 3.31Å; Y549-F552 PolarHBondContact O-N 3.47Å; Y549-F552 VanDerWaalsContact O-N 3.17Å; Y549-Y553 HydrophobicContact CE1-CD2 4.27Å; Y549-Y553 WeakPolarHBondContact O-CB 3.47Å; Y549-Y553 PolarHBondContact O-N 2.95Å
550	S	94.6	Very high	92.9	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-37.1	175.9	78.9	0	0	0	0	111.9	F486 I546 F547 L548 Y553 Y554 F569	F486-S550 VanDerWaalsContact CE1-CB 3.46Å; I546-S550 PolarHBondContact O-N 3.45Å; F547-S550 PolarHBondContact O-N 3.01Å; F547-S550 VanDerWaalsContact O-N 3.12Å; F547-S550 PolarHBondContact O-OG 3.05Å; L548-S550 VanDerWaalsContact C-N 3.34Å; S550-Y553 PolarHBondContact O-N 2.91Å; S550-Y554 WeakPolarHBondContact O-CB 3.25Å; S550-Y554 PolarHBondContact O-N 3.21Å; S550-F569 WeakPolarHBondContact O-CE1 3.3Å
551	V	94.4	Very high	92.6	Very high	63 Å²	63	56.3 Å²	56.3	38%	0.382	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-46.2	172.5	179.5	0	0	0	0	111.2	F547 L548 Y549 Y554 A555 F570	F547-V551 HydrophobicContact CE1-CG2 4.47Å; F547-V551 PolarHBondContact O-N 3.35Å; L548-V551 WeakPolarHBondContact O-CB 3.24Å; L548-V551 PolarHBondContact O-N 3.28Å; Y549-V551 VanDerWaalsContact C-N 3.29Å; Y549-V551 PolarHBondContact O-N 2.95Å; V551-Y554 PolarHBondContact O-N 3.04Å; V551-A555 WeakPolarHBondContact O-CB 3.38Å; V551-A555 PolarHBondContact O-N 2.59Å; V551-F570 HydrophobicContact CB-CE1 4.33Å; V551-F570 HydrophobicContact CG2-CE1 3.75Å
552	F	93.4	Very high	92.3	Very high	103 Å²	103	58 Å²	58	45%	0.452	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-44.8	175.6	170	-96.3	0	0	0	112	L548 Y549 A555 R556 R557	L548-F552 PolarHBondContact O-N 3.01Å; L548-F552 VanDerWaalsContact O-N 3.17Å; Y549-F552 HydrophobicContact CD2-CD1 4.34Å; Y549-F552 HydrophobicContact CE2-CD1 4.17Å; Y549-F552 WeakPolarHBondContact O-CB 3.31Å; Y549-F552 PolarHBondContact O-N 3.47Å; Y549-F552 VanDerWaalsContact O-N 3.17Å; F552-A555 PolarHBondContact O-N 3.09Å; F552-R556 HydrophobicContact CD2-CB 4.35Å; F552-R556 HydrophobicContact CD2-CG 4.09Å; F552-R556 HydrophobicContact CE2-CB 4.03Å; F552-R556 HydrophobicContact CE2-CG 3.94Å; F552-R556 HydrophobicContact CZ-CB 4.28Å; F552-R556 WeakPolarHBondContact O-CB 3.46Å; F552-R556 PolarHBondContact O-N 2.96Å; F552-R557 HydrophobicContact CE1-CG 4.31Å
553	Y	92.1	Very high	92	Very high	16 Å²	16	61.3 Å²	61.3	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-48	178.8	-175.4	-87.9	0	0	0	110.6	Y483 F486 A487 Y549 S550 A555 R557 S558 F569	Y483-Y553 HydrophobicContact CD2-CD2 4.24Å; Y483-Y553 AromaticContact CD2-CE2 3.89Å; Y483-Y553 HydrophobicContact CD2-CE2 3.89Å; Y483-Y553 AromaticContact CE2-CE2 3.94Å; Y483-Y553 HydrophobicContact CE2-CE2 3.94Å; F486-Y553 HydrophobicContact CB-CD2 4.1Å; F486-Y553 HydrophobicContact CB-CE1 4.36Å; F486-Y553 HydrophobicContact CB-CE2 3.91Å; F486-Y553 HydrophobicContact CB-CG 4.41Å; F486-Y553 HydrophobicContact CD1-CD1 4.1Å; F486-Y553 HydrophobicContact CD1-CG 4.11Å; A487-Y553 WeakPolarHBondContact CA-OH 3.35Å; Y549-Y553 HydrophobicContact CE1-CD2 4.27Å; Y549-Y553 WeakPolarHBondContact O-CB 3.47Å; Y549-Y553 PolarHBondContact O-N 2.95Å; S550-Y553 PolarHBondContact O-N 2.91Å; Y553-A555 PolarHBondContact O-N 3.47Å; Y553-R557 HydrophobicContact CD2-CB 4Å; Y553-R557 HydrophobicContact CE2-CB 4.19Å; Y553-R557 HydrophobicContact CG-CB 4.37Å; Y553-R557 CarbonylContact O-C 3.56Å; Y553-R557 WeakPolarHBondContact O-CA 3.5Å; Y553-R557 WeakPolarHBondContact O-CB 3.15Å; Y553-R557 PolarHBondContact O-N 3.27Å; Y553-S558 PolarHBondContact O-N 3.43Å; Y553-F569 HydrophobicContact CD1-CE2 4.16Å; Y553-F569 HydrophobicContact CD1-CZ 4.06Å
554	Y	92.4	Very high	91.8	Very high	44 Å²	44	61.3 Å²	61.3	17%	0.173	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-43.3	178.3	-175.7	-84.2	0	0	0	112.5	S550 V551 S558 M560 T566 F569 F570	S550-Y554 WeakPolarHBondContact O-CB 3.25Å; S550-Y554 PolarHBondContact O-N 3.21Å; V551-Y554 PolarHBondContact O-N 3.04Å; Y554-S558 VanDerWaalsContact CA-OG 3.29Å; Y554-S558 WeakPolarHBondContact CA-OG 3.5Å; Y554-S558 PolarHBondContact O-OG 3Å; Y554-M560 HydrophobicContact CD2-CB 4.49Å; Y554-M560 HydrophobicContact CE2-CB 4.05Å; Y554-T566 HydrophobicContact CE2-CG2 4.48Å; Y554-T566 PolarHBondContact OH-OG1 3.23Å; Y554-F569 HydrophobicContact CD2-CB 4.45Å; Y554-F569 AromaticContact CD2-CD1 3.65Å; Y554-F569 HydrophobicContact CD2-CD1 3.65Å; Y554-F569 HydrophobicContact CD2-CE1 4.02Å; Y554-F569 AromaticContact CD2-CG 3.99Å; Y554-F569 HydrophobicContact CD2-CG 3.99Å; Y554-F569 HydrophobicContact CG-CD1 4.24Å; Y554-F569 HydrophobicContact CG-CE1 4.24Å; Y554-F570 AromaticContact CD1-CE2 3.9Å; Y554-F570 HydrophobicContact CD1-CE2 3.9Å; Y554-F570 AromaticContact CD1-CZ 3.86Å; Y554-F570 HydrophobicContact CD1-CZ 3.86Å; Y554-F570 HydrophobicContact CD2-CE2 4.03Å; Y554-F570 HydrophobicContact CD2-CZ 4.25Å; Y554-F570 HydrophobicContact CE1-CE2 4.19Å; Y554-F570 HydrophobicContact CE2-CE2 4.29Å; Y554-F570 AromaticContact CG-CE2 3.84Å; Y554-F570 HydrophobicContact CG-CE2 3.84Å; Y554-F570 AromaticContact CG-CZ 3.69Å; Y554-F570 HydrophobicContact CG-CZ 3.69Å
555	A	91.9	Very high	91.7	Very high	70 Å²	70	56.6 Å²	56.6	58%	0.579	30%	0.299	S	S	*	.	H	α-helix	trans	-80.9	-26.3	-174.1	0	0	0	0	0	114.7	V551 F552 Y553	V551-A555 WeakPolarHBondContact O-CB 3.38Å; V551-A555 PolarHBondContact O-N 2.59Å; F552-A555 PolarHBondContact O-N 3.09Å; Y553-A555 PolarHBondContact O-N 3.47Å
556	R	90.3	Very high	91.6	Very high	198 Å²	198	56.6 Å²	56.6	75%	0.747	30%	0.302	S	S	*	.	H	α-helix	trans	-124	-16	-168.6	-64.4	-65	-166.4	150.4	1.4	114.7	F552	F552-R556 HydrophobicContact CD2-CB 4.35Å; F552-R556 HydrophobicContact CD2-CG 4.09Å; F552-R556 HydrophobicContact CE2-CB 4.03Å; F552-R556 HydrophobicContact CE2-CG 3.94Å; F552-R556 HydrophobicContact CZ-CB 4.28Å; F552-R556 WeakPolarHBondContact O-CB 3.46Å; F552-R556 PolarHBondContact O-N 2.96Å
557	R	86.1	Confident	91.6	Very high	148 Å²	148	58.9 Å²	58.9	56%	0.558	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	-33.2	-172.4	-67.6	-62.1	-169.1	125.9	-2.2	113.4	F552 Y553	F552-R557 HydrophobicContact CE1-CG 4.31Å; Y553-R557 HydrophobicContact CD2-CB 4Å; Y553-R557 HydrophobicContact CE2-CB 4.19Å; Y553-R557 HydrophobicContact CG-CB 4.37Å; Y553-R557 CarbonylContact O-C 3.56Å; Y553-R557 WeakPolarHBondContact O-CA 3.5Å; Y553-R557 WeakPolarHBondContact O-CB 3.15Å; Y553-R557 PolarHBondContact O-N 3.27Å
558	S	86	Confident	91.5	Very high	17 Å²	17	57 Å²	57	12%	0.119	31%	0.307	C	S	.	.			trans	-82.3	146.2	173	78.7	0	0	0	0	110.2	Y553 Y554	Y553-S558 PolarHBondContact O-N 3.43Å; Y554-S558 VanDerWaalsContact CA-OG 3.29Å; Y554-S558 WeakPolarHBondContact CA-OG 3.5Å; Y554-S558 PolarHBondContact O-OG 3Å
559	N	85.9	Confident	91.5	Very high	118 Å²	118	52.4 Å²	52.4	63%	0.631	28%	0.283	S	S	*	.			trans	-94.1	20.9	165.8	-68.7	-21.7	0	0	0	110.7	H53	H53-N559 HydrophobicContact CB-CB 4.28Å; H53-N559 WeakPolarHBondContact CB-O 3.12Å
560	M	89.8	Confident	91.6	Very high	19 Å²	19	53.4 Å²	53.4	9%	0.094	29%	0.288	C	S	.	.			trans	-75.5	140.5	-176.8	-69	168.5	179.5	0	0	110.2	H53 N54 P55 W490 Y554 Q565 F569	H53-M560 WeakPolarHBondContact O-CG 3.16Å; N54-M560 WeakPolarHBondContact OD1-CA 3.48Å; P55-M560 HydrophobicContact CG-CE 4.5Å; W490-M560 HydrophobicContact CB-CE 3.71Å; W490-M560 WeakPolarHBondContact O-CE 3.47Å; Y554-M560 HydrophobicContact CD2-CB 4.49Å; Y554-M560 HydrophobicContact CE2-CB 4.05Å; M560-Q565 HydrophobicContact CB-CG 3.9Å; M560-Q565 HydrophobicContact CG-CG 3.99Å; M560-Q565 HydrophobicContact SD-CG 4.18Å; M560-F569 HydrophobicContact SD-CD2 4.1Å
561	S	89.3	Confident	91.6	Very high	69 Å²	69	54 Å²	54	48%	0.483	30%	0.295	S	S	.	.			trans	-145.8	179.8	178.2	65.5	0	0	0	0	110.7	N54 Q565	N54-S561 VanDerWaalsContact CG-O 3.31Å; N54-S561 PolarHBondContact ND2-O 3.33Å; N54-S561 PolarHBondContact OD1-N 3.09Å; N54-S561 PolarHBondContact OD1-O 3.37Å; S561-Q565 WeakPolarHBondContact O-CB 3.24Å
562	G	89.7	Confident	91.6	Very high	40 Å²	40	54.1 Å²	54.1	41%	0.412	29%	0.289	S	S	.	.	S	Bend	trans	82.5	153.7	177.2	0	0	0	0	0	114.4	T566	G562-T566 VanDerWaalsContact O-CB 3.31Å; G562-T566 WeakPolarHBondContact O-CB 3.25Å; G562-T566 PolarHBondContact O-N 3.29Å; G562-T566 PolarHBondContact O-OG1 3.13Å
563	A	90.4	Very high	91.6	Very high	68 Å²	68	49.3 Å²	49.3	56%	0.562	27%	0.268	S	S	*	.	H	α-helix	trans	-67.7	-40.4	-173.3	0	0	0	0	0	112.8	T566 V567	A563-T566 PolarHBondContact O-N 2.99Å; A563-V567 WeakPolarHBondContact O-CG2 3.46Å; A563-V567 PolarHBondContact O-N 3.32Å
564	V	91.9	Very high	91.8	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-58.5	-178.3	179	0	0	0	0	110.4	E57 V397 H398 N401 T566 V567 E568	E57-V564 HydrophobicContact CB-CG1 4.39Å; E57-V564 HydrophobicContact CG-CB 4.35Å; E57-V564 HydrophobicContact CG-CG1 4.32Å; V397-V564 HydrophobicContact CG1-CG2 4.21Å; H398-V564 VanDerWaalsContact CE1-CG1 3.43Å; H398-V564 WeakPolarHBondContact CE1-CG1 3.05Å; H398-V564 WeakPolarHBondContact ND1-CG1 3.38Å; N401-V564 HydrophobicContact CB-CG2 3.73Å; V564-T566 VanDerWaalsContact C-N 3.28Å; V564-T566 PolarHBondContact O-N 2.96Å; V564-V567 PolarHBondContact O-N 3.04Å; V564-E568 WeakPolarHBondContact O-CB 3.31Å; V564-E568 PolarHBondContact O-N 3.29Å; V564-E568 VanDerWaalsContact O-N 3.14Å
565	Q	92.1	Very high	91.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-36.1	-179.8	-173.3	64.6	46.6	0	0	112.5	N54 M560 S561 F569	N54-Q565 HydrophobicContact CB-CB 3.92Å; N54-Q565 HydrophobicContact CB-CG 3.82Å; M560-Q565 HydrophobicContact CB-CG 3.9Å; M560-Q565 HydrophobicContact CG-CG 3.99Å; M560-Q565 HydrophobicContact SD-CG 4.18Å; S561-Q565 WeakPolarHBondContact O-CB 3.24Å; Q565-F569 WeakPolarHBondContact O-CB 3.46Å; Q565-F569 PolarHBondContact O-N 2.86Å
566	T	93.8	Very high	92	Very high	36 Å²	36	50.7 Å²	50.7	22%	0.221	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-50.1	-179.8	-57.3	0	0	0	0	112.1	Y554 G562 A563 V564 E568 F569 F570	Y554-T566 HydrophobicContact CE2-CG2 4.48Å; Y554-T566 PolarHBondContact OH-OG1 3.23Å; G562-T566 VanDerWaalsContact O-CB 3.31Å; G562-T566 WeakPolarHBondContact O-CB 3.25Å; G562-T566 PolarHBondContact O-N 3.29Å; G562-T566 PolarHBondContact O-OG1 3.13Å; A563-T566 PolarHBondContact O-N 2.99Å; V564-T566 VanDerWaalsContact C-N 3.28Å; V564-T566 PolarHBondContact O-N 2.96Å; T566-E568 VanDerWaalsContact C-N 3.31Å; T566-E568 PolarHBondContact O-N 3.47Å; T566-F569 PolarHBondContact O-N 3.39Å; T566-F570 HydrophobicContact CG2-CD2 3.69Å; T566-F570 HydrophobicContact CG2-CE2 3.87Å; T566-F570 VanDerWaalsContact O-CD2 3.31Å; T566-F570 WeakPolarHBondContact O-CD2 3.14Å; T566-F570 PolarHBondContact O-N 2.96Å
567	V	95	Very high	92.3	Very high	48 Å²	48	41.5 Å²	41.5	29%	0.291	24%	0.238	S	C	.	.	H	α-helix	trans	-64.6	-40.6	-178.6	171.9	0	0	0	0	110.4	V393 V394 V397 A563 V564 G571	V393-V567 HydrophobicContact CG1-CG1 4.25Å; V394-V567 HydrophobicContact CG2-CG1 4.08Å; V397-V567 HydrophobicContact CG2-CB 4.46Å; V397-V567 HydrophobicContact CG2-CG1 4.08Å; V397-V567 HydrophobicContact CG2-CG2 4.35Å; A563-V567 WeakPolarHBondContact O-CG2 3.46Å; A563-V567 PolarHBondContact O-N 3.32Å; V564-V567 PolarHBondContact O-N 3.04Å; V567-G571 WeakPolarHBondContact O-CA 3.17Å; V567-G571 PolarHBondContact O-N 3.42Å
568	E	93.1	Very high	92.8	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-49.2	176.8	-173.5	170.4	-178	0	0	112.5	Q56 V394 H398 W490 V564 T566 F570 G571 Y572	Q56-E568 HydrophobicContact CB-CG 4.44Å; Q56-E568 WeakPolarHBondContact CB-OE1 3.28Å; Q56-E568 WeakPolarHBondContact CB-OE2 3.26Å; V394-E568 HydrophobicContact CG1-CB 4.16Å; V394-E568 HydrophobicContact CG1-CG 4.13Å; H398-E568 IonicContact CE1-OE2 2.9Å; H398-E568 PolarHBondContact CE1-OE2 2.92Å; H398-E568 IonicContact NE2-OE2 3.57Å; H398-E568 PolarHBondContact NE2-OE2 3.3Å; W490-E568 HydrophobicContact CZ3-CG 4.47Å; V564-E568 WeakPolarHBondContact O-CB 3.31Å; V564-E568 PolarHBondContact O-N 3.29Å; V564-E568 VanDerWaalsContact O-N 3.14Å; T566-E568 VanDerWaalsContact C-N 3.31Å; T566-E568 PolarHBondContact O-N 3.47Å; E568-F570 PolarHBondContact O-N 3.11Å; E568-G571 PolarHBondContact O-N 2.91Å; E568-Y572 HydrophobicContact CG-CD2 3.67Å; E568-Y572 HydrophobicContact CG-CE2 3.68Å; E568-Y572 WeakPolarHBondContact O-CD2 3.47Å; E568-Y572 PolarHBondContact O-N 3.41Å
569	F	94.6	Very high	93.3	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-52.9	179.3	178.1	-89.3	0	0	0	111.5	F486 W490 S550 Y553 Y554 M560 Q565 T566 S573	F486-F569 HydrophobicContact CD1-CE2 4.29Å; F486-F569 HydrophobicContact CD1-CZ 4.18Å; F486-F569 HydrophobicContact CE1-CE2 4.38Å; F486-F569 HydrophobicContact CE1-CZ 4.01Å; W490-F569 HydrophobicContact CB-CD2 4.32Å; W490-F569 HydrophobicContact CB-CE2 4.19Å; W490-F569 AromaticContact CD1-CE2 3.54Å; W490-F569 AromaticContact CD2-CD2 3.46Å; W490-F569 HydrophobicContact CD2-CD2 3.46Å; W490-F569 VanDerWaalsContact CD2-CD2 3.46Å; W490-F569 AromaticContact CD2-CE2 3.81Å; W490-F569 HydrophobicContact CD2-CE2 3.81Å; W490-F569 AromaticContact CE2-CD2 3.68Å; W490-F569 AromaticContact CE2-CE2 3.88Å; W490-F569 AromaticContact CE3-CD2 3.8Å; W490-F569 HydrophobicContact CE3-CD2 3.8Å; W490-F569 AromaticContact CG-CD2 3.71Å; W490-F569 HydrophobicContact CG-CD2 3.71Å; W490-F569 AromaticContact CG-CE2 3.59Å; W490-F569 HydrophobicContact CG-CE2 3.59Å; W490-F569 HydrophobicContact CH2-CB 4.49Å; W490-F569 HydrophobicContact CH2-CD2 4.46Å; W490-F569 HydrophobicContact CZ2-CD2 4.19Å; W490-F569 HydrophobicContact CZ3-CB 4.37Å; W490-F569 HydrophobicContact CZ3-CD2 4.29Å; W490-F569 AromaticContact NE1-CE2 3.69Å; S550-F569 WeakPolarHBondContact O-CE1 3.3Å; Y553-F569 HydrophobicContact CD1-CE2 4.16Å; Y553-F569 HydrophobicContact CD1-CZ 4.06Å; Y554-F569 HydrophobicContact CD2-CB 4.45Å; Y554-F569 AromaticContact CD2-CD1 3.65Å; Y554-F569 HydrophobicContact CD2-CD1 3.65Å; Y554-F569 HydrophobicContact CD2-CE1 4.02Å; Y554-F569 AromaticContact CD2-CG 3.99Å; Y554-F569 HydrophobicContact CD2-CG 3.99Å; Y554-F569 HydrophobicContact CG-CD1 4.24Å; Y554-F569 HydrophobicContact CG-CE1 4.24Å; M560-F569 HydrophobicContact SD-CD2 4.1Å; Q565-F569 WeakPolarHBondContact O-CB 3.46Å; Q565-F569 PolarHBondContact O-N 2.86Å; T566-F569 PolarHBondContact O-N 3.39Å; F569-S573 WeakPolarHBondContact O-CB 3.46Å; F569-S573 PolarHBondContact O-N 3.33Å; F569-S573 PolarHBondContact O-OG 3.42Å
570	F	95.7	Very high	93.8	Very high	51 Å²	51	34.6 Å²	34.6	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-72.5	-36.5	-178.2	-76	-64.1	0	0	0	112.6	F547 V551 Y554 T566 E568 L574	F547-F570 HydrophobicContact CE2-CD1 4.28Å; F547-F570 HydrophobicContact CZ-CD1 4.44Å; V551-F570 HydrophobicContact CB-CE1 4.33Å; V551-F570 HydrophobicContact CG2-CE1 3.75Å; Y554-F570 AromaticContact CD1-CE2 3.9Å; Y554-F570 HydrophobicContact CD1-CE2 3.9Å; Y554-F570 AromaticContact CD1-CZ 3.86Å; Y554-F570 HydrophobicContact CD1-CZ 3.86Å; Y554-F570 HydrophobicContact CD2-CE2 4.03Å; Y554-F570 HydrophobicContact CD2-CZ 4.25Å; Y554-F570 HydrophobicContact CE1-CE2 4.19Å; Y554-F570 HydrophobicContact CE2-CE2 4.29Å; Y554-F570 AromaticContact CG-CE2 3.84Å; Y554-F570 HydrophobicContact CG-CE2 3.84Å; Y554-F570 AromaticContact CG-CZ 3.69Å; Y554-F570 HydrophobicContact CG-CZ 3.69Å; T566-F570 HydrophobicContact CG2-CD2 3.69Å; T566-F570 HydrophobicContact CG2-CE2 3.87Å; T566-F570 VanDerWaalsContact O-CD2 3.31Å; T566-F570 WeakPolarHBondContact O-CD2 3.14Å; T566-F570 PolarHBondContact O-N 2.96Å; E568-F570 PolarHBondContact O-N 3.11Å; F570-L574 VanDerWaalsContact O-CB 3.28Å; F570-L574 WeakPolarHBondContact O-CB 3.05Å; F570-L574 PolarHBondContact O-N 2.58Å
571	G	95.4	Very high	94.1	Very high	13 Å²	13	36 Å²	36	13%	0.134	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-57	177.4	0	0	0	0	0	111.7	T390 V567 E568 L574 L575	T390-G571 WeakPolarHBondContact CG2-O 3.26Å; V567-G571 WeakPolarHBondContact O-CA 3.17Å; V567-G571 PolarHBondContact O-N 3.42Å; E568-G571 PolarHBondContact O-N 2.91Å; G571-L574 PolarHBondContact O-N 2.9Å; G571-L575 PolarHBondContact O-N 3.46Å
572	Y	93.8	Very high	94.5	Very high	66 Å²	66	32.8 Å²	32.8	26%	0.259	19%	0.189	S	C	.	.	H	α-helix	trans	-74.2	-30.4	179.5	-62.6	-61	0	0	0	112.8	V394 W490 E568 L574 L575 T576	V394-Y572 HydrophobicContact CG1-CE2 3.98Å; W490-Y572 HydrophobicContact CH2-CD2 4.3Å; E568-Y572 HydrophobicContact CG-CD2 3.67Å; E568-Y572 HydrophobicContact CG-CE2 3.68Å; E568-Y572 WeakPolarHBondContact O-CD2 3.47Å; E568-Y572 PolarHBondContact O-N 3.41Å; Y572-L574 VanDerWaalsContact C-N 3.29Å; Y572-L574 PolarHBondContact O-N 2.87Å; Y572-L575 HydrophobicContact CD1-CD1 3.93Å; Y572-L575 HydrophobicContact CE1-CD1 4.42Å; Y572-L575 PolarHBondContact O-N 2.92Å; Y572-T576 PolarHBondContact O-N 2.88Å; Y572-T576 PolarHBondContact O-OG1 2.87Å
573	S	94.9	Very high	94.9	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-37.6	172.5	-67.7	0	0	0	0	112.3	F569 T576 G577	F569-S573 WeakPolarHBondContact O-CB 3.46Å; F569-S573 PolarHBondContact O-N 3.33Å; F569-S573 PolarHBondContact O-OG 3.42Å; S573-T576 PolarHBondContact O-N 3.49Å; S573-G577 PolarHBondContact O-N 3.34Å
574	L	95.8	Very high	95.2	Very high	90 Å²	90	28 Å²	28	47%	0.471	15%	0.145	S	C	.	.	H	α-helix	trans	-63.6	-45.1	173.7	-178.6	66.3	0	0	0	111.1	F547 F570 G571 Y572 G577 Y578	F547-L574 HydrophobicContact CD2-CB 4.06Å; F547-L574 HydrophobicContact CD2-CD1 4.03Å; F547-L574 HydrophobicContact CE2-CB 3.78Å; F547-L574 HydrophobicContact CE2-CD1 3.97Å; F547-L574 HydrophobicContact CE2-CG 4.47Å; F547-L574 HydrophobicContact CG-CD1 4.35Å; F547-L574 HydrophobicContact CZ-CD1 4.25Å; F570-L574 VanDerWaalsContact O-CB 3.28Å; F570-L574 WeakPolarHBondContact O-CB 3.05Å; F570-L574 PolarHBondContact O-N 2.58Å; G571-L574 PolarHBondContact O-N 2.9Å; Y572-L574 VanDerWaalsContact C-N 3.29Å; Y572-L574 PolarHBondContact O-N 2.87Å; L574-G577 PolarHBondContact O-N 2.94Å; L574-Y578 WeakPolarHBondContact O-CB 3.29Å; L574-Y578 PolarHBondContact O-N 3.36Å
575	L	95.6	Very high	95.4	Very high	12 Å²	12	27.9 Å²	27.9	6%	0.063	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-41.9	175.5	-74.4	173.3	0	0	0	112	F387 T390 G571 Y572 Y578 V579	F387-L575 HydrophobicContact CD2-CD1 3.98Å; T390-L575 HydrophobicContact CG2-CD1 3.76Å; T390-L575 HydrophobicContact CG2-CG 4.03Å; G571-L575 PolarHBondContact O-N 3.46Å; Y572-L575 HydrophobicContact CD1-CD1 3.93Å; Y572-L575 HydrophobicContact CE1-CD1 4.42Å; Y572-L575 PolarHBondContact O-N 2.92Å; L575-Y578 WeakPolarHBondContact O-CB 3.43Å; L575-Y578 PolarHBondContact O-N 3.4Å; L575-V579 WeakPolarHBondContact O-CG2 3.4Å; L575-V579 PolarHBondContact O-N 2.96Å
576	T	93.6	Very high	95.6	Very high	57 Å²	57	28 Å²	28	35%	0.35	15%	0.145	S	C	.	.	H	α-helix	trans	-59.6	-48.6	174.3	-59.8	0	0	0	0	110.5	Y572 S573 Y578 V579 F580	Y572-T576 PolarHBondContact O-N 2.88Å; Y572-T576 PolarHBondContact O-OG1 2.87Å; S573-T576 PolarHBondContact O-N 3.49Å; T576-Y578 VanDerWaalsContact C-N 3.26Å; T576-Y578 PolarHBondContact O-N 3.5Å; T576-V579 PolarHBondContact O-N 3.31Å; T576-V579 VanDerWaalsContact O-N 3.17Å; T576-F580 HydrophobicContact CG2-CD2 3.83Å; T576-F580 HydrophobicContact CG2-CE2 3.78Å; T576-F580 WeakPolarHBondContact O-CD2 3.19Å; T576-F580 PolarHBondContact O-N 3.13Å
577	G	95.8	Very high	95.8	Very high	5 Å²	5	27.7 Å²	27.7	5%	0.052	14%	0.141	C	C	.	.	H	α-helix	trans	-56	-40.5	174	0	0	0	0	0	112.5	G543 S573 L574 F580 F581	G543-G577 VanDerWaalsContact CA-O 3.26Å; G543-G577 WeakPolarHBondContact CA-O 3.42Å; G543-G577 WeakPolarHBondContact O-CA 3.19Å; S573-G577 PolarHBondContact O-N 3.34Å; L574-G577 PolarHBondContact O-N 2.94Å; G577-F580 PolarHBondContact O-N 3.43Å; G577-F581 WeakPolarHBondContact O-CB 3.4Å; G577-F581 PolarHBondContact O-N 2.93Å
578	Y	97.2	Very high	95.9	Very high	58 Å²	58	25.4 Å²	25.4	23%	0.227	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176.3	-176.7	-127.3	0	0	0	113.3	L382 F383 P386 L574 L575 T576 F581 L582	L382-Y578 WeakPolarHBondContact CG-OH 3.35Å; L382-Y578 PolarHBondContact O-OH 2.76Å; L382-Y578 VanDerWaalsContact O-OH 3.1Å; F383-Y578 HydrophobicContact CD2-CD1 4.04Å; F383-Y578 HydrophobicContact CD2-CE1 4.09Å; P386-Y578 HydrophobicContact CB-CE1 4.46Å; P386-Y578 HydrophobicContact CG-CE1 4.27Å; L574-Y578 WeakPolarHBondContact O-CB 3.29Å; L574-Y578 PolarHBondContact O-N 3.36Å; L575-Y578 WeakPolarHBondContact O-CB 3.43Å; L575-Y578 PolarHBondContact O-N 3.4Å; T576-Y578 VanDerWaalsContact C-N 3.26Å; T576-Y578 PolarHBondContact O-N 3.5Å; Y578-F581 WeakPolarHBondContact O-CB 3.25Å; Y578-F581 PolarHBondContact O-N 3.3Å; Y578-L582 HydrophobicContact CD1-CD1 4.27Å; Y578-L582 HydrophobicContact CD2-CG 4.4Å; Y578-L582 HydrophobicContact CE1-CD1 3.78Å; Y578-L582 HydrophobicContact CE2-CD1 4.11Å; Y578-L582 HydrophobicContact CE2-CD2 4.1Å; Y578-L582 HydrophobicContact CE2-CG 4.02Å; Y578-L582 WeakPolarHBondContact O-CG 3.48Å; Y578-L582 PolarHBondContact O-N 2.94Å
579	V	96.3	Very high	96.1	Very high	34 Å²	34	24.9 Å²	24.9	21%	0.206	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-46.5	173.9	169.7	0	0	0	0	110.8	F317 F383 L575 T576 F581 L582 M583	F317-V579 HydrophobicContact CB-CG1 4.11Å; F317-V579 HydrophobicContact CD1-CG1 3.84Å; F317-V579 HydrophobicContact CD1-CG2 4.45Å; F317-V579 HydrophobicContact CD2-CG1 4.07Å; F317-V579 HydrophobicContact CD2-CG2 4.44Å; F317-V579 HydrophobicContact CE1-CG1 4.28Å; F317-V579 HydrophobicContact CE1-CG2 4.06Å; F317-V579 HydrophobicContact CE2-CG1 4.46Å; F317-V579 HydrophobicContact CE2-CG2 4.03Å; F317-V579 HydrophobicContact CG-CG1 3.76Å; F317-V579 HydrophobicContact CZ-CG2 3.85Å; F383-V579 HydrophobicContact CD2-CG2 4.29Å; F383-V579 HydrophobicContact CE2-CG2 3.56Å; F383-V579 HydrophobicContact CZ-CG2 4.18Å; L575-V579 WeakPolarHBondContact O-CG2 3.4Å; L575-V579 PolarHBondContact O-N 2.96Å; T576-V579 PolarHBondContact O-N 3.31Å; T576-V579 VanDerWaalsContact O-N 3.17Å; V579-F581 VanDerWaalsContact C-N 3.31Å; V579-F581 PolarHBondContact O-N 2.91Å; V579-L582 PolarHBondContact O-N 2.94Å; V579-M583 WeakPolarHBondContact O-CB 3.36Å; V579-M583 PolarHBondContact O-N 3.07Å
580	F	95.4	Very high	96.2	Very high	46 Å²	46	28.2 Å²	28.2	20%	0.202	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-39.4	175.3	-87.5	-82.8	0	0	0	112	L508 I546 T576 G577 M583 L584	L508-F580 HydrophobicContact CD2-CD1 4.17Å; L508-F580 HydrophobicContact CD2-CE1 3.74Å; I546-F580 HydrophobicContact CD1-CB 3.89Å; I546-F580 HydrophobicContact CD1-CD1 3.83Å; I546-F580 HydrophobicContact CD1-CD2 3.85Å; I546-F580 HydrophobicContact CD1-CE1 4.32Å; I546-F580 HydrophobicContact CD1-CE2 4.34Å; I546-F580 HydrophobicContact CD1-CG 3.58Å; T576-F580 HydrophobicContact CG2-CD2 3.83Å; T576-F580 HydrophobicContact CG2-CE2 3.78Å; T576-F580 WeakPolarHBondContact O-CD2 3.19Å; T576-F580 PolarHBondContact O-N 3.13Å; G577-F580 PolarHBondContact O-N 3.43Å; F580-M583 HydrophobicContact CD1-CE 3.69Å; F580-M583 HydrophobicContact CE1-CE 3.84Å; F580-M583 PolarHBondContact O-N 2.79Å; F580-L584 HydrophobicContact CD1-CD1 4.18Å; F580-L584 VanDerWaalsContact O-CB 3.26Å; F580-L584 WeakPolarHBondContact O-CB 3.45Å; F580-L584 WeakPolarHBondContact O-CG 3.36Å; F580-L584 PolarHBondContact O-N 2.89Å
581	F	97.4	Very high	96.1	Very high	49 Å²	49	26.9 Å²	26.9	22%	0.215	14%	0.137	C	C	.	.	H	α-helix	trans	-59.7	-47.9	175.9	172.7	-84.6	0	0	0	112.1	L537 G540 G577 Y578 V579 G585	L537-F581 HydrophobicContact CD2-CE2 4.04Å; L537-F581 HydrophobicContact CD2-CZ 3.77Å; G540-F581 VanDerWaalsContact O-CA 3.25Å; G540-F581 WeakPolarHBondContact O-CA 3.4Å; G540-F581 WeakPolarHBondContact O-CB 3.26Å; G540-F581 WeakPolarHBondContact O-CD2 3.37Å; G577-F581 WeakPolarHBondContact O-CB 3.4Å; G577-F581 PolarHBondContact O-N 2.93Å; Y578-F581 WeakPolarHBondContact O-CB 3.25Å; Y578-F581 PolarHBondContact O-N 3.3Å; V579-F581 VanDerWaalsContact C-N 3.31Å; V579-F581 PolarHBondContact O-N 2.91Å; F581-G585 WeakPolarHBondContact O-CA 3.45Å; F581-G585 PolarHBondContact O-N 2.84Å
582	L	97.6	Very high	96.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-46.4	178.7	-65.6	175.1	0	0	0	111.5	V310 V313 G314 F317 L382 Y578 V579 T586	V310-L582 HydrophobicContact CB-CD2 4.37Å; V310-L582 HydrophobicContact CG1-CD2 3.84Å; V310-L582 HydrophobicContact CG2-CD2 4.2Å; V313-L582 HydrophobicContact CB-CD1 4.38Å; V313-L582 HydrophobicContact CG1-CD1 3.65Å; G314-L582 WeakPolarHBondContact CA-O 3.27Å; F317-L582 HydrophobicContact CD2-CB 4.5Å; F317-L582 HydrophobicContact CD2-CD1 4.39Å; F317-L582 HydrophobicContact CE2-CD1 4.09Å; L382-L582 HydrophobicContact CD2-CD2 4.26Å; Y578-L582 HydrophobicContact CD1-CD1 4.27Å; Y578-L582 HydrophobicContact CD2-CG 4.4Å; Y578-L582 HydrophobicContact CE1-CD1 3.78Å; Y578-L582 HydrophobicContact CE2-CD1 4.11Å; Y578-L582 HydrophobicContact CE2-CD2 4.1Å; Y578-L582 HydrophobicContact CE2-CG 4.02Å; Y578-L582 WeakPolarHBondContact O-CG 3.48Å; Y578-L582 PolarHBondContact O-N 2.94Å; V579-L582 PolarHBondContact O-N 2.94Å; L582-T586 WeakPolarHBondContact O-CB 3.3Å; L582-T586 PolarHBondContact O-N 2.91Å; L582-T586 PolarHBondContact O-OG1 3.43Å
583	M	96.9	Very high	96.2	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.039	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-52.2	-178.6	-177.7	-176.1	69.3	0	0	112.2	F317 L318 F505 V579 F580 T586 I587	F317-M583 HydrophobicContact CB-CB 4.35Å; L318-M583 HydrophobicContact CB-CG 4.1Å; L318-M583 HydrophobicContact CD1-CG 3.97Å; L318-M583 HydrophobicContact CD1-SD 4.22Å; F505-M583 HydrophobicContact CE2-CE 3.86Å; F505-M583 HydrophobicContact CE2-SD 3.72Å; F505-M583 HydrophobicContact CZ-SD 4.02Å; V579-M583 WeakPolarHBondContact O-CB 3.36Å; V579-M583 PolarHBondContact O-N 3.07Å; F580-M583 HydrophobicContact CD1-CE 3.69Å; F580-M583 HydrophobicContact CE1-CE 3.84Å; F580-M583 PolarHBondContact O-N 2.79Å; M583-T586 PolarHBondContact O-N 2.82Å; M583-I587 WeakPolarHBondContact O-CG1 3.16Å; M583-I587 PolarHBondContact O-N 3.43Å
584	L	96.6	Very high	96.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-71.7	-33.6	-178.9	-64.1	176.1	0	0	0	112	L508 L509 V539 T542 F580 T586 I587 S588	L508-L584 HydrophobicContact CD1-CD1 4.26Å; L508-L584 HydrophobicContact CD1-CD2 4.35Å; L508-L584 HydrophobicContact CD2-CD1 4.39Å; L508-L584 HydrophobicContact CD2-CD2 4.15Å; L508-L584 HydrophobicContact CG-CD1 4.49Å; L508-L584 HydrophobicContact CG-CD2 3.9Å; L509-L584 HydrophobicContact CD2-CD2 4.13Å; V539-L584 HydrophobicContact CG1-CB 4.1Å; T542-L584 HydrophobicContact CG2-CD1 3.78Å; F580-L584 HydrophobicContact CD1-CD1 4.18Å; F580-L584 VanDerWaalsContact O-CB 3.26Å; F580-L584 WeakPolarHBondContact O-CB 3.45Å; F580-L584 WeakPolarHBondContact O-CG 3.36Å; F580-L584 PolarHBondContact O-N 2.89Å; L584-T586 VanDerWaalsContact C-N 3.3Å; L584-T586 PolarHBondContact O-N 3.17Å; L584-I587 PolarHBondContact O-N 3.37Å; L584-S588 VanDerWaalsContact O-CB 3.27Å; L584-S588 WeakPolarHBondContact O-CB 3.35Å; L584-S588 PolarHBondContact O-N 2.95Å
585	G	96.9	Very high	95.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.7	-40.8	172	0	0	0	0	0	112.2	V536 F581 S588 F589	V536-G585 WeakPolarHBondContact O-CA 3.36Å; F581-G585 WeakPolarHBondContact O-CA 3.45Å; F581-G585 PolarHBondContact O-N 2.84Å; G585-S588 WeakPolarHBondContact O-CB 3.49Å; G585-S588 PolarHBondContact O-N 3.29Å; G585-F589 WeakPolarHBondContact O-CB 3.2Å; G585-F589 PolarHBondContact O-N 3.46Å
586	T	97.5	Very high	95.7	Very high	3 Å²	3	27 Å²	27	2%	0.018	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-44	175.5	-65.7	0	0	0	0	112.6	V310 L311 G314 A315 L582 M583 L584 S588 F589 F590	V310-T586 PolarHBondContact O-OG1 3.15Å; L311-T586 WeakPolarHBondContact CA-OG1 3.15Å; L311-T586 HydrophobicContact CD2-CG2 4.23Å; L311-T586 PolarHBondContact O-OG1 2.82Å; G314-T586 WeakPolarHBondContact CA-OG1 3.38Å; A315-T586 HydrophobicContact CB-CG2 4.33Å; L582-T586 WeakPolarHBondContact O-CB 3.3Å; L582-T586 PolarHBondContact O-N 2.91Å; L582-T586 PolarHBondContact O-OG1 3.43Å; M583-T586 PolarHBondContact O-N 2.82Å; L584-T586 VanDerWaalsContact C-N 3.3Å; L584-T586 PolarHBondContact O-N 3.17Å; T586-S588 VanDerWaalsContact C-N 3.3Å; T586-S588 PolarHBondContact O-N 2.93Å; T586-F589 PolarHBondContact O-N 3.32Å; T586-F590 HydrophobicContact CG2-CD2 3.61Å; T586-F590 HydrophobicContact CG2-CE2 3.53Å; T586-F590 VanDerWaalsContact O-CD2 3.29Å; T586-F590 WeakPolarHBondContact O-CD2 3.29Å; T586-F590 PolarHBondContact O-N 3.48Å
587	I	97	Very high	95.5	Very high	28 Å²	28	28.1 Å²	28.1	14%	0.144	13%	0.128	C	C	.	.	H	α-helix	trans	-61.5	-42.5	176.5	-69.4	-77.9	0	0	0	111.2	L318 L509 A513 M583 L584 S591	L318-I587 HydrophobicContact CD1-CD1 3.91Å; L318-I587 HydrophobicContact CD1-CG1 4.16Å; L318-I587 HydrophobicContact CD2-CD1 3.61Å; L318-I587 HydrophobicContact CD2-CG1 4.35Å; L318-I587 HydrophobicContact CG-CD1 4.42Å; L509-I587 HydrophobicContact CD2-CD1 4.2Å; L509-I587 HydrophobicContact CD2-CG1 3.95Å; A513-I587 HydrophobicContact CB-CG2 4.38Å; M583-I587 WeakPolarHBondContact O-CG1 3.16Å; M583-I587 PolarHBondContact O-N 3.43Å; L584-I587 PolarHBondContact O-N 3.37Å; I587-S591 VanDerWaalsContact O-CB 3.25Å; I587-S591 WeakPolarHBondContact O-CB 3.45Å; I587-S591 PolarHBondContact O-N 3.24Å; I587-S591 PolarHBondContact O-OG 2.9Å
588	S	96.4	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.2	-49.1	176.4	-172.8	0	0	0	0	111.5	S516 S535 S538 V539 L584 G585 T586 F590 S591 S592	S516-S588 WeakPolarHBondContact CB-OG 3.31Å; S516-S588 VanDerWaalsContact OG-CA 3.3Å; S516-S588 WeakPolarHBondContact OG-CA 3.28Å; S516-S588 PolarHBondContact OG-O 3.46Å; S516-S588 PolarHBondContact OG-OG 3.02Å; S535-S588 WeakPolarHBondContact O-CB 3.35Å; S535-S588 PolarHBondContact O-OG 3.05Å; S538-S588 PolarHBondContact OG-OG 3.2Å; V539-S588 WeakPolarHBondContact CG2-OG 3.37Å; L584-S588 VanDerWaalsContact O-CB 3.27Å; L584-S588 WeakPolarHBondContact O-CB 3.35Å; L584-S588 PolarHBondContact O-N 2.95Å; G585-S588 WeakPolarHBondContact O-CB 3.49Å; G585-S588 PolarHBondContact O-N 3.29Å; T586-S588 VanDerWaalsContact C-N 3.3Å; T586-S588 PolarHBondContact O-N 2.93Å; S588-F590 PolarHBondContact O-N 2.87Å; S588-S591 PolarHBondContact O-N 3.12Å; S588-S592 WeakPolarHBondContact O-CB 3.49Å; S588-S592 PolarHBondContact O-N 3.16Å; S588-S592 PolarHBondContact O-OG 3.48Å
589	F	97.3	Very high	94.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.8	-49.7	179	179.9	-94.1	0	0	0	112.7	L307 L311 F363 W531 W532 S535 V536 G585 T586 S591 S592 L593	L307-F589 HydrophobicContact CD2-CE2 4.12Å; L307-F589 HydrophobicContact CD2-CZ 4.42Å; L311-F589 HydrophobicContact CD1-CD1 3.47Å; L311-F589 VanDerWaalsContact CD1-CD1 3.47Å; L311-F589 HydrophobicContact CD1-CE1 3.41Å; L311-F589 VanDerWaalsContact CD1-CE1 3.41Å; L311-F589 HydrophobicContact CD1-CG 4.09Å; L311-F589 HydrophobicContact CD1-CZ 4Å; L311-F589 HydrophobicContact CD2-CB 3.59Å; L311-F589 HydrophobicContact CD2-CD1 3.51Å; L311-F589 HydrophobicContact CD2-CD2 4.45Å; L311-F589 HydrophobicContact CD2-CE1 4.35Å; L311-F589 HydrophobicContact CD2-CG 3.58Å; L311-F589 HydrophobicContact CG-CD1 4.14Å; L311-F589 HydrophobicContact CG-CG 4.45Å; F363-F589 AromaticContact CE1-CE1 3.75Å; F363-F589 HydrophobicContact CE1-CE1 3.75Å; F363-F589 AromaticContact CE1-CZ 3.63Å; F363-F589 HydrophobicContact CE1-CZ 3.63Å; F363-F589 HydrophobicContact CE2-CE1 4.31Å; F363-F589 AromaticContact CZ-CE1 3.57Å; F363-F589 HydrophobicContact CZ-CE1 3.57Å; F363-F589 AromaticContact CZ-CZ 3.57Å; F363-F589 HydrophobicContact CZ-CZ 3.57Å; W531-F589 HydrophobicContact CH2-CE2 4.06Å; W531-F589 HydrophobicContact CH2-CZ 4.21Å; W531-F589 HydrophobicContact CZ3-CD2 4.11Å; W531-F589 AromaticContact CZ3-CE2 3.71Å; W531-F589 HydrophobicContact CZ3-CE2 3.71Å; W531-F589 HydrophobicContact CZ3-CZ 4.25Å; W532-F589 HydrophobicContact CD2-CE2 4.42Å; W532-F589 AromaticContact CE3-CE2 3.63Å; W532-F589 HydrophobicContact CE3-CE2 3.63Å; W532-F589 AromaticContact CE3-CZ 3.6Å; W532-F589 HydrophobicContact CE3-CZ 3.6Å; W532-F589 HydrophobicContact CZ3-CE2 4.28Å; W532-F589 AromaticContact CZ3-CZ 3.78Å; W532-F589 HydrophobicContact CZ3-CZ 3.78Å; S535-F589 WeakPolarHBondContact OG-CD2 3.49Å; V536-F589 HydrophobicContact CG2-CB 3.89Å; V536-F589 HydrophobicContact CG2-CD2 4.02Å; V536-F589 HydrophobicContact CG2-CG 4.27Å; G585-F589 WeakPolarHBondContact O-CB 3.2Å; G585-F589 PolarHBondContact O-N 3.46Å; T586-F589 PolarHBondContact O-N 3.32Å; F589-S591 VanDerWaalsContact C-N 3.34Å; F589-S591 PolarHBondContact O-N 3.44Å; F589-S592 PolarHBondContact O-N 3.37Å; F589-L593 HydrophobicContact CE1-CD2 4.14Å; F589-L593 WeakPolarHBondContact O-CB 3.26Å; F589-L593 PolarHBondContact O-N 3.44Å
590	F	96.6	Very high	94	Very high	70 Å²	70	29.3 Å²	29.3	31%	0.307	13%	0.128	S	C	.	.	H	α-helix	trans	-67.7	-34.4	-179	-78	-62.4	0	0	0	112.7	V359 T586 S588 K594	V359-F590 HydrophobicContact CG1-CE2 4.43Å; V359-F590 HydrophobicContact CG1-CZ 4.09Å; T586-F590 HydrophobicContact CG2-CD2 3.61Å; T586-F590 HydrophobicContact CG2-CE2 3.53Å; T586-F590 VanDerWaalsContact O-CD2 3.29Å; T586-F590 WeakPolarHBondContact O-CD2 3.29Å; T586-F590 PolarHBondContact O-N 3.48Å; S588-F590 PolarHBondContact O-N 2.87Å; F590-K594 WeakPolarHBondContact O-CB 3.5Å; F590-K594 WeakPolarHBondContact O-CG 3.43Å; F590-K594 PolarHBondContact O-N 2.98Å
591	S	95.3	Very high	93.5	Very high	23 Å²	23	31.9 Å²	31.9	16%	0.161	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-46.9	173.8	-58.5	0	0	0	0	111.1	A513 I587 S588 F589 K594 F595	A513-S591 WeakPolarHBondContact CB-OG 3.41Å; I587-S591 VanDerWaalsContact O-CB 3.25Å; I587-S591 WeakPolarHBondContact O-CB 3.45Å; I587-S591 PolarHBondContact O-N 3.24Å; I587-S591 PolarHBondContact O-OG 2.9Å; S588-S591 PolarHBondContact O-N 3.12Å; F589-S591 VanDerWaalsContact C-N 3.34Å; F589-S591 PolarHBondContact O-N 3.44Å; S591-K594 PolarHBondContact O-N 3.29Å; S591-F595 WeakPolarHBondContact O-CB 3.2Å; S591-F595 PolarHBondContact O-N 2.94Å
592	S	95.3	Very high	92.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-44.1	175.8	-73.7	0	0	0	0	112.6	S516 T520 S588 F589 K594 F595 I596	S516-S592 PolarHBondContact OG-OG 3.24Å; T520-S592 PolarHBondContact OG1-OG 2.9Å; S588-S592 WeakPolarHBondContact O-CB 3.49Å; S588-S592 PolarHBondContact O-N 3.16Å; S588-S592 PolarHBondContact O-OG 3.48Å; F589-S592 PolarHBondContact O-N 3.37Å; S592-K594 PolarHBondContact O-N 3.3Å; S592-F595 PolarHBondContact O-N 2.89Å; S592-I596 WeakPolarHBondContact O-CB 3.46Å; S592-I596 VanDerWaalsContact O-CG1 3.26Å; S592-I596 WeakPolarHBondContact O-CG1 3.5Å; S592-I596 PolarHBondContact O-N 3.39Å
593	L	94.7	Very high	91.3	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.052	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-43.1	177.3	174	62.8	0	0	0	111.7	F363 F441 W531 F589 R597	F363-L593 HydrophobicContact CE2-CD2 4.03Å; F363-L593 HydrophobicContact CZ-CD2 4.22Å; F441-L593 HydrophobicContact CE2-CD1 4.14Å; F441-L593 HydrophobicContact CZ-CD1 4Å; W531-L593 HydrophobicContact CH2-CB 3.93Å; W531-L593 HydrophobicContact CH2-CD1 3.74Å; W531-L593 HydrophobicContact CH2-CG 4.4Å; W531-L593 HydrophobicContact CZ2-CD1 4.27Å; W531-L593 HydrophobicContact CZ3-CB 4.17Å; F589-L593 HydrophobicContact CE1-CD2 4.14Å; F589-L593 WeakPolarHBondContact O-CB 3.26Å; F589-L593 PolarHBondContact O-N 3.44Å; L593-R597 HydrophobicContact CD1-CG 4.32Å; L593-R597 WeakPolarHBondContact O-CB 3.2Å; L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 2.71Å
594	K	92.9	Very high	89.4	Confident	160 Å²	160	40.8 Å²	40.8	70%	0.696	19%	0.19	S	C	*	.	H	α-helix	trans	-62.5	-44.2	175.8	-79.4	-177.1	178.3	-178.6	0	111.4	F590 S591 S592 Y598	F590-K594 WeakPolarHBondContact O-CB 3.5Å; F590-K594 WeakPolarHBondContact O-CG 3.43Å; F590-K594 PolarHBondContact O-N 2.98Å; S591-K594 PolarHBondContact O-N 3.29Å; S592-K594 PolarHBondContact O-N 3.3Å; K594-Y598 WeakPolarHBondContact O-CB 3.39Å; K594-Y598 PolarHBondContact O-N 3.21Å
595	F	91.7	Very high	87.4	Confident	16 Å²	16	45.4 Å²	45.4	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-48.3	176.9	170.4	-110.1	0	0	0	112.4	L261 I517 T520 Y521 S591 S592 R597 Y598 I599	L261-F595 HydrophobicContact CD1-CE2 4.08Å; L261-F595 HydrophobicContact CD1-CZ 4.26Å; L261-F595 HydrophobicContact CD2-CE2 3.9Å; I517-F595 HydrophobicContact CG1-CB 4.1Å; I517-F595 HydrophobicContact CG2-CB 3.93Å; I517-F595 HydrophobicContact CG2-CD1 3.9Å; I517-F595 HydrophobicContact CG2-CD2 3.47Å; I517-F595 VanDerWaalsContact CG2-CD2 3.47Å; I517-F595 HydrophobicContact CG2-CE1 4.25Å; I517-F595 HydrophobicContact CG2-CE2 3.85Å; I517-F595 HydrophobicContact CG2-CG 3.49Å; I517-F595 VanDerWaalsContact CG2-CG 3.49Å; I517-F595 HydrophobicContact CG2-CZ 4.22Å; T520-F595 HydrophobicContact CG2-CD1 4.42Å; Y521-F595 HydrophobicContact CD2-CE1 4.21Å; Y521-F595 AromaticContact CD2-CZ 3.77Å; Y521-F595 HydrophobicContact CD2-CZ 3.77Å; Y521-F595 HydrophobicContact CG-CZ 4.22Å; S591-F595 WeakPolarHBondContact O-CB 3.2Å; S591-F595 PolarHBondContact O-N 2.94Å; S592-F595 PolarHBondContact O-N 2.89Å; F595-R597 VanDerWaalsContact C-N 3.35Å; F595-R597 PolarHBondContact O-N 3.47Å; F595-Y598 WeakPolarHBondContact O-CA 3.23Å; F595-Y598 WeakPolarHBondContact O-CB 3.11Å; F595-Y598 PolarHBondContact O-N 2.97Å; F595-Y598 VanDerWaalsContact O-N 3.07Å; F595-I599 HydrophobicContact CD2-CG2 4.06Å; F595-I599 HydrophobicContact CE1-CD1 4.09Å; F595-I599 HydrophobicContact CE1-CG2 4.32Å; F595-I599 HydrophobicContact CE2-CG2 3.55Å; F595-I599 HydrophobicContact CZ-CD1 4.34Å; F595-I599 HydrophobicContact CZ-CG2 3.7Å; F595-I599 PolarHBondContact O-N 3.31Å
596	I	91.1	Very high	84.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-47	178.9	-73	173.5	0	0	0	110.5	V297 F298 T520 L524 W531 S592 Y598 I599 Y600	V297-I596 HydrophobicContact CG1-CG2 3.58Å; F298-I596 HydrophobicContact CE1-CG2 3.77Å; F298-I596 HydrophobicContact CZ-CG2 3.7Å; T520-I596 HydrophobicContact CG2-CD1 3.73Å; T520-I596 HydrophobicContact CG2-CG1 4.01Å; L524-I596 HydrophobicContact CD1-CD1 4.19Å; L524-I596 HydrophobicContact CD1-CG1 3.89Å; W531-I596 HydrophobicContact CB-CD1 4.17Å; W531-I596 HydrophobicContact CD2-CD1 3.13Å; W531-I596 HydrophobicContact CE3-CD1 3.52Å; W531-I596 HydrophobicContact CG-CD1 3.42Å; W531-I596 VanDerWaalsContact CG-CD1 3.42Å; W531-I596 HydrophobicContact CH2-CD1 4.21Å; W531-I596 HydrophobicContact CZ2-CD1 3.88Å; W531-I596 HydrophobicContact CZ3-CD1 4.05Å; S592-I596 WeakPolarHBondContact O-CB 3.46Å; S592-I596 VanDerWaalsContact O-CG1 3.26Å; S592-I596 WeakPolarHBondContact O-CG1 3.5Å; S592-I596 PolarHBondContact O-N 3.39Å; I596-Y598 VanDerWaalsContact C-N 3.28Å; I596-Y598 PolarHBondContact O-N 2.59Å; I596-I599 WeakPolarHBondContact O-CG1 3.43Å; I596-I599 PolarHBondContact O-N 2.91Å; I596-Y600 HydrophobicContact CG2-CD2 3.72Å; I596-Y600 HydrophobicContact CG2-CE2 3.9Å; I596-Y600 WeakPolarHBondContact O-CD2 3.31Å; I596-Y600 PolarHBondContact O-N 3.13Å; I596-Y600 VanDerWaalsContact O-N 3.09Å
597	R	89.6	Confident	83.9	Confident	80 Å²	80	59.3 Å²	59.3	30%	0.302	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-42	174.8	-76.4	-179.6	165	-177	-6.8	111.9	F298 D442 P444 L593 F595 V601	F298-R597 HydrophobicContact CE1-CG 4.32Å; D442-R597 PolarHBondContact O-NH2 3.15Å; P444-R597 HydrophobicContact CG-CG 4.39Å; L593-R597 HydrophobicContact CD1-CG 4.32Å; L593-R597 WeakPolarHBondContact O-CB 3.2Å; L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 2.71Å; F595-R597 VanDerWaalsContact C-N 3.35Å; F595-R597 PolarHBondContact O-N 3.47Å; R597-V601 VanDerWaalsContact O-CB 3.28Å; R597-V601 WeakPolarHBondContact O-CB 3.38Å; R597-V601 WeakPolarHBondContact O-CG2 3.5Å; R597-V601 PolarHBondContact O-N 3.48Å
598	Y	87.7	Confident	83.2	Confident	116 Å²	116	60.9 Å²	60.9	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-48.3	177.8	177.7	-98.7	0	0	0	112.2	L261 K594 F595 I596 Y600 N602	L261-Y598 HydrophobicContact CD2-CD1 4.41Å; L261-Y598 HydrophobicContact CD2-CE1 4.05Å; K594-Y598 WeakPolarHBondContact O-CB 3.39Å; K594-Y598 PolarHBondContact O-N 3.21Å; F595-Y598 WeakPolarHBondContact O-CA 3.23Å; F595-Y598 WeakPolarHBondContact O-CB 3.11Å; F595-Y598 PolarHBondContact O-N 2.97Å; F595-Y598 VanDerWaalsContact O-N 3.07Å; I596-Y598 VanDerWaalsContact C-N 3.28Å; I596-Y598 PolarHBondContact O-N 2.59Å; Y598-Y600 PolarHBondContact O-N 2.75Å; Y598-N602 WeakPolarHBondContact CE2-ND2 3.5Å; Y598-N602 PolarHBondContact O-N 3.46Å; Y598-N602 PolarHBondContact O-ND2 3.12Å
599	I	85.7	Confident	82.5	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-67.8	-37.2	-178.3	64.6	176.3	0	0	0	112.8	L261 W290 L524 F595 I596 L603	L261-I599 HydrophobicContact CD1-CG2 3.91Å; W290-I599 HydrophobicContact CE3-CD1 4.07Å; W290-I599 HydrophobicContact CZ3-CB 4.24Å; W290-I599 HydrophobicContact CZ3-CD1 4.35Å; W290-I599 HydrophobicContact CZ3-CG1 4.47Å; L524-I599 HydrophobicContact CD1-CD1 4.06Å; F595-I599 HydrophobicContact CD2-CG2 4.06Å; F595-I599 HydrophobicContact CE1-CD1 4.09Å; F595-I599 HydrophobicContact CE1-CG2 4.32Å; F595-I599 HydrophobicContact CE2-CG2 3.55Å; F595-I599 HydrophobicContact CZ-CD1 4.34Å; F595-I599 HydrophobicContact CZ-CG2 3.7Å; F595-I599 PolarHBondContact O-N 3.31Å; I596-I599 WeakPolarHBondContact O-CG1 3.43Å; I596-I599 PolarHBondContact O-N 2.91Å; I599-L603 PolarHBondContact O-N 3.49Å
600	Y	85	Confident	81.6	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-85.4	-23.7	-177.5	-71.4	-72.7	0	0	0	114	W290 H294 V297 F298 I596 Y598 L603	W290-Y600 HydrophobicContact CE3-CE1 4.27Å; W290-Y600 PolarHBondContact O-OH 3.32Å; H294-Y600 HydrophobicContact CB-CD1 3.85Å; H294-Y600 HydrophobicContact CB-CE1 3.59Å; V297-Y600 HydrophobicContact CB-CE2 4.11Å; V297-Y600 HydrophobicContact CG1-CD2 4.29Å; V297-Y600 HydrophobicContact CG1-CE2 3.7Å; V297-Y600 HydrophobicContact CG2-CE1 4.4Å; V297-Y600 HydrophobicContact CG2-CE2 3.89Å; V297-Y600 WeakPolarHBondContact CG2-OH 3.33Å; F298-Y600 HydrophobicContact CE2-CD2 4.06Å; F298-Y600 HydrophobicContact CE2-CG 4.11Å; F298-Y600 HydrophobicContact CZ-CD2 4.05Å; F298-Y600 HydrophobicContact CZ-CG 4.4Å; I596-Y600 HydrophobicContact CG2-CD2 3.72Å; I596-Y600 HydrophobicContact CG2-CE2 3.9Å; I596-Y600 WeakPolarHBondContact O-CD2 3.31Å; I596-Y600 PolarHBondContact O-N 3.13Å; I596-Y600 VanDerWaalsContact O-N 3.09Å; Y598-Y600 PolarHBondContact O-N 2.75Å; Y600-L603 HydrophobicContact CD1-CD2 4.25Å; Y600-L603 WeakPolarHBondContact O-CB 3.19Å; Y600-L603 PolarHBondContact O-N 3.24Å
601	V	83.7	Confident	80.7	Confident	100 Å²	100	68 Å²	68	61%	0.606	33%	0.329	S	S	*	.	H	α-helix	trans	-71.2	-34.7	170.2	168.3	0	0	0	0	111.2	P444 R597	P444-V601 HydrophobicContact CB-CG2 3.94Å; P444-V601 HydrophobicContact CG-CG2 3.69Å; R597-V601 VanDerWaalsContact O-CB 3.28Å; R597-V601 WeakPolarHBondContact O-CB 3.38Å; R597-V601 WeakPolarHBondContact O-CG2 3.5Å; R597-V601 PolarHBondContact O-N 3.48Å
602	N	77.8	Confident	79.7	Confident	83 Å²	83	71 Å²	71	44%	0.444	34%	0.34	S	S	.	.	S	Bend	trans	-82.9	-2.8	176.3	-70.3	-76.2	0	0	0	113	Y598 K604	Y598-N602 WeakPolarHBondContact CE2-ND2 3.5Å; Y598-N602 PolarHBondContact O-N 3.46Å; Y598-N602 PolarHBondContact O-ND2 3.12Å; N602-K604 PolarHBondContact O-N 3.18Å; N602-K604 VanDerWaalsContact O-N 3.16Å
603	L	71.4	Confident	78.6	Confident	18 Å²	18	76.1 Å²	76.1	9%	0.094	37%	0.365	C	S	.	.	S	Bend	trans	-74.6	101.3	170.2	-162.6	87	0	0	0	107.1	W290 K291 H294 I599 Y600 M605	W290-L603 HydrophobicContact CH2-CD1 4.22Å; W290-L603 HydrophobicContact CZ3-CD1 4.02Å; K291-L603 HydrophobicContact CD-CD1 4.43Å; K291-L603 HydrophobicContact CG-CD1 4.24Å; H294-L603 HydrophobicContact CB-CD2 4.23Å; I599-L603 PolarHBondContact O-N 3.49Å; Y600-L603 HydrophobicContact CD1-CD2 4.25Å; Y600-L603 WeakPolarHBondContact O-CB 3.19Å; Y600-L603 PolarHBondContact O-N 3.24Å; L603-M605 HydrophobicContact CD2-CE 4.16Å; L603-M605 HydrophobicContact CD2-CG 3.54Å; L603-M605 HydrophobicContact CD2-SD 3.52Å; L603-M605 VanDerWaalsContact CD2-SD 3.52Å; L603-M605 HydrophobicContact CG-CG 3.86Å; L603-M605 HydrophobicContact CG-SD 4.41Å; L603-M605 PolarHBondContact O-N 3.44Å; L603-M605 VanDerWaalsContact O-N 3.12Å
604	K	57.8	Low	77.3	Confident	145 Å²	145	81.2 Å²	81.2	63%	0.63	39%	0.389	S	S	*	.			trans	-64.7	112.4	168.1	-73.4	-179.1	-179.9	177	0	107.2	Y268 N602	Y268-K604 PolarHBondContact OH-O 3.42Å; N602-K604 PolarHBondContact O-N 3.18Å; N602-K604 VanDerWaalsContact O-N 3.16Å
605	M	54.1	Low	76	Confident	96 Å²	96	74.6 Å²	74.6	47%	0.473	36%	0.363	S	S	.	.			trans	-133	108.7	166.4	-62.8	-149.1	-49.3	0	0	105.9	H294 L603	H294-M605 WeakPolarHBondContact CD2-CE 3.49Å; H294-M605 VanDerWaalsContact NE2-CE 3.29Å; H294-M605 WeakPolarHBondContact NE2-CE 3.35Å; L603-M605 HydrophobicContact CD2-CE 4.16Å; L603-M605 HydrophobicContact CD2-CG 3.54Å; L603-M605 HydrophobicContact CD2-SD 3.52Å; L603-M605 VanDerWaalsContact CD2-SD 3.52Å; L603-M605 HydrophobicContact CG-CG 3.86Å; L603-M605 HydrophobicContact CG-SD 4.41Å; L603-M605 PolarHBondContact O-N 3.44Å; L603-M605 VanDerWaalsContact O-N 3.12Å
606	D	36.9	Very low	74.6	Confident	236 Å²	236	79.9 Å²	79.9	100%	1.262	39%	0.39	S	S	*	.			trans	-64.6	0	174.2	-74.8	-22.2	0	0	0	112

Retrieved 606 of 606 residues in 180.5 ms (Link to these results)

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