A0A077ZKM9_TRITR Loading...

TBC1 domain family member 15

Acts as a GTPase activating protein for RAB7A. Does not act on RAB4, RAB5 or RAB6.

AlphaFold DB , UniProt , Accession A0A077ZKM9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 422 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	Very low	28.5	Very low	236 Å²	236	163.3 Å²	163.3	100%	1.163	84%	0.842	S	S	*	*				0	116	0	-93.2	174.5	156.2	0	0	107.9
2	I	30.4	Very low	28.5	Very low	159 Å²	159	164.7 Å²	164.7	82%	0.815	84%	0.842	S	S	*	*			trans	64.2	102.6	161.8	-47	-179.7	0	0	0	116.6
3	F	23.5	Very low	28.4	Very low	210 Å²	210	158.9 Å²	158.9	92%	0.921	83%	0.834	S	S	*	*			trans	-61.7	124.8	161.3	-83.3	-100	0	0	0	110.2
4	E	26.6	Very low	28.5	Very low	180 Å²	180	153.4 Å²	153.4	84%	0.841	82%	0.823	S	S	*	*			trans	-165.3	111.8	151.5	-117.7	178	-164.1	0	0	110.4
5	K	31.2	Very low	28.5	Very low	206 Å²	206	153.5 Å²	153.5	90%	0.896	82%	0.822	S	S	*	*			trans	157.9	91.8	142	-87.2	175.3	-178.3	-176.7	0	109.9
6	A	30.6	Very low	28.5	Very low	88 Å²	88	153.9 Å²	153.9	73%	0.727	82%	0.823	S	S	*	*			trans	-75.3	137.2	162.1	0	0	0	0	0	109.6
7	P	28.5	Very low	28.5	Very low	108 Å²	108	155.8 Å²	155.8	70%	0.701	82%	0.822	S	S	*	*			trans	-92.3	136.8	-177.6	33	-30.1	0	0	0	113.3
8	A	27.6	Very low	28.5	Very low	104 Å²	104	158 Å²	158	86%	0.86	83%	0.827	S	S	*	*			trans	36.2	84.5	147.1	0	0	0	0	0	119.5
9	W	24.6	Very low	28.4	Very low	220 Å²	220	159.5 Å²	159.5	83%	0.833	83%	0.83	S	S	*	*			trans	-147.2	31.5	158.4	47.7	-85.4	0	0	0	112.9
10	S	27.9	Very low	28.5	Very low	101 Å²	101	158.1 Å²	158.1	71%	0.706	82%	0.823	S	S	*	*			trans	-127.7	25.9	-169.9	63.2	0	0	0	0	116.9
11	K	30.5	Very low	28.5	Very low	184 Å²	184	154.8 Å²	154.8	80%	0.8	82%	0.819	S	S	*	*	S	Bend	trans	-122	-5.5	173.5	-84.7	-172.5	174.6	-176.8	0	117.1
12	E	28.2	Very low	28.4	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	80%	0.798	S	S	*	*	S	Bend	trans	-106.3	-4.1	176.1	-82.4	152.1	154.6	0	0	114.2
13	A	28.2	Very low	28.4	Very low	90 Å²	90	144.2 Å²	144.2	74%	0.744	78%	0.781	S	S	*	*	S	Bend	trans	-90.4	2.2	174.6	0	0	0	0	0	114.2
14	A	29.4	Very low	28.6	Very low	81 Å²	81	143.1 Å²	143.1	67%	0.669	77%	0.771	S	S	*	*	S	Bend	trans	-115.7	9	-175.3	0	0	0	0	0	114.4
15	L	29	Very low	28.8	Very low	155 Å²	155	140 Å²	140	81%	0.812	76%	0.764	S	S	*	*	S	Bend	trans	-116.3	13.8	178.3	-84	160.6	0	0	0	113.7
16	L	28.6	Very low	28.7	Very low	161 Å²	161	134.6 Å²	134.6	84%	0.843	75%	0.749	S	S	*	*	S	Bend	trans	-115.8	13.7	178.5	-82.6	164.7	0	0	0	114
17	K	27.7	Very low	28.6	Very low	185 Å²	185	137.6 Å²	137.6	80%	0.804	75%	0.745	S	S	*	*	S	Bend	trans	-122.4	92.9	172.2	-74.5	-176.6	176.5	-178.9	0	108
18	E	28.4	Very low	28.6	Very low	196 Å²	196	139.7 Å²	139.7	92%	0.916	74%	0.744	S	S	*	*	S	Bend	trans	172.3	-10.2	139.4	-96.4	171.9	175.6	0	0	115.7
19	E	26.6	Very low	28.6	Very low	187 Å²	187	143.8 Å²	143.8	87%	0.874	74%	0.742	S	S	*	*	S	Bend	trans	-100.1	-0.3	-169.9	-82.7	-169.3	152.9	0	0	118.8
20	N	30.3	Very low	28.8	Very low	131 Å²	131	140.1 Å²	140.1	70%	0.701	74%	0.737	S	S	*	*	S	Bend	trans	-125.8	10.7	-172	-82.1	-33.5	0	0	0	117.5
21	A	29.6	Very low	28.7	Very low	89 Å²	89	142 Å²	142	74%	0.736	74%	0.739	S	S	*	*	S	Bend	trans	-80.5	-20.9	178.1	0	0	0	0	0	113.9
22	A	29.5	Very low	28.5	Very low	88 Å²	88	138.5 Å²	138.5	73%	0.727	74%	0.735	S	S	*	*	S	Bend	trans	-94.8	-21.2	-173.9	0	0	0	0	0	114.7
23	D	29.7	Very low	28.4	Very low	85 Å²	85	139.3 Å²	139.3	46%	0.455	73%	0.732	S	S	.	*	S	Bend	trans	-91.1	-6.9	-177.5	-156.1	42.8	0	0	0	113.6	K27	D23-K27 IonicContact OD2-NZ 3.01Å; D23-K27 PolarHBondContact OD2-NZ 3.47Å
24	W	27.9	Very low	28.3	Very low	186 Å²	186	141.5 Å²	141.5	71%	0.705	74%	0.736	S	S	*	*	H	α-helix	trans	-84.4	-32.1	-177.4	-128	70.4	0	0	0	113.4	T26 F28	W24-T26 VanDerWaalsContact C-N 3.26Å; W24-T26 PolarHBondContact O-N 3.44Å; W24-F28 HydrophobicContact CE3-CD2 4.17Å; W24-F28 HydrophobicContact CE3-CE2 4.19Å; W24-F28 HydrophobicContact CH2-CE2 4.03Å; W24-F28 HydrophobicContact CZ3-CD2 4.04Å; W24-F28 AromaticContact CZ3-CE2 3.59Å; W24-F28 HydrophobicContact CZ3-CE2 3.59Å
25	V	30.5	Very low	28.3	Very low	114 Å²	114	143.8 Å²	143.8	69%	0.691	74%	0.742	S	S	*	*	H	α-helix	trans	-72.1	-23.3	-179.2	179.3	0	0	0	0	111.6
26	T	30	Very low	28.4	Very low	94 Å²	94	140.9 Å²	140.9	58%	0.577	73%	0.731	S	S	*	*	H	α-helix	trans	-87.1	-27.9	-178.2	-8.5	0	0	0	0	113.2	W24	W24-T26 VanDerWaalsContact C-N 3.26Å; W24-T26 PolarHBondContact O-N 3.44Å
27	K	27.9	Very low	28.3	Very low	151 Å²	151	141.8 Å²	141.8	66%	0.657	73%	0.733	S	S	*	*	H	α-helix	trans	-85.9	-12.9	178.7	-82.4	171.9	-179.1	145.1	0	114.5	D23 K29	D23-K27 IonicContact OD2-NZ 3.01Å; D23-K27 PolarHBondContact OD2-NZ 3.47Å; K27-K29 VanDerWaalsContact C-N 3.26Å; K27-K29 PolarHBondContact O-N 3.42Å
28	F	28.7	Very low	28.3	Very low	152 Å²	152	137.6 Å²	137.6	67%	0.667	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-9.6	177.4	-127.1	-88	0	0	0	114.5	W24	W24-F28 HydrophobicContact CE3-CD2 4.17Å; W24-F28 HydrophobicContact CE3-CE2 4.19Å; W24-F28 HydrophobicContact CH2-CE2 4.03Å; W24-F28 HydrophobicContact CZ3-CD2 4.04Å; W24-F28 AromaticContact CZ3-CE2 3.59Å; W24-F28 HydrophobicContact CZ3-CE2 3.59Å
29	K	28.1	Very low	28.3	Very low	190 Å²	190	130.2 Å²	130.2	83%	0.826	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-4.1	-175.1	-87.8	-173.1	173.7	-176.9	0	115.6	K27	K27-K29 VanDerWaalsContact C-N 3.26Å; K27-K29 PolarHBondContact O-N 3.42Å
30	I	27.7	Very low	28.4	Very low	143 Å²	143	127.3 Å²	127.3	73%	0.733	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	-26.6	-163	-58.7	-176.6	0	0	0	116.4
31	N	26	Very low	28.4	Very low	139 Å²	139	123.8 Å²	123.8	74%	0.743	67%	0.672	S	S	*	*			trans	-173.5	120.9	175.9	-132.9	-31.8	0	0	0	113.5
32	P	26.3	Very low	28.6	Very low	111 Å²	111	124.3 Å²	124.3	72%	0.721	66%	0.658	S	S	*	*			trans	-112.3	72.6	177.2	38.8	-26.2	0	0	0	112
33	Y	25.9	Very low	28.8	Very low	197 Å²	197	122 Å²	122	77%	0.773	63%	0.632	S	S	*	*			trans	-143	99	148.1	-76.1	-75.2	0	0	0	107.3
34	T	27	Very low	28.8	Very low	136 Å²	136	125.5 Å²	125.5	83%	0.834	64%	0.643	S	S	*	*			trans	162.2	117	143.5	46.4	0	0	0	0	110.5
35	T	28.2	Very low	29	Very low	129 Å²	129	120.3 Å²	120.3	79%	0.791	63%	0.629	S	S	*	*				154.5	110	112.9	-59.1	0	0	0	0	110.8
36	T	32.9	Very low	29.3	Very low	94 Å²	94	116.2 Å²	116.2	58%	0.577	60%	0.602	S	S	*	*			trans	-58.4	125.4	162.8	38.2	0	0	0	0	112.2
37	M	24.8	Very low	29.3	Very low	180 Å²	180	115 Å²	115	89%	0.887	59%	0.591	S	S	*	*			trans	175.4	60.2	149.4	-89.3	-101	176	0	0	110.7
38	T	29.3	Very low	29.5	Very low	98 Å²	98	111.6 Å²	111.6	60%	0.601	58%	0.583	S	S	*	*			trans	-161.6	36.6	165.2	-16.9	0	0	0	0	113.1	L40	T38-L40 PolarHBondContact O-N 3.25Å
39	S	28.2	Very low	29.7	Very low	41 Å²	41	106.3 Å²	106.3	29%	0.287	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-16.3	-169.6	31.4	0	0	0	0	115.4	L72	S39-L72 WeakPolarHBondContact O-CD1 3.14Å; S39-L72 WeakPolarHBondContact O-CD2 3.43Å
40	L	28.2	Very low	30.1	Very low	125 Å²	125	99.9 Å²	99.9	65%	0.654	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-25.6	-177	-83.7	153.5	0	0	0	115.4	T38 L72	T38-L40 PolarHBondContact O-N 3.25Å; L40-L72 HydrophobicContact CD2-CD2 4.35Å; L40-L72 HydrophobicContact CG-CD2 4.44Å
41	A	29.5	Very low	30.1	Very low	58 Å²	58	97.1 Å²	97.1	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-78.9	-36.3	176.2	0	0	0	0	0	111.8	F43 K44 D45	A41-F43 VanDerWaalsContact C-N 3.26Å; A41-F43 PolarHBondContact O-N 3.23Å; A41-K44 PolarHBondContact O-N 3.39Å; A41-D45 PolarHBondContact O-N 2.65Å
42	K	34.4	Very low	30.2	Very low	99 Å²	99	92.4 Å²	92.4	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-25.1	178.2	-72.7	-169.5	172.8	-163.5	0	113.8	F46	K42-F46 WeakPolarHBondContact O-CA 3.4Å; K42-F46 WeakPolarHBondContact O-CB 3.03Å; K42-F46 PolarHBondContact O-N 2.82Å
43	F	33.6	Very low	30.4	Very low	41 Å²	41	92 Å²	92	18%	0.18	51%	0.508	C	S	.	.	H	α-helix	trans	-73	-39.8	-178.7	-176.2	-110.7	0	0	0	113.4	A41 L47 L69 L72 I81	A41-F43 VanDerWaalsContact C-N 3.26Å; A41-F43 PolarHBondContact O-N 3.23Å; F43-L47 HydrophobicContact CD1-CD1 4.24Å; F43-L47 HydrophobicContact CE1-CD1 3.92Å; F43-L47 HydrophobicContact CE2-CD1 4.36Å; F43-L47 HydrophobicContact CZ-CD1 4.08Å; F43-L47 PolarHBondContact O-N 2.91Å; F43-L47 VanDerWaalsContact O-N 3.1Å; F43-L69 HydrophobicContact CD2-CD2 4.26Å; F43-L69 HydrophobicContact CE2-CD2 4.15Å; F43-L72 HydrophobicContact CB-CD1 3.77Å; F43-L72 HydrophobicContact CD2-CD1 3.55Å; F43-L72 HydrophobicContact CE2-CD1 4.28Å; F43-L72 HydrophobicContact CG-CD1 3.97Å; F43-I81 HydrophobicContact CE1-CD1 4.31Å; F43-I81 HydrophobicContact CE1-CG1 3.91Å; F43-I81 HydrophobicContact CE2-CD1 3.51Å; F43-I81 HydrophobicContact CE2-CG1 4.05Å; F43-I81 HydrophobicContact CZ-CD1 3.21Å; F43-I81 HydrophobicContact CZ-CG1 3.19Å
44	K	30.8	Very low	30.6	Very low	157 Å²	157	87.8 Å²	87.8	68%	0.683	50%	0.503	S	S	*	.	H	α-helix	trans	-66.2	-45.9	173.9	-172.1	177.4	179.1	179.9	0	109.7	A41 L47 T48	A41-K44 PolarHBondContact O-N 3.39Å; K44-L47 PolarHBondContact O-N 2.79Å; K44-T48 PolarHBondContact O-N 2.54Å; K44-T48 PolarHBondContact O-OG1 3.23Å
45	D	31.9	Very low	30.9	Very low	78 Å²	78	89.1 Å²	89.1	42%	0.417	49%	0.493	S	S	.	.	H	α-helix	trans	-61.8	-45	175.5	-70.9	-14.1	0	0	0	111.5	A41 L47 T48 D49	A41-D45 PolarHBondContact O-N 2.65Å; D45-L47 PolarHBondContact O-N 2.76Å; D45-T48 WeakPolarHBondContact CA-OG1 3.14Å; D45-T48 CarbonylContact O-C 3.55Å; D45-T48 PolarHBondContact O-N 2.83Å; D45-T48 PolarHBondContact O-OG1 3.17Å; D45-T48 VanDerWaalsContact O-OG1 3.05Å; D45-D49 WeakPolarHBondContact O-CA 3.36Å; D45-D49 WeakPolarHBondContact O-CB 3.18Å; D45-D49 PolarHBondContact O-N 2.95Å
46	F	35.2	Very low	31.2	Very low	27 Å²	27	85.9 Å²	85.9	12%	0.118	47%	0.47	C	S	.	.	H	α-helix	trans	-59.5	-42.7	178.7	179.8	-94.5	0	0	0	112.9	K42 D49 F50 D65 M66 L69	K42-F46 WeakPolarHBondContact O-CA 3.4Å; K42-F46 WeakPolarHBondContact O-CB 3.03Å; K42-F46 PolarHBondContact O-N 2.82Å; F46-D49 PolarHBondContact O-N 2.74Å; F46-F50 WeakPolarHBondContact O-CB 3.4Å; F46-F50 PolarHBondContact O-N 3.17Å; F46-D65 HydrophobicContact CD2-CB 4.32Å; F46-D65 HydrophobicContact CE2-CB 4.1Å; F46-M66 HydrophobicContact CE2-CE 4.36Å; F46-M66 HydrophobicContact CZ-CE 3.91Å; F46-L69 HydrophobicContact CD1-CD1 4.45Å; F46-L69 HydrophobicContact CD1-CD2 4.19Å; F46-L69 HydrophobicContact CE1-CD1 3.67Å; F46-L69 HydrophobicContact CE1-CD2 3.99Å; F46-L69 HydrophobicContact CE1-CG 4.24Å; F46-L69 HydrophobicContact CE2-CD1 4.26Å; F46-L69 HydrophobicContact CZ-CD1 3.57Å; F46-L69 HydrophobicContact CZ-CG 4.47Å
47	L	30	Very low	31.4	Very low	69 Å²	69	84.2 Å²	84.2	36%	0.361	46%	0.455	S	S	.	.	H	α-helix	trans	-74.1	-34.8	177	-76.6	168.7	0	0	0	112.9	F43 K44 D45 I81	F43-L47 HydrophobicContact CD1-CD1 4.24Å; F43-L47 HydrophobicContact CE1-CD1 3.92Å; F43-L47 HydrophobicContact CE2-CD1 4.36Å; F43-L47 HydrophobicContact CZ-CD1 4.08Å; F43-L47 PolarHBondContact O-N 2.91Å; F43-L47 VanDerWaalsContact O-N 3.1Å; K44-L47 PolarHBondContact O-N 2.79Å; D45-L47 PolarHBondContact O-N 2.76Å; L47-I81 HydrophobicContact CD1-CD1 4.48Å; L47-I81 HydrophobicContact CD1-CG1 4.39Å
48	T	32.4	Very low	32	Very low	79 Å²	79	77.5 Å²	77.5	49%	0.485	42%	0.423	S	S	.	.	H	α-helix	trans	-73.5	-29.1	170.6	39.1	0	0	0	0	113.1	K44 D45 A51 S52	K44-T48 PolarHBondContact O-N 2.54Å; K44-T48 PolarHBondContact O-OG1 3.23Å; D45-T48 WeakPolarHBondContact CA-OG1 3.14Å; D45-T48 CarbonylContact O-C 3.55Å; D45-T48 PolarHBondContact O-N 2.83Å; D45-T48 PolarHBondContact O-OG1 3.17Å; D45-T48 VanDerWaalsContact O-OG1 3.05Å; T48-A51 CarbonylContact O-C 3.6Å; T48-A51 PolarHBondContact O-N 3.36Å; T48-S52 PolarHBondContact O-N 3.41Å
49	D	34.1	Very low	32.5	Very low	41 Å²	41	74.2 Å²	74.2	22%	0.219	40%	0.401	C	S	.	.	H	α-helix	trans	-76.9	-30.1	178	-76.1	-27.1	0	0	0	111.3	D45 F46 A51 S52 R55	D45-D49 WeakPolarHBondContact O-CA 3.36Å; D45-D49 WeakPolarHBondContact O-CB 3.18Å; D45-D49 PolarHBondContact O-N 2.95Å; F46-D49 PolarHBondContact O-N 2.74Å; D49-A51 PolarHBondContact O-N 3.14Å; D49-A51 VanDerWaalsContact O-N 3.12Å; D49-S52 PolarHBondContact O-N 2.99Å; D49-R55 WeakPolarHBondContact OD2-CD 3.03Å; D49-R55 IonicContact OD2-CZ 2.8Å; D49-R55 VanDerWaalsContact OD2-CZ 3.24Å; D49-R55 IonicContact OD2-NE 2.72Å; D49-R55 PolarHBondContact OD2-NE 3.46Å; D49-R55 IonicContact OD2-NH1 3.97Å; D49-R55 PolarHBondContact OD2-NH1 3.32Å
50	F	34.7	Very low	33	Very low	55 Å²	55	78.3 Å²	78.3	24%	0.241	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.5	170.3	-143.3	-120.1	0	0	0	113.5	F46 K283	F46-F50 WeakPolarHBondContact O-CB 3.4Å; F46-F50 PolarHBondContact O-N 3.17Å; F50-K283 HydrophobicContact CD1-CD 4.19Å; F50-K283 HydrophobicContact CE1-CD 3.4Å; F50-K283 VanDerWaalsContact CE1-CD 3.4Å; F50-K283 HydrophobicContact CE1-CG 3.88Å; F50-K283 HydrophobicContact CZ-CD 3.91Å; F50-K283 HydrophobicContact CZ-CG 3.93Å; F50-K283 PolarHBondContact O-NZ 2.95Å; F50-K283 VanDerWaalsContact O-NZ 3.11Å
51	A	28.7	Very low	33.8	Very low	86 Å²	86	76.3 Å²	76.3	71%	0.711	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-2.1	175.6	0	0	0	0	0	113.3	T48 D49	T48-A51 CarbonylContact O-C 3.6Å; T48-A51 PolarHBondContact O-N 3.36Å; D49-A51 PolarHBondContact O-N 3.14Å; D49-A51 VanDerWaalsContact O-N 3.12Å
52	S	28.7	Very low	34.7	Very low	40 Å²	40	74.1 Å²	74.1	28%	0.28	38%	0.38	S	S	.	.			trans	-104.9	118.6	-177.1	-174.9	0	0	0	0	111.1	T48 D49 T54	T48-S52 PolarHBondContact O-N 3.41Å; D49-S52 PolarHBondContact O-N 2.99Å; S52-T54 PolarHBondContact O-N 2.99Å; S52-T54 PolarHBondContact OG-OG1 3.06Å
53	P	29.9	Very low	35.2	Very low	101 Å²	101	72.9 Å²	72.9	66%	0.656	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	2.9	-178.7	-20.2	30.4	0	0	0	115.8
54	T	29.3	Very low	36	Very low	109 Å²	109	74.4 Å²	74.4	67%	0.669	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-10.8	-163.9	24.3	0	0	0	0	116.3	S52	S52-T54 PolarHBondContact O-N 2.99Å; S52-T54 PolarHBondContact OG-OG1 3.06Å
55	R	33.6	Very low	36.9	Very low	164 Å²	164	68.3 Å²	68.3	62%	0.619	36%	0.363	S	S	*	.			trans	-95.3	104.9	170.1	-83.7	-166.9	178.6	175.8	-2.7	110.6	D49 F57	D49-R55 WeakPolarHBondContact OD2-CD 3.03Å; D49-R55 IonicContact OD2-CZ 2.8Å; D49-R55 VanDerWaalsContact OD2-CZ 3.24Å; D49-R55 IonicContact OD2-NE 2.72Å; D49-R55 PolarHBondContact OD2-NE 3.46Å; D49-R55 IonicContact OD2-NH1 3.97Å; D49-R55 PolarHBondContact OD2-NH1 3.32Å; R55-F57 PolarHBondContact O-N 3.42Å
56	L	35.1	Very low	37.8	Very low	62 Å²	62	64.9 Å²	64.9	33%	0.325	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64	121.5	162.6	-93.8	116.9	0	0	0	108.3	D58 K191 F192 I195	L56-D58 PolarHBondContact O-N 3.09Å; L56-K191 HydrophobicContact CD1-CD 4.21Å; L56-K191 VanDerWaalsContact CD1-CE 3.4Å; L56-F192 HydrophobicContact CD1-CE1 4.13Å; L56-F192 HydrophobicContact CD2-CE1 4.22Å; L56-I195 HydrophobicContact CD2-CD1 3.98Å
57	F	37.8	Very low	38.6	Very low	59 Å²	59	68.5 Å²	68.5	26%	0.259	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-61.5	120.5	176.1	-107.9	-107.1	0	0	0	110.6	R55 Y62	R55-F57 PolarHBondContact O-N 3.42Å; F57-Y62 HydrophobicContact CE1-CD2 4.38Å
58	D	37.4	Very low	39.7	Very low	38 Å²	38	66.2 Å²	66.2	20%	0.203	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-87.7	126.4	158.1	-173.1	-26.1	0	0	0	107.3	L56 R60 D61 Y62 Q241	L56-D58 PolarHBondContact O-N 3.09Å; D58-R60 PolarHBondContact O-N 3.37Å; D58-R60 VanDerWaalsContact O-N 3.07Å; D58-R60 WeakPolarHBondContact OD1-CB 3.45Å; D58-R60 PolarHBondContact OD1-N 2.96Å; D58-R60 IonicContact OD1-NE 3.65Å; D58-R60 PolarHBondContact OD1-NE 3.19Å; D58-R60 IonicContact OD2-CZ 3.24Å; D58-R60 IonicContact OD2-NE 3.49Å; D58-R60 PolarHBondContact OD2-NE 3.13Å; D58-R60 IonicContact OD2-NH2 2.79Å; D58-R60 PolarHBondContact OD2-NH2 3.42Å; D58-R60 VanDerWaalsContact OD2-NH2 3.11Å; D58-D61 WeakPolarHBondContact O-CA 3.48Å; D58-D61 WeakPolarHBondContact O-CB 3.3Å; D58-D61 PolarHBondContact O-N 3.47Å; D58-Y62 PolarHBondContact O-N 2.9Å; D58-Q241 PolarHBondContact OD1-NE2 3.3Å; D58-Q241 VanDerWaalsContact OD1-NE2 3.11Å; D58-Q241 PolarHBondContact OD1-OE1 2.89Å; D58-Q241 VanDerWaalsContact OD1-OE1 3.05Å
59	M	38.6	Very low	40.3	Very low	30 Å²	30	63.4 Å²	63.4	15%	0.148	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-19.5	177.3	-75.6	-110.4	-70.6	0	0	113.2	D61 Y62 E63 Q241 R317 L320	M59-D61 VanDerWaalsContact C-N 3.34Å; M59-Y62 PolarHBondContact O-N 3.43Å; M59-E63 PolarHBondContact O-N 2.96Å; M59-Q241 HydrophobicContact CB-CG 4.3Å; M59-Q241 HydrophobicContact CG-CG 4Å; M59-R317 HydrophobicContact CE-CG 4.41Å; M59-L320 HydrophobicContact SD-CD2 4.31Å
60	R	39.4	Very low	40.8	Very low	126 Å²	126	61.5 Å²	61.5	48%	0.475	32%	0.324	S	S	.	.	H	α-helix	trans	-68.4	-34.9	170.8	-74.2	179.6	-78.2	-163	-6.3	112.5	D58 T64	D58-R60 PolarHBondContact O-N 3.37Å; D58-R60 VanDerWaalsContact O-N 3.07Å; D58-R60 WeakPolarHBondContact OD1-CB 3.45Å; D58-R60 PolarHBondContact OD1-N 2.96Å; D58-R60 IonicContact OD1-NE 3.65Å; D58-R60 PolarHBondContact OD1-NE 3.19Å; D58-R60 IonicContact OD2-CZ 3.24Å; D58-R60 IonicContact OD2-NE 3.49Å; D58-R60 PolarHBondContact OD2-NE 3.13Å; D58-R60 IonicContact OD2-NH2 2.79Å; D58-R60 PolarHBondContact OD2-NH2 3.42Å; D58-R60 VanDerWaalsContact OD2-NH2 3.11Å; R60-T64 PolarHBondContact O-N 3.04Å; R60-T64 PolarHBondContact O-OG1 3.05Å
61	D	44.6	Very low	41.3	Very low	84 Å²	84	63.2 Å²	63.2	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-71.7	-35.7	173.8	-71.7	-23.7	0	0	0	109.4	D58 M59 E63 T64 D65	D58-D61 WeakPolarHBondContact O-CA 3.48Å; D58-D61 WeakPolarHBondContact O-CB 3.3Å; D58-D61 PolarHBondContact O-N 3.47Å; M59-D61 VanDerWaalsContact C-N 3.34Å; D61-E63 PolarHBondContact O-N 2.94Å; D61-T64 CarbonylContact O-C 3.6Å; D61-T64 PolarHBondContact O-N 3.38Å; D61-T64 VanDerWaalsContact O-N 3.16Å; D61-D65 WeakPolarHBondContact O-CA 3.39Å; D61-D65 WeakPolarHBondContact O-CB 3.37Å; D61-D65 PolarHBondContact O-N 3.39Å
62	Y	48.5	Very low	42	Very low	11 Å²	11	60.7 Å²	60.7	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-54.8	-49.8	176.2	170	-92.5	0	0	0	113.9	F57 D58 M59 T64 D65 M66 F313 F316	F57-Y62 HydrophobicContact CE1-CD2 4.38Å; D58-Y62 PolarHBondContact O-N 2.9Å; M59-Y62 PolarHBondContact O-N 3.43Å; Y62-T64 PolarHBondContact O-N 2.97Å; Y62-D65 PolarHBondContact O-N 2.68Å; Y62-M66 HydrophobicContact CD1-CG 4.42Å; Y62-M66 HydrophobicContact CD2-CE 4.19Å; Y62-M66 HydrophobicContact CD2-CG 3.89Å; Y62-M66 HydrophobicContact CE1-CG 4.02Å; Y62-M66 HydrophobicContact CE2-CE 3.98Å; Y62-M66 HydrophobicContact CE2-CG 3.45Å; Y62-M66 VanDerWaalsContact CE2-CG 3.45Å; Y62-M66 HydrophobicContact CE2-SD 4.01Å; Y62-M66 HydrophobicContact CG-CG 4.34Å; Y62-M66 VanDerWaalsContact CZ-CG 3.5Å; Y62-M66 VanDerWaalsContact O-CB 3.23Å; Y62-M66 WeakPolarHBondContact O-CB 3.47Å; Y62-M66 WeakPolarHBondContact O-CG 3.35Å; Y62-M66 PolarHBondContact O-N 3.42Å; Y62-F313 PolarHBondContact OH-O 3.19Å; Y62-F316 AromaticContact CD2-CD1 3.82Å; Y62-F316 HydrophobicContact CD2-CD1 3.82Å; Y62-F316 HydrophobicContact CD2-CE1 4.06Å; Y62-F316 HydrophobicContact CD2-CG 4.33Å; Y62-F316 HydrophobicContact CE1-CD1 4.46Å; Y62-F316 HydrophobicContact CE2-CB 3.72Å; Y62-F316 AromaticContact CE2-CD1 3.48Å; Y62-F316 HydrophobicContact CE2-CD1 3.48Å; Y62-F316 VanDerWaalsContact CE2-CD1 3.48Å; Y62-F316 HydrophobicContact CE2-CD2 4.42Å; Y62-F316 HydrophobicContact CE2-CE1 4.18Å; Y62-F316 AromaticContact CE2-CG 3.64Å; Y62-F316 HydrophobicContact CE2-CG 3.64Å; Y62-F316 HydrophobicContact CG-CD1 4.44Å; Y62-F316 AromaticContact CZ-CD1 3.86Å; Y62-F316 WeakPolarHBondContact OH-CB 3.32Å
63	E	46	Very low	42.7	Very low	74 Å²	74	62.9 Å²	62.9	35%	0.346	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-40.6	178	-78	-174.2	170.5	0	0	112	M59 D61 D65 Q67 R317	M59-E63 PolarHBondContact O-N 2.96Å; D61-E63 PolarHBondContact O-N 2.94Å; E63-D65 VanDerWaalsContact C-N 3.35Å; E63-Q67 WeakPolarHBondContact O-CB 3.41Å; E63-Q67 VanDerWaalsContact O-CG 3.24Å; E63-Q67 WeakPolarHBondContact O-CG 3.14Å; E63-Q67 PolarHBondContact O-N 3.15Å; E63-R317 IonicContact OE1-NH1 2.65Å
64	T	50.2	Low	43.2	Very low	72 Å²	72	64.8 Å²	64.8	44%	0.442	31%	0.311	S	S	.	.	H	α-helix	trans	-67.3	-38.6	179.3	-49.9	0	0	0	0	111.4	R60 D61 Y62 S68	R60-T64 PolarHBondContact O-N 3.04Å; R60-T64 PolarHBondContact O-OG1 3.05Å; D61-T64 CarbonylContact O-C 3.6Å; D61-T64 PolarHBondContact O-N 3.38Å; D61-T64 VanDerWaalsContact O-N 3.16Å; Y62-T64 PolarHBondContact O-N 2.97Å; T64-S68 WeakPolarHBondContact O-CB 3.49Å; T64-S68 PolarHBondContact O-N 3.06Å
65	D	48.5	Very low	43.4	Very low	30 Å²	30	68.1 Å²	68.1	16%	0.16	31%	0.311	C	S	.	.	H	α-helix	trans	-75.3	-41.7	-178.9	-70.1	-18.4	0	0	0	109.9	F46 D61 Y62 E63 S68 L69	F46-D65 HydrophobicContact CD2-CB 4.32Å; F46-D65 HydrophobicContact CE2-CB 4.1Å; D61-D65 WeakPolarHBondContact O-CA 3.39Å; D61-D65 WeakPolarHBondContact O-CB 3.37Å; D61-D65 PolarHBondContact O-N 3.39Å; Y62-D65 PolarHBondContact O-N 2.68Å; E63-D65 VanDerWaalsContact C-N 3.35Å; D65-S68 WeakPolarHBondContact CA-OG 3.32Å; D65-S68 CarbonylContact O-C 3.58Å; D65-S68 PolarHBondContact O-N 3.08Å; D65-S68 VanDerWaalsContact O-N 3.14Å; D65-S68 PolarHBondContact O-OG 3.22Å; D65-L69 WeakPolarHBondContact O-CG 3.31Å; D65-L69 PolarHBondContact O-N 3.26Å
66	M	52.2	Low	43.3	Very low	6 Å²	6	67.7 Å²	67.7	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-41.1	171.1	-73.6	-55.7	116.2	0	0	111.9	F46 Y62 S68 L69 A70 F313 L375	F46-M66 HydrophobicContact CE2-CE 4.36Å; F46-M66 HydrophobicContact CZ-CE 3.91Å; Y62-M66 HydrophobicContact CD1-CG 4.42Å; Y62-M66 HydrophobicContact CD2-CE 4.19Å; Y62-M66 HydrophobicContact CD2-CG 3.89Å; Y62-M66 HydrophobicContact CE1-CG 4.02Å; Y62-M66 HydrophobicContact CE2-CE 3.98Å; Y62-M66 HydrophobicContact CE2-CG 3.45Å; Y62-M66 VanDerWaalsContact CE2-CG 3.45Å; Y62-M66 HydrophobicContact CE2-SD 4.01Å; Y62-M66 HydrophobicContact CG-CG 4.34Å; Y62-M66 VanDerWaalsContact CZ-CG 3.5Å; Y62-M66 VanDerWaalsContact O-CB 3.23Å; Y62-M66 WeakPolarHBondContact O-CB 3.47Å; Y62-M66 WeakPolarHBondContact O-CG 3.35Å; Y62-M66 PolarHBondContact O-N 3.42Å; M66-S68 VanDerWaalsContact C-N 3.29Å; M66-S68 PolarHBondContact O-N 3.09Å; M66-L69 HydrophobicContact CE-CD1 3.26Å; M66-L69 WeakPolarHBondContact O-CB 3.42Å; M66-L69 PolarHBondContact O-N 3.34Å; M66-L69 HydrophobicContact SD-CD1 3.76Å; M66-A70 WeakPolarHBondContact O-CB 3.37Å; M66-A70 PolarHBondContact O-N 2.84Å; M66-F313 HydrophobicContact CE-CD2 4.38Å; M66-F313 HydrophobicContact CE-CG 4.45Å; M66-F313 HydrophobicContact SD-CB 3.58Å; M66-F313 VanDerWaalsContact SD-CB 3.58Å; M66-F313 HydrophobicContact SD-CD2 4.02Å; M66-F313 HydrophobicContact SD-CG 3.97Å; M66-L375 HydrophobicContact CB-CD2 3.78Å
67	Q	51.2	Low	43.2	Very low	102 Å²	102	68.9 Å²	68.9	48%	0.477	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-34.8	172.2	-75.4	178.3	13.8	0	0	112	E63 A70 Q71	E63-Q67 WeakPolarHBondContact O-CB 3.41Å; E63-Q67 VanDerWaalsContact O-CG 3.24Å; E63-Q67 WeakPolarHBondContact O-CG 3.14Å; E63-Q67 PolarHBondContact O-N 3.15Å; Q67-A70 VanDerWaalsContact O-CB 3.31Å; Q67-A70 WeakPolarHBondContact O-CB 3.28Å; Q67-A70 PolarHBondContact O-N 2.98Å; Q67-Q71 WeakPolarHBondContact O-CG 3.35Å; Q67-Q71 PolarHBondContact O-N 2.95Å
68	S	52.8	Low	42.9	Very low	21 Å²	21	72.2 Å²	72.2	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-69.7	-38.4	175.9	78.1	0	0	0	0	112.3	T64 D65 M66 Q71 L72	T64-S68 WeakPolarHBondContact O-CB 3.49Å; T64-S68 PolarHBondContact O-N 3.06Å; D65-S68 WeakPolarHBondContact CA-OG 3.32Å; D65-S68 CarbonylContact O-C 3.58Å; D65-S68 PolarHBondContact O-N 3.08Å; D65-S68 VanDerWaalsContact O-N 3.14Å; D65-S68 PolarHBondContact O-OG 3.22Å; M66-S68 VanDerWaalsContact C-N 3.29Å; M66-S68 PolarHBondContact O-N 3.09Å; S68-Q71 PolarHBondContact O-N 2.94Å; S68-L72 WeakPolarHBondContact O-CD1 3.3Å; S68-L72 VanDerWaalsContact O-CG 3.31Å; S68-L72 WeakPolarHBondContact O-CG 3.42Å; S68-L72 PolarHBondContact O-N 3.42Å
69	L	45.5	Very low	42.4	Very low	20 Å²	20	77 Å²	77	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-61.4	-43.4	169.8	-78.7	162.2	0	0	0	111.6	F43 F46 D65 M66 Q71 L72 Q73	F43-L69 HydrophobicContact CD2-CD2 4.26Å; F43-L69 HydrophobicContact CE2-CD2 4.15Å; F46-L69 HydrophobicContact CD1-CD1 4.45Å; F46-L69 HydrophobicContact CD1-CD2 4.19Å; F46-L69 HydrophobicContact CE1-CD1 3.67Å; F46-L69 HydrophobicContact CE1-CD2 3.99Å; F46-L69 HydrophobicContact CE1-CG 4.24Å; F46-L69 HydrophobicContact CE2-CD1 4.26Å; F46-L69 HydrophobicContact CZ-CD1 3.57Å; F46-L69 HydrophobicContact CZ-CG 4.47Å; D65-L69 WeakPolarHBondContact O-CG 3.31Å; D65-L69 PolarHBondContact O-N 3.26Å; M66-L69 HydrophobicContact CE-CD1 3.26Å; M66-L69 WeakPolarHBondContact O-CB 3.42Å; M66-L69 PolarHBondContact O-N 3.34Å; M66-L69 HydrophobicContact SD-CD1 3.76Å; L69-Q71 VanDerWaalsContact C-N 3.28Å; L69-Q71 PolarHBondContact O-N 3.27Å; L69-L72 PolarHBondContact O-N 3.07Å; L69-Q73 PolarHBondContact O-N 3.06Å
70	A	44.6	Very low	41.8	Very low	2 Å²	2	78.6 Å²	78.6	2%	0.017	40%	0.4	C	S	.	.	H	α-helix	trans	-57.6	-41.4	175	0	0	0	0	0	112.6	M66 Q67 F371 S372	M66-A70 WeakPolarHBondContact O-CB 3.37Å; M66-A70 PolarHBondContact O-N 2.84Å; Q67-A70 VanDerWaalsContact O-CB 3.31Å; Q67-A70 WeakPolarHBondContact O-CB 3.28Å; Q67-A70 PolarHBondContact O-N 2.98Å; A70-F371 HydrophobicContact CB-CD1 3.28Å; A70-F371 HydrophobicContact CB-CE1 3.56Å; A70-S372 WeakPolarHBondContact CB-OG 3.38Å
71	Q	46	Very low	41.3	Very low	90 Å²	90	76.5 Å²	76.5	42%	0.421	40%	0.398	S	S	.	.	H	α-helix	trans	-73.2	-31	179.2	-74	178.9	7.5	0	0	112.3	Q67 S68 L69 K74	Q67-Q71 WeakPolarHBondContact O-CG 3.35Å; Q67-Q71 PolarHBondContact O-N 2.95Å; S68-Q71 PolarHBondContact O-N 2.94Å; L69-Q71 VanDerWaalsContact C-N 3.28Å; L69-Q71 PolarHBondContact O-N 3.27Å; Q71-K74 PolarHBondContact O-N 2.92Å
72	L	43.4	Very low	40.5	Very low	33 Å²	33	77.5 Å²	77.5	17%	0.173	41%	0.412	C	S	.	.	H	α-helix	trans	-71.3	-37.3	176.6	-76.5	161.2	0	0	0	112.2	S39 L40 F43 S68 L69 K74 R75	S39-L72 WeakPolarHBondContact O-CD1 3.14Å; S39-L72 WeakPolarHBondContact O-CD2 3.43Å; L40-L72 HydrophobicContact CD2-CD2 4.35Å; L40-L72 HydrophobicContact CG-CD2 4.44Å; F43-L72 HydrophobicContact CB-CD1 3.77Å; F43-L72 HydrophobicContact CD2-CD1 3.55Å; F43-L72 HydrophobicContact CE2-CD1 4.28Å; F43-L72 HydrophobicContact CG-CD1 3.97Å; S68-L72 WeakPolarHBondContact O-CD1 3.3Å; S68-L72 VanDerWaalsContact O-CG 3.31Å; S68-L72 WeakPolarHBondContact O-CG 3.42Å; S68-L72 PolarHBondContact O-N 3.42Å; L69-L72 PolarHBondContact O-N 3.07Å; L72-K74 VanDerWaalsContact C-N 3.27Å; L72-K74 PolarHBondContact O-N 3.22Å; L72-R75 PolarHBondContact O-N 3.44Å
73	Q	42.4	Very low	39.6	Very low	86 Å²	86	82.2 Å²	82.2	40%	0.402	44%	0.436	S	S	.	.	H	α-helix	trans	-68.7	-21.7	175	-75.7	-177.4	-28.2	0	0	113.9	L69 R75 G308	L69-Q73 PolarHBondContact O-N 3.06Å; Q73-R75 PolarHBondContact O-N 2.88Å; Q73-G308 PolarHBondContact NE2-O 3.34Å; Q73-G308 PolarHBondContact OE1-O 3.38Å
74	K	41.3	Very low	38.7	Very low	142 Å²	142	87.1 Å²	87.1	62%	0.617	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-4.8	176.7	-78.5	-175.3	177.5	-179.4	0	114.3	Q71 L72	Q71-K74 PolarHBondContact O-N 2.92Å; L72-K74 VanDerWaalsContact C-N 3.27Å; L72-K74 PolarHBondContact O-N 3.22Å
75	R	31.7	Very low	37.8	Very low	179 Å²	179	89 Å²	89	68%	0.675	47%	0.47	S	S	*	.	S	Bend	trans	-110.9	115.1	169.3	-73.2	-178.9	173.4	172.7	-1.9	107.3	L72 Q73 P77	L72-R75 PolarHBondContact O-N 3.44Å; Q73-R75 PolarHBondContact O-N 2.88Å; R75-P77 WeakPolarHBondContact O-CD 3.45Å
76	D	31.4	Very low	36.9	Very low	154 Å²	154	94.3 Å²	94.3	82%	0.824	50%	0.499	S	S	*	.			trans	-46.6	117.6	163.5	-83	-46	0	0	0	108.3
77	P	34.5	Very low	35.9	Very low	87 Å²	87	99.9 Å²	99.9	57%	0.565	53%	0.529	S	S	*	.				-136	131.2	96.3	34.6	-20.4	0	0	0	112.3	R75 D79 A80	R75-P77 WeakPolarHBondContact O-CD 3.45Å; P77-D79 PolarHBondContact O-N 2.68Å; P77-A80 HydrophobicContact CG-CB 3.99Å
78	V	29.8	Very low	35	Very low	130 Å²	130	102.7 Å²	102.7	79%	0.788	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	1.7	171.5	169.2	0	0	0	0	114.5
79	D	27.4	Very low	34.4	Very low	139 Å²	139	109.8 Å²	109.8	74%	0.743	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	9.3	-169.7	-71.4	-47.3	0	0	0	116.5	P77	P77-D79 PolarHBondContact O-N 2.68Å
80	A	27	Very low	34	Very low	62 Å²	62	117.7 Å²	117.7	51%	0.512	61%	0.612	S	S	.	*	S	Bend	trans	-101	3.9	-173.2	0	0	0	0	0	116.7	P77	P77-A80 HydrophobicContact CG-CB 3.99Å
81	I	28.5	Very low	34	Very low	83 Å²	83	122.7 Å²	122.7	43%	0.426	64%	0.638	S	S	.	*			trans	-137.7	71.4	159	-47	178.6	0	0	0	108.2	F43 L47 I83	F43-I81 HydrophobicContact CE1-CD1 4.31Å; F43-I81 HydrophobicContact CE1-CG1 3.91Å; F43-I81 HydrophobicContact CE2-CD1 3.51Å; F43-I81 HydrophobicContact CE2-CG1 4.05Å; F43-I81 HydrophobicContact CZ-CD1 3.21Å; F43-I81 HydrophobicContact CZ-CG1 3.19Å; L47-I81 HydrophobicContact CD1-CD1 4.48Å; L47-I81 HydrophobicContact CD1-CG1 4.39Å; I81-I83 HydrophobicContact CG2-CB 4.27Å; I81-I83 HydrophobicContact CG2-CD1 3.63Å; I81-I83 HydrophobicContact CG2-CG1 3.51Å; I81-I83 PolarHBondContact O-N 3.39Å
82	S	27.2	Very low	33.8	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	65%	0.649	S	S	*	*			trans	-70.2	78.7	145.2	63.1	0	0	0	0	106.9	Q84	S82-Q84 PolarHBondContact O-N 2.96Å
83	I	29.8	Very low	34	Very low	110 Å²	110	130.7 Å²	130.7	56%	0.564	68%	0.681	S	S	*	*			trans	-51.8	126.1	140.1	-74	153	0	0	0	102.3	I81 V85	I81-I83 HydrophobicContact CG2-CB 4.27Å; I81-I83 HydrophobicContact CG2-CD1 3.63Å; I81-I83 HydrophobicContact CG2-CG1 3.51Å; I81-I83 PolarHBondContact O-N 3.39Å; I83-V85 HydrophobicContact CB-CG2 4.28Å; I83-V85 HydrophobicContact CG2-CG2 4.06Å; I83-V85 PolarHBondContact O-N 3.24Å
84	Q	28.1	Very low	34.4	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.822	68%	0.683	S	S	*	*			trans	-59.7	83.9	165	-73.2	176.7	-53.8	0	0	106	S82 D86	S82-Q84 PolarHBondContact O-N 2.96Å; Q84-D86 PolarHBondContact O-N 3.26Å
85	V	31.3	Very low	35.3	Very low	112 Å²	112	129.3 Å²	129.3	68%	0.679	69%	0.691	S	S	*	*			trans	-72.2	86.5	160.9	-179.9	0	0	0	0	101.4	I83 N87	I83-V85 HydrophobicContact CB-CG2 4.28Å; I83-V85 HydrophobicContact CG2-CG2 4.06Å; I83-V85 PolarHBondContact O-N 3.24Å; V85-N87 PolarHBondContact O-N 2.95Å
86	D	28.3	Very low	37.5	Very low	141 Å²	141	122.2 Å²	122.2	75%	0.754	67%	0.666	S	S	*	*			trans	-54.2	114.5	167.8	-99.4	-23.1	0	0	0	106.8	Q84	Q84-D86 PolarHBondContact O-N 3.26Å
87	N	31.8	Very low	40	Very low	123 Å²	123	123.6 Å²	123.6	66%	0.658	67%	0.665	S	S	*	*	S	Bend	trans	65.5	106.2	173.7	-65.8	-24.1	0	0	0	118	V85 F89	V85-N87 PolarHBondContact O-N 2.95Å; N87-F89 WeakPolarHBondContact O-CD2 3.37Å; N87-F89 PolarHBondContact O-N 3Å
88	D	31.9	Very low	42.5	Very low	161 Å²	161	121.3 Å²	121.3	86%	0.861	65%	0.648	S	S	*	*				-11.9	93.2	129.6	-67.8	-40.8	0	0	0	113.7	Q90	D88-Q90 PolarHBondContact O-N 2.72Å
89	F	41.1	Very low	45.5	Very low	171 Å²	171	117.1 Å²	117.1	75%	0.75	62%	0.624	S	S	*	*			trans	-82.3	99.8	151.7	-78.9	-91.2	0	0	0	106.3	N87 L91	N87-F89 WeakPolarHBondContact O-CD2 3.37Å; N87-F89 PolarHBondContact O-N 3Å; F89-L91 VanDerWaalsContact C-N 3.27Å; F89-L91 PolarHBondContact O-N 3.22Å
90	Q	36.3	Very low	48.4	Very low	186 Å²	186	116.4 Å²	116.4	87%	0.869	63%	0.626	S	S	*	*			trans	-55.8	106.2	148.9	-89.2	-177.2	-18.6	0	0	105.5	D88 V92	D88-Q90 PolarHBondContact O-N 2.72Å; Q90-V92 PolarHBondContact O-N 3.28Å
91	L	43.9	Very low	51.4	Low	106 Å²	106	117 Å²	117	56%	0.555	62%	0.615	S	S	*	*			trans	-49.7	115.7	160.2	-124.5	90.6	0	0	0	104.4	F89 E93	F89-L91 VanDerWaalsContact C-N 3.27Å; F89-L91 PolarHBondContact O-N 3.22Å; L91-E93 PolarHBondContact O-N 3.15Å; L91-E93 VanDerWaalsContact O-N 3.07Å
92	V	42.9	Very low	54	Low	108 Å²	108	119.5 Å²	119.5	66%	0.655	62%	0.623	S	S	*	*			trans	-45.3	124.1	152.2	177.9	0	0	0	0	103.4	Q90 T94	Q90-V92 PolarHBondContact O-N 3.28Å; V92-T94 WeakPolarHBondContact O-CA 3.46Å; V92-T94 PolarHBondContact O-N 2.8Å; V92-T94 PolarHBondContact O-OG1 3.11Å
93	E	48.3	Very low	56.5	Low	183 Å²	183	122.2 Å²	122.2	86%	0.855	63%	0.628	S	S	*	*			trans	-55	84.9	164	-86.1	-176.6	150.5	0	0	105.1	L91 T95	L91-E93 PolarHBondContact O-N 3.15Å; L91-E93 VanDerWaalsContact O-N 3.07Å; E93-T95 PolarHBondContact O-N 2.75Å
94	T	50.7	Low	58.6	Low	70 Å²	70	119.3 Å²	119.3	43%	0.429	61%	0.613	S	S	.	*			trans	-85.6	93.5	-167.7	-39.3	0	0	0	0	101.3	V92 L96	V92-T94 WeakPolarHBondContact O-CA 3.46Å; V92-T94 PolarHBondContact O-N 2.8Å; V92-T94 PolarHBondContact O-OG1 3.11Å; T94-L96 HydrophobicContact CG2-CB 3.84Å; T94-L96 PolarHBondContact O-N 2.92Å
95	T	59.4	Low	60.7	Low	130 Å²	130	116.6 Å²	116.6	80%	0.798	61%	0.611	S	S	*	*			trans	-58.6	24.6	166.7	18.5	0	0	0	0	112.6	E93 K97	E93-T95 PolarHBondContact O-N 2.75Å; T95-K97 PolarHBondContact O-N 3.19Å
96	L	78.4	Confident	62.7	Low	29 Å²	29	114.7 Å²	114.7	15%	0.152	59%	0.591	C	S	.	*			trans	-66.7	102.7	174.2	-171.5	75.1	0	0	0	107.3	T94 L98 V295 V404 E407 L408	T94-L96 HydrophobicContact CG2-CB 3.84Å; T94-L96 PolarHBondContact O-N 2.92Å; L96-L98 HydrophobicContact CD2-CD2 4.32Å; L96-V295 HydrophobicContact CD2-CG1 3.94Å; L96-V404 HydrophobicContact CD1-CB 4.42Å; L96-V404 HydrophobicContact CD2-CG2 4.34Å; L96-E407 HydrophobicContact CD1-CB 3.49Å; L96-E407 VanDerWaalsContact CD1-CB 3.49Å; L96-E407 WeakPolarHBondContact CD1-OE2 3.4Å; L96-L408 HydrophobicContact CD2-CD2 3.65Å
97	K	82.9	Confident	64.7	Low	183 Å²	183	110.4 Å²	110.4	80%	0.796	57%	0.573	S	S	*	*			trans	-89.8	111.2	173.2	-73.4	-174.9	177.2	-178.5	0	108	T95	T95-K97 PolarHBondContact O-N 3.19Å
98	L	88.5	Confident	66.8	Low	40 Å²	40	112.1 Å²	112.1	21%	0.209	58%	0.576	C	S	.	*	P	Polyproline II helix	trans	-62	139.1	172.6	-62.9	-178.7	0	0	0	110	L96 V296 L401 V404	L96-L98 HydrophobicContact CD2-CD2 4.32Å; L98-V296 HydrophobicContact CD1-CG2 4.5Å; L98-L401 HydrophobicContact CD1-CD2 4.35Å; L98-L401 HydrophobicContact CD2-CD2 3.91Å; L98-V404 HydrophobicContact CD2-CG2 3.77Å
99	P	91.1	Very high	69.1	Low	42 Å²	42	108 Å²	108	27%	0.273	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-64.8	164.1	177.1	28.1	-34.5	0	0	0	110.5	R101 Q400 A403 V404	P99-R101 PolarHBondContact O-N 3.13Å; P99-Q400 HydrophobicContact CG-CB 4.47Å; P99-Q400 PolarHBondContact O-NE2 3.14Å; P99-A403 HydrophobicContact CG-CB 3.96Å; P99-V404 HydrophobicContact CG-CG1 4.38Å
100	P	89.5	Confident	71	Confident	123 Å²	123	100.6 Å²	100.6	80%	0.799	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-53.4	139.1	173.8	-24.7	33.8	0	0	0	112	K102	P100-K102 PolarHBondContact O-N 3.36Å
101	R	89.7	Confident	73.3	Confident	74 Å²	74	93.3 Å²	93.3	28%	0.279	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-64.8	131.3	179.8	-173.3	169.6	-65.1	158.3	2.6	110.8	P99 E358 Q400	P99-R101 PolarHBondContact O-N 3.13Å; R101-E358 IonicContact CZ-OE1 3.4Å; R101-E358 VanDerWaalsContact CZ-OE1 3.32Å; R101-E358 IonicContact CZ-OE2 2.78Å; R101-E358 VanDerWaalsContact NH1-CD 3.3Å; R101-E358 IonicContact NH1-OE1 2.65Å; R101-E358 PolarHBondContact NH1-OE1 2.95Å; R101-E358 IonicContact NH1-OE2 3.23Å; R101-E358 PolarHBondContact NH1-OE2 3.44Å; R101-E358 VanDerWaalsContact NH2-CD 3.31Å; R101-E358 IonicContact NH2-OE1 2.8Å; R101-E358 PolarHBondContact NH2-OE1 2.75Å; R101-E358 VanDerWaalsContact NH2-OE1 3.17Å; R101-E358 IonicContact NH2-OE2 3.14Å; R101-E358 PolarHBondContact NH2-OE2 3.34Å; R101-Q400 HydrophobicContact CB-CG 4.35Å
102	K	83.6	Confident	75.2	Confident	136 Å²	136	92.6 Å²	92.6	59%	0.591	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-74.4	127	169	-67.3	-175.8	179.9	175.2	0	109	P100	P100-K102 PolarHBondContact O-N 3.36Å
103	I	78.2	Confident	77.2	Confident	162 Å²	162	95.3 Å²	95.3	83%	0.831	50%	0.495	S	S	*	.			trans	-87.3	111.7	170	-57.4	174.2	0	0	0	106.7
104	L	74.2	Confident	78.8	Confident	49 Å²	49	90.7 Å²	90.7	26%	0.257	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-101.1	119.7	179.5	-67.9	167.6	0	0	0	109.3	R106 E395 H399	L104-R106 PolarHBondContact O-N 3.32Å; L104-E395 HydrophobicContact CD1-CG 3.74Å; L104-E395 WeakPolarHBondContact CD1-OE1 3.23Å; L104-H399 WeakPolarHBondContact CD1-CD2 3.36Å; L104-H399 WeakPolarHBondContact CD1-NE2 3.39Å
105	P	72.6	Confident	80.5	Confident	120 Å²	120	87.6 Å²	87.6	78%	0.779	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-67.1	131.1	176.2	27.3	-31.6	0	0	0	109.2
106	R	72.9	Confident	81.6	Confident	72 Å²	72	88 Å²	88	27%	0.272	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-75.8	131.3	171.4	-63.7	-65.2	-65.6	-179	-0.7	109.4	L104 E395	L104-R106 PolarHBondContact O-N 3.32Å; R106-E395 IonicContact NH1-OE2 3.17Å; R106-E395 PolarHBondContact NH1-OE2 2.64Å
107	S	71.1	Confident	81.9	Confident	51 Å²	51	91.1 Å²	91.1	36%	0.357	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-74.2	166.5	173.4	37.1	0	0	0	0	112.1	E130	S107-E130 WeakPolarHBondContact CB-OE1 3.18Å; S107-E130 WeakPolarHBondContact CB-OE2 3.32Å; S107-E130 PolarHBondContact OG-OE1 2.84Å; S107-E130 PolarHBondContact OG-OE2 3.5Å
108	H	75.1	Confident	81.9	Confident	158 Å²	158	84 Å²	84	73%	0.731	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-78.9	149.2	-179.1	-68.6	32	0	0	0	110.4
109	P	79.5	Confident	81.6	Confident	75 Å²	75	85.7 Å²	85.7	49%	0.487	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-55.2	144.7	177.2	-23.5	32.5	0	0	0	112.2	S111 G131	P109-S111 PolarHBondContact O-N 2.99Å; P109-G131 CarbonylContact C-O 3.59Å; P109-G131 WeakPolarHBondContact CA-O 3.4Å
110	L	81.1	Confident	81.2	Confident	15 Å²	15	87.9 Å²	87.9	8%	0.079	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-54.4	113.6	177.2	-174.4	72.9	0	0	0	110	Q114 W115 P128 G131 Q133	L110-Q114 HydrophobicContact CD1-CB 3.56Å; L110-Q114 HydrophobicContact CG-CB 4.43Å; L110-W115 HydrophobicContact CD2-CB 4.31Å; L110-W115 HydrophobicContact CD2-CE3 3.75Å; L110-W115 HydrophobicContact CD2-CZ3 4.45Å; L110-P128 HydrophobicContact CD1-CB 4.37Å; L110-P128 HydrophobicContact CD2-CB 3.71Å; L110-P128 HydrophobicContact CD2-CG 3.99Å; L110-G131 PolarHBondContact N-O 2.83Å; L110-Q133 VanDerWaalsContact O-CB 3.23Å; L110-Q133 WeakPolarHBondContact O-CB 3.49Å; L110-Q133 PolarHBondContact O-N 3.35Å
111	S	84.6	Confident	80.8	Confident	33 Å²	33	92.2 Å²	92.2	23%	0.231	47%	0.467	C	S	.	.			trans	-79.3	158.2	177.4	64.5	0	0	0	0	111.9	P109 Q113 Q114 W115	P109-S111 PolarHBondContact O-N 2.99Å; S111-Q113 PolarHBondContact O-N 3.05Å; S111-Q113 VanDerWaalsContact O-N 3.15Å; S111-Q114 PolarHBondContact O-N 3.4Å; S111-Q114 VanDerWaalsContact O-N 3.11Å; S111-Q114 WeakPolarHBondContact OG-CG 3.37Å; S111-Q114 PolarHBondContact OG-N 3.06Å; S111-Q114 PolarHBondContact OG-OE1 3.05Å; S111-W115 PolarHBondContact O-N 2.92Å
112	E	84.4	Confident	80.4	Confident	92 Å²	92	92.6 Å²	92.6	43%	0.43	47%	0.474	S	S	.	.	H	α-helix	trans	-55.3	-32.3	173.4	-67.6	-171	-172.5	0	0	113.4	K116 L136	E112-K116 VanDerWaalsContact O-CG 3.31Å; E112-K116 WeakPolarHBondContact O-CG 3.45Å; E112-K116 PolarHBondContact O-N 2.67Å; E112-L136 HydrophobicContact CG-CD1 4.44Å; E112-L136 HydrophobicContact CG-CD2 3.99Å; E112-L136 HydrophobicContact CG-CG 4.12Å
113	Q	84.7	Confident	80	Confident	164 Å²	164	86.8 Å²	86.8	77%	0.766	45%	0.453	S	S	*	.	H	α-helix	trans	-69.6	-45.7	177.9	-69.7	-176.5	-8.5	0	0	111.3	S111 W115 K116 S117	S111-Q113 PolarHBondContact O-N 3.05Å; S111-Q113 VanDerWaalsContact O-N 3.15Å; Q113-W115 VanDerWaalsContact C-N 3.35Å; Q113-K116 PolarHBondContact O-N 3.05Å; Q113-S117 PolarHBondContact O-N 3.36Å
114	Q	83.2	Confident	79.9	Confident	87 Å²	87	79.6 Å²	79.6	41%	0.407	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-43.9	175.9	-72.3	164.8	-57.7	0	0	110.7	L110 S111 K116 S117 C118	L110-Q114 HydrophobicContact CD1-CB 3.56Å; L110-Q114 HydrophobicContact CG-CB 4.43Å; S111-Q114 PolarHBondContact O-N 3.4Å; S111-Q114 VanDerWaalsContact O-N 3.11Å; S111-Q114 WeakPolarHBondContact OG-CG 3.37Å; S111-Q114 PolarHBondContact OG-N 3.06Å; S111-Q114 PolarHBondContact OG-OE1 3.05Å; Q114-K116 VanDerWaalsContact C-N 3.34Å; Q114-K116 PolarHBondContact O-N 3.37Å; Q114-S117 WeakPolarHBondContact CA-OG 3.48Å; Q114-S117 PolarHBondContact O-N 2.84Å; Q114-S117 PolarHBondContact O-OG 3Å; Q114-C118 PolarHBondContact O-N 3.29Å; Q114-C118 PolarHBondContact O-SG 3.36Å
115	W	84.6	Confident	80.1	Confident	4 Å²	4	77.7 Å²	77.7	2%	0.015	41%	0.407	C	S	.	.	H	α-helix	trans	-56.6	-46.1	176.2	179.8	-119	0	0	0	112.6	L110 S111 Q113 S117 C118 I125 P128 L136 E139 V140 Y143 W150	L110-W115 HydrophobicContact CD2-CB 4.31Å; L110-W115 HydrophobicContact CD2-CE3 3.75Å; L110-W115 HydrophobicContact CD2-CZ3 4.45Å; S111-W115 PolarHBondContact O-N 2.92Å; Q113-W115 VanDerWaalsContact C-N 3.35Å; W115-S117 VanDerWaalsContact C-N 3.29Å; W115-S117 PolarHBondContact O-N 3.29Å; W115-C118 PolarHBondContact O-N 2.75Å; W115-I125 HydrophobicContact CE3-CG2 4.26Å; W115-I125 HydrophobicContact CH2-CD1 3.4Å; W115-I125 VanDerWaalsContact CH2-CD1 3.4Å; W115-I125 HydrophobicContact CH2-CG2 3.89Å; W115-I125 HydrophobicContact CZ2-CD1 3.36Å; W115-I125 HydrophobicContact CZ3-CD1 4.21Å; W115-I125 HydrophobicContact CZ3-CG2 3.68Å; W115-P128 HydrophobicContact CZ3-CG 4.27Å; W115-L136 HydrophobicContact CB-CD1 3.72Å; W115-L136 HydrophobicContact CB-CD2 4.25Å; W115-L136 HydrophobicContact CG-CD1 4.14Å; W115-L136 HydrophobicContact CG-CD2 4.02Å; W115-E139 HydrophobicContact CZ2-CG 4.15Å; W115-E139 VanDerWaalsContact NE1-CD 3.29Å; W115-E139 PolarHBondContact NE1-OE1 3.28Å; W115-E139 PolarHBondContact NE1-OE2 3.34Å; W115-V140 HydrophobicContact CD2-CG2 4.09Å; W115-V140 HydrophobicContact CE3-CG2 4Å; W115-V140 HydrophobicContact CH2-CB 4.29Å; W115-V140 HydrophobicContact CH2-CG1 4.23Å; W115-V140 HydrophobicContact CH2-CG2 3.68Å; W115-V140 HydrophobicContact CZ2-CG2 3.79Å; W115-V140 HydrophobicContact CZ3-CG1 4.22Å; W115-V140 HydrophobicContact CZ3-CG2 3.79Å; W115-Y143 HydrophobicContact CH2-CD2 4.3Å; W115-Y143 HydrophobicContact CH2-CE2 4.44Å; W115-Y143 HydrophobicContact CZ2-CE2 4.35Å; W115-W150 HydrophobicContact CH2-CZ3 4.11Å; W115-W150 HydrophobicContact CZ3-CZ3 4.18Å
116	K	84.4	Confident	80.1	Confident	139 Å²	139	77.5 Å²	77.5	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-62.3	-36.4	175.7	-74.9	169.9	-177.8	165.9	0	112.5	E112 Q113 Q114 C118 K119	E112-K116 VanDerWaalsContact O-CG 3.31Å; E112-K116 WeakPolarHBondContact O-CG 3.45Å; E112-K116 PolarHBondContact O-N 2.67Å; Q113-K116 PolarHBondContact O-N 3.05Å; Q114-K116 VanDerWaalsContact C-N 3.34Å; Q114-K116 PolarHBondContact O-N 3.37Å; K116-C118 VanDerWaalsContact C-N 3.29Å; K116-C118 PolarHBondContact O-N 2.58Å; K116-K119 PolarHBondContact O-N 3.31Å
117	S	84.3	Confident	79.9	Confident	95 Å²	95	77.2 Å²	77.2	66%	0.664	40%	0.402	S	S	*	.	H	α-helix	trans	-71	-23	177.8	72.3	0	0	0	0	113.9	Q113 Q114 W115 K119	Q113-S117 PolarHBondContact O-N 3.36Å; Q114-S117 WeakPolarHBondContact CA-OG 3.48Å; Q114-S117 PolarHBondContact O-N 2.84Å; Q114-S117 PolarHBondContact O-OG 3Å; W115-S117 VanDerWaalsContact C-N 3.29Å; W115-S117 PolarHBondContact O-N 3.29Å; S117-K119 VanDerWaalsContact C-N 3.29Å
118	C	82.1	Confident	79.7	Confident	33 Å²	33	75.4 Å²	75.4	22%	0.223	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.2	177.2	-65.2	0	0	0	0	113.6	Q114 W115 K116 I125 I126	Q114-C118 PolarHBondContact O-N 3.29Å; Q114-C118 PolarHBondContact O-SG 3.36Å; W115-C118 PolarHBondContact O-N 2.75Å; K116-C118 VanDerWaalsContact C-N 3.29Å; K116-C118 PolarHBondContact O-N 2.58Å; C118-I125 HydrophobicContact CB-CG2 4.05Å; C118-I125 WeakPolarHBondContact O-CA 3.34Å; C118-I126 PolarHBondContact O-N 3.08Å
119	K	82.9	Confident	79	Confident	76 Å²	76	71.3 Å²	71.3	33%	0.33	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-87	125.6	178.4	-66.5	-170.8	172.9	-173	0	110.7	K116 S117 S124 I125 E139	K116-K119 PolarHBondContact O-N 3.31Å; S117-K119 VanDerWaalsContact C-N 3.29Å; K119-S124 WeakPolarHBondContact CA-O 3.36Å; K119-I125 HydrophobicContact CD-CD1 4.48Å; K119-I125 HydrophobicContact CG-CD1 4.1Å; K119-I125 HydrophobicContact CG-CG1 4.07Å; K119-E139 WeakPolarHBondContact CE-OE1 3.43Å; K119-E139 IonicContact NZ-OE1 3.55Å; K119-E139 PolarHBondContact NZ-OE1 2.65Å; K119-E139 IonicContact NZ-OE2 3.18Å
120	N	82.2	Confident	78.4	Confident	87 Å²	87	71 Å²	71	47%	0.465	37%	0.371	S	S	.	.			trans	-71	168.8	169	-65.9	-40.1	0	0	0	110.9	D122 G123 S124	N120-D122 WeakPolarHBondContact CB-OD1 3.34Å; N120-D122 PolarHBondContact O-N 2.71Å; N120-D122 VanDerWaalsContact O-N 3.14Å; N120-G123 PolarHBondContact O-N 2.99Å; N120-S124 WeakPolarHBondContact CB-OG 3.41Å; N120-S124 PolarHBondContact N-O 3.07Å; N120-S124 PolarHBondContact ND2-OG 3.22Å
121	E	82.4	Confident	77.8	Confident	215 Å²	215	70.6 Å²	70.6	100%	1.005	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.3	179.8	-67.7	-174.7	169.5	0	0	113.6
122	D	80.2	Confident	77.6	Confident	82 Å²	82	69.2 Å²	69.2	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-4.5	178.1	71.3	-14.7	0	0	0	114	N120 S124 P153 E154	N120-D122 WeakPolarHBondContact CB-OD1 3.34Å; N120-D122 PolarHBondContact O-N 2.71Å; N120-D122 VanDerWaalsContact O-N 3.14Å; D122-S124 WeakPolarHBondContact OD1-CB 3.48Å; D122-S124 PolarHBondContact OD1-N 2.84Å; D122-S124 PolarHBondContact OD1-OG 3.08Å; D122-P153 HydrophobicContact CB-CB 4.16Å; D122-P153 VanDerWaalsContact O-CA 3.24Å; D122-P153 WeakPolarHBondContact O-CA 3.34Å; D122-P153 WeakPolarHBondContact O-CB 3.34Å; D122-E154 PolarHBondContact O-N 3.28Å
123	G	76	Confident	77.5	Confident	14 Å²	14	69.1 Å²	69.1	14%	0.144	36%	0.359	C	S	.	.	S	Bend	trans	91.6	-1.5	-177.5	0	0	0	0	0	115.6	N120 I125	N120-G123 PolarHBondContact O-N 2.99Å; G123-I125 WeakPolarHBondContact O-CG1 3.45Å
124	S	75.8	Confident	77.5	Confident	11 Å²	11	65.3 Å²	65.3	8%	0.077	34%	0.341	C	S	.	.			trans	-68.2	153.5	172.6	61.7	0	0	0	0	111.6	K119 N120 D122 W152	K119-S124 WeakPolarHBondContact CA-O 3.36Å; N120-S124 WeakPolarHBondContact CB-OG 3.41Å; N120-S124 PolarHBondContact N-O 3.07Å; N120-S124 PolarHBondContact ND2-OG 3.22Å; D122-S124 WeakPolarHBondContact OD1-CB 3.48Å; D122-S124 PolarHBondContact OD1-N 2.84Å; D122-S124 PolarHBondContact OD1-OG 3.08Å; S124-W152 WeakPolarHBondContact CA-O 3.47Å
125	I	79	Confident	77.7	Confident	8 Å²	8	64 Å²	64	4%	0.041	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-132.4	142.3	-165.4	-43.8	-172.4	0	0	0	111.7	W115 C118 K119 G123 Y143 W150	W115-I125 HydrophobicContact CE3-CG2 4.26Å; W115-I125 HydrophobicContact CH2-CD1 3.4Å; W115-I125 VanDerWaalsContact CH2-CD1 3.4Å; W115-I125 HydrophobicContact CH2-CG2 3.89Å; W115-I125 HydrophobicContact CZ2-CD1 3.36Å; W115-I125 HydrophobicContact CZ3-CD1 4.21Å; W115-I125 HydrophobicContact CZ3-CG2 3.68Å; C118-I125 HydrophobicContact CB-CG2 4.05Å; C118-I125 WeakPolarHBondContact O-CA 3.34Å; K119-I125 HydrophobicContact CD-CD1 4.48Å; K119-I125 HydrophobicContact CG-CD1 4.1Å; K119-I125 HydrophobicContact CG-CG1 4.07Å; G123-I125 WeakPolarHBondContact O-CG1 3.45Å; I125-Y143 HydrophobicContact CD1-CE1 4.26Å; I125-Y143 HydrophobicContact CD1-CE2 4.03Å; I125-W150 HydrophobicContact CB-CE3 4.14Å; I125-W150 HydrophobicContact CG2-CE3 4.31Å; I125-W150 HydrophobicContact CG2-CZ3 4.35Å; I125-W150 PolarHBondContact N-O 3.44Å
126	I	71.5	Confident	78	Confident	116 Å²	116	64.3 Å²	64.3	60%	0.595	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-84.5	126.6	168.6	-56.6	174.7	0	0	0	109.4	C118	C118-I126 PolarHBondContact O-N 3.08Å
127	N	69.3	Low	78.4	Confident	66 Å²	66	58.4 Å²	58.4	35%	0.353	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-55.1	121.7	-176.6	-175.8	12.3	0	0	0	112	W150	N127-W150 HydrophobicContact CB-CD2 4.09Å; N127-W150 HydrophobicContact CB-CE3 4.38Å; N127-W150 HydrophobicContact CB-CZ2 4.32Å; N127-W150 VanDerWaalsContact OD1-CZ2 3.24Å; N127-W150 WeakPolarHBondContact OD1-CZ2 3.33Å
128	P	65.9	Low	78.8	Confident	13 Å²	13	57.9 Å²	57.9	8%	0.084	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-73.9	135.5	174.7	29.9	-32.7	0	0	0	111.4	L110 W115 V140 W150 T341	L110-P128 HydrophobicContact CD1-CB 4.37Å; L110-P128 HydrophobicContact CD2-CB 3.71Å; L110-P128 HydrophobicContact CD2-CG 3.99Å; W115-P128 HydrophobicContact CZ3-CG 4.27Å; P128-V140 HydrophobicContact CG-CG1 4.26Å; P128-W150 VanDerWaalsContact CD-CH2 3.45Å; P128-W150 VanDerWaalsContact CD-CZ3 3.48Å; P128-W150 HydrophobicContact CG-CH2 4.21Å; P128-W150 HydrophobicContact CG-CZ3 4.46Å; P128-T341 VanDerWaalsContact O-CG2 3.24Å; P128-T341 WeakPolarHBondContact O-CG2 3.44Å
129	S	61.1	Low	79.3	Confident	73 Å²	73	59.5 Å²	59.5	51%	0.51	32%	0.317	S	S	.	.			trans	-90.8	6	-177.1	52.2	0	0	0	0	114.8
130	E	67.4	Low	79.7	Confident	69 Å²	69	55.9 Å²	55.9	32%	0.322	30%	0.302	S	S	.	.	S	Bend	trans	-141	169.3	-163.1	-53.5	-173	149.9	0	0	113	S107	S107-E130 WeakPolarHBondContact CB-OE1 3.18Å; S107-E130 WeakPolarHBondContact CB-OE2 3.32Å; S107-E130 PolarHBondContact OG-OE1 2.84Å; S107-E130 PolarHBondContact OG-OE2 3.5Å
131	G	67.6	Low	80.3	Confident	6 Å²	6	51.8 Å²	51.8	6%	0.062	28%	0.279	C	S	.	.			trans	-58.8	155.6	-177.2	0	0	0	0	0	112.9	P109 L110	P109-G131 CarbonylContact C-O 3.59Å; P109-G131 WeakPolarHBondContact CA-O 3.4Å; L110-G131 PolarHBondContact N-O 2.83Å
132	I	81.5	Confident	80.9	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.015	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-115.2	136.8	-167.3	-59.6	160.9	0	0	0	111	H134 L136 R137 V140 L144 E337	I132-H134 PolarHBondContact O-N 2.84Å; I132-L136 HydrophobicContact CG2-CB 3.66Å; I132-R137 HydrophobicContact CB-CG 4.4Å; I132-R137 HydrophobicContact CG2-CG 4.1Å; I132-V140 HydrophobicContact CD1-CB 3.85Å; I132-V140 HydrophobicContact CD1-CG1 3.35Å; I132-V140 HydrophobicContact CD1-CG2 4.5Å; I132-V140 HydrophobicContact CG1-CG1 4.27Å; I132-V140 HydrophobicContact CG2-CB 4.42Å; I132-V140 HydrophobicContact CG2-CG2 4.16Å; I132-L144 HydrophobicContact CD1-CD1 3.64Å; I132-E337 HydrophobicContact CD1-CB 4.44Å; I132-E337 HydrophobicContact CD1-CG 3.94Å; I132-E337 PolarHBondContact N-OE2 3.24Å
133	Q	82.4	Confident	81.6	Confident	91 Å²	91	39.5 Å²	39.5	43%	0.425	22%	0.219	S	C	.	.			trans	-63.4	135.7	172	-172.7	178.7	-7.4	0	0	110.5	L110 G135 L136	L110-Q133 VanDerWaalsContact O-CB 3.23Å; L110-Q133 WeakPolarHBondContact O-CB 3.49Å; L110-Q133 PolarHBondContact O-N 3.35Å; Q133-G135 VanDerWaalsContact C-N 3.26Å; Q133-G135 PolarHBondContact O-N 3.46Å; Q133-L136 WeakPolarHBondContact O-CB 3.43Å; Q133-L136 PolarHBondContact O-N 3.21Å
134	H	84.3	Confident	82.3	Confident	83 Å²	83	39.3 Å²	39.3	38%	0.384	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-45.9	-44.2	-172.1	-172.7	105.9	0	0	0	114.4	I132 L136 R137 Y252 E330	I132-H134 PolarHBondContact O-N 2.84Å; H134-L136 PolarHBondContact O-N 2.87Å; H134-L136 VanDerWaalsContact O-N 3.17Å; H134-R137 PolarHBondContact ND1-NH1 3.35Å; H134-R137 WeakPolarHBondContact O-CB 3.35Å; H134-R137 PolarHBondContact O-N 3.27Å; H134-R137 VanDerWaalsContact O-N 3.16Å; H134-Y252 AromaticContact CE1-CE1 3.92Å; H134-E330 IonicContact CE1-OE1 2.79Å; H134-E330 IonicContact ND1-OE1 3.98Å; H134-E330 PolarHBondContact ND1-OE1 3.17Å; H134-E330 VanDerWaalsContact ND1-OE1 3.13Å; H134-E330 IonicContact ND1-OE2 2.95Å
135	G	86.9	Confident	83.2	Confident	60 Å²	60	39.1 Å²	39.1	62%	0.619	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-63.1	-20.7	-178.9	0	0	0	0	0	115.2	Q133	Q133-G135 VanDerWaalsContact C-N 3.26Å; Q133-G135 PolarHBondContact O-N 3.46Å
136	L	89.9	Confident	83.9	Confident	11 Å²	11	41.6 Å²	41.6	6%	0.058	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-92.9	-16.4	178.5	-67.7	176.9	0	0	0	113.3	E112 W115 I132 Q133 H134 K138 E139 V140	E112-L136 HydrophobicContact CG-CD1 4.44Å; E112-L136 HydrophobicContact CG-CD2 3.99Å; E112-L136 HydrophobicContact CG-CG 4.12Å; W115-L136 HydrophobicContact CB-CD1 3.72Å; W115-L136 HydrophobicContact CB-CD2 4.25Å; W115-L136 HydrophobicContact CG-CD1 4.14Å; W115-L136 HydrophobicContact CG-CD2 4.02Å; I132-L136 HydrophobicContact CG2-CB 3.66Å; Q133-L136 WeakPolarHBondContact O-CB 3.43Å; Q133-L136 PolarHBondContact O-N 3.21Å; H134-L136 PolarHBondContact O-N 2.87Å; H134-L136 VanDerWaalsContact O-N 3.17Å; L136-K138 VanDerWaalsContact C-N 3.3Å; L136-K138 PolarHBondContact O-N 3.16Å; L136-E139 PolarHBondContact O-N 3.17Å; L136-V140 HydrophobicContact CB-CG2 4Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.38Å
137	R	93	Very high	85	Confident	15 Å²	15	36.6 Å²	36.6	6%	0.057	22%	0.215	C	C	.	.	H	α-helix	trans	-55.3	-44	-171.3	-69.4	-176.4	177.3	133.3	-3.7	112.5	I132 H134 E139 V140 W141 I253 E330 F333 E337	I132-R137 HydrophobicContact CB-CG 4.4Å; I132-R137 HydrophobicContact CG2-CG 4.1Å; H134-R137 PolarHBondContact ND1-NH1 3.35Å; H134-R137 WeakPolarHBondContact O-CB 3.35Å; H134-R137 PolarHBondContact O-N 3.27Å; H134-R137 VanDerWaalsContact O-N 3.16Å; R137-E139 PolarHBondContact O-N 3.29Å; R137-V140 PolarHBondContact O-N 2.64Å; R137-W141 HydrophobicContact CB-CD2 4.5Å; R137-W141 HydrophobicContact CB-CG 4.5Å; R137-W141 WeakPolarHBondContact O-CB 3.37Å; R137-W141 VanDerWaalsContact O-CD1 3.32Å; R137-W141 PolarHBondContact O-N 3.29Å; R137-I253 HydrophobicContact CB-CD1 4.3Å; R137-I253 HydrophobicContact CB-CG2 3.83Å; R137-E330 IonicContact CZ-OE2 2.95Å; R137-E330 IonicContact NH1-OE1 3.3Å; R137-E330 IonicContact NH1-OE2 2.67Å; R137-E330 PolarHBondContact NH1-OE2 3.12Å; R137-E330 IonicContact NH2-OE2 2.79Å; R137-E330 PolarHBondContact NH2-OE2 3.1Å; R137-F333 VanDerWaalsContact NH1-CD2 3.28Å; R137-E337 VanDerWaalsContact CD-OE1 3.3Å; R137-E337 WeakPolarHBondContact CD-OE1 3.43Å; R137-E337 WeakPolarHBondContact CG-OE1 3.38Å; R137-E337 IonicContact CZ-OE1 2.68Å; R137-E337 IonicContact NE-OE1 3.37Å; R137-E337 PolarHBondContact NE-OE1 2.9Å
138	K	93.2	Very high	86.2	Confident	83 Å²	83	34.6 Å²	34.6	36%	0.361	20%	0.203	S	C	.	.	H	α-helix	trans	-57.8	-34.6	179.1	-177.3	166.2	-177.9	162	0	113.1	L136 I253 F254 D256	L136-K138 VanDerWaalsContact C-N 3.3Å; L136-K138 PolarHBondContact O-N 3.16Å; K138-I253 HydrophobicContact CB-CG2 4.4Å; K138-F254 WeakPolarHBondContact CE-O 3.45Å; K138-F254 HydrophobicContact CG-CD1 3.84Å; K138-F254 HydrophobicContact CG-CE1 4.24Å; K138-F254 PolarHBondContact NZ-O 3.43Å; K138-F254 VanDerWaalsContact O-CE1 3.32Å; K138-F254 WeakPolarHBondContact O-CE1 3.46Å; K138-D256 WeakPolarHBondContact CE-OD2 3.45Å; K138-D256 IonicContact NZ-OD2 3.19Å; K138-D256 PolarHBondContact NZ-OD2 3.05Å
139	E	91.9	Very high	87.5	Confident	68 Å²	68	37.3 Å²	37.3	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-82.5	-52.4	177.2	-170.7	-176.1	173.4	0	0	110.9	W115 K119 L136 R137 W141 K142 Y143	W115-E139 HydrophobicContact CZ2-CG 4.15Å; W115-E139 VanDerWaalsContact NE1-CD 3.29Å; W115-E139 PolarHBondContact NE1-OE1 3.28Å; W115-E139 PolarHBondContact NE1-OE2 3.34Å; K119-E139 WeakPolarHBondContact CE-OE1 3.43Å; K119-E139 IonicContact NZ-OE1 3.55Å; K119-E139 PolarHBondContact NZ-OE1 2.65Å; K119-E139 IonicContact NZ-OE2 3.18Å; L136-E139 PolarHBondContact O-N 3.17Å; R137-E139 PolarHBondContact O-N 3.29Å; E139-W141 PolarHBondContact O-N 3.49Å; E139-K142 WeakPolarHBondContact O-CB 3.48Å; E139-K142 PolarHBondContact O-N 3.13Å; E139-Y143 HydrophobicContact CG-CE2 4.49Å; E139-Y143 WeakPolarHBondContact O-CD2 3.5Å
140	V	92	Very high	88.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-36.6	-171.6	-175.6	0	0	0	0	111.9	W115 P128 I132 L136 R137 K142 Y143 L144 W150	W115-V140 HydrophobicContact CD2-CG2 4.09Å; W115-V140 HydrophobicContact CE3-CG2 4Å; W115-V140 HydrophobicContact CH2-CB 4.29Å; W115-V140 HydrophobicContact CH2-CG1 4.23Å; W115-V140 HydrophobicContact CH2-CG2 3.68Å; W115-V140 HydrophobicContact CZ2-CG2 3.79Å; W115-V140 HydrophobicContact CZ3-CG1 4.22Å; W115-V140 HydrophobicContact CZ3-CG2 3.79Å; P128-V140 HydrophobicContact CG-CG1 4.26Å; I132-V140 HydrophobicContact CD1-CB 3.85Å; I132-V140 HydrophobicContact CD1-CG1 3.35Å; I132-V140 HydrophobicContact CD1-CG2 4.5Å; I132-V140 HydrophobicContact CG1-CG1 4.27Å; I132-V140 HydrophobicContact CG2-CB 4.42Å; I132-V140 HydrophobicContact CG2-CG2 4.16Å; L136-V140 HydrophobicContact CB-CG2 4Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.38Å; R137-V140 PolarHBondContact O-N 2.64Å; V140-K142 PolarHBondContact O-N 2.79Å; V140-Y143 WeakPolarHBondContact O-CB 3.42Å; V140-Y143 PolarHBondContact O-N 2.71Å; V140-L144 HydrophobicContact CG1-CD1 4.09Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 PolarHBondContact O-N 2.79Å; V140-L144 VanDerWaalsContact O-N 3.09Å; V140-W150 HydrophobicContact CG1-CH2 4.31Å
141	W	94.9	Very high	89.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-25.2	-179.7	-75.4	19.8	0	0	0	112.8	R137 E139 Y143 L144 L145 L250 I253 F254 F333 E337 W340	R137-W141 HydrophobicContact CB-CD2 4.5Å; R137-W141 HydrophobicContact CB-CG 4.5Å; R137-W141 WeakPolarHBondContact O-CB 3.37Å; R137-W141 VanDerWaalsContact O-CD1 3.32Å; R137-W141 PolarHBondContact O-N 3.29Å; E139-W141 PolarHBondContact O-N 3.49Å; W141-Y143 PolarHBondContact O-N 3.02Å; W141-L144 PolarHBondContact O-N 3.5Å; W141-L145 HydrophobicContact CB-CD1 4.46Å; W141-L145 VanDerWaalsContact O-CB 3.27Å; W141-L145 WeakPolarHBondContact O-CB 3.41Å; W141-L145 WeakPolarHBondContact O-CG 3.4Å; W141-L145 PolarHBondContact O-N 3.24Å; W141-L250 HydrophobicContact CE3-CD2 3.78Å; W141-L250 HydrophobicContact CZ3-CD2 3.63Å; W141-I253 HydrophobicContact CD2-CG2 4.3Å; W141-I253 HydrophobicContact CE3-CB 4.16Å; W141-I253 HydrophobicContact CE3-CG1 4.24Å; W141-I253 HydrophobicContact CE3-CG2 3.95Å; W141-I253 HydrophobicContact CH2-CG1 3.77Å; W141-I253 HydrophobicContact CZ2-CG1 4.38Å; W141-I253 HydrophobicContact CZ3-CB 3.95Å; W141-I253 HydrophobicContact CZ3-CG1 3.65Å; W141-I253 HydrophobicContact CZ3-CG2 4.23Å; W141-F254 HydrophobicContact CB-CE2 4.45Å; W141-F254 HydrophobicContact CB-CZ 3.86Å; W141-F254 HydrophobicContact CE3-CE2 4.19Å; W141-F333 HydrophobicContact CH2-CB 4.45Å; W141-F333 AromaticContact CH2-CD1 3.61Å; W141-F333 HydrophobicContact CH2-CD1 3.61Å; W141-F333 HydrophobicContact CH2-CE1 4.23Å; W141-F333 HydrophobicContact CH2-CG 4.23Å; W141-F333 HydrophobicContact CZ2-CB 4Å; W141-F333 HydrophobicContact CZ2-CD1 4.03Å; W141-F333 HydrophobicContact CZ2-CG 4.2Å; W141-E337 HydrophobicContact CZ2-CG 4.29Å; W141-E337 PolarHBondContact NE1-OE1 3.39Å; W141-W340 HydrophobicContact CD2-CH2 4.39Å; W141-W340 AromaticContact CD2-CZ3 3.66Å; W141-W340 HydrophobicContact CD2-CZ3 3.66Å; W141-W340 AromaticContact CE2-CZ3 3.68Å; W141-W340 HydrophobicContact CE3-CH2 4.18Å; W141-W340 AromaticContact CE3-CZ3 3.91Å; W141-W340 HydrophobicContact CE3-CZ3 3.91Å; W141-W340 HydrophobicContact CG-CZ3 4.13Å; W141-W340 HydrophobicContact CH2-CH2 4.15Å; W141-W340 HydrophobicContact CH2-CZ3 4.12Å; W141-W340 HydrophobicContact CZ2-CH2 4.37Å; W141-W340 AromaticContact CZ2-CZ3 3.9Å; W141-W340 HydrophobicContact CZ2-CZ3 3.9Å; W141-W340 HydrophobicContact CZ3-CH2 4.1Å; W141-W340 HydrophobicContact CZ3-CZ3 4.16Å
142	K	95.2	Very high	91.1	Very high	24 Å²	24	38.9 Å²	38.9	10%	0.104	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-32.6	173.2	-61.3	-171.8	179.7	-162.2	0	112	E139 V140 C147 Y148 F254 D259	E139-K142 WeakPolarHBondContact O-CB 3.48Å; E139-K142 PolarHBondContact O-N 3.13Å; V140-K142 PolarHBondContact O-N 2.79Å; K142-C147 HydrophobicContact CB-CB 4.12Å; K142-C147 WeakPolarHBondContact O-CA 3.25Å; K142-C147 WeakPolarHBondContact O-CB 3.48Å; K142-C147 PolarHBondContact O-N 2.9Å; K142-Y148 HydrophobicContact CB-CD2 3.69Å; K142-Y148 HydrophobicContact CB-CE2 3.77Å; K142-Y148 HydrophobicContact CB-CG 4.3Å; K142-Y148 HydrophobicContact CD-CD2 4.2Å; K142-Y148 HydrophobicContact CD-CE2 3.38Å; K142-Y148 WeakPolarHBondContact CD-OH 3.29Å; K142-Y148 HydrophobicContact CG-CE2 4.21Å; K142-Y148 PolarHBondContact NZ-OH 3.43Å; K142-Y148 PolarHBondContact O-N 3.41Å; K142-F254 HydrophobicContact CD-CE1 4.49Å; K142-F254 HydrophobicContact CG-CE1 3.79Å; K142-F254 HydrophobicContact CG-CZ 4.23Å; K142-D259 VanDerWaalsContact CE-CG 3.48Å; K142-D259 WeakPolarHBondContact CE-OD2 3.47Å; K142-D259 IonicContact NZ-OD1 2.74Å; K142-D259 PolarHBondContact NZ-OD1 3.02Å; K142-D259 IonicContact NZ-OD2 3.61Å; K142-D259 PolarHBondContact NZ-OD2 3.14Å
143	Y	93.7	Very high	91.6	Very high	15 Å²	15	40.6 Å²	40.6	6%	0.059	23%	0.23	C	C	.	.	H	α-helix	trans	-80.6	-47.1	176.1	-64.6	-92	0	0	0	111.3	W115 I125 E139 V140 W141 L145 G146 Y148 W150	W115-Y143 HydrophobicContact CH2-CD2 4.3Å; W115-Y143 HydrophobicContact CH2-CE2 4.44Å; W115-Y143 HydrophobicContact CZ2-CE2 4.35Å; I125-Y143 HydrophobicContact CD1-CE1 4.26Å; I125-Y143 HydrophobicContact CD1-CE2 4.03Å; E139-Y143 HydrophobicContact CG-CE2 4.49Å; E139-Y143 WeakPolarHBondContact O-CD2 3.5Å; V140-Y143 WeakPolarHBondContact O-CB 3.42Å; V140-Y143 PolarHBondContact O-N 2.71Å; W141-Y143 PolarHBondContact O-N 3.02Å; Y143-L145 PolarHBondContact O-N 3.42Å; Y143-G146 PolarHBondContact O-N 3.28Å; Y143-Y148 HydrophobicContact CD2-CD2 4.3Å; Y143-Y148 HydrophobicContact CE1-CD2 4.27Å; Y143-Y148 HydrophobicContact CE1-CG 4.48Å; Y143-Y148 AromaticContact CE2-CD2 3.85Å; Y143-Y148 HydrophobicContact CE2-CD2 3.85Å; Y143-Y148 AromaticContact CZ-CD2 3.85Å; Y143-W150 VanDerWaalsContact CB-CZ2 3.48Å; Y143-W150 HydrophobicContact CD1-CD2 4.22Å; Y143-W150 AromaticContact CD1-CE3 3.99Å; Y143-W150 HydrophobicContact CD1-CE3 3.99Å; Y143-W150 HydrophobicContact CD1-CZ3 4.36Å; Y143-W150 HydrophobicContact CG-CD2 4.42Å; Y143-W150 HydrophobicContact CG-CE3 4.07Å; Y143-W150 HydrophobicContact CG-CH2 4.27Å; Y143-W150 AromaticContact CG-CZ3 3.98Å; Y143-W150 HydrophobicContact CG-CZ3 3.98Å
144	L	92.5	Very high	91.9	Very high	11 Å²	11	42 Å²	42	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-35.5	179.1	-71.6	173.8	0	0	0	113.1	I132 V140 W141 G146 W150 W340 T341	I132-L144 HydrophobicContact CD1-CD1 3.64Å; V140-L144 HydrophobicContact CG1-CD1 4.09Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 PolarHBondContact O-N 2.79Å; V140-L144 VanDerWaalsContact O-N 3.09Å; W141-L144 PolarHBondContact O-N 3.5Å; L144-G146 VanDerWaalsContact C-N 3.34Å; L144-W150 HydrophobicContact CD2-CH2 4.29Å; L144-W150 HydrophobicContact CD2-CZ2 3.89Å; L144-W150 HydrophobicContact CG-CH2 4.38Å; L144-W150 HydrophobicContact CG-CZ2 4.22Å; L144-W340 HydrophobicContact CB-CB 3.97Å; L144-W340 HydrophobicContact CB-CE3 4.34Å; L144-W340 HydrophobicContact CD1-CE3 4.41Å; L144-W340 HydrophobicContact CD2-CB 4.3Å; L144-T341 HydrophobicContact CD2-CG2 3.94Å
145	L	95	Very high	92.4	Very high	6 Å²	6	42 Å²	42	3%	0.031	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	10.1	178.7	-63.2	170.6	0	0	0	112.8	W141 Y143 C147 L250 A263 G266 F267 W340	W141-L145 HydrophobicContact CB-CD1 4.46Å; W141-L145 VanDerWaalsContact O-CB 3.27Å; W141-L145 WeakPolarHBondContact O-CB 3.41Å; W141-L145 WeakPolarHBondContact O-CG 3.4Å; W141-L145 PolarHBondContact O-N 3.24Å; Y143-L145 PolarHBondContact O-N 3.42Å; L145-C147 VanDerWaalsContact C-N 3.29Å; L145-C147 PolarHBondContact O-N 3.03Å; L145-L250 HydrophobicContact CD1-CD2 3.77Å; L145-A263 HydrophobicContact CD1-CB 3.67Å; L145-G266 WeakPolarHBondContact O-CA 3.35Å; L145-F267 HydrophobicContact CD2-CB 3.95Å; L145-F267 HydrophobicContact CD2-CG 4.42Å; L145-W340 HydrophobicContact CD1-CH2 4.02Å; L145-W340 HydrophobicContact CD1-CZ2 4.46Å; L145-W340 HydrophobicContact CD1-CZ3 4.06Å; L145-W340 HydrophobicContact CD2-CD2 3.68Å; L145-W340 HydrophobicContact CD2-CE3 4.02Å; L145-W340 HydrophobicContact CD2-CG 4.18Å; L145-W340 HydrophobicContact CD2-CH2 4.08Å; L145-W340 HydrophobicContact CD2-CZ2 3.76Å; L145-W340 HydrophobicContact CD2-CZ3 4.2Å; L145-W340 HydrophobicContact CG-CD2 4.32Å; L145-W340 HydrophobicContact CG-CE3 4.17Å; L145-W340 HydrophobicContact CG-CH2 4.39Å; L145-W340 HydrophobicContact CG-CZ3 4.21Å
146	G	93.6	Very high	92.8	Very high	60 Å²	60	43.5 Å²	43.5	62%	0.619	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	20.6	173	0	0	0	0	0	115.3	Y143 L144 Y148	Y143-G146 PolarHBondContact O-N 3.28Å; L144-G146 VanDerWaalsContact C-N 3.34Å; G146-Y148 VanDerWaalsContact C-N 3.32Å
147	C	94.4	Very high	93	Very high	11 Å²	11	43.4 Å²	43.4	7%	0.074	24%	0.235	C	C	.	.	S	Bend	trans	-68	-39.7	168.2	-59.4	0	0	0	0	110.4	K142 L145 W262	K142-C147 HydrophobicContact CB-CB 4.12Å; K142-C147 WeakPolarHBondContact O-CA 3.25Å; K142-C147 WeakPolarHBondContact O-CB 3.48Å; K142-C147 PolarHBondContact O-N 2.9Å; L145-C147 VanDerWaalsContact C-N 3.29Å; L145-C147 PolarHBondContact O-N 3.03Å; C147-W262 VanDerWaalsContact SG-C 3.5Å
148	Y	94.6	Very high	93.1	Very high	24 Å²	24	47.5 Å²	47.5	9%	0.094	26%	0.256	C	S	.	.	S	Bend	trans	-119.6	153.1	172.5	-54.2	-28.2	0	0	0	110.1	K142 Y143 G146 C157 R160 Q161 L164	K142-Y148 HydrophobicContact CB-CD2 3.69Å; K142-Y148 HydrophobicContact CB-CE2 3.77Å; K142-Y148 HydrophobicContact CB-CG 4.3Å; K142-Y148 HydrophobicContact CD-CD2 4.2Å; K142-Y148 HydrophobicContact CD-CE2 3.38Å; K142-Y148 WeakPolarHBondContact CD-OH 3.29Å; K142-Y148 HydrophobicContact CG-CE2 4.21Å; K142-Y148 PolarHBondContact NZ-OH 3.43Å; K142-Y148 PolarHBondContact O-N 3.41Å; Y143-Y148 HydrophobicContact CD2-CD2 4.3Å; Y143-Y148 HydrophobicContact CE1-CD2 4.27Å; Y143-Y148 HydrophobicContact CE1-CG 4.48Å; Y143-Y148 AromaticContact CE2-CD2 3.85Å; Y143-Y148 HydrophobicContact CE2-CD2 3.85Å; Y143-Y148 AromaticContact CZ-CD2 3.85Å; G146-Y148 VanDerWaalsContact C-N 3.32Å; Y148-C157 HydrophobicContact CD1-CB 4.4Å; Y148-C157 HydrophobicContact CD2-CB 4.39Å; Y148-C157 HydrophobicContact CE2-CB 4.45Å; Y148-C157 HydrophobicContact CG-CB 4.39Å; Y148-R160 HydrophobicContact CD1-CG 4.37Å; Y148-R160 HydrophobicContact CE1-CG 4.46Å; Y148-Q161 PolarHBondContact OH-OE1 3.01Å; Y148-L164 HydrophobicContact CE1-CD1 4.49Å
149	D	91.6	Very high	93.2	Very high	70 Å²	70	49 Å²	49	37%	0.374	27%	0.265	S	S	.	.			trans	-96.9	141.7	171.6	-173.2	-76.4	0	0	0	109.7	S151 W152	D149-S151 PolarHBondContact O-N 3.17Å; D149-S151 VanDerWaalsContact OD1-CB 3.26Å; D149-S151 WeakPolarHBondContact OD1-CB 3.4Å; D149-S151 PolarHBondContact OD1-N 3.16Å; D149-S151 PolarHBondContact OD1-OG 3.39Å; D149-W152 HydrophobicContact CB-CD2 3.68Å; D149-W152 VanDerWaalsContact CB-CE2 3.41Å; D149-W152 HydrophobicContact CB-CE3 4.39Å; D149-W152 HydrophobicContact CB-CG 3.78Å; D149-W152 HydrophobicContact CB-CZ2 3.95Å; D149-W152 VanDerWaalsContact CB-NE1 3.3Å; D149-W152 WeakPolarHBondContact O-CB 3.39Å; D149-W152 PolarHBondContact O-N 2.95Å; D149-W152 VanDerWaalsContact O-N 3.12Å
150	W	90.2	Very high	93.5	Very high	50 Å²	50	50 Å²	50	19%	0.189	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.8	-179.6	-60.5	102.3	0	0	0	113.3	W115 I125 N127 P128 V140 Y143 L144 W152	W115-W150 HydrophobicContact CH2-CZ3 4.11Å; W115-W150 HydrophobicContact CZ3-CZ3 4.18Å; I125-W150 HydrophobicContact CB-CE3 4.14Å; I125-W150 HydrophobicContact CG2-CE3 4.31Å; I125-W150 HydrophobicContact CG2-CZ3 4.35Å; I125-W150 PolarHBondContact N-O 3.44Å; N127-W150 HydrophobicContact CB-CD2 4.09Å; N127-W150 HydrophobicContact CB-CE3 4.38Å; N127-W150 HydrophobicContact CB-CZ2 4.32Å; N127-W150 VanDerWaalsContact OD1-CZ2 3.24Å; N127-W150 WeakPolarHBondContact OD1-CZ2 3.33Å; P128-W150 VanDerWaalsContact CD-CH2 3.45Å; P128-W150 VanDerWaalsContact CD-CZ3 3.48Å; P128-W150 HydrophobicContact CG-CH2 4.21Å; P128-W150 HydrophobicContact CG-CZ3 4.46Å; V140-W150 HydrophobicContact CG1-CH2 4.31Å; Y143-W150 VanDerWaalsContact CB-CZ2 3.48Å; Y143-W150 HydrophobicContact CD1-CD2 4.22Å; Y143-W150 AromaticContact CD1-CE3 3.99Å; Y143-W150 HydrophobicContact CD1-CE3 3.99Å; Y143-W150 HydrophobicContact CD1-CZ3 4.36Å; Y143-W150 HydrophobicContact CG-CD2 4.42Å; Y143-W150 HydrophobicContact CG-CE3 4.07Å; Y143-W150 HydrophobicContact CG-CH2 4.27Å; Y143-W150 AromaticContact CG-CZ3 3.98Å; Y143-W150 HydrophobicContact CG-CZ3 3.98Å; L144-W150 HydrophobicContact CD2-CH2 4.29Å; L144-W150 HydrophobicContact CD2-CZ2 3.89Å; L144-W150 HydrophobicContact CG-CH2 4.38Å; L144-W150 HydrophobicContact CG-CZ2 4.22Å; W150-W152 VanDerWaalsContact C-N 3.29Å; W150-W152 PolarHBondContact O-N 3.05Å
151	S	90.2	Very high	93.7	Very high	80 Å²	80	51.7 Å²	51.7	56%	0.559	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.2	-178.8	70.4	0	0	0	0	114.3	D149	D149-S151 PolarHBondContact O-N 3.17Å; D149-S151 VanDerWaalsContact OD1-CB 3.26Å; D149-S151 WeakPolarHBondContact OD1-CB 3.4Å; D149-S151 PolarHBondContact OD1-N 3.16Å; D149-S151 PolarHBondContact OD1-OG 3.39Å
152	W	91.7	Very high	93.8	Very high	52 Å²	52	59.1 Å²	59.1	20%	0.197	31%	0.306	C	S	.	.			trans	-80.1	138	-172.8	-71.3	5.1	0	0	0	112.2	S124 D149 W150 K156 R160	S124-W152 WeakPolarHBondContact CA-O 3.47Å; D149-W152 HydrophobicContact CB-CD2 3.68Å; D149-W152 VanDerWaalsContact CB-CE2 3.41Å; D149-W152 HydrophobicContact CB-CE3 4.39Å; D149-W152 HydrophobicContact CB-CG 3.78Å; D149-W152 HydrophobicContact CB-CZ2 3.95Å; D149-W152 VanDerWaalsContact CB-NE1 3.3Å; D149-W152 WeakPolarHBondContact O-CB 3.39Å; D149-W152 PolarHBondContact O-N 2.95Å; D149-W152 VanDerWaalsContact O-N 3.12Å; W150-W152 VanDerWaalsContact C-N 3.29Å; W150-W152 PolarHBondContact O-N 3.05Å; W152-K156 HydrophobicContact CB-CB 4.32Å; W152-K156 HydrophobicContact CB-CD 4.16Å; W152-K156 HydrophobicContact CB-CG 4.44Å; W152-K156 HydrophobicContact CD2-CD 3.71Å; W152-K156 HydrophobicContact CD2-CG 3.98Å; W152-K156 VanDerWaalsContact CE2-CE 3.43Å; W152-K156 HydrophobicContact CE3-CD 4.3Å; W152-K156 HydrophobicContact CE3-CG 4.06Å; W152-K156 HydrophobicContact CG-CD 3.61Å; W152-K156 HydrophobicContact CG-CG 4.15Å; W152-R160 HydrophobicContact CH2-CG 4.46Å; W152-R160 HydrophobicContact CZ3-CB 3.95Å; W152-R160 HydrophobicContact CZ3-CG 3.86Å
153	P	92.1	Very high	93.9	Very high	39 Å²	39	62 Å²	62	25%	0.253	32%	0.32	S	S	.	.			trans	-70.2	159.4	169.2	31.5	-35.6	0	0	0	110.5	D122 S155 K156 C157	D122-P153 HydrophobicContact CB-CB 4.16Å; D122-P153 VanDerWaalsContact O-CA 3.24Å; D122-P153 WeakPolarHBondContact O-CA 3.34Å; D122-P153 WeakPolarHBondContact O-CB 3.34Å; P153-S155 PolarHBondContact O-N 3.5Å; P153-K156 HydrophobicContact CG-CB 4.01Å; P153-K156 WeakPolarHBondContact O-CB 3.33Å; P153-K156 PolarHBondContact O-N 3.4Å; P153-C157 PolarHBondContact O-N 3.34Å
154	E	90.1	Very high	94.1	Very high	121 Å²	121	61.5 Å²	61.5	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-57.2	-37.9	-175.9	-164.8	-175	-173.1	0	0	112.5	D122 K156 C157 M158	D122-E154 PolarHBondContact O-N 3.28Å; E154-K156 VanDerWaalsContact C-N 3.28Å; E154-K156 PolarHBondContact O-N 2.97Å; E154-C157 WeakPolarHBondContact O-CB 3.23Å; E154-C157 PolarHBondContact O-N 3.17Å; E154-C157 VanDerWaalsContact O-N 3.14Å; E154-M158 HydrophobicContact CG-CE 3.63Å; E154-M158 WeakPolarHBondContact O-CG 3.49Å; E154-M158 PolarHBondContact O-N 3.42Å
155	S	93.6	Very high	94.4	Very high	82 Å²	82	64.7 Å²	64.7	57%	0.573	33%	0.334	S	S	*	.	H	α-helix	trans	-58.5	-38.4	177.9	58.3	0	0	0	0	112.9	P153 M158 E159	P153-S155 PolarHBondContact O-N 3.5Å; S155-M158 PolarHBondContact O-N 2.95Å; S155-E159 PolarHBondContact O-N 3.46Å; S155-E159 VanDerWaalsContact O-N 3.09Å
156	K	95.1	Very high	94.5	Very high	91 Å²	91	68.3 Å²	68.3	40%	0.396	35%	0.351	S	S	.	.	H	α-helix	trans	-73.6	-36.6	177.7	-172.4	173.9	178	-170.3	0	111.4	W152 P153 E154 M158 E159 R160	W152-K156 HydrophobicContact CB-CB 4.32Å; W152-K156 HydrophobicContact CB-CD 4.16Å; W152-K156 HydrophobicContact CB-CG 4.44Å; W152-K156 HydrophobicContact CD2-CD 3.71Å; W152-K156 HydrophobicContact CD2-CG 3.98Å; W152-K156 VanDerWaalsContact CE2-CE 3.43Å; W152-K156 HydrophobicContact CE3-CD 4.3Å; W152-K156 HydrophobicContact CE3-CG 4.06Å; W152-K156 HydrophobicContact CG-CD 3.61Å; W152-K156 HydrophobicContact CG-CG 4.15Å; P153-K156 HydrophobicContact CG-CB 4.01Å; P153-K156 WeakPolarHBondContact O-CB 3.33Å; P153-K156 PolarHBondContact O-N 3.4Å; E154-K156 VanDerWaalsContact C-N 3.28Å; E154-K156 PolarHBondContact O-N 2.97Å; K156-M158 VanDerWaalsContact C-N 3.34Å; K156-E159 PolarHBondContact O-N 2.88Å; K156-R160 WeakPolarHBondContact O-CB 3.39Å; K156-R160 PolarHBondContact O-N 3.47Å
157	C	94.2	Very high	94.7	Very high	9 Å²	9	68 Å²	68	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-41.2	172.2	-64.4	0	0	0	0	111.6	Y148 P153 E154 R160 Q161	Y148-C157 HydrophobicContact CD1-CB 4.4Å; Y148-C157 HydrophobicContact CD2-CB 4.39Å; Y148-C157 HydrophobicContact CE2-CB 4.45Å; Y148-C157 HydrophobicContact CG-CB 4.39Å; P153-C157 PolarHBondContact O-N 3.34Å; E154-C157 WeakPolarHBondContact O-CB 3.23Å; E154-C157 PolarHBondContact O-N 3.17Å; E154-C157 VanDerWaalsContact O-N 3.14Å; C157-R160 PolarHBondContact O-N 3.23Å; C157-Q161 PolarHBondContact O-N 3.3Å
158	M	94.7	Very high	94.9	Very high	101 Å²	101	67.8 Å²	67.8	50%	0.498	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-41.3	175.6	-65.5	-172.4	-150.4	0	0	112.7	E154 S155 K156 Q161 K162	E154-M158 HydrophobicContact CG-CE 3.63Å; E154-M158 WeakPolarHBondContact O-CG 3.49Å; E154-M158 PolarHBondContact O-N 3.42Å; S155-M158 PolarHBondContact O-N 2.95Å; K156-M158 VanDerWaalsContact C-N 3.34Å; M158-Q161 PolarHBondContact O-N 3.39Å; M158-K162 PolarHBondContact O-N 3.43Å
159	E	96.8	Very high	95	Very high	116 Å²	116	72.8 Å²	72.8	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-45.7	174.6	-174.2	-179.6	-180	0	0	110.9	S155 K156 Q161 K162 Q163	S155-E159 PolarHBondContact O-N 3.46Å; S155-E159 VanDerWaalsContact O-N 3.09Å; K156-E159 PolarHBondContact O-N 2.88Å; E159-Q161 VanDerWaalsContact C-N 3.31Å; E159-Q161 PolarHBondContact O-N 3.27Å; E159-K162 PolarHBondContact O-N 3.37Å; E159-Q163 PolarHBondContact O-N 2.89Å
160	R	97	Very high	95.3	Very high	88 Å²	88	73.2 Å²	73.2	33%	0.332	36%	0.357	S	S	.	.	H	α-helix	trans	-57.5	-45.5	175.8	-176.9	63.6	171.7	164.9	1.1	111.2	Y148 W152 K156 C157 K162 Q163 L164	Y148-R160 HydrophobicContact CD1-CG 4.37Å; Y148-R160 HydrophobicContact CE1-CG 4.46Å; W152-R160 HydrophobicContact CH2-CG 4.46Å; W152-R160 HydrophobicContact CZ3-CB 3.95Å; W152-R160 HydrophobicContact CZ3-CG 3.86Å; K156-R160 WeakPolarHBondContact O-CB 3.39Å; K156-R160 PolarHBondContact O-N 3.47Å; C157-R160 PolarHBondContact O-N 3.23Å; R160-K162 VanDerWaalsContact C-N 3.27Å; R160-K162 PolarHBondContact O-N 3.03Å; R160-Q163 WeakPolarHBondContact O-CB 3.3Å; R160-Q163 PolarHBondContact O-N 3.11Å; R160-L164 HydrophobicContact CG-CD1 4.05Å; R160-L164 HydrophobicContact CG-CG 4.09Å; R160-L164 WeakPolarHBondContact O-CG 3.49Å; R160-L164 PolarHBondContact O-N 3.5Å
161	Q	96.9	Very high	95.5	Very high	35 Å²	35	71.9 Å²	71.9	16%	0.164	35%	0.354	C	S	.	.	H	α-helix	trans	-57	-41.3	179.5	-171.7	64.4	17.6	0	0	112.1	Y148 C157 M158 E159 Q163 L164 I165 D259	Y148-Q161 PolarHBondContact OH-OE1 3.01Å; C157-Q161 PolarHBondContact O-N 3.3Å; M158-Q161 PolarHBondContact O-N 3.39Å; E159-Q161 VanDerWaalsContact C-N 3.31Å; E159-Q161 PolarHBondContact O-N 3.27Å; Q161-Q163 VanDerWaalsContact C-N 3.33Å; Q161-Q163 PolarHBondContact O-N 2.87Å; Q161-L164 PolarHBondContact O-N 3.1Å; Q161-I165 HydrophobicContact CG-CD1 4.12Å; Q161-I165 VanDerWaalsContact O-CG1 3.3Å; Q161-I165 WeakPolarHBondContact O-CG1 3.33Å; Q161-I165 PolarHBondContact O-N 3.21Å; Q161-D259 PolarHBondContact NE2-OD1 2.81Å
162	K	97.5	Very high	95.8	Very high	156 Å²	156	69.7 Å²	69.7	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-62.7	-41	176.4	-67.5	174.1	-176.1	174.4	0	111.8	M158 E159 R160 E166	M158-K162 PolarHBondContact O-N 3.43Å; E159-K162 PolarHBondContact O-N 3.37Å; R160-K162 VanDerWaalsContact C-N 3.27Å; R160-K162 PolarHBondContact O-N 3.03Å; K162-E166 PolarHBondContact O-N 2.89Å
163	Q	97.4	Very high	96.1	Very high	85 Å²	85	70.5 Å²	70.5	40%	0.397	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-45.5	176.1	-63.4	171.8	-1.7	0	0	111.2	E159 R160 Q161 I165 E166 S167	E159-Q163 PolarHBondContact O-N 2.89Å; R160-Q163 WeakPolarHBondContact O-CB 3.3Å; R160-Q163 PolarHBondContact O-N 3.11Å; Q161-Q163 VanDerWaalsContact C-N 3.33Å; Q161-Q163 PolarHBondContact O-N 2.87Å; Q163-I165 VanDerWaalsContact C-N 3.34Å; Q163-I165 PolarHBondContact O-N 3.11Å; Q163-E166 PolarHBondContact O-N 3.26Å; Q163-S167 WeakPolarHBondContact O-CB 3.38Å; Q163-S167 PolarHBondContact O-N 3.42Å; Q163-S167 PolarHBondContact O-OG 3.02Å
164	L	97.5	Very high	96.2	Very high	4 Å²	4	72.4 Å²	72.4	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-42.8	179	-68.8	-178.6	0	0	0	112	Y148 R160 Q161 Y168 W262	Y148-L164 HydrophobicContact CE1-CD1 4.49Å; R160-L164 HydrophobicContact CG-CD1 4.05Å; R160-L164 HydrophobicContact CG-CG 4.09Å; R160-L164 WeakPolarHBondContact O-CG 3.49Å; R160-L164 PolarHBondContact O-N 3.5Å; Q161-L164 PolarHBondContact O-N 3.1Å; L164-Y168 VanDerWaalsContact O-CB 3.32Å; L164-Y168 WeakPolarHBondContact O-CB 3.48Å; L164-Y168 PolarHBondContact O-N 3.03Å; L164-W262 HydrophobicContact CB-CG 4.28Å; L164-W262 HydrophobicContact CD1-CB 4.48Å; L164-W262 HydrophobicContact CD1-CG 4.26Å; L164-W262 HydrophobicContact CD2-CD2 3.55Å; L164-W262 HydrophobicContact CD2-CE3 4.03Å; L164-W262 HydrophobicContact CD2-CG 3.8Å; L164-W262 HydrophobicContact CD2-CH2 4.46Å; L164-W262 HydrophobicContact CD2-CZ2 4.04Å; L164-W262 HydrophobicContact CD2-CZ3 4.46Å; L164-W262 HydrophobicContact CG-CD2 4.5Å; L164-W262 HydrophobicContact CG-CG 4.32Å; L164-W262 PolarHBondContact O-NE1 3.29Å
165	I	98	Very high	96.3	Very high	78 Å²	78	68 Å²	68	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-49	175.8	-68.9	164.3	0	0	0	111	Q161 Q163 Y168 R169 V258	Q161-I165 HydrophobicContact CG-CD1 4.12Å; Q161-I165 VanDerWaalsContact O-CG1 3.3Å; Q161-I165 WeakPolarHBondContact O-CG1 3.33Å; Q161-I165 PolarHBondContact O-N 3.21Å; Q163-I165 VanDerWaalsContact C-N 3.34Å; Q163-I165 PolarHBondContact O-N 3.11Å; I165-Y168 PolarHBondContact O-N 3.27Å; I165-R169 WeakPolarHBondContact O-CB 3.44Å; I165-R169 PolarHBondContact O-N 3.39Å; I165-V258 HydrophobicContact CG1-CG1 3.89Å; I165-V258 HydrophobicContact CG1-CG2 4.41Å
166	E	97.9	Very high	96.3	Very high	82 Å²	82	69.5 Å²	69.5	38%	0.383	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-42.9	-177.7	-178.4	55.8	-162	0	0	111.8	K162 Q163 Y168 R169 I170	K162-E166 PolarHBondContact O-N 2.89Å; Q163-E166 PolarHBondContact O-N 3.26Å; E166-Y168 VanDerWaalsContact C-N 3.32Å; E166-Y168 PolarHBondContact O-N 3.23Å; E166-R169 WeakPolarHBondContact O-CB 3.1Å; E166-R169 PolarHBondContact O-N 3.15Å; E166-R169 IonicContact OE1-CZ 3.84Å; E166-R169 IonicContact OE1-NE 2.89Å; E166-R169 PolarHBondContact OE1-NE 3.43Å; E166-R169 IonicContact OE1-NH2 3.28Å; E166-R169 PolarHBondContact OE1-NH2 3.07Å; E166-R169 IonicContact OE2-CZ 2.94Å; E166-R169 IonicContact OE2-NE 2.8Å; E166-R169 PolarHBondContact OE2-NE 2.9Å; E166-R169 IonicContact OE2-NH2 3.16Å; E166-I170 HydrophobicContact CG-CD1 4.14Å; E166-I170 WeakPolarHBondContact O-CG1 3.5Å; E166-I170 PolarHBondContact O-N 3.46Å
167	S	97.2	Very high	96.3	Very high	53 Å²	53	68.8 Å²	68.8	37%	0.371	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-42.5	175.5	-68.3	0	0	0	0	112	Q163 I170 L171	Q163-S167 WeakPolarHBondContact O-CB 3.38Å; Q163-S167 PolarHBondContact O-N 3.42Å; Q163-S167 PolarHBondContact O-OG 3.02Å; S167-I170 PolarHBondContact O-N 3.19Å; S167-L171 WeakPolarHBondContact O-CG 3.47Å; S167-L171 PolarHBondContact O-N 3.38Å; S167-L171 VanDerWaalsContact O-N 3.15Å
168	Y	97.8	Very high	96.2	Very high	7 Å²	7	69.8 Å²	69.8	3%	0.027	34%	0.337	C	S	.	.	H	α-helix	trans	-60.5	-47.6	174.9	-176.6	-102.9	0	0	0	111.9	L164 I165 E166 I170 L171 K172 T227 E257 V258 F261	L164-Y168 VanDerWaalsContact O-CB 3.32Å; L164-Y168 WeakPolarHBondContact O-CB 3.48Å; L164-Y168 PolarHBondContact O-N 3.03Å; I165-Y168 PolarHBondContact O-N 3.27Å; E166-Y168 VanDerWaalsContact C-N 3.32Å; E166-Y168 PolarHBondContact O-N 3.23Å; Y168-I170 VanDerWaalsContact C-N 3.27Å; Y168-I170 PolarHBondContact O-N 3.2Å; Y168-L171 PolarHBondContact O-N 3.49Å; Y168-K172 HydrophobicContact CE1-CB 4.23Å; Y168-K172 HydrophobicContact CE1-CD 3.75Å; Y168-K172 WeakPolarHBondContact O-CB 3.48Å; Y168-K172 PolarHBondContact O-N 3.44Å; Y168-T227 HydrophobicContact CD2-CG2 3.84Å; Y168-T227 HydrophobicContact CE2-CG2 3.38Å; Y168-T227 PolarHBondContact OH-OG1 2.99Å; Y168-E257 HydrophobicContact CE1-CB 4.33Å; Y168-E257 HydrophobicContact CE1-CG 3.82Å; Y168-E257 WeakPolarHBondContact CE1-OE1 3.35Å; Y168-E257 VanDerWaalsContact CZ-OE1 3.28Å; Y168-E257 VanDerWaalsContact OH-CG 3.26Å; Y168-E257 WeakPolarHBondContact OH-CG 3.45Å; Y168-E257 PolarHBondContact OH-OE1 2.96Å; Y168-V258 HydrophobicContact CD1-CG2 3.71Å; Y168-V258 HydrophobicContact CE1-CG2 4.44Å; Y168-V258 HydrophobicContact CG-CG2 4.11Å; Y168-F261 HydrophobicContact CD2-CB 3.66Å; Y168-F261 AromaticContact CD2-CD1 3.46Å; Y168-F261 HydrophobicContact CD2-CD1 3.46Å; Y168-F261 VanDerWaalsContact CD2-CD1 3.46Å; Y168-F261 AromaticContact CD2-CD2 3.86Å; Y168-F261 HydrophobicContact CD2-CD2 3.86Å; Y168-F261 HydrophobicContact CD2-CE1 4.04Å; Y168-F261 HydrophobicContact CD2-CE2 4.35Å; Y168-F261 AromaticContact CD2-CG 3.37Å; Y168-F261 HydrophobicContact CD2-CG 3.37Å; Y168-F261 HydrophobicContact CD2-CZ 4.45Å; Y168-F261 HydrophobicContact CE2-CB 3.43Å; Y168-F261 VanDerWaalsContact CE2-CB 3.43Å; Y168-F261 AromaticContact CE2-CD1 3.96Å; Y168-F261 HydrophobicContact CE2-CD1 3.96Å; Y168-F261 AromaticContact CE2-CD2 3.5Å; Y168-F261 HydrophobicContact CE2-CD2 3.5Å; Y168-F261 HydrophobicContact CE2-CE2 4.21Å; Y168-F261 AromaticContact CE2-CG 3.34Å; Y168-F261 HydrophobicContact CE2-CG 3.34Å
169	R	97.5	Very high	96.2	Very high	130 Å²	130	68.4 Å²	68.4	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-58.1	-41	179.9	-167.8	-170.2	71.7	76.4	2.4	111.8	I165 E166 T173	I165-R169 WeakPolarHBondContact O-CB 3.44Å; I165-R169 PolarHBondContact O-N 3.39Å; E166-R169 WeakPolarHBondContact O-CB 3.1Å; E166-R169 PolarHBondContact O-N 3.15Å; E166-R169 IonicContact OE1-CZ 3.84Å; E166-R169 IonicContact OE1-NE 2.89Å; E166-R169 PolarHBondContact OE1-NE 3.43Å; E166-R169 IonicContact OE1-NH2 3.28Å; E166-R169 PolarHBondContact OE1-NH2 3.07Å; E166-R169 IonicContact OE2-CZ 2.94Å; E166-R169 IonicContact OE2-NE 2.8Å; E166-R169 PolarHBondContact OE2-NE 2.9Å; E166-R169 IonicContact OE2-NH2 3.16Å; R169-T173 WeakPolarHBondContact O-CB 3.31Å; R169-T173 PolarHBondContact O-N 2.95Å; R169-T173 PolarHBondContact O-OG1 3.41Å
170	I	97.2	Very high	95.9	Very high	78 Å²	78	66.8 Å²	66.8	40%	0.4	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-52.6	176.7	-68.6	165.5	0	0	0	110.1	E166 S167 Y168 K172 T173 Q174	E166-I170 HydrophobicContact CG-CD1 4.14Å; E166-I170 WeakPolarHBondContact O-CG1 3.5Å; E166-I170 PolarHBondContact O-N 3.46Å; S167-I170 PolarHBondContact O-N 3.19Å; Y168-I170 VanDerWaalsContact C-N 3.27Å; Y168-I170 PolarHBondContact O-N 3.2Å; I170-K172 PolarHBondContact O-N 3.04Å; I170-T173 WeakPolarHBondContact O-CB 3.45Å; I170-T173 PolarHBondContact O-N 3.35Å; I170-Q174 WeakPolarHBondContact O-CG 3.24Å; I170-Q174 PolarHBondContact O-N 3.46Å
171	L	95.9	Very high	95.8	Very high	22 Å²	22	67 Å²	67	12%	0.115	35%	0.348	C	S	.	.	H	α-helix	trans	-59.8	-45.3	-179.8	-68.1	164.8	0	0	0	112	S167 Y168 T173 Q174 T227 M230 Y231 F261	S167-L171 WeakPolarHBondContact O-CG 3.47Å; S167-L171 PolarHBondContact O-N 3.38Å; S167-L171 VanDerWaalsContact O-N 3.15Å; Y168-L171 PolarHBondContact O-N 3.49Å; L171-T173 VanDerWaalsContact C-N 3.3Å; L171-T173 PolarHBondContact O-N 3.33Å; L171-Q174 WeakPolarHBondContact O-CB 3.45Å; L171-Q174 PolarHBondContact O-N 3.31Å; L171-Q174 VanDerWaalsContact O-N 3.16Å; L171-T227 HydrophobicContact CB-CG2 3.52Å; L171-M230 HydrophobicContact CD2-CB 4.36Å; L171-Y231 HydrophobicContact CD1-CD2 3.89Å; L171-F261 HydrophobicContact CD1-CE1 4.25Å; L171-F261 HydrophobicContact CD1-CZ 3.87Å
172	K	96.5	Very high	95.5	Very high	34 Å²	34	70 Å²	70	15%	0.148	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-39.8	178	-175.6	170.9	-175.9	171.5	0	112	Y168 I170 Q174 W175 K176 D223 T227 E257	Y168-K172 HydrophobicContact CE1-CB 4.23Å; Y168-K172 HydrophobicContact CE1-CD 3.75Å; Y168-K172 WeakPolarHBondContact O-CB 3.48Å; Y168-K172 PolarHBondContact O-N 3.44Å; I170-K172 PolarHBondContact O-N 3.04Å; K172-Q174 VanDerWaalsContact C-N 3.27Å; K172-Q174 PolarHBondContact O-N 2.96Å; K172-W175 HydrophobicContact CG-CZ2 4.46Å; K172-W175 PolarHBondContact O-NE1 3.41Å; K172-K176 VanDerWaalsContact CE-NZ 3.3Å; K172-K176 HydrophobicContact CG-CD 4.3Å; K172-K176 HydrophobicContact CG-CG 4.43Å; K172-K176 WeakPolarHBondContact O-CB 3.47Å; K172-K176 PolarHBondContact O-N 2.92Å; K172-K176 VanDerWaalsContact O-N 3.14Å; K172-D223 WeakPolarHBondContact CE-OD2 3.35Å; K172-D223 IonicContact NZ-OD2 3.76Å; K172-D223 PolarHBondContact NZ-OD2 3.49Å; K172-T227 HydrophobicContact CB-CG2 4.18Å; K172-E257 VanDerWaalsContact CD-OE1 3.31Å; K172-E257 WeakPolarHBondContact CD-OE1 3.42Å; K172-E257 VanDerWaalsContact CE-OE1 3.22Å; K172-E257 WeakPolarHBondContact CE-OE1 3.33Å; K172-E257 IonicContact NZ-OE1 3.97Å; K172-E257 PolarHBondContact NZ-OE1 2.83Å; K172-E257 IonicContact NZ-OE2 3.24Å; K172-E257 PolarHBondContact NZ-OE2 3.44Å
173	T	97	Very high	95.2	Very high	69 Å²	69	64.3 Å²	64.3	42%	0.423	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-36.1	177.8	-58.2	0	0	0	0	111.5	R169 I170 L171 W175 K176 S177	R169-T173 WeakPolarHBondContact O-CB 3.31Å; R169-T173 PolarHBondContact O-N 2.95Å; R169-T173 PolarHBondContact O-OG1 3.41Å; I170-T173 WeakPolarHBondContact O-CB 3.45Å; I170-T173 PolarHBondContact O-N 3.35Å; L171-T173 VanDerWaalsContact C-N 3.3Å; L171-T173 PolarHBondContact O-N 3.33Å; T173-W175 PolarHBondContact O-N 3.24Å; T173-K176 PolarHBondContact O-N 3.12Å; T173-S177 WeakPolarHBondContact O-CB 3.46Å; T173-S177 PolarHBondContact O-N 2.95Å; T173-S177 PolarHBondContact O-OG 3.09Å
174	Q	93.7	Very high	94.8	Very high	79 Å²	79	63.3 Å²	63.3	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-57.9	-52.7	-178.3	-66.5	170.3	0.1	0	0	111.5	I170 L171 K172 S177 M230	I170-Q174 WeakPolarHBondContact O-CG 3.24Å; I170-Q174 PolarHBondContact O-N 3.46Å; L171-Q174 WeakPolarHBondContact O-CB 3.45Å; L171-Q174 PolarHBondContact O-N 3.31Å; L171-Q174 VanDerWaalsContact O-N 3.16Å; K172-Q174 VanDerWaalsContact C-N 3.27Å; K172-Q174 PolarHBondContact O-N 2.96Å; Q174-S177 PolarHBondContact O-OG 3.09Å; Q174-M230 HydrophobicContact CB-CE 3.36Å; Q174-M230 HydrophobicContact CG-CE 4.5Å
175	W	92.3	Very high	94.5	Very high	29 Å²	29	70.8 Å²	70.8	11%	0.11	37%	0.369	C	S	.	.	H	α-helix	trans	-75.5	-35.7	-179	72.3	-97.3	0	0	0	112.5	K172 T173 S177 V178 H222 D223 M226 T227 M230	K172-W175 HydrophobicContact CG-CZ2 4.46Å; K172-W175 PolarHBondContact O-NE1 3.41Å; T173-W175 PolarHBondContact O-N 3.24Å; W175-S177 PolarHBondContact O-N 3.47Å; W175-V178 WeakPolarHBondContact O-CB 3.3Å; W175-V178 WeakPolarHBondContact O-CG2 3.44Å; W175-V178 PolarHBondContact O-N 3.14Å; W175-H222 AromaticContact CH2-CE1 3.86Å; W175-D223 WeakPolarHBondContact CH2-OD1 3.24Å; W175-D223 HydrophobicContact CZ2-CB 4.21Å; W175-M226 HydrophobicContact CD2-CB 3.83Å; W175-M226 HydrophobicContact CD2-CE 4.23Å; W175-M226 HydrophobicContact CE3-CB 4.2Å; W175-M226 HydrophobicContact CE3-CE 3.81Å; W175-M226 HydrophobicContact CG-CB 4.33Å; W175-M226 HydrophobicContact CH2-CB 4.08Å; W175-M226 HydrophobicContact CH2-CG 4.31Å; W175-M226 HydrophobicContact CZ2-CB 3.71Å; W175-M226 HydrophobicContact CZ2-CG 4.42Å; W175-M226 HydrophobicContact CZ3-CB 4.32Å; W175-M226 HydrophobicContact CZ3-CE 4.26Å; W175-M226 HydrophobicContact CZ3-CG 4.37Å; W175-T227 PolarHBondContact NE1-OG1 3.17Å; W175-M230 HydrophobicContact CB-CE 4.14Å; W175-M230 HydrophobicContact CB-CG 3.73Å; W175-M230 HydrophobicContact CB-SD 3.81Å; W175-M230 HydrophobicContact CG-CG 4.2Å
176	K	94.6	Very high	94.1	Very high	113 Å²	113	71.1 Å²	71.1	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-66.4	-23.6	176.4	-74.7	-157.3	173.3	-170.9	0	113.5	K172 T173 D223	K172-K176 VanDerWaalsContact CE-NZ 3.3Å; K172-K176 HydrophobicContact CG-CD 4.3Å; K172-K176 HydrophobicContact CG-CG 4.43Å; K172-K176 WeakPolarHBondContact O-CB 3.47Å; K172-K176 PolarHBondContact O-N 2.92Å; K172-K176 VanDerWaalsContact O-N 3.14Å; T173-K176 PolarHBondContact O-N 3.12Å; K176-D223 WeakPolarHBondContact CE-OD2 3.31Å; K176-D223 IonicContact NZ-OD1 2.79Å; K176-D223 IonicContact NZ-OD2 3.21Å; K176-D223 PolarHBondContact NZ-OD2 2.95Å
177	S	95.3	Very high	93.5	Very high	76 Å²	76	70.5 Å²	70.5	53%	0.531	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.6	178.1	71.8	0	0	0	0	114.2	T173 Q174 W175 T179	T173-S177 WeakPolarHBondContact O-CB 3.46Å; T173-S177 PolarHBondContact O-N 2.95Å; T173-S177 PolarHBondContact O-OG 3.09Å; Q174-S177 PolarHBondContact O-OG 3.09Å; W175-S177 PolarHBondContact O-N 3.47Å; S177-T179 PolarHBondContact O-N 3.1Å
178	V	92	Very high	92.8	Very high	31 Å²	31	70.3 Å²	70.3	19%	0.188	37%	0.365	C	S	.	.			trans	-66	119	179	179.5	0	0	0	0	109.3	W175 Q182 E183 W186	W175-V178 WeakPolarHBondContact O-CB 3.3Å; W175-V178 WeakPolarHBondContact O-CG2 3.44Å; W175-V178 PolarHBondContact O-N 3.14Å; V178-Q182 HydrophobicContact CG1-CB 3.93Å; V178-E183 HydrophobicContact CG1-CB 3.91Å; V178-W186 HydrophobicContact CG2-CE3 4.47Å; V178-W186 HydrophobicContact CG2-CZ3 4.06Å
179	T	93.6	Very high	92.2	Very high	72 Å²	72	70.2 Å²	70.2	44%	0.442	37%	0.365	S	S	.	.			trans	-73.8	156.7	176	61.2	0	0	0	0	111.3	S177 D181 Q182 E183	S177-T179 PolarHBondContact O-N 3.1Å; T179-D181 PolarHBondContact O-N 3.13Å; T179-D181 VanDerWaalsContact O-N 3.15Å; T179-Q182 PolarHBondContact O-N 2.62Å; T179-Q182 VanDerWaalsContact O-N 3.11Å; T179-Q182 VanDerWaalsContact OG1-CG 3.31Å; T179-Q182 WeakPolarHBondContact OG1-CG 3.44Å; T179-Q182 PolarHBondContact OG1-N 2.8Å; T179-Q182 PolarHBondContact OG1-OE1 3.35Å; T179-E183 WeakPolarHBondContact O-CB 3.41Å; T179-E183 PolarHBondContact O-N 3.46Å
180	A	91.9	Very high	91.8	Very high	81 Å²	81	67.9 Å²	67.9	67%	0.669	36%	0.356	S	S	*	.	H	α-helix	trans	-55	-34.5	175.3	0	0	0	0	0	112.9	S184	A180-S184 WeakPolarHBondContact O-CB 3.48Å; A180-S184 PolarHBondContact O-N 3.35Å
181	D	94.2	Very high	91.3	Very high	93 Å²	93	68.2 Å²	68.2	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-68.8	-45.3	177.8	-176.6	53.2	0	0	0	112	T179 S184 R185	T179-D181 PolarHBondContact O-N 3.13Å; T179-D181 VanDerWaalsContact O-N 3.15Å; D181-S184 PolarHBondContact O-N 2.98Å; D181-S184 PolarHBondContact O-OG 3.5Å; D181-R185 VanDerWaalsContact CG-NH2 3.27Å; D181-R185 VanDerWaalsContact O-CZ 3.32Å; D181-R185 PolarHBondContact O-NH1 3.05Å; D181-R185 IonicContact OD1-CZ 3.56Å; D181-R185 IonicContact OD1-NH1 2.68Å; D181-R185 PolarHBondContact OD1-NH1 3.48Å; D181-R185 IonicContact OD1-NH2 3.66Å; D181-R185 IonicContact OD2-CZ 3.3Å; D181-R185 VanDerWaalsContact OD2-CZ 3.3Å; D181-R185 IonicContact OD2-NH1 3.15Å; D181-R185 PolarHBondContact OD2-NH1 3Å; D181-R185 VanDerWaalsContact OD2-NH1 3.15Å; D181-R185 IonicContact OD2-NH2 2.62Å; D181-R185 PolarHBondContact OD2-NH2 3.23Å
182	Q	91.5	Very high	90.7	Very high	97 Å²	97	67.4 Å²	67.4	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-45.9	171.8	-72.8	168	-63	0	0	111.6	V178 T179 S184 R185 W186	V178-Q182 HydrophobicContact CG1-CB 3.93Å; T179-Q182 PolarHBondContact O-N 2.62Å; T179-Q182 VanDerWaalsContact O-N 3.11Å; T179-Q182 VanDerWaalsContact OG1-CG 3.31Å; T179-Q182 WeakPolarHBondContact OG1-CG 3.44Å; T179-Q182 PolarHBondContact OG1-N 2.8Å; T179-Q182 PolarHBondContact OG1-OE1 3.35Å; Q182-S184 VanDerWaalsContact C-N 3.26Å; Q182-S184 PolarHBondContact O-N 3.22Å; Q182-R185 PolarHBondContact O-N 2.87Å; Q182-W186 PolarHBondContact O-N 3.38Å; Q182-W186 VanDerWaalsContact O-N 3.14Å
183	E	89.8	Confident	90.4	Very high	37 Å²	37	68.6 Å²	68.6	17%	0.173	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-39.7	179	-179.2	165.2	-126.8	0	0	111	V178 T179 R185 W186 H189 R190 R193	V178-E183 HydrophobicContact CG1-CB 3.91Å; T179-E183 WeakPolarHBondContact O-CB 3.41Å; T179-E183 PolarHBondContact O-N 3.46Å; E183-R185 PolarHBondContact O-N 3.11Å; E183-R185 VanDerWaalsContact O-N 3.14Å; E183-W186 PolarHBondContact O-N 3.4Å; E183-H189 IonicContact OE1-CE1 3.53Å; E183-H189 PolarHBondContact OE1-CE1 3.34Å; E183-H189 VanDerWaalsContact OE1-CE1 3.28Å; E183-H189 IonicContact OE1-ND1 3.71Å; E183-H189 PolarHBondContact OE1-ND1 2.89Å; E183-H189 VanDerWaalsContact OE1-ND1 3.16Å; E183-R190 HydrophobicContact CG-CG 3.47Å; E183-R190 VanDerWaalsContact CG-CG 3.47Å; E183-R190 WeakPolarHBondContact O-CD 3.43Å; E183-R190 WeakPolarHBondContact O-CG 3.41Å; E183-R190 PolarHBondContact O-NH1 3.4Å; E183-R193 IonicContact OE1-CZ 3.67Å; E183-R193 VanDerWaalsContact OE1-CZ 3.24Å; E183-R193 IonicContact OE1-NE 3.81Å; E183-R193 IonicContact OE1-NH1 2.66Å; E183-R193 PolarHBondContact OE1-NH1 3.22Å; E183-R193 IonicContact OE1-NH2 3.88Å; E183-R193 IonicContact OE2-CZ 2.67Å; E183-R193 IonicContact OE2-NH1 2.67Å; E183-R193 PolarHBondContact OE2-NH1 2.78Å
184	S	90.1	Very high	90	Very high	65 Å²	65	68.3 Å²	68.3	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-24.3	176.9	81.2	0	0	0	0	113.8	A180 D181 Q182 R190	A180-S184 WeakPolarHBondContact O-CB 3.48Å; A180-S184 PolarHBondContact O-N 3.35Å; D181-S184 PolarHBondContact O-N 2.98Å; D181-S184 PolarHBondContact O-OG 3.5Å; Q182-S184 VanDerWaalsContact C-N 3.26Å; Q182-S184 PolarHBondContact O-N 3.22Å; S184-R190 PolarHBondContact O-NH1 3.16Å
185	R	91.2	Very high	89.7	Confident	160 Å²	160	66 Å²	66	60%	0.604	34%	0.339	S	S	*	.	H	α-helix	trans	-100.2	-5.8	177.8	-67.7	-174.1	-69.4	-86.7	1.6	114	D181 Q182 E183	D181-R185 VanDerWaalsContact CG-NH2 3.27Å; D181-R185 VanDerWaalsContact O-CZ 3.32Å; D181-R185 PolarHBondContact O-NH1 3.05Å; D181-R185 IonicContact OD1-CZ 3.56Å; D181-R185 IonicContact OD1-NH1 2.68Å; D181-R185 PolarHBondContact OD1-NH1 3.48Å; D181-R185 IonicContact OD1-NH2 3.66Å; D181-R185 IonicContact OD2-CZ 3.3Å; D181-R185 VanDerWaalsContact OD2-CZ 3.3Å; D181-R185 IonicContact OD2-NH1 3.15Å; D181-R185 PolarHBondContact OD2-NH1 3Å; D181-R185 VanDerWaalsContact OD2-NH1 3.15Å; D181-R185 IonicContact OD2-NH2 2.62Å; D181-R185 PolarHBondContact OD2-NH2 3.23Å; Q182-R185 PolarHBondContact O-N 2.87Å; E183-R185 PolarHBondContact O-N 3.11Å; E183-R185 VanDerWaalsContact O-N 3.14Å
186	W	88.4	Confident	89.7	Confident	85 Å²	85	64.6 Å²	64.6	32%	0.322	33%	0.334	S	S	.	.			trans	-105.1	80.2	178	-164.2	-3.3	0	0	0	111	V178 Q182 E183 D188 H189 R190 M230 F233	V178-W186 HydrophobicContact CG2-CE3 4.47Å; V178-W186 HydrophobicContact CG2-CZ3 4.06Å; Q182-W186 PolarHBondContact O-N 3.38Å; Q182-W186 VanDerWaalsContact O-N 3.14Å; E183-W186 PolarHBondContact O-N 3.4Å; W186-D188 VanDerWaalsContact C-N 3.28Å; W186-D188 PolarHBondContact O-N 2.83Å; W186-H189 HydrophobicContact CB-CB 4.01Å; W186-H189 HydrophobicContact CD2-CB 3.28Å; W186-H189 HydrophobicContact CE3-CB 3.7Å; W186-H189 AromaticContact CE3-CD2 3.84Å; W186-H189 AromaticContact CE3-CG 3.92Å; W186-H189 HydrophobicContact CG-CB 3.4Å; W186-H189 HydrophobicContact CZ2-CB 4.25Å; W186-H189 HydrophobicContact CZ3-CB 4.32Å; W186-H189 AromaticContact CZ3-CD2 3.74Å; W186-H189 PolarHBondContact O-N 2.79Å; W186-R190 PolarHBondContact O-N 2.8Å; W186-R190 PolarHBondContact O-NH1 3.25Å; W186-M230 HydrophobicContact CH2-CE 4.14Å; W186-M230 HydrophobicContact CH2-SD 4.14Å; W186-F233 AromaticContact CH2-CE1 3.7Å; W186-F233 HydrophobicContact CH2-CE1 3.7Å; W186-F233 HydrophobicContact CH2-CZ 4.04Å; W186-F233 HydrophobicContact CZ2-CD1 4.41Å; W186-F233 AromaticContact CZ2-CE1 3.57Å; W186-F233 HydrophobicContact CZ2-CE1 3.57Å; W186-F233 HydrophobicContact CZ2-CZ 4.33Å
187	S	85.7	Confident	89.5	Confident	69 Å²	69	62.9 Å²	62.9	48%	0.483	33%	0.327	S	S	.	.	H	α-helix	trans	-57.7	-41.4	-176.5	55.2	0	0	0	0	113.1	R190 K191	S187-R190 PolarHBondContact O-N 3.42Å; S187-K191 WeakPolarHBondContact O-CB 3.41Å; S187-K191 PolarHBondContact O-N 3.16Å
188	D	82.5	Confident	89.2	Confident	50 Å²	50	64.9 Å²	64.9	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-49.8	-178	-78.3	-0.1	0	0	0	110.1	W186 R190 K191 F192 K237	W186-D188 VanDerWaalsContact C-N 3.28Å; W186-D188 PolarHBondContact O-N 2.83Å; D188-R190 PolarHBondContact O-N 2.83Å; D188-K191 WeakPolarHBondContact O-CB 3.37Å; D188-K191 PolarHBondContact O-N 3.17Å; D188-K191 VanDerWaalsContact O-N 3.13Å; D188-F192 VanDerWaalsContact C-CD2 3.41Å; D188-F192 HydrophobicContact CB-CD2 4.36Å; D188-F192 HydrophobicContact CB-CE2 3.75Å; D188-F192 WeakPolarHBondContact O-CD2 3.37Å; D188-F192 WeakPolarHBondContact O-CE2 3.36Å; D188-F192 WeakPolarHBondContact O-CG 3.47Å; D188-F192 PolarHBondContact O-N 3.11Å; D188-K237 IonicContact OD2-NZ 3.47Å; D188-K237 PolarHBondContact OD2-NZ 3.01Å
189	H	86.2	Confident	89.1	Confident	5 Å²	5	63.6 Å²	63.6	2%	0.023	32%	0.319	C	S	.	.	H	α-helix	trans	-54.2	-48.9	174.6	178.1	-78.9	0	0	0	113.2	E183 W186 K191 F192 R193 M229	E183-H189 IonicContact OE1-CE1 3.53Å; E183-H189 PolarHBondContact OE1-CE1 3.34Å; E183-H189 VanDerWaalsContact OE1-CE1 3.28Å; E183-H189 IonicContact OE1-ND1 3.71Å; E183-H189 PolarHBondContact OE1-ND1 2.89Å; E183-H189 VanDerWaalsContact OE1-ND1 3.16Å; W186-H189 HydrophobicContact CB-CB 4.01Å; W186-H189 HydrophobicContact CD2-CB 3.28Å; W186-H189 HydrophobicContact CE3-CB 3.7Å; W186-H189 AromaticContact CE3-CD2 3.84Å; W186-H189 AromaticContact CE3-CG 3.92Å; W186-H189 HydrophobicContact CG-CB 3.4Å; W186-H189 HydrophobicContact CZ2-CB 4.25Å; W186-H189 HydrophobicContact CZ3-CB 4.32Å; W186-H189 AromaticContact CZ3-CD2 3.74Å; W186-H189 PolarHBondContact O-N 2.79Å; H189-K191 VanDerWaalsContact C-N 3.31Å; H189-K191 PolarHBondContact O-N 2.89Å; H189-F192 PolarHBondContact O-N 3.43Å; H189-R193 WeakPolarHBondContact O-CB 3.49Å; H189-R193 PolarHBondContact O-N 3.38Å; H189-M229 WeakPolarHBondContact CD2-CE 3.43Å
190	R	88.8	Confident	89	Confident	80 Å²	80	60.6 Å²	60.6	30%	0.302	30%	0.3	S	S	.	.	H	α-helix	trans	-59	-45.7	177.9	-66.8	-165.1	-51	-85.9	12.4	111.4	E183 S184 W186 S187 D188 F192 R193 D194	E183-R190 HydrophobicContact CG-CG 3.47Å; E183-R190 VanDerWaalsContact CG-CG 3.47Å; E183-R190 WeakPolarHBondContact O-CD 3.43Å; E183-R190 WeakPolarHBondContact O-CG 3.41Å; E183-R190 PolarHBondContact O-NH1 3.4Å; S184-R190 PolarHBondContact O-NH1 3.16Å; W186-R190 PolarHBondContact O-N 2.8Å; W186-R190 PolarHBondContact O-NH1 3.25Å; S187-R190 PolarHBondContact O-N 3.42Å; D188-R190 PolarHBondContact O-N 2.83Å; R190-F192 VanDerWaalsContact C-N 3.34Å; R190-F192 PolarHBondContact O-N 3.01Å; R190-R193 PolarHBondContact O-N 3.46Å; R190-D194 WeakPolarHBondContact O-CB 3.32Å; R190-D194 PolarHBondContact O-N 3.26Å
191	K	86	Confident	88.9	Confident	85 Å²	85	61.8 Å²	61.8	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-57.2	-47.8	178.6	-174.4	-170.8	-169.7	-176.6	0	111.4	L56 S187 D188 H189 D194 I195	L56-K191 HydrophobicContact CD1-CD 4.21Å; L56-K191 VanDerWaalsContact CD1-CE 3.4Å; S187-K191 WeakPolarHBondContact O-CB 3.41Å; S187-K191 PolarHBondContact O-N 3.16Å; D188-K191 WeakPolarHBondContact O-CB 3.37Å; D188-K191 PolarHBondContact O-N 3.17Å; D188-K191 VanDerWaalsContact O-N 3.13Å; H189-K191 VanDerWaalsContact C-N 3.31Å; H189-K191 PolarHBondContact O-N 2.89Å; K191-D194 PolarHBondContact O-N 3.4Å; K191-I195 HydrophobicContact CG-CD1 4.25Å; K191-I195 VanDerWaalsContact O-CG1 3.26Å; K191-I195 WeakPolarHBondContact O-CG1 3.04Å; K191-I195 PolarHBondContact O-N 3Å; K191-I195 VanDerWaalsContact O-N 3.15Å
192	F	84.5	Confident	88.7	Confident	5 Å²	5	62.3 Å²	62.3	2%	0.022	29%	0.289	C	S	.	.	H	α-helix	trans	-71.8	-40	-177.6	-60	-54.4	0	0	0	112.9	L56 D188 H189 R190 D194 I195 I196 M229 K237 C238	L56-F192 HydrophobicContact CD1-CE1 4.13Å; L56-F192 HydrophobicContact CD2-CE1 4.22Å; D188-F192 VanDerWaalsContact C-CD2 3.41Å; D188-F192 HydrophobicContact CB-CD2 4.36Å; D188-F192 HydrophobicContact CB-CE2 3.75Å; D188-F192 WeakPolarHBondContact O-CD2 3.37Å; D188-F192 WeakPolarHBondContact O-CE2 3.36Å; D188-F192 WeakPolarHBondContact O-CG 3.47Å; D188-F192 PolarHBondContact O-N 3.11Å; H189-F192 PolarHBondContact O-N 3.43Å; R190-F192 VanDerWaalsContact C-N 3.34Å; R190-F192 PolarHBondContact O-N 3.01Å; F192-D194 VanDerWaalsContact C-N 3.31Å; F192-D194 PolarHBondContact O-N 3.19Å; F192-I195 HydrophobicContact CD1-CD1 4.3Å; F192-I195 PolarHBondContact O-N 2.93Å; F192-I195 VanDerWaalsContact O-N 3.15Å; F192-I196 VanDerWaalsContact O-CG1 3.31Å; F192-I196 WeakPolarHBondContact O-CG1 3.3Å; F192-I196 PolarHBondContact O-N 3.22Å; F192-M229 HydrophobicContact CB-SD 3.65Å; F192-M229 HydrophobicContact CD2-SD 4.22Å; F192-M229 HydrophobicContact CG-SD 4.34Å; F192-K237 WeakPolarHBondContact CE1-O 3.43Å; F192-K237 HydrophobicContact CE2-CB 4.36Å; F192-K237 HydrophobicContact CZ-CB 3.8Å; F192-K237 WeakPolarHBondContact CZ-O 3.48Å; F192-C238 HydrophobicContact CB-CB 4.26Å; F192-C238 VanDerWaalsContact CD1-C 3.46Å; F192-C238 HydrophobicContact CD1-CB 3.92Å; F192-C238 WeakPolarHBondContact CD1-O 3.5Å; F192-C238 HydrophobicContact CD2-CB 3.34Å; F192-C238 HydrophobicContact CE1-CB 4.17Å; F192-C238 WeakPolarHBondContact CE1-O 3.26Å; F192-C238 HydrophobicContact CE2-CB 3.57Å; F192-C238 HydrophobicContact CG-CB 3.55Å; F192-C238 HydrophobicContact CZ-CB 4.04Å
193	R	89.7	Confident	88.6	Confident	59 Å²	59	57.8 Å²	57.8	22%	0.223	27%	0.268	C	S	.	.	H	α-helix	trans	-55.5	-48.9	171.3	-175.1	-164	63.5	-170.7	-7.1	110.8	E183 H189 R190 I195 I196 E197 M226	E183-R193 IonicContact OE1-CZ 3.67Å; E183-R193 VanDerWaalsContact OE1-CZ 3.24Å; E183-R193 IonicContact OE1-NE 3.81Å; E183-R193 IonicContact OE1-NH1 2.66Å; E183-R193 PolarHBondContact OE1-NH1 3.22Å; E183-R193 IonicContact OE1-NH2 3.88Å; E183-R193 IonicContact OE2-CZ 2.67Å; E183-R193 IonicContact OE2-NH1 2.67Å; E183-R193 PolarHBondContact OE2-NH1 2.78Å; H189-R193 WeakPolarHBondContact O-CB 3.49Å; H189-R193 PolarHBondContact O-N 3.38Å; R190-R193 PolarHBondContact O-N 3.46Å; R193-I195 PolarHBondContact O-N 3.2Å; R193-I196 PolarHBondContact O-N 2.95Å; R193-I196 VanDerWaalsContact O-N 3.15Å; R193-E197 WeakPolarHBondContact CD-OE1 3.34Å; R193-E197 HydrophobicContact CG-CG 4.27Å; R193-E197 WeakPolarHBondContact CG-OE1 2.96Å; R193-E197 IonicContact NE-OE1 3.79Å; R193-E197 WeakPolarHBondContact O-CB 3.41Å; R193-E197 WeakPolarHBondContact O-CG 3.15Å; R193-E197 PolarHBondContact O-N 3.05Å; R193-M226 HydrophobicContact CB-CE 4.16Å; R193-M226 HydrophobicContact CB-SD 4.05Å; R193-M226 HydrophobicContact CG-CE 4.09Å; R193-M226 HydrophobicContact CG-SD 4Å
194	D	89.1	Confident	88.6	Confident	63 Å²	63	57.8 Å²	57.8	34%	0.337	27%	0.27	S	S	.	.	H	α-helix	trans	-62.7	-30.6	-179.8	-66	-3.4	0	0	0	112.5	R190 K191 F192 K198	R190-D194 WeakPolarHBondContact O-CB 3.32Å; R190-D194 PolarHBondContact O-N 3.26Å; K191-D194 PolarHBondContact O-N 3.4Å; F192-D194 VanDerWaalsContact C-N 3.31Å; F192-D194 PolarHBondContact O-N 3.19Å; D194-K198 VanDerWaalsContact O-CD 3.32Å; D194-K198 WeakPolarHBondContact O-CD 3.37Å; D194-K198 WeakPolarHBondContact O-CG 3.49Å; D194-K198 PolarHBondContact O-N 3.31Å
195	I	87.3	Confident	88.6	Confident	31 Å²	31	58.3 Å²	58.3	16%	0.159	26%	0.262	C	S	.	.	H	α-helix	trans	-74.2	-46.5	174.4	-62.2	164.6	0	0	0	110.1	L56 K191 F192 R193 E197 K198 D199 Y239	L56-I195 HydrophobicContact CD2-CD1 3.98Å; K191-I195 HydrophobicContact CG-CD1 4.25Å; K191-I195 VanDerWaalsContact O-CG1 3.26Å; K191-I195 WeakPolarHBondContact O-CG1 3.04Å; K191-I195 PolarHBondContact O-N 3Å; K191-I195 VanDerWaalsContact O-N 3.15Å; F192-I195 HydrophobicContact CD1-CD1 4.3Å; F192-I195 PolarHBondContact O-N 2.93Å; F192-I195 VanDerWaalsContact O-N 3.15Å; R193-I195 PolarHBondContact O-N 3.2Å; I195-E197 PolarHBondContact O-N 2.87Å; I195-K198 PolarHBondContact O-N 3.03Å; I195-D199 PolarHBondContact O-N 3.49Å; I195-Y239 HydrophobicContact CB-CD1 4.16Å; I195-Y239 HydrophobicContact CG2-CD1 3.56Å; I195-Y239 HydrophobicContact CG2-CE1 3.63Å
196	I	90.5	Very high	88.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56.9	-51.1	177.2	-71.6	165.8	0	0	0	110.1	F192 R193 K198 D199 V200 L225 M226 Y239	F192-I196 VanDerWaalsContact O-CG1 3.31Å; F192-I196 WeakPolarHBondContact O-CG1 3.3Å; F192-I196 PolarHBondContact O-N 3.22Å; R193-I196 PolarHBondContact O-N 2.95Å; R193-I196 VanDerWaalsContact O-N 3.15Å; I196-K198 VanDerWaalsContact C-N 3.31Å; I196-K198 PolarHBondContact O-N 3.44Å; I196-D199 PolarHBondContact O-N 3.4Å; I196-D199 VanDerWaalsContact O-N 3.11Å; I196-V200 HydrophobicContact CG2-CG2 3.89Å; I196-V200 WeakPolarHBondContact O-CB 3.38Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 2.67Å; I196-L225 HydrophobicContact CD1-CB 4.04Å; I196-L225 HydrophobicContact CG1-CB 4.17Å; I196-L225 HydrophobicContact CG2-CB 3.87Å; I196-L225 HydrophobicContact CG2-CD1 3.96Å; I196-M226 HydrophobicContact CD1-CG 4.38Å; I196-M226 HydrophobicContact CD1-SD 3.68Å; I196-Y239 HydrophobicContact CD1-CD2 4.16Å; I196-Y239 HydrophobicContact CD1-CG 4.01Å; I196-Y239 HydrophobicContact CG1-CD1 3.69Å; I196-Y239 HydrophobicContact CG1-CD2 3.57Å; I196-Y239 HydrophobicContact CG1-CE1 4.2Å; I196-Y239 HydrophobicContact CG1-CE2 4.06Å; I196-Y239 HydrophobicContact CG1-CG 3.36Å
197	E	91.9	Very high	88.6	Confident	76 Å²	76	56.7 Å²	56.7	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-56.6	-45.1	179.4	-73.4	174.4	-178.1	0	0	111.4	R193 I195 D199 I201	R193-E197 WeakPolarHBondContact CD-OE1 3.34Å; R193-E197 HydrophobicContact CG-CG 4.27Å; R193-E197 WeakPolarHBondContact CG-OE1 2.96Å; R193-E197 IonicContact NE-OE1 3.79Å; R193-E197 WeakPolarHBondContact O-CB 3.41Å; R193-E197 WeakPolarHBondContact O-CG 3.15Å; R193-E197 PolarHBondContact O-N 3.05Å; I195-E197 PolarHBondContact O-N 2.87Å; E197-D199 VanDerWaalsContact C-N 3.33Å; E197-D199 PolarHBondContact O-N 2.94Å; E197-I201 VanDerWaalsContact O-CD1 3.26Å; E197-I201 WeakPolarHBondContact O-CD1 3.33Å; E197-I201 WeakPolarHBondContact O-CG1 3.37Å; E197-I201 PolarHBondContact O-N 3.37Å
198	K	89.2	Confident	88.9	Confident	118 Å²	118	61.2 Å²	61.2	51%	0.513	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-37.5	177.4	-76	170.2	-171.9	164.4	0	112.9	D194 I195 I196 R202	D194-K198 VanDerWaalsContact O-CD 3.32Å; D194-K198 WeakPolarHBondContact O-CD 3.37Å; D194-K198 WeakPolarHBondContact O-CG 3.49Å; D194-K198 PolarHBondContact O-N 3.31Å; I195-K198 PolarHBondContact O-N 3.03Å; I196-K198 VanDerWaalsContact C-N 3.31Å; I196-K198 PolarHBondContact O-N 3.44Å; K198-R202 WeakPolarHBondContact O-CG 3.38Å; K198-R202 PolarHBondContact O-NE 3.11Å
199	D	88.5	Confident	89.3	Confident	5 Å²	5	61 Å²	61	3%	0.027	28%	0.28	C	S	.	.	H	α-helix	trans	-71.1	-51.5	178.7	-89.4	18.6	0	0	0	111	I195 I196 E197 I201 R202 T203 Y239 Q241 G242	I195-D199 PolarHBondContact O-N 3.49Å; I196-D199 PolarHBondContact O-N 3.4Å; I196-D199 VanDerWaalsContact O-N 3.11Å; E197-D199 VanDerWaalsContact C-N 3.33Å; E197-D199 PolarHBondContact O-N 2.94Å; D199-I201 VanDerWaalsContact C-N 3.32Å; D199-I201 PolarHBondContact O-N 2.83Å; D199-R202 CarbonylContact O-C 3.58Å; D199-R202 WeakPolarHBondContact O-CA 3.1Å; D199-R202 WeakPolarHBondContact O-CB 3.37Å; D199-R202 PolarHBondContact O-N 2.92Å; D199-R202 IonicContact OD1-CZ 3.13Å; D199-R202 IonicContact OD1-NH2 3.61Å; D199-R202 PolarHBondContact OD1-NH2 3.15Å; D199-T203 PolarHBondContact O-N 2.89Å; D199-T203 PolarHBondContact O-OG1 3.38Å; D199-Y239 HydrophobicContact CB-CE1 4.27Å; D199-Y239 WeakPolarHBondContact CB-OH 3.04Å; D199-Y239 WeakPolarHBondContact OD2-CE1 3.34Å; D199-Y239 PolarHBondContact OD2-OH 3.08Å; D199-Q241 WeakPolarHBondContact OD2-CA 3.35Å; D199-Q241 WeakPolarHBondContact OD2-CG 3.15Å; D199-G242 PolarHBondContact OD2-N 3.45Å
200	V	92.2	Very high	89.7	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-52.5	-47.7	-179.4	171.3	0	0	0	0	111.4	I196 R202 T203 L218 L221 H222 L225	I196-V200 HydrophobicContact CG2-CG2 3.89Å; I196-V200 WeakPolarHBondContact O-CB 3.38Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 2.67Å; V200-R202 PolarHBondContact O-N 3.03Å; V200-R202 VanDerWaalsContact O-N 3.09Å; V200-T203 PolarHBondContact O-N 3.13Å; V200-T203 VanDerWaalsContact O-N 3.14Å; V200-L218 HydrophobicContact CG1-CB 3.93Å; V200-L218 HydrophobicContact CG1-CD2 4.18Å; V200-L218 VanDerWaalsContact CG1-O 3.31Å; V200-L218 WeakPolarHBondContact CG1-O 3.47Å; V200-L218 WeakPolarHBondContact O-CD2 3.26Å; V200-L221 HydrophobicContact CB-CD2 4.41Å; V200-L221 HydrophobicContact CG2-CD2 3.63Å; V200-H222 HydrophobicContact CG1-CB 4.33Å; V200-H222 HydrophobicContact CG2-CB 4.12Å; V200-L225 HydrophobicContact CG2-CD1 4.13Å
201	I	90.5	Very high	89.8	Confident	106 Å²	106	61.6 Å²	61.6	54%	0.544	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.9	-177.6	-63.7	162.7	0	0	0	112.1	E197 D199 R205	E197-I201 VanDerWaalsContact O-CD1 3.26Å; E197-I201 WeakPolarHBondContact O-CD1 3.33Å; E197-I201 WeakPolarHBondContact O-CG1 3.37Å; E197-I201 PolarHBondContact O-N 3.37Å; D199-I201 VanDerWaalsContact C-N 3.32Å; D199-I201 PolarHBondContact O-N 2.83Å; I201-R205 WeakPolarHBondContact O-CD 3.31Å; I201-R205 WeakPolarHBondContact O-CG 3.39Å; I201-R205 PolarHBondContact O-NH1 2.99Å
202	R	88.7	Confident	89.9	Confident	104 Å²	104	59.6 Å²	59.6	39%	0.392	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-14.6	-178.9	-62	-178.3	-66.2	150.5	-6.2	113.5	K198 D199 V200 D204	K198-R202 WeakPolarHBondContact O-CG 3.38Å; K198-R202 PolarHBondContact O-NE 3.11Å; D199-R202 CarbonylContact O-C 3.58Å; D199-R202 WeakPolarHBondContact O-CA 3.1Å; D199-R202 WeakPolarHBondContact O-CB 3.37Å; D199-R202 PolarHBondContact O-N 2.92Å; D199-R202 IonicContact OD1-CZ 3.13Å; D199-R202 IonicContact OD1-NH2 3.61Å; D199-R202 PolarHBondContact OD1-NH2 3.15Å; V200-R202 PolarHBondContact O-N 3.03Å; V200-R202 VanDerWaalsContact O-N 3.09Å; R202-D204 PolarHBondContact O-N 2.85Å
203	T	89.5	Confident	89.9	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.012	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	122.8	-173.8	-56.5	0	0	0	0	111.1	D199 V200 R205 L221 S244	D199-T203 PolarHBondContact O-N 2.89Å; D199-T203 PolarHBondContact O-OG1 3.38Å; V200-T203 PolarHBondContact O-N 3.13Å; V200-T203 VanDerWaalsContact O-N 3.14Å; T203-R205 WeakPolarHBondContact O-CD 3.49Å; T203-R205 PolarHBondContact O-N 3.28Å; T203-L221 HydrophobicContact CG2-CD1 4Å; T203-S244 PolarHBondContact OG1-OG 3.14Å
204	D	90.2	Very high	89.7	Confident	37 Å²	37	71.3 Å²	71.3	20%	0.198	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	41.8	36.4	168.8	-65	-39.3	0	0	0	116.1	R202 N206 H207 F210 S248 K324 F329	R202-D204 PolarHBondContact O-N 2.85Å; D204-N206 PolarHBondContact O-N 3.47Å; D204-H207 HydrophobicContact CB-CB 4.32Å; D204-H207 VanDerWaalsContact O-CB 3.3Å; D204-H207 WeakPolarHBondContact O-CB 3.42Å; D204-H207 PolarHBondContact O-N 3.18Å; D204-F210 HydrophobicContact CB-CD2 3.75Å; D204-F210 HydrophobicContact CB-CE2 4.25Å; D204-S248 VanDerWaalsContact OD2-CB 3.29Å; D204-S248 WeakPolarHBondContact OD2-CB 3.32Å; D204-S248 PolarHBondContact OD2-OG 3.41Å; D204-K324 VanDerWaalsContact CG-NZ 3.26Å; D204-K324 IonicContact OD1-NZ 2.7Å; D204-K324 PolarHBondContact OD1-NZ 3.4Å; D204-K324 WeakPolarHBondContact OD2-CE 3.4Å; D204-K324 IonicContact OD2-NZ 2.84Å; D204-K324 PolarHBondContact OD2-NZ 3.39Å; D204-F329 HydrophobicContact CB-CE2 4.27Å; D204-F329 HydrophobicContact CB-CZ 4.2Å; D204-F329 WeakPolarHBondContact OD2-CZ 3.35Å
205	R	90.7	Very high	89.8	Confident	76 Å²	76	69.4 Å²	69.4	29%	0.287	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12	-177.4	-59.3	-57.7	-62.9	-74.1	2.7	114.4	I201 T203 H207 F210 Q211 G212 D213	I201-R205 WeakPolarHBondContact O-CD 3.31Å; I201-R205 WeakPolarHBondContact O-CG 3.39Å; I201-R205 PolarHBondContact O-NH1 2.99Å; T203-R205 WeakPolarHBondContact O-CD 3.49Å; T203-R205 PolarHBondContact O-N 3.28Å; R205-H207 VanDerWaalsContact C-N 3.33Å; R205-F210 PolarHBondContact NE-O 3.31Å; R205-F210 VanDerWaalsContact NE-O 3.1Å; R205-Q211 WeakPolarHBondContact O-CG 3.36Å; R205-G212 PolarHBondContact NH2-O 2.97Å; R205-D213 IonicContact NH2-OD1 3.91Å
206	N	88.1	Confident	90.1	Very high	160 Å²	160	75.9 Å²	75.9	86%	0.856	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.3	172.3	-63.8	-18.9	0	0	0	112.4	D204 Q211	D204-N206 PolarHBondContact O-N 3.47Å; N206-Q211 PolarHBondContact O-NE2 2.83Å
207	H	90.7	Very high	90.3	Very high	50 Å²	50	77.9 Å²	77.9	23%	0.231	39%	0.387	C	S	.	.	S	Bend	trans	-90.7	130.3	-179.5	-167	-76.9	0	0	0	110.7	D204 R205 F209 F210 Q211 Y252 F329	D204-H207 HydrophobicContact CB-CB 4.32Å; D204-H207 VanDerWaalsContact O-CB 3.3Å; D204-H207 WeakPolarHBondContact O-CB 3.42Å; D204-H207 PolarHBondContact O-N 3.18Å; R205-H207 VanDerWaalsContact C-N 3.33Å; H207-F209 VanDerWaalsContact ND1-CB 3.33Å; H207-F209 WeakPolarHBondContact ND1-CB 3.37Å; H207-F209 PolarHBondContact ND1-N 2.67Å; H207-F209 PolarHBondContact O-N 3.34Å; H207-F209 VanDerWaalsContact O-N 3.08Å; H207-F210 HydrophobicContact CB-CD2 4.45Å; H207-F210 PolarHBondContact O-N 3.06Å; H207-Q211 WeakPolarHBondContact O-CG 3.38Å; H207-Q211 PolarHBondContact O-N 2.93Å; H207-Y252 AromaticContact CE1-CD2 3.91Å; H207-Y252 AromaticContact CE1-CE2 3.56Å; H207-F329 AromaticContact CD2-CD2 3.66Å; H207-F329 AromaticContact CD2-CE2 3.86Å; H207-F329 AromaticContact CD2-CG 3.79Å; H207-F329 AromaticContact NE2-CD1 3.87Å; H207-F329 AromaticContact NE2-CG 3.79Å
208	E	91.7	Very high	90.4	Very high	165 Å²	165	75.1 Å²	75.1	77%	0.771	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-50	-40.7	-174.6	-174.6	176.6	178.5	0	0	112.8	F210 Q211	E208-F210 PolarHBondContact O-N 3.33Å; E208-F210 VanDerWaalsContact O-N 3.17Å; E208-Q211 PolarHBondContact O-N 2.66Å; E208-Q211 VanDerWaalsContact O-N 3.16Å
209	F	92.5	Very high	90.7	Very high	46 Å²	46	73.3 Å²	73.3	20%	0.202	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-56.9	-30.4	178.1	-169.7	-96.6	0	0	0	114.8	H207 N215 N217 V251 Y252	H207-F209 VanDerWaalsContact ND1-CB 3.33Å; H207-F209 WeakPolarHBondContact ND1-CB 3.37Å; H207-F209 PolarHBondContact ND1-N 2.67Å; H207-F209 PolarHBondContact O-N 3.34Å; H207-F209 VanDerWaalsContact O-N 3.08Å; F209-N215 PolarHBondContact O-ND2 3.14Å; F209-N217 HydrophobicContact CD1-CB 3.92Å; F209-N217 HydrophobicContact CE1-CB 3.47Å; F209-N217 VanDerWaalsContact CE1-CB 3.47Å; F209-N217 HydrophobicContact CZ-CB 3.98Å; F209-N217 WeakPolarHBondContact CZ-ND2 3.18Å; F209-N217 WeakPolarHBondContact CZ-OD1 3.5Å; F209-N217 PolarHBondContact O-ND2 3.35Å; F209-V251 HydrophobicContact CE1-CG1 3.98Å; F209-V251 HydrophobicContact CZ-CG1 4.4Å; F209-Y252 HydrophobicContact CB-CD2 3.81Å; F209-Y252 HydrophobicContact CB-CE2 4.15Å; F209-Y252 HydrophobicContact CD1-CD2 4.03Å; F209-Y252 AromaticContact CD2-CD2 3.66Å; F209-Y252 HydrophobicContact CD2-CD2 3.66Å; F209-Y252 HydrophobicContact CD2-CE2 4.09Å; F209-Y252 HydrophobicContact CE1-CD2 4.49Å; F209-Y252 HydrophobicContact CE2-CD2 4.18Å; F209-Y252 AromaticContact CG-CD2 3.58Å; F209-Y252 HydrophobicContact CG-CD2 3.58Å; F209-Y252 HydrophobicContact CG-CE2 4.22Å
210	F	93.3	Very high	91	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-111	7.9	-179.8	-59.9	-69.7	0	0	0	113.2	D204 R205 H207 E208 N215 N217 L218 L221 S248 V251 F329	D204-F210 HydrophobicContact CB-CD2 3.75Å; D204-F210 HydrophobicContact CB-CE2 4.25Å; R205-F210 PolarHBondContact NE-O 3.31Å; R205-F210 VanDerWaalsContact NE-O 3.1Å; H207-F210 HydrophobicContact CB-CD2 4.45Å; H207-F210 PolarHBondContact O-N 3.06Å; E208-F210 PolarHBondContact O-N 3.33Å; E208-F210 VanDerWaalsContact O-N 3.17Å; F210-N215 VanDerWaalsContact C-ND2 3.29Å; F210-N215 WeakPolarHBondContact CA-ND2 3.39Å; F210-N217 HydrophobicContact CD1-CB 4.04Å; F210-N217 HydrophobicContact CE1-CB 4.08Å; F210-L218 HydrophobicContact CB-CD2 4.14Å; F210-L218 HydrophobicContact CD1-CD2 3.78Å; F210-L218 HydrophobicContact CD1-CG 4.46Å; F210-L218 HydrophobicContact CG-CD2 4.33Å; F210-L221 HydrophobicContact CE1-CD1 3.92Å; F210-L221 HydrophobicContact CZ-CD1 4.17Å; F210-S248 WeakPolarHBondContact CE2-OG 3.23Å; F210-S248 WeakPolarHBondContact CZ-OG 3.32Å; F210-V251 HydrophobicContact CE1-CG1 4.42Å; F210-F329 HydrophobicContact CE2-CE1 4.26Å; F210-F329 HydrophobicContact CE2-CZ 4.03Å
211	Q	91	Very high	91.2	Very high	97 Å²	97	73.9 Å²	73.9	45%	0.453	38%	0.376	S	S	.	.			trans	-77.5	160.1	178.1	-81.5	177.7	19.3	0	0	112.4	R205 N206 H207 E208 N215	R205-Q211 WeakPolarHBondContact O-CG 3.36Å; N206-Q211 PolarHBondContact O-NE2 2.83Å; H207-Q211 WeakPolarHBondContact O-CG 3.38Å; H207-Q211 PolarHBondContact O-N 2.93Å; E208-Q211 PolarHBondContact O-N 2.66Å; E208-Q211 VanDerWaalsContact O-N 3.16Å; Q211-N215 PolarHBondContact N-ND2 2.96Å; Q211-N215 PolarHBondContact O-ND2 2.91Å
212	G	89	Confident	91.5	Very high	43 Å²	43	70.5 Å²	70.5	44%	0.443	36%	0.358	S	S	.	.	S	Bend	trans	91.3	155.1	-179.3	0	0	0	0	0	113.1	R205	R205-G212 PolarHBondContact NH2-O 2.97Å
213	D	83.3	Confident	91.8	Very high	145 Å²	145	66.2 Å²	66.2	78%	0.775	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	146.9	169.3	-61.6	-32.1	0	0	0	108.4	R205 N215	R205-D213 IonicContact NH2-OD1 3.91Å; D213-N215 VanDerWaalsContact C-N 3.3Å; D213-N215 PolarHBondContact O-N 2.97Å
214	D	86.1	Confident	92.2	Very high	165 Å²	165	66.1 Å²	66.1	88%	0.882	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	36	-176.8	-56.6	-34.4	0	0	0	115.1	E216	D214-E216 PolarHBondContact O-N 3.37Å
215	N	91.8	Very high	92.4	Very high	23 Å²	23	64.4 Å²	64.4	12%	0.123	33%	0.333	C	S	.	.			trans	-68.1	122.6	177.9	-175.3	-39.2	0	0	0	111.9	F209 F210 Q211 D213 N217 L218 T219	F209-N215 PolarHBondContact O-ND2 3.14Å; F210-N215 VanDerWaalsContact C-ND2 3.29Å; F210-N215 WeakPolarHBondContact CA-ND2 3.39Å; Q211-N215 PolarHBondContact N-ND2 2.96Å; Q211-N215 PolarHBondContact O-ND2 2.91Å; D213-N215 VanDerWaalsContact C-N 3.3Å; D213-N215 PolarHBondContact O-N 2.97Å; N215-N217 PolarHBondContact O-N 2.92Å; N215-N217 WeakPolarHBondContact OD1-CA 3.4Å; N215-N217 WeakPolarHBondContact OD1-CB 3.24Å; N215-N217 PolarHBondContact OD1-N 3.01Å; N215-N217 PolarHBondContact OD1-ND2 3.49Å; N215-L218 HydrophobicContact CB-CD1 4.13Å; N215-L218 HydrophobicContact CB-CG 4.11Å; N215-L218 WeakPolarHBondContact O-CB 3.34Å; N215-L218 PolarHBondContact O-N 3.02Å; N215-T219 PolarHBondContact O-N 2.88Å
216	E	93.5	Very high	92.6	Very high	167 Å²	167	60.8 Å²	60.8	78%	0.78	32%	0.319	S	S	*	.	H	α-helix	trans	-58.5	-31.9	179.4	-63.7	-174.7	172	0	0	113	D214 L218 T219 L220	D214-E216 PolarHBondContact O-N 3.37Å; E216-L218 VanDerWaalsContact C-N 3.31Å; E216-L218 PolarHBondContact O-N 3.42Å; E216-T219 CarbonylContact O-C 3.54Å; E216-T219 WeakPolarHBondContact O-CA 3.31Å; E216-T219 VanDerWaalsContact O-CB 3.3Å; E216-T219 WeakPolarHBondContact O-CB 3.47Å; E216-T219 PolarHBondContact O-N 3.45Å; E216-L220 PolarHBondContact O-N 3.43Å
217	N	94.5	Very high	92.9	Very high	41 Å²	41	53.2 Å²	53.2	22%	0.219	28%	0.279	C	S	.	.	H	α-helix	trans	-68.2	-30.6	177.2	-59.1	-41.6	0	0	0	112.3	F209 F210 N215 T219 L220 L221	F209-N217 HydrophobicContact CD1-CB 3.92Å; F209-N217 HydrophobicContact CE1-CB 3.47Å; F209-N217 VanDerWaalsContact CE1-CB 3.47Å; F209-N217 HydrophobicContact CZ-CB 3.98Å; F209-N217 WeakPolarHBondContact CZ-ND2 3.18Å; F209-N217 WeakPolarHBondContact CZ-OD1 3.5Å; F209-N217 PolarHBondContact O-ND2 3.35Å; F210-N217 HydrophobicContact CD1-CB 4.04Å; F210-N217 HydrophobicContact CE1-CB 4.08Å; N215-N217 PolarHBondContact O-N 2.92Å; N215-N217 WeakPolarHBondContact OD1-CA 3.4Å; N215-N217 WeakPolarHBondContact OD1-CB 3.24Å; N215-N217 PolarHBondContact OD1-N 3.01Å; N215-N217 PolarHBondContact OD1-ND2 3.49Å; N217-T219 VanDerWaalsContact C-N 3.31Å; N217-L220 PolarHBondContact O-N 2.86Å; N217-L221 WeakPolarHBondContact O-CB 3.42Å; N217-L221 PolarHBondContact O-N 2.83Å
218	L	94.4	Very high	93.1	Very high	19 Å²	19	51 Å²	51	10%	0.099	27%	0.268	C	S	.	.	H	α-helix	trans	-69.6	-33.9	170.8	-65.7	179.1	0	0	0	111	V200 F210 N215 E216 L221 H222	V200-L218 HydrophobicContact CG1-CB 3.93Å; V200-L218 HydrophobicContact CG1-CD2 4.18Å; V200-L218 VanDerWaalsContact CG1-O 3.31Å; V200-L218 WeakPolarHBondContact CG1-O 3.47Å; V200-L218 WeakPolarHBondContact O-CD2 3.26Å; F210-L218 HydrophobicContact CB-CD2 4.14Å; F210-L218 HydrophobicContact CD1-CD2 3.78Å; F210-L218 HydrophobicContact CD1-CG 4.46Å; F210-L218 HydrophobicContact CG-CD2 4.33Å; N215-L218 HydrophobicContact CB-CD1 4.13Å; N215-L218 HydrophobicContact CB-CG 4.11Å; N215-L218 WeakPolarHBondContact O-CB 3.34Å; N215-L218 PolarHBondContact O-N 3.02Å; E216-L218 VanDerWaalsContact C-N 3.31Å; E216-L218 PolarHBondContact O-N 3.42Å; L218-L221 PolarHBondContact O-N 2.98Å; L218-H222 WeakPolarHBondContact O-CB 3.46Å; L218-H222 PolarHBondContact O-N 2.87Å
219	T	94.6	Very high	93	Very high	79 Å²	79	43.4 Å²	43.4	49%	0.485	23%	0.233	S	C	.	.	H	α-helix	trans	-67.9	-39.4	173.9	-57.5	0	0	0	0	111	N215 E216 N217 H222 D223	N215-T219 PolarHBondContact O-N 2.88Å; E216-T219 CarbonylContact O-C 3.54Å; E216-T219 WeakPolarHBondContact O-CA 3.31Å; E216-T219 VanDerWaalsContact O-CB 3.3Å; E216-T219 WeakPolarHBondContact O-CB 3.47Å; E216-T219 PolarHBondContact O-N 3.45Å; N217-T219 VanDerWaalsContact C-N 3.31Å; T219-H222 PolarHBondContact O-N 2.64Å; T219-D223 WeakPolarHBondContact O-CB 3.43Å; T219-D223 PolarHBondContact O-N 3.28Å
220	L	95.7	Very high	92.9	Very high	26 Å²	26	41.8 Å²	41.8	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-47.3	172.8	-168	166.5	0	0	0	110.7	E216 N217 H222 D223 V224 V251 E257	E216-L220 PolarHBondContact O-N 3.43Å; N217-L220 PolarHBondContact O-N 2.86Å; L220-H222 VanDerWaalsContact C-N 3.35Å; L220-H222 PolarHBondContact O-N 3.16Å; L220-D223 PolarHBondContact O-N 3.17Å; L220-V224 HydrophobicContact CD2-CG2 3.79Å; L220-V224 WeakPolarHBondContact O-CG2 3.38Å; L220-V224 PolarHBondContact O-N 2.97Å; L220-V251 HydrophobicContact CB-CG1 4.45Å; L220-V251 HydrophobicContact CD1-CG1 4.17Å; L220-V251 HydrophobicContact CD2-CB 4.16Å; L220-V251 HydrophobicContact CD2-CG1 3.51Å; L220-V251 HydrophobicContact CD2-CG2 3.59Å; L220-V251 HydrophobicContact CG-CG1 4.25Å; L220-E257 HydrophobicContact CD2-CG 4.48Å; L220-E257 HydrophobicContact CG-CB 4.31Å; L220-E257 HydrophobicContact CG-CG 4.3Å
221	L	95.9	Very high	92.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-44.3	178.4	-157.6	144.8	0	0	0	111.6	V200 T203 F210 N217 L218 L225 L247	V200-L221 HydrophobicContact CB-CD2 4.41Å; V200-L221 HydrophobicContact CG2-CD2 3.63Å; T203-L221 HydrophobicContact CG2-CD1 4Å; F210-L221 HydrophobicContact CE1-CD1 3.92Å; F210-L221 HydrophobicContact CZ-CD1 4.17Å; N217-L221 WeakPolarHBondContact O-CB 3.42Å; N217-L221 PolarHBondContact O-N 2.83Å; L218-L221 PolarHBondContact O-N 2.98Å; L221-L225 HydrophobicContact CD2-CD1 3.65Å; L221-L225 HydrophobicContact CD2-CG 4.44Å; L221-L225 WeakPolarHBondContact O-CG 3.13Å; L221-L225 PolarHBondContact O-N 3.29Å; L221-L225 VanDerWaalsContact O-N 3.17Å; L221-L247 HydrophobicContact CD2-CD2 4.25Å; L221-L247 HydrophobicContact CG-CD2 3.87Å; L221-L247 HydrophobicContact CG-CG 4.22Å
222	H	95.6	Very high	92.6	Very high	35 Å²	35	43.1 Å²	43.1	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-53.2	173	169.2	-86.2	0	0	0	112.2	W175 V200 L218 T219 L220 V224 L225 M226	W175-H222 AromaticContact CH2-CE1 3.86Å; V200-H222 HydrophobicContact CG1-CB 4.33Å; V200-H222 HydrophobicContact CG2-CB 4.12Å; L218-H222 WeakPolarHBondContact O-CB 3.46Å; L218-H222 PolarHBondContact O-N 2.87Å; T219-H222 PolarHBondContact O-N 2.64Å; L220-H222 VanDerWaalsContact C-N 3.35Å; L220-H222 PolarHBondContact O-N 3.16Å; H222-V224 VanDerWaalsContact C-N 3.31Å; H222-V224 PolarHBondContact O-N 3.08Å; H222-L225 PolarHBondContact O-N 2.91Å; H222-M226 WeakPolarHBondContact O-CB 3.44Å; H222-M226 WeakPolarHBondContact O-CG 3.33Å; H222-M226 PolarHBondContact O-N 2.94Å
223	D	96.5	Very high	92.1	Very high	14 Å²	14	45.2 Å²	45.2	8%	0.075	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-36	-174.5	-81.5	12.1	0	0	0	111.8	K172 W175 K176 T219 L220 T227 E257	K172-D223 WeakPolarHBondContact CE-OD2 3.35Å; K172-D223 IonicContact NZ-OD2 3.76Å; K172-D223 PolarHBondContact NZ-OD2 3.49Å; W175-D223 WeakPolarHBondContact CH2-OD1 3.24Å; W175-D223 HydrophobicContact CZ2-CB 4.21Å; K176-D223 WeakPolarHBondContact CE-OD2 3.31Å; K176-D223 IonicContact NZ-OD1 2.79Å; K176-D223 IonicContact NZ-OD2 3.21Å; K176-D223 PolarHBondContact NZ-OD2 2.95Å; T219-D223 WeakPolarHBondContact O-CB 3.43Å; T219-D223 PolarHBondContact O-N 3.28Å; L220-D223 PolarHBondContact O-N 3.17Å; D223-T227 WeakPolarHBondContact O-CB 3.3Å; D223-T227 PolarHBondContact O-N 3.03Å; D223-T227 PolarHBondContact O-OG1 3.37Å; D223-E257 WeakPolarHBondContact CB-OE1 3.24Å
224	V	96.8	Very high	91.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-44.9	175	170.5	0	0	0	0	111.3	L220 H222 T227 Y228 L247 E257 F261	L220-V224 HydrophobicContact CD2-CG2 3.79Å; L220-V224 WeakPolarHBondContact O-CG2 3.38Å; L220-V224 PolarHBondContact O-N 2.97Å; H222-V224 VanDerWaalsContact C-N 3.31Å; H222-V224 PolarHBondContact O-N 3.08Å; V224-T227 PolarHBondContact O-N 3.39Å; V224-Y228 WeakPolarHBondContact O-CB 3.4Å; V224-Y228 PolarHBondContact O-N 3.27Å; V224-L247 HydrophobicContact CB-CD1 4.5Å; V224-L247 HydrophobicContact CB-CD2 3.9Å; V224-L247 HydrophobicContact CG1-CD1 3.69Å; V224-L247 HydrophobicContact CG1-CD2 3.65Å; V224-L247 HydrophobicContact CG1-CG 4.35Å; V224-E257 HydrophobicContact CG2-CG 3.64Å; V224-F261 HydrophobicContact CG1-CB 4.03Å; V224-F261 HydrophobicContact CG1-CD2 4.21Å; V224-F261 HydrophobicContact CG2-CB 4.38Å
225	L	94.9	Very high	90	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-42.2	178.2	-69.9	174.2	0	0	0	112.3	I196 V200 L221 H222 T227 Y228 M229 Y239 L247 F264	I196-L225 HydrophobicContact CD1-CB 4.04Å; I196-L225 HydrophobicContact CG1-CB 4.17Å; I196-L225 HydrophobicContact CG2-CB 3.87Å; I196-L225 HydrophobicContact CG2-CD1 3.96Å; V200-L225 HydrophobicContact CG2-CD1 4.13Å; L221-L225 HydrophobicContact CD2-CD1 3.65Å; L221-L225 HydrophobicContact CD2-CG 4.44Å; L221-L225 WeakPolarHBondContact O-CG 3.13Å; L221-L225 PolarHBondContact O-N 3.29Å; L221-L225 VanDerWaalsContact O-N 3.17Å; H222-L225 PolarHBondContact O-N 2.91Å; L225-T227 VanDerWaalsContact C-N 3.28Å; L225-T227 PolarHBondContact O-N 3.38Å; L225-Y228 PolarHBondContact O-N 2.8Å; L225-M229 PolarHBondContact O-N 2.56Å; L225-Y239 HydrophobicContact CB-CD2 4.42Å; L225-Y239 HydrophobicContact CB-CE2 4.48Å; L225-Y239 HydrophobicContact CD1-CD2 4.28Å; L225-Y239 HydrophobicContact CD1-CE2 3.55Å; L225-Y239 HydrophobicContact CD2-CD2 3.93Å; L225-Y239 HydrophobicContact CD2-CE2 3.61Å; L225-Y239 HydrophobicContact CG-CD2 4.43Å; L225-Y239 HydrophobicContact CG-CE2 4.05Å; L225-L247 HydrophobicContact CD1-CD2 4.3Å; L225-L247 HydrophobicContact CD2-CB 4.47Å; L225-L247 HydrophobicContact CD2-CD2 3.62Å; L225-L247 HydrophobicContact CG-CD2 3.55Å; L225-F264 HydrophobicContact CD2-CE1 4.09Å; L225-F264 HydrophobicContact CD2-CZ 4.17Å
226	M	94.3	Very high	87.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-37.9	174.6	-74.1	-61.3	-66.9	0	0	111.5	W175 R193 I196 H222 M229	W175-M226 HydrophobicContact CD2-CB 3.83Å; W175-M226 HydrophobicContact CD2-CE 4.23Å; W175-M226 HydrophobicContact CE3-CB 4.2Å; W175-M226 HydrophobicContact CE3-CE 3.81Å; W175-M226 HydrophobicContact CG-CB 4.33Å; W175-M226 HydrophobicContact CH2-CB 4.08Å; W175-M226 HydrophobicContact CH2-CG 4.31Å; W175-M226 HydrophobicContact CZ2-CB 3.71Å; W175-M226 HydrophobicContact CZ2-CG 4.42Å; W175-M226 HydrophobicContact CZ3-CB 4.32Å; W175-M226 HydrophobicContact CZ3-CE 4.26Å; W175-M226 HydrophobicContact CZ3-CG 4.37Å; R193-M226 HydrophobicContact CB-CE 4.16Å; R193-M226 HydrophobicContact CB-SD 4.05Å; R193-M226 HydrophobicContact CG-CE 4.09Å; R193-M226 HydrophobicContact CG-SD 4Å; I196-M226 HydrophobicContact CD1-CG 4.38Å; I196-M226 HydrophobicContact CD1-SD 3.68Å; H222-M226 WeakPolarHBondContact O-CB 3.44Å; H222-M226 WeakPolarHBondContact O-CG 3.33Å; H222-M226 PolarHBondContact O-N 2.94Å; M226-M229 HydrophobicContact CE-CE 3.75Å; M226-M229 WeakPolarHBondContact O-CB 3.45Å; M226-M229 PolarHBondContact O-N 3Å; M226-M229 HydrophobicContact SD-CE 4.27Å
227	T	95.3	Very high	85.8	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-71.6	-35.7	176.1	-53.6	0	0	0	0	111.6	Y168 L171 K172 W175 D223 V224 L225 M229 M230 Y231 F261	Y168-T227 HydrophobicContact CD2-CG2 3.84Å; Y168-T227 HydrophobicContact CE2-CG2 3.38Å; Y168-T227 PolarHBondContact OH-OG1 2.99Å; L171-T227 HydrophobicContact CB-CG2 3.52Å; K172-T227 HydrophobicContact CB-CG2 4.18Å; W175-T227 PolarHBondContact NE1-OG1 3.17Å; D223-T227 WeakPolarHBondContact O-CB 3.3Å; D223-T227 PolarHBondContact O-N 3.03Å; D223-T227 PolarHBondContact O-OG1 3.37Å; V224-T227 PolarHBondContact O-N 3.39Å; L225-T227 VanDerWaalsContact C-N 3.28Å; L225-T227 PolarHBondContact O-N 3.38Å; T227-M229 VanDerWaalsContact C-N 3.31Å; T227-M229 PolarHBondContact O-N 3.27Å; T227-M230 WeakPolarHBondContact O-CB 3.42Å; T227-M230 PolarHBondContact O-N 3.14Å; T227-Y231 PolarHBondContact O-N 2.59Å; T227-Y231 VanDerWaalsContact O-N 3.11Å; T227-F261 HydrophobicContact CG2-CD2 4.17Å; T227-F261 HydrophobicContact CG2-CE2 3.83Å; T227-F261 HydrophobicContact CG2-CZ 4.39Å
228	Y	94.1	Very high	84.5	Confident	5 Å²	5	35.6 Å²	35.6	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-36.4	175.5	-174.5	-92.7	0	0	0	112.5	V224 L225 M230 Y231 N232 L235 M243 F261 F264 V265 M268	V224-Y228 WeakPolarHBondContact O-CB 3.4Å; V224-Y228 PolarHBondContact O-N 3.27Å; L225-Y228 PolarHBondContact O-N 2.8Å; Y228-M230 PolarHBondContact O-N 3.05Å; Y228-Y231 HydrophobicContact CD2-CD1 4.35Å; Y228-Y231 HydrophobicContact CE2-CD1 4.1Å; Y228-Y231 WeakPolarHBondContact O-CB 3.36Å; Y228-Y231 PolarHBondContact O-N 2.93Å; Y228-N232 HydrophobicContact CE1-CB 4.43Å; Y228-N232 PolarHBondContact O-N 3.03Å; Y228-L235 HydrophobicContact CE1-CD1 3.58Å; Y228-L235 WeakPolarHBondContact OH-CD1 3.49Å; Y228-M243 HydrophobicContact CD1-CE 3.71Å; Y228-M243 HydrophobicContact CE1-CE 3.47Å; Y228-M243 VanDerWaalsContact CE1-CE 3.47Å; Y228-F261 HydrophobicContact CD2-CE2 4.4Å; Y228-F264 AromaticContact CD1-CE1 3.96Å; Y228-F264 HydrophobicContact CD1-CE1 3.96Å; Y228-F264 AromaticContact CD2-CD1 3.72Å; Y228-F264 HydrophobicContact CD2-CD1 3.72Å; Y228-F264 AromaticContact CD2-CE1 3.85Å; Y228-F264 HydrophobicContact CD2-CE1 3.85Å; Y228-F264 HydrophobicContact CE1-CE1 4.32Å; Y228-F264 HydrophobicContact CE2-CD1 4.19Å; Y228-F264 HydrophobicContact CE2-CE1 4.2Å; Y228-F264 AromaticContact CG-CD1 3.96Å; Y228-F264 HydrophobicContact CG-CD1 3.96Å; Y228-F264 AromaticContact CG-CE1 3.71Å; Y228-F264 HydrophobicContact CG-CE1 3.71Å; Y228-V265 HydrophobicContact CD2-CG2 3.92Å; Y228-V265 HydrophobicContact CE2-CG2 3.95Å; Y228-M268 HydrophobicContact CE1-CG 4.44Å; Y228-M268 HydrophobicContact CE2-CB 4.1Å; Y228-M268 HydrophobicContact CE2-CG 4.05Å; Y228-M268 VanDerWaalsContact OH-CB 3.23Å; Y228-M268 WeakPolarHBondContact OH-CB 3.43Å
229	M	90.2	Very high	83.7	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-55.7	-35.5	171.2	179.8	-179.1	68.9	0	0	112.6	H189 F192 L225 M226 T227 C238	H189-M229 WeakPolarHBondContact CD2-CE 3.43Å; F192-M229 HydrophobicContact CB-SD 3.65Å; F192-M229 HydrophobicContact CD2-SD 4.22Å; F192-M229 HydrophobicContact CG-SD 4.34Å; L225-M229 PolarHBondContact O-N 2.56Å; M226-M229 HydrophobicContact CE-CE 3.75Å; M226-M229 WeakPolarHBondContact O-CB 3.45Å; M226-M229 PolarHBondContact O-N 3Å; M226-M229 HydrophobicContact SD-CE 4.27Å; T227-M229 VanDerWaalsContact C-N 3.31Å; T227-M229 PolarHBondContact O-N 3.27Å; M229-C238 HydrophobicContact CG-CB 3.72Å; M229-C238 VanDerWaalsContact CG-SG 3.59Å; M229-C238 HydrophobicContact SD-CB 4.33Å
230	M	90.7	Very high	83	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.059	17%	0.166	C	C	.	.	H	α-helix	trans	-79.5	-26.2	176.8	-54.7	-57.9	-81.7	0	0	112.7	L171 Q174 W175 W186 T227 Y228 F233	L171-M230 HydrophobicContact CD2-CB 4.36Å; Q174-M230 HydrophobicContact CB-CE 3.36Å; Q174-M230 HydrophobicContact CG-CE 4.5Å; W175-M230 HydrophobicContact CB-CE 4.14Å; W175-M230 HydrophobicContact CB-CG 3.73Å; W175-M230 HydrophobicContact CB-SD 3.81Å; W175-M230 HydrophobicContact CG-CG 4.2Å; W186-M230 HydrophobicContact CH2-CE 4.14Å; W186-M230 HydrophobicContact CH2-SD 4.14Å; T227-M230 WeakPolarHBondContact O-CB 3.42Å; T227-M230 PolarHBondContact O-N 3.14Å; Y228-M230 PolarHBondContact O-N 3.05Å; M230-F233 HydrophobicContact CB-CE2 4.24Å; M230-F233 HydrophobicContact CB-CZ 4.21Å; M230-F233 HydrophobicContact CE-CE1 4.37Å; M230-F233 HydrophobicContact CE-CE2 4.31Å; M230-F233 HydrophobicContact CE-CZ 3.51Å; M230-F233 HydrophobicContact CG-CZ 4.43Å; M230-F233 WeakPolarHBondContact O-CD2 3.29Å; M230-F233 WeakPolarHBondContact O-CE2 3.43Å; M230-F233 HydrophobicContact SD-CE1 3.79Å; M230-F233 HydrophobicContact SD-CE2 4.31Å; M230-F233 HydrophobicContact SD-CZ 3.38Å; M230-F233 WeakPolarHBondContact SD-CZ 3.4Å
231	Y	92	Very high	82.2	Confident	94 Å²	94	32.7 Å²	32.7	37%	0.369	17%	0.165	S	C	.	.	H	α-helix	trans	-72.9	-48.5	178.1	177.2	-100.1	0	0	0	112	L171 T227 Y228 F261 W262 V265	L171-Y231 HydrophobicContact CD1-CD2 3.89Å; T227-Y231 PolarHBondContact O-N 2.59Å; T227-Y231 VanDerWaalsContact O-N 3.11Å; Y228-Y231 HydrophobicContact CD2-CD1 4.35Å; Y228-Y231 HydrophobicContact CE2-CD1 4.1Å; Y228-Y231 WeakPolarHBondContact O-CB 3.36Å; Y228-Y231 PolarHBondContact O-N 2.93Å; Y231-F261 HydrophobicContact CD2-CZ 4.15Å; Y231-F261 AromaticContact CG-CZ 3.97Å; Y231-F261 HydrophobicContact CG-CZ 3.97Å; Y231-W262 HydrophobicContact CD2-CH2 4.43Å; Y231-W262 HydrophobicContact CD2-CZ3 4.49Å; Y231-W262 HydrophobicContact CE2-CH2 4.03Å; Y231-W262 AromaticContact CE2-CZ3 3.87Å; Y231-W262 HydrophobicContact CE2-CZ3 3.87Å; Y231-V265 HydrophobicContact CD1-CG1 4.41Å; Y231-V265 HydrophobicContact CD1-CG2 3.95Å; Y231-V265 HydrophobicContact CE1-CB 4.43Å; Y231-V265 HydrophobicContact CE1-CG1 3.58Å; Y231-V265 HydrophobicContact CE1-CG2 3.95Å; Y231-V265 HydrophobicContact CG-CG2 4.37Å
232	N	86	Confident	81.6	Confident	31 Å²	31	32.7 Å²	32.7	17%	0.166	17%	0.165	C	C	.	.			trans	-119.7	80.4	179.1	-167.9	-12.8	0	0	0	110.2	Y228 D234 L235 E272	Y228-N232 HydrophobicContact CE1-CB 4.43Å; Y228-N232 PolarHBondContact O-N 3.03Å; N232-D234 PolarHBondContact O-N 2.99Å; N232-D234 PolarHBondContact OD1-N 3.14Å; N232-L235 HydrophobicContact CB-CD1 3.94Å; N232-L235 WeakPolarHBondContact ND2-CD1 3.08Å; N232-L235 WeakPolarHBondContact ND2-CG 3.39Å; N232-L235 PolarHBondContact OD1-N 2.85Å; N232-L235 VanDerWaalsContact OD1-N 3.09Å; N232-E272 PolarHBondContact ND2-OE2 3.18Å
233	F	77.5	Confident	81.3	Confident	87 Å²	87	31.1 Å²	31.1	38%	0.382	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.5	175.3	-82.8	-72	0	0	0	113.2	W186 M230	W186-F233 AromaticContact CH2-CE1 3.7Å; W186-F233 HydrophobicContact CH2-CE1 3.7Å; W186-F233 HydrophobicContact CH2-CZ 4.04Å; W186-F233 HydrophobicContact CZ2-CD1 4.41Å; W186-F233 AromaticContact CZ2-CE1 3.57Å; W186-F233 HydrophobicContact CZ2-CE1 3.57Å; W186-F233 HydrophobicContact CZ2-CZ 4.33Å; M230-F233 HydrophobicContact CB-CE2 4.24Å; M230-F233 HydrophobicContact CB-CZ 4.21Å; M230-F233 HydrophobicContact CE-CE1 4.37Å; M230-F233 HydrophobicContact CE-CE2 4.31Å; M230-F233 HydrophobicContact CE-CZ 3.51Å; M230-F233 HydrophobicContact CG-CZ 4.43Å; M230-F233 WeakPolarHBondContact O-CD2 3.29Å; M230-F233 WeakPolarHBondContact O-CE2 3.43Å; M230-F233 HydrophobicContact SD-CE1 3.79Å; M230-F233 HydrophobicContact SD-CE2 4.31Å; M230-F233 HydrophobicContact SD-CZ 3.38Å; M230-F233 WeakPolarHBondContact SD-CZ 3.4Å
234	D	68.7	Low	81.1	Confident	151 Å²	151	30.6 Å²	30.6	81%	0.807	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-2.8	-166.7	-84.2	-18.9	0	0	0	114.5	N232 G236	N232-D234 PolarHBondContact O-N 2.99Å; N232-D234 PolarHBondContact OD1-N 3.14Å; D234-G236 PolarHBondContact O-N 2.96Å
235	L	57.4	Low	80.8	Confident	12 Å²	12	30.8 Å²	30.8	6%	0.063	16%	0.156	C	C	.	.	S	Bend	trans	-52.5	-8.5	-171.5	-136.3	154.4	0	0	0	115.4	Y228 N232 E272 F275 Y276	Y228-L235 HydrophobicContact CE1-CD1 3.58Å; Y228-L235 WeakPolarHBondContact OH-CD1 3.49Å; N232-L235 HydrophobicContact CB-CD1 3.94Å; N232-L235 WeakPolarHBondContact ND2-CD1 3.08Å; N232-L235 WeakPolarHBondContact ND2-CG 3.39Å; N232-L235 PolarHBondContact OD1-N 2.85Å; N232-L235 VanDerWaalsContact OD1-N 3.09Å; L235-E272 HydrophobicContact CD2-CB 4.16Å; L235-F275 HydrophobicContact CD2-CB 4.44Å; L235-Y276 HydrophobicContact CD2-CD1 3.7Å; L235-Y276 HydrophobicContact CD2-CE1 3.44Å; L235-Y276 VanDerWaalsContact CD2-CE1 3.44Å; L235-Y276 HydrophobicContact CG-CE1 3.94Å; L235-Y276 VanDerWaalsContact O-CD1 3.23Å; L235-Y276 WeakPolarHBondContact O-CD1 3.19Å; L235-Y276 WeakPolarHBondContact O-CE1 3.43Å
236	G	47	Very low	80.8	Confident	34 Å²	34	30.7 Å²	30.7	35%	0.351	16%	0.156	S	C	.	.	S	Bend	trans	135.9	9.7	177.6	0	0	0	0	0	112.6	D234	D234-G236 PolarHBondContact O-N 2.96Å
237	K	49.9	Very low	81	Confident	132 Å²	132	30.7 Å²	30.7	57%	0.574	16%	0.156	S	C	*	.	S	Bend	trans	88.7	77.5	-163.2	-54.4	-169.7	174.2	-148.9	0	112.4	D188 F192	D188-K237 IonicContact OD2-NZ 3.47Å; D188-K237 PolarHBondContact OD2-NZ 3.01Å; F192-K237 WeakPolarHBondContact CE1-O 3.43Å; F192-K237 HydrophobicContact CE2-CB 4.36Å; F192-K237 HydrophobicContact CZ-CB 3.8Å; F192-K237 WeakPolarHBondContact CZ-O 3.48Å
238	C	66.5	Low	81	Confident	11 Å²	11	30.7 Å²	30.7	7%	0.074	16%	0.156	C	C	.	.	S	Bend	trans	28.2	160.3	166.9	-58.3	0	0	0	0	121.9	F192 M229	F192-C238 HydrophobicContact CB-CB 4.26Å; F192-C238 VanDerWaalsContact CD1-C 3.46Å; F192-C238 HydrophobicContact CD1-CB 3.92Å; F192-C238 WeakPolarHBondContact CD1-O 3.5Å; F192-C238 HydrophobicContact CD2-CB 3.34Å; F192-C238 HydrophobicContact CE1-CB 4.17Å; F192-C238 WeakPolarHBondContact CE1-O 3.26Å; F192-C238 HydrophobicContact CE2-CB 3.57Å; F192-C238 HydrophobicContact CG-CB 3.55Å; F192-C238 HydrophobicContact CZ-CB 4.04Å; M229-C238 HydrophobicContact CG-CB 3.72Å; M229-C238 VanDerWaalsContact CG-SG 3.59Å; M229-C238 HydrophobicContact SD-CB 4.33Å
239	Y	78.2	Confident	81.2	Confident	9 Å²	9	30.4 Å²	30.4	4%	0.035	16%	0.155	C	C	.	.			trans	12.2	116.8	-173.9	-173	-89	0	0	0	117.5	I195 I196 D199 L225 M243 S244	I195-Y239 HydrophobicContact CB-CD1 4.16Å; I195-Y239 HydrophobicContact CG2-CD1 3.56Å; I195-Y239 HydrophobicContact CG2-CE1 3.63Å; I196-Y239 HydrophobicContact CD1-CD2 4.16Å; I196-Y239 HydrophobicContact CD1-CG 4.01Å; I196-Y239 HydrophobicContact CG1-CD1 3.69Å; I196-Y239 HydrophobicContact CG1-CD2 3.57Å; I196-Y239 HydrophobicContact CG1-CE1 4.2Å; I196-Y239 HydrophobicContact CG1-CE2 4.06Å; I196-Y239 HydrophobicContact CG1-CG 3.36Å; D199-Y239 HydrophobicContact CB-CE1 4.27Å; D199-Y239 WeakPolarHBondContact CB-OH 3.04Å; D199-Y239 WeakPolarHBondContact OD2-CE1 3.34Å; D199-Y239 PolarHBondContact OD2-OH 3.08Å; L225-Y239 HydrophobicContact CB-CD2 4.42Å; L225-Y239 HydrophobicContact CB-CE2 4.48Å; L225-Y239 HydrophobicContact CD1-CD2 4.28Å; L225-Y239 HydrophobicContact CD1-CE2 3.55Å; L225-Y239 HydrophobicContact CD2-CD2 3.93Å; L225-Y239 HydrophobicContact CD2-CE2 3.61Å; L225-Y239 HydrophobicContact CG-CD2 4.43Å; L225-Y239 HydrophobicContact CG-CE2 4.05Å; Y239-M243 HydrophobicContact CD2-CB 3.97Å; Y239-M243 HydrophobicContact CD2-SD 4.21Å; Y239-M243 HydrophobicContact CE2-CB 3.47Å; Y239-M243 VanDerWaalsContact CE2-CB 3.47Å; Y239-S244 WeakPolarHBondContact OH-CB 3.34Å; Y239-S244 PolarHBondContact OH-N 3.39Å; Y239-S244 PolarHBondContact OH-OG 2.86Å; Y239-S244 VanDerWaalsContact OH-OG 3.13Å
240	V	79.3	Confident	81.5	Confident	32 Å²	32	30.2 Å²	30.2	19%	0.194	15%	0.154	C	C	.	.			trans	-107.1	139.7	173.3	-179	0	0	0	0	110.4	G242 M243 F275	V240-G242 PolarHBondContact O-N 3.27Å; V240-M243 HydrophobicContact CB-SD 4.35Å; V240-M243 PolarHBondContact N-SD 3.16Å; V240-M243 VanDerWaalsContact N-SD 3.39Å; V240-M243 WeakPolarHBondContact O-CB 3.37Å; V240-M243 VanDerWaalsContact O-CG 3.26Å; V240-M243 WeakPolarHBondContact O-CG 3.44Å; V240-M243 PolarHBondContact O-N 2.9Å; V240-M243 VanDerWaalsContact O-N 3.12Å; V240-F275 HydrophobicContact CB-CB 4.09Å; V240-F275 HydrophobicContact CB-CD1 3.79Å; V240-F275 HydrophobicContact CB-CG 4.39Å; V240-F275 HydrophobicContact CG1-CB 4.5Å; V240-F275 HydrophobicContact CG1-CD1 3.83Å; V240-F275 HydrophobicContact CG2-CB 4.09Å; V240-F275 WeakPolarHBondContact CG2-O 3.17Å
241	Q	79.3	Confident	81.8	Confident	21 Å²	21	29.7 Å²	29.7	10%	0.098	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	133.5	179.7	-178.8	167	-12.1	0	0	111.2	D58 M59 D199	D58-Q241 PolarHBondContact OD1-NE2 3.3Å; D58-Q241 VanDerWaalsContact OD1-NE2 3.11Å; D58-Q241 PolarHBondContact OD1-OE1 2.89Å; D58-Q241 VanDerWaalsContact OD1-OE1 3.05Å; M59-Q241 HydrophobicContact CB-CG 4.3Å; M59-Q241 HydrophobicContact CG-CG 4Å; D199-Q241 WeakPolarHBondContact OD2-CA 3.35Å; D199-Q241 WeakPolarHBondContact OD2-CG 3.15Å
242	G	83.1	Confident	82.1	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.01	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	-16.1	-172.4	0	0	0	0	0	114.1	D199 V240 S244 D245 L246	D199-G242 PolarHBondContact OD2-N 3.45Å; V240-G242 PolarHBondContact O-N 3.27Å; G242-S244 VanDerWaalsContact C-N 3.27Å; G242-S244 PolarHBondContact O-N 3.36Å; G242-D245 WeakPolarHBondContact O-CB 3.2Å; G242-D245 PolarHBondContact O-N 3.08Å; G242-D245 VanDerWaalsContact O-N 3.1Å; G242-L246 PolarHBondContact O-N 2.83Å
243	M	89.1	Confident	82.5	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-31.9	172.2	-74.5	178.2	69.3	0	0	112.5	Y228 Y239 V240 D245 L246 L247 F264 M268 F275	Y228-M243 HydrophobicContact CD1-CE 3.71Å; Y228-M243 HydrophobicContact CE1-CE 3.47Å; Y228-M243 VanDerWaalsContact CE1-CE 3.47Å; Y239-M243 HydrophobicContact CD2-CB 3.97Å; Y239-M243 HydrophobicContact CD2-SD 4.21Å; Y239-M243 HydrophobicContact CE2-CB 3.47Å; Y239-M243 VanDerWaalsContact CE2-CB 3.47Å; V240-M243 HydrophobicContact CB-SD 4.35Å; V240-M243 PolarHBondContact N-SD 3.16Å; V240-M243 VanDerWaalsContact N-SD 3.39Å; V240-M243 WeakPolarHBondContact O-CB 3.37Å; V240-M243 VanDerWaalsContact O-CG 3.26Å; V240-M243 WeakPolarHBondContact O-CG 3.44Å; V240-M243 PolarHBondContact O-N 2.9Å; V240-M243 VanDerWaalsContact O-N 3.12Å; M243-D245 VanDerWaalsContact C-N 3.3Å; M243-D245 PolarHBondContact O-N 3.11Å; M243-L246 PolarHBondContact O-N 3.21Å; M243-L247 PolarHBondContact O-N 3.36Å; M243-F264 HydrophobicContact CB-CZ 4.15Å; M243-F264 HydrophobicContact CE-CE1 3.85Å; M243-F264 HydrophobicContact CE-CZ 3.64Å; M243-M268 HydrophobicContact CE-CE 3.52Å; M243-M268 HydrophobicContact CE-CG 4.36Å; M243-M268 HydrophobicContact CE-SD 3.88Å; M243-M268 HydrophobicContact CG-CE 4.29Å; M243-M268 HydrophobicContact CG-SD 4.42Å; M243-M268 HydrophobicContact SD-CE 4.11Å; M243-F275 HydrophobicContact CG-CD1 3.98Å; M243-F275 HydrophobicContact CG-CE1 3.9Å; M243-F275 HydrophobicContact CG-CG 4.34Å; M243-F275 HydrophobicContact CG-CZ 4.21Å
244	S	92.1	Very high	83.4	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-35.4	171.2	58.9	0	0	0	0	113.1	T203 Y239 G242 L246 L247 S248	T203-S244 PolarHBondContact OG1-OG 3.14Å; Y239-S244 WeakPolarHBondContact OH-CB 3.34Å; Y239-S244 PolarHBondContact OH-N 3.39Å; Y239-S244 PolarHBondContact OH-OG 2.86Å; Y239-S244 VanDerWaalsContact OH-OG 3.13Å; G242-S244 VanDerWaalsContact C-N 3.27Å; G242-S244 PolarHBondContact O-N 3.36Å; S244-L246 VanDerWaalsContact C-N 3.3Å; S244-L246 PolarHBondContact O-N 3.27Å; S244-L247 PolarHBondContact O-N 2.94Å; S244-S248 WeakPolarHBondContact O-CB 3.42Å; S244-S248 PolarHBondContact O-N 3.19Å
245	D	91.8	Very high	84.6	Confident	3 Å²	3	18.8 Å²	18.8	2%	0.016	11%	0.109	C	C	.	.	H	α-helix	trans	-64.6	-38.6	176.3	-73	-38.6	0	0	0	110.1	G242 M243 P249 I321 K324 R325	G242-D245 WeakPolarHBondContact O-CB 3.2Å; G242-D245 PolarHBondContact O-N 3.08Å; G242-D245 VanDerWaalsContact O-N 3.1Å; M243-D245 VanDerWaalsContact C-N 3.3Å; M243-D245 PolarHBondContact O-N 3.11Å; D245-P249 WeakPolarHBondContact O-CD 3.14Å; D245-I321 HydrophobicContact CB-CG2 4.46Å; D245-K324 HydrophobicContact CB-CG 3.96Å; D245-K324 WeakPolarHBondContact O-CE 3.35Å; D245-K324 WeakPolarHBondContact O-CG 3.34Å; D245-R325 IonicContact OD1-CZ 2.78Å; D245-R325 IonicContact OD1-NE 3.48Å; D245-R325 IonicContact OD1-NH2 2.92Å; D245-R325 PolarHBondContact OD1-NH2 2.96Å; D245-R325 IonicContact OD2-CZ 2.72Å; D245-R325 VanDerWaalsContact OD2-CZ 3.3Å; D245-R325 IonicContact OD2-NE 3.22Å; D245-R325 PolarHBondContact OD2-NE 3.27Å; D245-R325 IonicContact OD2-NH2 3.46Å; D245-R325 PolarHBondContact OD2-NH2 2.96Å
246	L	95.2	Very high	86.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.9	-38.6	175.3	-65	-174.9	0	0	0	112.8	G242 M243 S244 F264 F267 M268 F275 I321 W336	G242-L246 PolarHBondContact O-N 2.83Å; M243-L246 PolarHBondContact O-N 3.21Å; S244-L246 VanDerWaalsContact C-N 3.3Å; S244-L246 PolarHBondContact O-N 3.27Å; L246-F264 HydrophobicContact CB-CE2 4.09Å; L246-F267 HydrophobicContact CB-CD1 4.36Å; L246-F267 HydrophobicContact CB-CE1 4.01Å; L246-F267 HydrophobicContact CD2-CE1 3.93Å; L246-F267 HydrophobicContact CD2-CZ 3.89Å; L246-F267 HydrophobicContact CG-CE1 4.42Å; L246-M268 HydrophobicContact CD1-SD 4.23Å; L246-F275 HydrophobicContact CD1-CE2 3.81Å; L246-F275 HydrophobicContact CD1-CZ 3.61Å; L246-I321 HydrophobicContact CD2-CB 4.27Å; L246-W336 HydrophobicContact CD2-CH2 4.24Å; L246-W336 HydrophobicContact CD2-CZ2 3.93Å; L246-W336 WeakPolarHBondContact O-CH2 3.18Å
247	L	97	Very high	88.6	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-73.3	-34.3	-179.1	175.8	61.1	0	0	0	113	L221 V224 L225 M243 S244 L250 V251 F264	L221-L247 HydrophobicContact CD2-CD2 4.25Å; L221-L247 HydrophobicContact CG-CD2 3.87Å; L221-L247 HydrophobicContact CG-CG 4.22Å; V224-L247 HydrophobicContact CB-CD1 4.5Å; V224-L247 HydrophobicContact CB-CD2 3.9Å; V224-L247 HydrophobicContact CG1-CD1 3.69Å; V224-L247 HydrophobicContact CG1-CD2 3.65Å; V224-L247 HydrophobicContact CG1-CG 4.35Å; L225-L247 HydrophobicContact CD1-CD2 4.3Å; L225-L247 HydrophobicContact CD2-CB 4.47Å; L225-L247 HydrophobicContact CD2-CD2 3.62Å; L225-L247 HydrophobicContact CG-CD2 3.55Å; M243-L247 PolarHBondContact O-N 3.36Å; S244-L247 PolarHBondContact O-N 2.94Å; L247-L250 HydrophobicContact CD1-CB 4.4Å; L247-L250 HydrophobicContact CD1-CD1 4.42Å; L247-L250 WeakPolarHBondContact O-CA 3.35Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.41Å; L247-V251 HydrophobicContact CD1-CG2 3.75Å; L247-V251 HydrophobicContact CD2-CG2 4.36Å; L247-V251 HydrophobicContact CG-CG2 3.75Å; L247-V251 PolarHBondContact O-N 3.17Å; L247-F264 HydrophobicContact CB-CD2 3.86Å; L247-F264 HydrophobicContact CB-CE2 3.86Å; L247-F264 HydrophobicContact CB-CG 4.46Å; L247-F264 HydrophobicContact CB-CZ 4.46Å; L247-F264 HydrophobicContact CD1-CB 3.82Å; L247-F264 HydrophobicContact CD1-CD2 3.98Å; L247-F264 HydrophobicContact CD1-CG 3.87Å; L247-F264 HydrophobicContact CG-CD2 4.48Å
248	S	96.9	Very high	90.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-52.2	-50.3	-172.7	164.1	0	0	0	0	114.3	D204 F210 S244 L250 V251 Y252 F329	D204-S248 VanDerWaalsContact OD2-CB 3.29Å; D204-S248 WeakPolarHBondContact OD2-CB 3.32Å; D204-S248 PolarHBondContact OD2-OG 3.41Å; F210-S248 WeakPolarHBondContact CE2-OG 3.23Å; F210-S248 WeakPolarHBondContact CZ-OG 3.32Å; S244-S248 WeakPolarHBondContact O-CB 3.42Å; S244-S248 PolarHBondContact O-N 3.19Å; S248-L250 VanDerWaalsContact C-N 3.3Å; S248-L250 PolarHBondContact O-N 2.87Å; S248-V251 PolarHBondContact O-N 3.26Å; S248-Y252 PolarHBondContact O-N 3.47Å; S248-F329 WeakPolarHBondContact OG-CZ 3.26Å
249	P	97.1	Very high	92.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.2	-36.9	173.6	-33	42.2	0	0	0	114.4	D245 Y252 I253 K324 I332 F333 W336	D245-P249 WeakPolarHBondContact O-CD 3.14Å; P249-Y252 PolarHBondContact O-N 3.37Å; P249-I253 WeakPolarHBondContact O-CG1 3.27Å; P249-I253 PolarHBondContact O-N 3.09Å; P249-K324 HydrophobicContact CG-CD 3.71Å; P249-I332 HydrophobicContact CG-CG2 4.33Å; P249-F333 HydrophobicContact CB-CD1 4.32Å; P249-F333 HydrophobicContact CB-CE1 3.84Å; P249-W336 HydrophobicContact CB-CE3 4.29Å; P249-W336 HydrophobicContact CB-CH2 4.05Å; P249-W336 HydrophobicContact CB-CZ3 3.5Å; P249-W336 HydrophobicContact CG-CH2 3.57Å; P249-W336 HydrophobicContact CG-CZ3 3.58Å
250	L	97.7	Very high	93.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.3	-44.9	178.9	-56.1	177.6	0	0	0	110.3	W141 L145 L247 S248 Y252 I253 F254 S260 A263 F264 F267 W340	W141-L250 HydrophobicContact CE3-CD2 3.78Å; W141-L250 HydrophobicContact CZ3-CD2 3.63Å; L145-L250 HydrophobicContact CD1-CD2 3.77Å; L247-L250 HydrophobicContact CD1-CB 4.4Å; L247-L250 HydrophobicContact CD1-CD1 4.42Å; L247-L250 WeakPolarHBondContact O-CA 3.35Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.41Å; S248-L250 VanDerWaalsContact C-N 3.3Å; S248-L250 PolarHBondContact O-N 2.87Å; L250-Y252 VanDerWaalsContact C-N 3.26Å; L250-Y252 PolarHBondContact O-N 2.94Å; L250-I253 PolarHBondContact O-N 2.95Å; L250-F254 HydrophobicContact CB-CD2 4.31Å; L250-F254 HydrophobicContact CD2-CE2 4.43Å; L250-F254 WeakPolarHBondContact O-CD2 3.46Å; L250-F254 PolarHBondContact O-N 3.26Å; L250-S260 PolarHBondContact O-OG 2.78Å; L250-A263 HydrophobicContact CD1-CB 4.27Å; L250-A263 HydrophobicContact CD2-CB 4.37Å; L250-F264 VanDerWaalsContact CD1-CA 3.46Å; L250-F264 HydrophobicContact CD1-CB 3.72Å; L250-F264 HydrophobicContact CD1-CD2 3.95Å; L250-F264 HydrophobicContact CD1-CG 4.35Å; L250-F267 HydrophobicContact CD1-CB 4.49Å; L250-F267 HydrophobicContact CD1-CD1 4.18Å; L250-W340 HydrophobicContact CD2-CH2 4Å
251	V	97.1	Very high	94.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59.7	-41.5	176.5	175	0	0	0	0	111	F209 F210 L220 L247 S248 G255 S260	F209-V251 HydrophobicContact CE1-CG1 3.98Å; F209-V251 HydrophobicContact CZ-CG1 4.4Å; F210-V251 HydrophobicContact CE1-CG1 4.42Å; L220-V251 HydrophobicContact CB-CG1 4.45Å; L220-V251 HydrophobicContact CD1-CG1 4.17Å; L220-V251 HydrophobicContact CD2-CB 4.16Å; L220-V251 HydrophobicContact CD2-CG1 3.51Å; L220-V251 HydrophobicContact CD2-CG2 3.59Å; L220-V251 HydrophobicContact CG-CG1 4.25Å; L247-V251 HydrophobicContact CD1-CG2 3.75Å; L247-V251 HydrophobicContact CD2-CG2 4.36Å; L247-V251 HydrophobicContact CG-CG2 3.75Å; L247-V251 PolarHBondContact O-N 3.17Å; S248-V251 PolarHBondContact O-N 3.26Å; V251-G255 WeakPolarHBondContact O-CA 3.44Å; V251-G255 PolarHBondContact O-N 2.78Å; V251-S260 WeakPolarHBondContact CA-OG 3.37Å
252	Y	96.5	Very high	95	Very high	64 Å²	64	14.1 Å²	14.1	25%	0.251	8%	0.08	S	C	.	.	H	α-helix	trans	-62	-45.5	176.6	174.9	-98.5	0	0	0	113	H134 H207 F209 S248 P249 L250 F329 F333	H134-Y252 AromaticContact CE1-CE1 3.92Å; H207-Y252 AromaticContact CE1-CD2 3.91Å; H207-Y252 AromaticContact CE1-CE2 3.56Å; F209-Y252 HydrophobicContact CB-CD2 3.81Å; F209-Y252 HydrophobicContact CB-CE2 4.15Å; F209-Y252 HydrophobicContact CD1-CD2 4.03Å; F209-Y252 AromaticContact CD2-CD2 3.66Å; F209-Y252 HydrophobicContact CD2-CD2 3.66Å; F209-Y252 HydrophobicContact CD2-CE2 4.09Å; F209-Y252 HydrophobicContact CE1-CD2 4.49Å; F209-Y252 HydrophobicContact CE2-CD2 4.18Å; F209-Y252 AromaticContact CG-CD2 3.58Å; F209-Y252 HydrophobicContact CG-CD2 3.58Å; F209-Y252 HydrophobicContact CG-CE2 4.22Å; S248-Y252 PolarHBondContact O-N 3.47Å; P249-Y252 PolarHBondContact O-N 3.37Å; L250-Y252 VanDerWaalsContact C-N 3.26Å; L250-Y252 PolarHBondContact O-N 2.94Å; Y252-F329 HydrophobicContact CD1-CD1 4.01Å; Y252-F329 HydrophobicContact CD1-CE1 4.46Å; Y252-F329 HydrophobicContact CE1-CD1 4.44Å; Y252-F329 HydrophobicContact CG-CD1 4.05Å; Y252-F329 HydrophobicContact CG-CE1 4.08Å; Y252-F333 HydrophobicContact CD1-CE1 4.3Å; Y252-F333 HydrophobicContact CD1-CE2 4.17Å; Y252-F333 AromaticContact CD1-CZ 3.43Å; Y252-F333 HydrophobicContact CD1-CZ 3.43Å; Y252-F333 VanDerWaalsContact CD1-CZ 3.43Å; Y252-F333 AromaticContact CE1-CE2 3.88Å; Y252-F333 HydrophobicContact CE1-CE2 3.88Å; Y252-F333 AromaticContact CE1-CZ 3.59Å; Y252-F333 HydrophobicContact CE1-CZ 3.59Å
253	I	96.1	Very high	95.7	Very high	17 Å²	17	14.1 Å²	14.1	9%	0.087	8%	0.079	C	C	.	.	H	α-helix	trans	-73.4	-43.5	-177.6	-69.2	-60.9	0	0	0	112.5	R137 K138 W141 P249 L250 F333	R137-I253 HydrophobicContact CB-CD1 4.3Å; R137-I253 HydrophobicContact CB-CG2 3.83Å; K138-I253 HydrophobicContact CB-CG2 4.4Å; W141-I253 HydrophobicContact CD2-CG2 4.3Å; W141-I253 HydrophobicContact CE3-CB 4.16Å; W141-I253 HydrophobicContact CE3-CG1 4.24Å; W141-I253 HydrophobicContact CE3-CG2 3.95Å; W141-I253 HydrophobicContact CH2-CG1 3.77Å; W141-I253 HydrophobicContact CZ2-CG1 4.38Å; W141-I253 HydrophobicContact CZ3-CB 3.95Å; W141-I253 HydrophobicContact CZ3-CG1 3.65Å; W141-I253 HydrophobicContact CZ3-CG2 4.23Å; P249-I253 WeakPolarHBondContact O-CG1 3.27Å; P249-I253 PolarHBondContact O-N 3.09Å; L250-I253 PolarHBondContact O-N 2.95Å; I253-F333 HydrophobicContact CD1-CD2 4.26Å; I253-F333 HydrophobicContact CD1-CE1 4.18Å; I253-F333 HydrophobicContact CD1-CE2 3.84Å; I253-F333 HydrophobicContact CD1-CZ 3.78Å; I253-F333 HydrophobicContact CG1-CD1 4.44Å; I253-F333 HydrophobicContact CG1-CE1 4.01Å; I253-F333 HydrophobicContact CG1-CZ 4.07Å
254	F	96.2	Very high	96.1	Very high	6 Å²	6	14 Å²	14	3%	0.026	8%	0.079	C	C	.	.	H	α-helix	trans	-79.5	-43.4	-177.4	-71.6	-73.1	0	0	0	111.6	K138 W141 K142 L250 D256 D259 S260 A263	K138-F254 WeakPolarHBondContact CE-O 3.45Å; K138-F254 HydrophobicContact CG-CD1 3.84Å; K138-F254 HydrophobicContact CG-CE1 4.24Å; K138-F254 PolarHBondContact NZ-O 3.43Å; K138-F254 VanDerWaalsContact O-CE1 3.32Å; K138-F254 WeakPolarHBondContact O-CE1 3.46Å; W141-F254 HydrophobicContact CB-CE2 4.45Å; W141-F254 HydrophobicContact CB-CZ 3.86Å; W141-F254 HydrophobicContact CE3-CE2 4.19Å; K142-F254 HydrophobicContact CD-CE1 4.49Å; K142-F254 HydrophobicContact CG-CE1 3.79Å; K142-F254 HydrophobicContact CG-CZ 4.23Å; L250-F254 HydrophobicContact CB-CD2 4.31Å; L250-F254 HydrophobicContact CD2-CE2 4.43Å; L250-F254 WeakPolarHBondContact O-CD2 3.46Å; L250-F254 PolarHBondContact O-N 3.26Å; F254-D256 PolarHBondContact O-N 3.46Å; F254-D259 HydrophobicContact CB-CB 4.13Å; F254-D259 HydrophobicContact CD1-CB 3.44Å; F254-D259 VanDerWaalsContact CD1-CB 3.44Å; F254-D259 HydrophobicContact CE1-CB 4.02Å; F254-D259 HydrophobicContact CG-CB 3.86Å; F254-S260 WeakPolarHBondContact CB-OG 3.45Å; F254-A263 HydrophobicContact CD2-CB 4.03Å; F254-A263 HydrophobicContact CE2-CB 3.26Å; F254-A263 HydrophobicContact CZ-CB 3.72Å
255	G	92.6	Very high	96.3	Very high	47 Å²	47	14.1 Å²	14.1	49%	0.485	8%	0.079	S	C	.	.			trans	64.3	14.2	-175.8	0	0	0	0	0	114	V251	V251-G255 WeakPolarHBondContact O-CA 3.44Å; V251-G255 PolarHBondContact O-N 2.78Å
256	D	92.8	Very high	96.5	Very high	41 Å²	41	14.4 Å²	14.4	22%	0.219	8%	0.083	C	C	.	.	S	Bend	trans	-142.2	150.2	174.8	74.5	86.9	0	0	0	111.3	K138 F254 V258 D259 S260	K138-D256 WeakPolarHBondContact CE-OD2 3.45Å; K138-D256 IonicContact NZ-OD2 3.19Å; K138-D256 PolarHBondContact NZ-OD2 3.05Å; F254-D256 PolarHBondContact O-N 3.46Å; D256-V258 PolarHBondContact OD1-N 3.36Å; D256-D259 VanDerWaalsContact OD1-CB 3.23Å; D256-D259 WeakPolarHBondContact OD1-CB 3.48Å; D256-D259 PolarHBondContact OD1-N 2.86Å; D256-S260 WeakPolarHBondContact O-CB 3.24Å; D256-S260 PolarHBondContact O-N 3.4Å; D256-S260 PolarHBondContact O-OG 2.84Å
257	E	95.6	Very high	96.5	Very high	45 Å²	45	14.4 Å²	14.4	21%	0.21	8%	0.083	C	C	.	.	H	α-helix	trans	-71.3	-38.8	-167.4	-156.8	-174.1	164.7	0	0	113.5	Y168 K172 L220 D223 V224 F261	Y168-E257 HydrophobicContact CE1-CB 4.33Å; Y168-E257 HydrophobicContact CE1-CG 3.82Å; Y168-E257 WeakPolarHBondContact CE1-OE1 3.35Å; Y168-E257 VanDerWaalsContact CZ-OE1 3.28Å; Y168-E257 VanDerWaalsContact OH-CG 3.26Å; Y168-E257 WeakPolarHBondContact OH-CG 3.45Å; Y168-E257 PolarHBondContact OH-OE1 2.96Å; K172-E257 VanDerWaalsContact CD-OE1 3.31Å; K172-E257 WeakPolarHBondContact CD-OE1 3.42Å; K172-E257 VanDerWaalsContact CE-OE1 3.22Å; K172-E257 WeakPolarHBondContact CE-OE1 3.33Å; K172-E257 IonicContact NZ-OE1 3.97Å; K172-E257 PolarHBondContact NZ-OE1 2.83Å; K172-E257 IonicContact NZ-OE2 3.24Å; K172-E257 PolarHBondContact NZ-OE2 3.44Å; L220-E257 HydrophobicContact CD2-CG 4.48Å; L220-E257 HydrophobicContact CG-CB 4.31Å; L220-E257 HydrophobicContact CG-CG 4.3Å; D223-E257 WeakPolarHBondContact CB-OE1 3.24Å; V224-E257 HydrophobicContact CG2-CG 3.64Å; E257-F261 VanDerWaalsContact O-CB 3.28Å; E257-F261 WeakPolarHBondContact O-CB 3.48Å; E257-F261 PolarHBondContact O-N 3.03Å
258	V	97.4	Very high	96.4	Very high	25 Å²	25	14.4 Å²	14.4	15%	0.152	8%	0.083	C	C	.	.	H	α-helix	trans	-73	-49.2	-173.8	177.1	0	0	0	0	110.3	I165 Y168 D256 F261 W262	I165-V258 HydrophobicContact CG1-CG1 3.89Å; I165-V258 HydrophobicContact CG1-CG2 4.41Å; Y168-V258 HydrophobicContact CD1-CG2 3.71Å; Y168-V258 HydrophobicContact CE1-CG2 4.44Å; Y168-V258 HydrophobicContact CG-CG2 4.11Å; D256-V258 PolarHBondContact OD1-N 3.36Å; V258-F261 PolarHBondContact O-N 3.33Å; V258-W262 VanDerWaalsContact O-CD1 3.23Å; V258-W262 PolarHBondContact O-N 2.95Å; V258-W262 VanDerWaalsContact O-N 3.09Å
259	D	97.2	Very high	96.1	Very high	14 Å²	14	18.9 Å²	18.9	8%	0.075	11%	0.107	C	C	.	.	H	α-helix	trans	-66.8	-41.3	-179.9	-68.3	-26.5	0	0	0	110.2	K142 Q161 F254 D256 F261 W262 A263	K142-D259 VanDerWaalsContact CE-CG 3.48Å; K142-D259 WeakPolarHBondContact CE-OD2 3.47Å; K142-D259 IonicContact NZ-OD1 2.74Å; K142-D259 PolarHBondContact NZ-OD1 3.02Å; K142-D259 IonicContact NZ-OD2 3.61Å; K142-D259 PolarHBondContact NZ-OD2 3.14Å; Q161-D259 PolarHBondContact NE2-OD1 2.81Å; F254-D259 HydrophobicContact CB-CB 4.13Å; F254-D259 HydrophobicContact CD1-CB 3.44Å; F254-D259 VanDerWaalsContact CD1-CB 3.44Å; F254-D259 HydrophobicContact CE1-CB 4.02Å; F254-D259 HydrophobicContact CG-CB 3.86Å; D256-D259 VanDerWaalsContact OD1-CB 3.23Å; D256-D259 WeakPolarHBondContact OD1-CB 3.48Å; D256-D259 PolarHBondContact OD1-N 2.86Å; D259-F261 VanDerWaalsContact C-N 3.33Å; D259-F261 PolarHBondContact O-N 3.15Å; D259-W262 PolarHBondContact O-N 3.03Å; D259-A263 WeakPolarHBondContact O-CB 3.48Å; D259-A263 PolarHBondContact O-N 3Å
260	S	97.9	Very high	95.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-43.4	173.5	-68.6	0	0	0	0	112.6	L250 V251 F254 D256 F264	L250-S260 PolarHBondContact O-OG 2.78Å; V251-S260 WeakPolarHBondContact CA-OG 3.37Å; F254-S260 WeakPolarHBondContact CB-OG 3.45Å; D256-S260 WeakPolarHBondContact O-CB 3.24Å; D256-S260 PolarHBondContact O-N 3.4Å; D256-S260 PolarHBondContact O-OG 2.84Å; S260-F264 VanDerWaalsContact O-CB 3.22Å; S260-F264 WeakPolarHBondContact O-CB 3.26Å; S260-F264 PolarHBondContact O-N 3.23Å
261	F	98.1	Very high	95.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-49.9	178.7	170.7	-91.2	0	0	0	112.2	Y168 L171 V224 T227 Y228 Y231 E257 V258 D259 F264 V265	Y168-F261 HydrophobicContact CD2-CB 3.66Å; Y168-F261 AromaticContact CD2-CD1 3.46Å; Y168-F261 HydrophobicContact CD2-CD1 3.46Å; Y168-F261 VanDerWaalsContact CD2-CD1 3.46Å; Y168-F261 AromaticContact CD2-CD2 3.86Å; Y168-F261 HydrophobicContact CD2-CD2 3.86Å; Y168-F261 HydrophobicContact CD2-CE1 4.04Å; Y168-F261 HydrophobicContact CD2-CE2 4.35Å; Y168-F261 AromaticContact CD2-CG 3.37Å; Y168-F261 HydrophobicContact CD2-CG 3.37Å; Y168-F261 HydrophobicContact CD2-CZ 4.45Å; Y168-F261 HydrophobicContact CE2-CB 3.43Å; Y168-F261 VanDerWaalsContact CE2-CB 3.43Å; Y168-F261 AromaticContact CE2-CD1 3.96Å; Y168-F261 HydrophobicContact CE2-CD1 3.96Å; Y168-F261 AromaticContact CE2-CD2 3.5Å; Y168-F261 HydrophobicContact CE2-CD2 3.5Å; Y168-F261 HydrophobicContact CE2-CE2 4.21Å; Y168-F261 AromaticContact CE2-CG 3.34Å; Y168-F261 HydrophobicContact CE2-CG 3.34Å; L171-F261 HydrophobicContact CD1-CE1 4.25Å; L171-F261 HydrophobicContact CD1-CZ 3.87Å; V224-F261 HydrophobicContact CG1-CB 4.03Å; V224-F261 HydrophobicContact CG1-CD2 4.21Å; V224-F261 HydrophobicContact CG2-CB 4.38Å; T227-F261 HydrophobicContact CG2-CD2 4.17Å; T227-F261 HydrophobicContact CG2-CE2 3.83Å; T227-F261 HydrophobicContact CG2-CZ 4.39Å; Y228-F261 HydrophobicContact CD2-CE2 4.4Å; Y231-F261 HydrophobicContact CD2-CZ 4.15Å; Y231-F261 AromaticContact CG-CZ 3.97Å; Y231-F261 HydrophobicContact CG-CZ 3.97Å; E257-F261 VanDerWaalsContact O-CB 3.28Å; E257-F261 WeakPolarHBondContact O-CB 3.48Å; E257-F261 PolarHBondContact O-N 3.03Å; V258-F261 PolarHBondContact O-N 3.33Å; D259-F261 VanDerWaalsContact C-N 3.33Å; D259-F261 PolarHBondContact O-N 3.15Å; F261-F264 CarbonylContact O-C 3.44Å; F261-F264 WeakPolarHBondContact O-CB 3.36Å; F261-F264 PolarHBondContact O-N 2.83Å; F261-F264 VanDerWaalsContact O-N 3.14Å; F261-V265 HydrophobicContact CD1-CG2 4.21Å; F261-V265 HydrophobicContact CE1-CG2 3.71Å; F261-V265 HydrophobicContact CE2-CG2 4.25Å; F261-V265 HydrophobicContact CZ-CG2 3.73Å; F261-V265 WeakPolarHBondContact O-CG2 3.4Å; F261-V265 PolarHBondContact O-N 3.23Å
262	W	97.9	Very high	95.1	Very high	29 Å²	29	25.8 Å²	25.8	11%	0.11	14%	0.135	C	C	.	.	H	α-helix	trans	-72.3	-33.6	-176.3	-72.7	111.8	0	0	0	112.5	C147 L164 Y231 V258 D259 F264 V265 G266	C147-W262 VanDerWaalsContact SG-C 3.5Å; L164-W262 HydrophobicContact CB-CG 4.28Å; L164-W262 HydrophobicContact CD1-CB 4.48Å; L164-W262 HydrophobicContact CD1-CG 4.26Å; L164-W262 HydrophobicContact CD2-CD2 3.55Å; L164-W262 HydrophobicContact CD2-CE3 4.03Å; L164-W262 HydrophobicContact CD2-CG 3.8Å; L164-W262 HydrophobicContact CD2-CH2 4.46Å; L164-W262 HydrophobicContact CD2-CZ2 4.04Å; L164-W262 HydrophobicContact CD2-CZ3 4.46Å; L164-W262 HydrophobicContact CG-CD2 4.5Å; L164-W262 HydrophobicContact CG-CG 4.32Å; L164-W262 PolarHBondContact O-NE1 3.29Å; Y231-W262 HydrophobicContact CD2-CH2 4.43Å; Y231-W262 HydrophobicContact CD2-CZ3 4.49Å; Y231-W262 HydrophobicContact CE2-CH2 4.03Å; Y231-W262 AromaticContact CE2-CZ3 3.87Å; Y231-W262 HydrophobicContact CE2-CZ3 3.87Å; V258-W262 VanDerWaalsContact O-CD1 3.23Å; V258-W262 PolarHBondContact O-N 2.95Å; V258-W262 VanDerWaalsContact O-N 3.09Å; D259-W262 PolarHBondContact O-N 3.03Å; W262-F264 VanDerWaalsContact C-N 3.29Å; W262-F264 PolarHBondContact O-N 2.55Å; W262-V265 HydrophobicContact CE3-CB 4.17Å; W262-V265 HydrophobicContact CE3-CG1 4.29Å; W262-V265 HydrophobicContact CE3-CG2 4.13Å; W262-V265 HydrophobicContact CZ3-CG1 4.38Å; W262-V265 HydrophobicContact CZ3-CG2 4.4Å; W262-V265 PolarHBondContact O-N 3.01Å; W262-G266 PolarHBondContact O-N 3.17Å
263	A	97.8	Very high	94.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-42.3	167.8	0	0	0	0	0	111.2	L145 L250 F254 D259 G266 F267	L145-A263 HydrophobicContact CD1-CB 3.67Å; L250-A263 HydrophobicContact CD1-CB 4.27Å; L250-A263 HydrophobicContact CD2-CB 4.37Å; F254-A263 HydrophobicContact CD2-CB 4.03Å; F254-A263 HydrophobicContact CE2-CB 3.26Å; F254-A263 HydrophobicContact CZ-CB 3.72Å; D259-A263 WeakPolarHBondContact O-CB 3.48Å; D259-A263 PolarHBondContact O-N 3Å; A263-G266 PolarHBondContact O-N 3.12Å; A263-F267 WeakPolarHBondContact O-CB 3.34Å; A263-F267 PolarHBondContact O-N 2.88Å
264	F	97.4	Very high	94.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.5	-39.4	177.2	-175.5	-113.4	0	0	0	112.4	L225 Y228 M243 L246 L247 L250 S260 F261 W262 G266 F267 M268	L225-F264 HydrophobicContact CD2-CE1 4.09Å; L225-F264 HydrophobicContact CD2-CZ 4.17Å; Y228-F264 AromaticContact CD1-CE1 3.96Å; Y228-F264 HydrophobicContact CD1-CE1 3.96Å; Y228-F264 AromaticContact CD2-CD1 3.72Å; Y228-F264 HydrophobicContact CD2-CD1 3.72Å; Y228-F264 AromaticContact CD2-CE1 3.85Å; Y228-F264 HydrophobicContact CD2-CE1 3.85Å; Y228-F264 HydrophobicContact CE1-CE1 4.32Å; Y228-F264 HydrophobicContact CE2-CD1 4.19Å; Y228-F264 HydrophobicContact CE2-CE1 4.2Å; Y228-F264 AromaticContact CG-CD1 3.96Å; Y228-F264 HydrophobicContact CG-CD1 3.96Å; Y228-F264 AromaticContact CG-CE1 3.71Å; Y228-F264 HydrophobicContact CG-CE1 3.71Å; M243-F264 HydrophobicContact CB-CZ 4.15Å; M243-F264 HydrophobicContact CE-CE1 3.85Å; M243-F264 HydrophobicContact CE-CZ 3.64Å; L246-F264 HydrophobicContact CB-CE2 4.09Å; L247-F264 HydrophobicContact CB-CD2 3.86Å; L247-F264 HydrophobicContact CB-CE2 3.86Å; L247-F264 HydrophobicContact CB-CG 4.46Å; L247-F264 HydrophobicContact CB-CZ 4.46Å; L247-F264 HydrophobicContact CD1-CB 3.82Å; L247-F264 HydrophobicContact CD1-CD2 3.98Å; L247-F264 HydrophobicContact CD1-CG 3.87Å; L247-F264 HydrophobicContact CG-CD2 4.48Å; L250-F264 VanDerWaalsContact CD1-CA 3.46Å; L250-F264 HydrophobicContact CD1-CB 3.72Å; L250-F264 HydrophobicContact CD1-CD2 3.95Å; L250-F264 HydrophobicContact CD1-CG 4.35Å; S260-F264 VanDerWaalsContact O-CB 3.22Å; S260-F264 WeakPolarHBondContact O-CB 3.26Å; S260-F264 PolarHBondContact O-N 3.23Å; F261-F264 CarbonylContact O-C 3.44Å; F261-F264 WeakPolarHBondContact O-CB 3.36Å; F261-F264 PolarHBondContact O-N 2.83Å; F261-F264 VanDerWaalsContact O-N 3.14Å; W262-F264 VanDerWaalsContact C-N 3.29Å; W262-F264 PolarHBondContact O-N 2.55Å; F264-G266 VanDerWaalsContact C-N 3.33Å; F264-G266 PolarHBondContact O-N 2.76Å; F264-F267 PolarHBondContact O-N 3.48Å; F264-M268 HydrophobicContact CD1-CG 4.1Å; F264-M268 HydrophobicContact CD2-CG 4.21Å; F264-M268 HydrophobicContact CE1-CG 3.7Å; F264-M268 HydrophobicContact CE1-SD 4.34Å; F264-M268 HydrophobicContact CE2-CG 3.82Å; F264-M268 HydrophobicContact CE2-SD 3.86Å; F264-M268 HydrophobicContact CG-CG 4.34Å; F264-M268 HydrophobicContact CZ-CG 3.55Å; F264-M268 HydrophobicContact CZ-SD 3.64Å; F264-M268 WeakPolarHBondContact O-CB 3.16Å; F264-M268 VanDerWaalsContact O-CG 3.28Å; F264-M268 WeakPolarHBondContact O-CG 3.35Å; F264-M268 PolarHBondContact O-N 2.88Å
265	V	96.1	Very high	93.7	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.036	16%	0.155	C	C	.	.	H	α-helix	trans	-57.8	-48.1	171	169.8	0	0	0	0	110.6	Y228 Y231 F261 W262 F267 M268 N269	Y228-V265 HydrophobicContact CD2-CG2 3.92Å; Y228-V265 HydrophobicContact CE2-CG2 3.95Å; Y231-V265 HydrophobicContact CD1-CG1 4.41Å; Y231-V265 HydrophobicContact CD1-CG2 3.95Å; Y231-V265 HydrophobicContact CE1-CB 4.43Å; Y231-V265 HydrophobicContact CE1-CG1 3.58Å; Y231-V265 HydrophobicContact CE1-CG2 3.95Å; Y231-V265 HydrophobicContact CG-CG2 4.37Å; F261-V265 HydrophobicContact CD1-CG2 4.21Å; F261-V265 HydrophobicContact CE1-CG2 3.71Å; F261-V265 HydrophobicContact CE2-CG2 4.25Å; F261-V265 HydrophobicContact CZ-CG2 3.73Å; F261-V265 WeakPolarHBondContact O-CG2 3.4Å; F261-V265 PolarHBondContact O-N 3.23Å; W262-V265 HydrophobicContact CE3-CB 4.17Å; W262-V265 HydrophobicContact CE3-CG1 4.29Å; W262-V265 HydrophobicContact CE3-CG2 4.13Å; W262-V265 HydrophobicContact CZ3-CG1 4.38Å; W262-V265 HydrophobicContact CZ3-CG2 4.4Å; W262-V265 PolarHBondContact O-N 3.01Å; V265-F267 VanDerWaalsContact C-N 3.3Å; V265-F267 PolarHBondContact O-N 3.32Å; V265-M268 PolarHBondContact O-N 2.91Å; V265-N269 PolarHBondContact O-N 3.22Å; V265-N269 PolarHBondContact O-ND2 3.1Å; V265-N269 PolarHBondContact O-OD1 3.4Å
266	G	95.8	Very high	93.2	Very high	8 Å²	8	32.3 Å²	32.3	8%	0.082	15%	0.145	C	C	.	.	H	α-helix	trans	-57.1	-43.2	175.4	0	0	0	0	0	113.1	L145 W262 A263 F264 N269	L145-G266 WeakPolarHBondContact O-CA 3.35Å; W262-G266 PolarHBondContact O-N 3.17Å; A263-G266 PolarHBondContact O-N 3.12Å; F264-G266 VanDerWaalsContact C-N 3.33Å; F264-G266 PolarHBondContact O-N 2.76Å; G266-N269 PolarHBondContact O-N 2.82Å
267	F	96	Very high	92.3	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-67.2	-44.2	177.8	-166.4	-175.4	0	0	0	111.9	L145 L246 L250 A263 F264 V265 N269 R270 C271 L322 W336 W340	L145-F267 HydrophobicContact CD2-CB 3.95Å; L145-F267 HydrophobicContact CD2-CG 4.42Å; L246-F267 HydrophobicContact CB-CD1 4.36Å; L246-F267 HydrophobicContact CB-CE1 4.01Å; L246-F267 HydrophobicContact CD2-CE1 3.93Å; L246-F267 HydrophobicContact CD2-CZ 3.89Å; L246-F267 HydrophobicContact CG-CE1 4.42Å; L250-F267 HydrophobicContact CD1-CB 4.49Å; L250-F267 HydrophobicContact CD1-CD1 4.18Å; A263-F267 WeakPolarHBondContact O-CB 3.34Å; A263-F267 PolarHBondContact O-N 2.88Å; F264-F267 PolarHBondContact O-N 3.48Å; V265-F267 VanDerWaalsContact C-N 3.3Å; V265-F267 PolarHBondContact O-N 3.32Å; F267-N269 VanDerWaalsContact C-N 3.34Å; F267-N269 PolarHBondContact O-N 3.49Å; F267-R270 WeakPolarHBondContact O-CB 3.1Å; F267-R270 PolarHBondContact O-N 3.16Å; F267-R270 VanDerWaalsContact O-N 3.08Å; F267-C271 PolarHBondContact O-N 3.35Å; F267-C271 PolarHBondContact O-SG 3.14Å; F267-C271 VanDerWaalsContact O-SG 3.34Å; F267-L322 HydrophobicContact CE2-CD1 3.38Å; F267-L322 HydrophobicContact CZ-CD1 3.68Å; F267-W336 HydrophobicContact CD1-CZ3 4.39Å; F267-W336 HydrophobicContact CE1-CD2 4.15Å; F267-W336 AromaticContact CE1-CE3 3.84Å; F267-W336 HydrophobicContact CE1-CE3 3.84Å; F267-W336 AromaticContact CE1-CH2 3.56Å; F267-W336 HydrophobicContact CE1-CH2 3.56Å; F267-W336 AromaticContact CE1-CZ2 3.87Å; F267-W336 HydrophobicContact CE1-CZ2 3.87Å; F267-W336 AromaticContact CE1-CZ3 3.5Å; F267-W336 HydrophobicContact CE1-CZ3 3.5Å; F267-W336 VanDerWaalsContact CE1-CZ3 3.5Å; F267-W336 AromaticContact CZ-CD2 4Å; F267-W336 HydrophobicContact CZ-CD2 4Å; F267-W336 AromaticContact CZ-CE2 3.84Å; F267-W336 HydrophobicContact CZ-CE3 4.16Å; F267-W336 HydrophobicContact CZ-CH2 4.08Å; F267-W336 AromaticContact CZ-CZ2 3.91Å; F267-W336 HydrophobicContact CZ-CZ2 3.91Å; F267-W336 HydrophobicContact CZ-CZ3 4.17Å; F267-W340 AromaticContact CD1-CZ2 3.96Å; F267-W340 HydrophobicContact CD1-CZ2 3.96Å; F267-W340 HydrophobicContact CD2-CZ2 4.12Å; F267-W340 AromaticContact CD2-NE1 3.75Å; F267-W340 AromaticContact CE1-CZ2 3.88Å; F267-W340 HydrophobicContact CE1-CZ2 3.88Å; F267-W340 HydrophobicContact CE2-CZ2 4.04Å; F267-W340 AromaticContact CE2-NE1 3.61Å; F267-W340 HydrophobicContact CG-CZ2 4.09Å; F267-W340 AromaticContact CZ-CZ2 3.92Å; F267-W340 HydrophobicContact CZ-CZ2 3.92Å
268	M	93.5	Very high	91.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-37.7	177.7	-71.4	-58.3	-58.9	0	0	111.7	Y228 M243 L246 F264 V265 R270 C271 E272 F275	Y228-M268 HydrophobicContact CE1-CG 4.44Å; Y228-M268 HydrophobicContact CE2-CB 4.1Å; Y228-M268 HydrophobicContact CE2-CG 4.05Å; Y228-M268 VanDerWaalsContact OH-CB 3.23Å; Y228-M268 WeakPolarHBondContact OH-CB 3.43Å; M243-M268 HydrophobicContact CE-CE 3.52Å; M243-M268 HydrophobicContact CE-CG 4.36Å; M243-M268 HydrophobicContact CE-SD 3.88Å; M243-M268 HydrophobicContact CG-CE 4.29Å; M243-M268 HydrophobicContact CG-SD 4.42Å; M243-M268 HydrophobicContact SD-CE 4.11Å; L246-M268 HydrophobicContact CD1-SD 4.23Å; F264-M268 HydrophobicContact CD1-CG 4.1Å; F264-M268 HydrophobicContact CD2-CG 4.21Å; F264-M268 HydrophobicContact CE1-CG 3.7Å; F264-M268 HydrophobicContact CE1-SD 4.34Å; F264-M268 HydrophobicContact CE2-CG 3.82Å; F264-M268 HydrophobicContact CE2-SD 3.86Å; F264-M268 HydrophobicContact CG-CG 4.34Å; F264-M268 HydrophobicContact CZ-CG 3.55Å; F264-M268 HydrophobicContact CZ-SD 3.64Å; F264-M268 WeakPolarHBondContact O-CB 3.16Å; F264-M268 VanDerWaalsContact O-CG 3.28Å; F264-M268 WeakPolarHBondContact O-CG 3.35Å; F264-M268 PolarHBondContact O-N 2.88Å; V265-M268 PolarHBondContact O-N 2.91Å; M268-R270 PolarHBondContact O-N 3.49Å; M268-C271 CarbonylContact O-C 3.59Å; M268-C271 PolarHBondContact O-N 3.43Å; M268-E272 HydrophobicContact CB-CB 4.48Å; M268-E272 HydrophobicContact CE-CB 3.87Å; M268-E272 WeakPolarHBondContact O-CA 3.31Å; M268-E272 WeakPolarHBondContact O-CB 3.33Å; M268-E272 WeakPolarHBondContact O-CG 3.42Å; M268-E272 PolarHBondContact O-N 2.87Å; M268-F275 HydrophobicContact CE-CD2 3.75Å; M268-F275 HydrophobicContact CE-CE2 4.08Å; M268-F275 HydrophobicContact CE-CG 4.46Å; M268-F275 HydrophobicContact SD-CE2 4.38Å
269	N	92.2	Very high	90.5	Very high	94 Å²	94	35.1 Å²	35.1	50%	0.503	17%	0.165	S	C	.	.	H	α-helix	trans	-55	-26.1	174.4	-68.6	-20.6	0	0	0	113.1	V265 G266 F267	V265-N269 PolarHBondContact O-N 3.22Å; V265-N269 PolarHBondContact O-ND2 3.1Å; V265-N269 PolarHBondContact O-OD1 3.4Å; G266-N269 PolarHBondContact O-N 2.82Å; F267-N269 VanDerWaalsContact C-N 3.34Å; F267-N269 PolarHBondContact O-N 3.49Å
270	R	91.3	Very high	89.9	Confident	101 Å²	101	39.7 Å²	39.7	38%	0.381	19%	0.189	S	C	.	.	H	α-helix	trans	-83.7	-27.9	178.3	-58.2	174.9	67.2	105.5	10.7	113.3	F267 M268 L339 D342	F267-R270 WeakPolarHBondContact O-CB 3.1Å; F267-R270 PolarHBondContact O-N 3.16Å; F267-R270 VanDerWaalsContact O-N 3.08Å; M268-R270 PolarHBondContact O-N 3.49Å; R270-L339 PolarHBondContact NH2-O 2.7Å; R270-D342 IonicContact CZ-OD1 2.65Å; R270-D342 IonicContact CZ-OD2 2.98Å; R270-D342 IonicContact NH1-OD1 3.5Å; R270-D342 IonicContact NH1-OD2 2.79Å; R270-D342 PolarHBondContact NH1-OD2 3.07Å; R270-D342 VanDerWaalsContact NH2-CG 3.27Å; R270-D342 IonicContact NH2-OD1 3.24Å; R270-D342 PolarHBondContact NH2-OD1 2.91Å; R270-D342 IonicContact NH2-OD2 3.54Å; R270-D342 PolarHBondContact NH2-OD2 3.2Å; R270-D342 VanDerWaalsContact NH2-OD2 3.14Å
271	C	90.9	Very high	89.4	Confident	8 Å²	8	41 Å²	41	5%	0.054	20%	0.198	C	C	.	.	H	α-helix	trans	-134.2	1.3	-169.3	66	0	0	0	0	115.8	F267 M268 R273 N274 L322	F267-C271 PolarHBondContact O-N 3.35Å; F267-C271 PolarHBondContact O-SG 3.14Å; F267-C271 VanDerWaalsContact O-SG 3.34Å; M268-C271 CarbonylContact O-C 3.59Å; M268-C271 PolarHBondContact O-N 3.43Å; C271-R273 PolarHBondContact O-N 3Å; C271-R273 VanDerWaalsContact O-N 3.13Å; C271-N274 VanDerWaalsContact O-CB 3.25Å; C271-N274 WeakPolarHBondContact O-CB 3.19Å; C271-N274 PolarHBondContact O-N 3.46Å; C271-L322 HydrophobicContact CB-CD1 4.36Å
272	E	88.3	Confident	88.9	Confident	35 Å²	35	41.1 Å²	41.1	16%	0.164	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-59.1	-32.3	-172.8	61.2	177.1	-172.5	0	0	113.2	N232 L235 M268 N274 F275 Y276	N232-E272 PolarHBondContact ND2-OE2 3.18Å; L235-E272 HydrophobicContact CD2-CB 4.16Å; M268-E272 HydrophobicContact CB-CB 4.48Å; M268-E272 HydrophobicContact CE-CB 3.87Å; M268-E272 WeakPolarHBondContact O-CA 3.31Å; M268-E272 WeakPolarHBondContact O-CB 3.33Å; M268-E272 WeakPolarHBondContact O-CG 3.42Å; M268-E272 PolarHBondContact O-N 2.87Å; E272-N274 PolarHBondContact O-N 3.39Å; E272-F275 WeakPolarHBondContact O-CB 3.23Å; E272-F275 PolarHBondContact O-N 3.39Å; E272-Y276 HydrophobicContact CB-CE1 4.34Å; E272-Y276 HydrophobicContact CG-CE1 4.24Å; E272-Y276 WeakPolarHBondContact O-CD1 3.38Å; E272-Y276 WeakPolarHBondContact O-CE1 3.36Å
273	R	87.7	Confident	88.3	Confident	179 Å²	179	42.8 Å²	42.8	68%	0.675	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-57.6	-24.3	175.9	-68	-174.2	170.6	-175.4	-2.3	112.9	C271 F275 Y276 S281	C271-R273 PolarHBondContact O-N 3Å; C271-R273 VanDerWaalsContact O-N 3.13Å; R273-F275 PolarHBondContact O-N 3.41Å; R273-Y276 PolarHBondContact O-N 3.04Å; R273-S281 WeakPolarHBondContact O-CB 3.4Å
274	N	86.7	Confident	88.1	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.059	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-70.1	-20.9	176.3	-63.9	-4.8	0	0	0	112.5	C271 E272 S281 Q285 L320	C271-N274 VanDerWaalsContact O-CB 3.25Å; C271-N274 WeakPolarHBondContact O-CB 3.19Å; C271-N274 PolarHBondContact O-N 3.46Å; E272-N274 PolarHBondContact O-N 3.39Å; N274-S281 WeakPolarHBondContact OD1-CB 3.4Å; N274-S281 PolarHBondContact OD1-OG 2.95Å; N274-Q285 PolarHBondContact OD1-NE2 2.89Å; N274-L320 HydrophobicContact CB-CD1 4.16Å
275	F	84.7	Confident	87.9	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.039	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-99.4	2.4	-178.2	-60.6	-82.7	0	0	0	112.8	L235 V240 M243 L246 M268 E272 R273 L320	L235-F275 HydrophobicContact CD2-CB 4.44Å; V240-F275 HydrophobicContact CB-CB 4.09Å; V240-F275 HydrophobicContact CB-CD1 3.79Å; V240-F275 HydrophobicContact CB-CG 4.39Å; V240-F275 HydrophobicContact CG1-CB 4.5Å; V240-F275 HydrophobicContact CG1-CD1 3.83Å; V240-F275 HydrophobicContact CG2-CB 4.09Å; V240-F275 WeakPolarHBondContact CG2-O 3.17Å; M243-F275 HydrophobicContact CG-CD1 3.98Å; M243-F275 HydrophobicContact CG-CE1 3.9Å; M243-F275 HydrophobicContact CG-CG 4.34Å; M243-F275 HydrophobicContact CG-CZ 4.21Å; L246-F275 HydrophobicContact CD1-CE2 3.81Å; L246-F275 HydrophobicContact CD1-CZ 3.61Å; M268-F275 HydrophobicContact CE-CD2 3.75Å; M268-F275 HydrophobicContact CE-CE2 4.08Å; M268-F275 HydrophobicContact CE-CG 4.46Å; M268-F275 HydrophobicContact SD-CE2 4.38Å; E272-F275 WeakPolarHBondContact O-CB 3.23Å; E272-F275 PolarHBondContact O-N 3.39Å; R273-F275 PolarHBondContact O-N 3.41Å; F275-L320 HydrophobicContact CD1-CD1 3.92Å; F275-L320 HydrophobicContact CE1-CD1 3.68Å; F275-L320 HydrophobicContact CE1-CG 4.03Å; F275-L320 HydrophobicContact CZ-CD1 4.08Å; F275-L320 HydrophobicContact CZ-CG 4.39Å; F275-L320 WeakPolarHBondContact CZ-O 3.4Å
276	Y	81.6	Confident	87.8	Confident	72 Å²	72	46.4 Å²	46.4	28%	0.282	23%	0.227	S	C	.	.	S	Bend	trans	-70.3	144.7	179.7	-77.1	23.6	0	0	0	110.2	L235 E272 R273 D278 Q279	L235-Y276 HydrophobicContact CD2-CD1 3.7Å; L235-Y276 HydrophobicContact CD2-CE1 3.44Å; L235-Y276 VanDerWaalsContact CD2-CE1 3.44Å; L235-Y276 HydrophobicContact CG-CE1 3.94Å; L235-Y276 VanDerWaalsContact O-CD1 3.23Å; L235-Y276 WeakPolarHBondContact O-CD1 3.19Å; L235-Y276 WeakPolarHBondContact O-CE1 3.43Å; E272-Y276 HydrophobicContact CB-CE1 4.34Å; E272-Y276 HydrophobicContact CG-CE1 4.24Å; E272-Y276 WeakPolarHBondContact O-CD1 3.38Å; E272-Y276 WeakPolarHBondContact O-CE1 3.36Å; R273-Y276 PolarHBondContact O-N 3.04Å; Y276-D278 PolarHBondContact O-N 3.33Å; Y276-Q279 PolarHBondContact O-N 3.26Å
277	S	74.6	Confident	87.7	Confident	58 Å²	58	51.4 Å²	51.4	41%	0.406	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23	-175.5	52.5	0	0	0	0	113.7	Q279	S277-Q279 VanDerWaalsContact C-N 3.26Å; S277-Q279 PolarHBondContact O-N 3.17Å
278	D	78	Confident	87.6	Confident	89 Å²	89	53.1 Å²	53.1	48%	0.476	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-19.2	174.2	67.4	15.1	0	0	0	113.7	Y276 L280	Y276-D278 PolarHBondContact O-N 3.33Å; D278-L280 PolarHBondContact O-N 3.46Å; D278-L280 PolarHBondContact OD1-N 3.1Å
279	Q	77.7	Confident	87.8	Confident	24 Å²	24	53.1 Å²	53.1	11%	0.112	26%	0.255	C	S	.	.			trans	52	24.8	-176.2	-59.7	177.7	24.8	0	0	113.4	Y276 S277 S281 I282 K283	Y276-Q279 PolarHBondContact O-N 3.26Å; S277-Q279 VanDerWaalsContact C-N 3.26Å; S277-Q279 PolarHBondContact O-N 3.17Å; Q279-S281 VanDerWaalsContact C-N 3.32Å; Q279-S281 PolarHBondContact O-N 3.48Å; Q279-I282 HydrophobicContact CB-CG2 3.84Å; Q279-I282 WeakPolarHBondContact O-CG2 3.46Å; Q279-K283 VanDerWaalsContact O-CG 3.24Å; Q279-K283 WeakPolarHBondContact O-CG 3.38Å; Q279-K283 PolarHBondContact O-N 2.79Å
280	L	83.7	Confident	87.9	Confident	110 Å²	110	51.4 Å²	51.4	58%	0.576	24%	0.243	S	C	*	.	H	α-helix	trans	-67.1	-39.3	-174.6	-174.3	63.8	0	0	0	110.8	D278 T284	D278-L280 PolarHBondContact O-N 3.46Å; D278-L280 PolarHBondContact OD1-N 3.1Å; L280-T284 WeakPolarHBondContact O-CB 3.49Å; L280-T284 PolarHBondContact O-N 3.38Å; L280-T284 PolarHBondContact O-OG1 3.32Å
281	S	87.5	Confident	88	Confident	27 Å²	27	47.1 Å²	47.1	19%	0.189	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-49.2	-180	-171.1	0	0	0	0	112.3	R273 N274 Q279 T284 Q285	R273-S281 WeakPolarHBondContact O-CB 3.4Å; N274-S281 WeakPolarHBondContact OD1-CB 3.4Å; N274-S281 PolarHBondContact OD1-OG 2.95Å; Q279-S281 VanDerWaalsContact C-N 3.32Å; Q279-S281 PolarHBondContact O-N 3.48Å; S281-T284 PolarHBondContact O-N 2.8Å; S281-Q285 WeakPolarHBondContact O-CG 3.35Å; S281-Q285 PolarHBondContact O-N 2.79Å; S281-Q285 PolarHBondContact O-NE2 3.48Å; S281-Q285 PolarHBondContact OG-NE2 2.88Å
282	I	87.2	Confident	88.2	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-39.1	-176.9	-163.6	64.6	0	0	0	111.6	Q279 T284 Q285 L286 F316 I319	Q279-I282 HydrophobicContact CB-CG2 3.84Å; Q279-I282 WeakPolarHBondContact O-CG2 3.46Å; I282-T284 VanDerWaalsContact C-N 3.32Å; I282-T284 PolarHBondContact O-N 2.81Å; I282-Q285 PolarHBondContact O-N 2.69Å; I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 3Å; I282-F316 HydrophobicContact CB-CE2 4.4Å; I282-F316 HydrophobicContact CG1-CD2 3.65Å; I282-F316 HydrophobicContact CG1-CE2 3.58Å; I282-F316 HydrophobicContact CG1-CZ 4.48Å; I282-F316 HydrophobicContact CG2-CE2 3.92Å; I282-I319 HydrophobicContact CD1-CB 3.65Å; I282-I319 HydrophobicContact CD1-CG2 3.33Å
283	K	86.7	Confident	88.6	Confident	64 Å²	64	45.3 Å²	45.3	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-61.6	-42.7	173.9	-68.4	174	-150.7	-169.4	0	111.2	F50 Q279 L286 K287	F50-K283 HydrophobicContact CD1-CD 4.19Å; F50-K283 HydrophobicContact CE1-CD 3.4Å; F50-K283 VanDerWaalsContact CE1-CD 3.4Å; F50-K283 HydrophobicContact CE1-CG 3.88Å; F50-K283 HydrophobicContact CZ-CD 3.91Å; F50-K283 HydrophobicContact CZ-CG 3.93Å; F50-K283 PolarHBondContact O-NZ 2.95Å; F50-K283 VanDerWaalsContact O-NZ 3.11Å; Q279-K283 VanDerWaalsContact O-CG 3.24Å; Q279-K283 WeakPolarHBondContact O-CG 3.38Å; Q279-K283 PolarHBondContact O-N 2.79Å; K283-L286 PolarHBondContact O-N 2.97Å; K283-K287 PolarHBondContact O-N 3.24Å
284	T	92.2	Very high	88.9	Confident	60 Å²	60	38.8 Å²	38.8	37%	0.368	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-48.7	176.8	-58.2	0	0	0	0	110.4	L280 S281 I282 L286 K287 Q288	L280-T284 WeakPolarHBondContact O-CB 3.49Å; L280-T284 PolarHBondContact O-N 3.38Å; L280-T284 PolarHBondContact O-OG1 3.32Å; S281-T284 PolarHBondContact O-N 2.8Å; I282-T284 VanDerWaalsContact C-N 3.32Å; I282-T284 PolarHBondContact O-N 2.81Å; T284-L286 PolarHBondContact O-N 3.02Å; T284-K287 WeakPolarHBondContact O-CB 3.2Å; T284-K287 PolarHBondContact O-N 2.88Å; T284-K287 VanDerWaalsContact O-N 3.15Å; T284-Q288 HydrophobicContact CG2-CG 4.31Å; T284-Q288 VanDerWaalsContact O-CG 3.24Å; T284-Q288 WeakPolarHBondContact O-CG 3.49Å; T284-Q288 PolarHBondContact O-N 3.37Å
285	Q	94.5	Very high	89.2	Confident	15 Å²	15	39.6 Å²	39.6	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-37.8	179.6	-76.7	171.2	69	0	0	113.3	N274 S281 I282 Q288 L289 I319 H349 L350	N274-Q285 PolarHBondContact OD1-NE2 2.89Å; S281-Q285 WeakPolarHBondContact O-CG 3.35Å; S281-Q285 PolarHBondContact O-N 2.79Å; S281-Q285 PolarHBondContact O-NE2 3.48Å; S281-Q285 PolarHBondContact OG-NE2 2.88Å; I282-Q285 PolarHBondContact O-N 2.69Å; Q285-Q288 PolarHBondContact O-N 3.2Å; Q285-L289 WeakPolarHBondContact O-CB 3.23Å; Q285-L289 PolarHBondContact O-N 3.47Å; Q285-I319 HydrophobicContact CB-CD1 4.34Å; Q285-I319 HydrophobicContact CB-CG2 4.16Å; Q285-H349 PolarHBondContact OE1-NE2 3.04Å; Q285-L350 HydrophobicContact CB-CD2 4.17Å
286	L	92.8	Very high	89.7	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-39.7	173.7	-71.7	172.1	0	0	0	112.3	I282 K283 T284 L289 K290 M312 F313 C315 F316 I319	I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 3Å; K283-L286 PolarHBondContact O-N 2.97Å; T284-L286 PolarHBondContact O-N 3.02Å; L286-L289 PolarHBondContact O-N 3.38Å; L286-K290 PolarHBondContact O-N 2.67Å; L286-M312 HydrophobicContact CD2-CB 4.08Å; L286-M312 WeakPolarHBondContact CD2-O 3.37Å; L286-F313 HydrophobicContact CD1-CD1 3.72Å; L286-F313 HydrophobicContact CD1-CE1 3.98Å; L286-C315 HydrophobicContact CD2-CB 4.36Å; L286-F316 HydrophobicContact CD1-CD2 4.33Å; L286-I319 HydrophobicContact CD2-CD1 3.79Å; L286-I319 HydrophobicContact CG-CD1 4.33Å
287	K	93.2	Very high	90.3	Very high	114 Å²	114	37.8 Å²	37.8	50%	0.496	20%	0.198	S	C	.	.	H	α-helix	trans	-62.5	-46.6	172.8	-174.1	-169	173.4	-149.8	0	110.8	K283 T284 L289 K290 C291 E411	K283-K287 PolarHBondContact O-N 3.24Å; T284-K287 WeakPolarHBondContact O-CB 3.2Å; T284-K287 PolarHBondContact O-N 2.88Å; T284-K287 VanDerWaalsContact O-N 3.15Å; K287-L289 VanDerWaalsContact C-N 3.3Å; K287-L289 PolarHBondContact O-N 2.85Å; K287-K290 WeakPolarHBondContact O-CB 3.16Å; K287-K290 PolarHBondContact O-N 2.95Å; K287-C291 PolarHBondContact O-N 3.41Å; K287-C291 PolarHBondContact O-SG 3.34Å; K287-C291 VanDerWaalsContact O-SG 3.33Å; K287-E411 IonicContact NZ-OE1 3.95Å; K287-E411 PolarHBondContact NZ-OE1 2.82Å
288	Q	95.2	Very high	91.2	Very high	37 Å²	37	38.9 Å²	38.9	17%	0.173	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-41.3	177.7	-68.3	174.4	-35.8	0	0	111.4	T284 Q285 K290 C291 L292 L350 I415	T284-Q288 HydrophobicContact CG2-CG 4.31Å; T284-Q288 VanDerWaalsContact O-CG 3.24Å; T284-Q288 WeakPolarHBondContact O-CG 3.49Å; T284-Q288 PolarHBondContact O-N 3.37Å; Q285-Q288 PolarHBondContact O-N 3.2Å; Q288-K290 PolarHBondContact O-N 2.79Å; Q288-C291 PolarHBondContact O-N 3.41Å; Q288-L292 VanDerWaalsContact O-CG 3.31Å; Q288-L292 WeakPolarHBondContact O-CG 3.21Å; Q288-L292 PolarHBondContact O-N 2.93Å; Q288-L350 HydrophobicContact CB-CD1 3.7Å; Q288-I415 HydrophobicContact CB-CD1 3.74Å; Q288-I415 HydrophobicContact CB-CG1 4.04Å; Q288-I415 HydrophobicContact CB-CG2 4.17Å; Q288-I415 HydrophobicContact CG-CD1 3.72Å; Q288-I415 HydrophobicContact CG-CG1 3.68Å; Q288-I415 HydrophobicContact CG-CG2 4.48Å
289	L	96.4	Very high	92	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-44.2	174.8	178.5	60.8	0	0	0	112.1	Q285 L286 K287 L292 L293 M312 C315 I319 L350 C353 L354	Q285-L289 WeakPolarHBondContact O-CB 3.23Å; Q285-L289 PolarHBondContact O-N 3.47Å; L286-L289 PolarHBondContact O-N 3.38Å; K287-L289 VanDerWaalsContact C-N 3.3Å; K287-L289 PolarHBondContact O-N 2.85Å; L289-L292 PolarHBondContact O-N 3.14Å; L289-L293 WeakPolarHBondContact O-CB 3.49Å; L289-L293 PolarHBondContact O-N 3.5Å; L289-M312 HydrophobicContact CD2-CB 4.12Å; L289-M312 HydrophobicContact CD2-CE 3.94Å; L289-M312 HydrophobicContact CD2-CG 4.42Å; L289-M312 HydrophobicContact CG-CE 3.98Å; L289-M312 HydrophobicContact CG-CG 4.43Å; L289-C315 HydrophobicContact CD2-CB 3.74Å; L289-I319 HydrophobicContact CD2-CD1 4.37Å; L289-L350 HydrophobicContact CB-CD2 4.5Å; L289-C353 HydrophobicContact CD1-CB 3.59Å; L289-C353 HydrophobicContact CD2-CB 3.9Å; L289-C353 HydrophobicContact CG-CB 4.42Å; L289-L354 HydrophobicContact CD1-CD2 3.59Å; L289-L354 HydrophobicContact CD1-CG 3.81Å
290	K	94.6	Very high	92.9	Very high	58 Å²	58	39 Å²	39	25%	0.252	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-50.2	174.3	178.8	-167.5	-175.4	-89.3	0	111.4	L286 K287 Q288 L292 L293 E294 Q310 M312	L286-K290 PolarHBondContact O-N 2.67Å; K287-K290 WeakPolarHBondContact O-CB 3.16Å; K287-K290 PolarHBondContact O-N 2.95Å; Q288-K290 PolarHBondContact O-N 2.79Å; K290-L292 VanDerWaalsContact C-N 3.32Å; K290-L292 PolarHBondContact O-N 2.91Å; K290-L293 WeakPolarHBondContact O-CB 3.37Å; K290-L293 PolarHBondContact O-N 3.34Å; K290-L293 VanDerWaalsContact O-N 3.15Å; K290-E294 WeakPolarHBondContact CE-OE1 3.36Å; K290-E294 IonicContact NZ-OE1 3.11Å; K290-E294 PolarHBondContact NZ-OE1 2.87Å; K290-E294 WeakPolarHBondContact O-CG 3.25Å; K290-E294 PolarHBondContact O-N 2.98Å; K290-Q310 VanDerWaalsContact CD-O 3.31Å; K290-Q310 WeakPolarHBondContact CD-O 3.45Å; K290-M312 HydrophobicContact CB-CG 4.09Å
291	C	94.6	Very high	93.4	Very high	11 Å²	11	34.4 Å²	34.4	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-42.1	180	-65.8	0	0	0	0	111.7	K287 Q288 E294 V295 I412 I415	K287-C291 PolarHBondContact O-N 3.41Å; K287-C291 PolarHBondContact O-SG 3.34Å; K287-C291 VanDerWaalsContact O-SG 3.33Å; Q288-C291 PolarHBondContact O-N 3.41Å; C291-E294 PolarHBondContact O-N 2.65Å; C291-V295 PolarHBondContact O-N 3.4Å; C291-I412 VanDerWaalsContact C-CD1 3.48Å; C291-I412 HydrophobicContact CB-CD1 3.75Å; C291-I412 VanDerWaalsContact O-CD1 3.3Å; C291-I412 WeakPolarHBondContact O-CD1 3.44Å; C291-I415 HydrophobicContact CB-CD1 4.32Å
292	L	95.2	Very high	93.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-41.5	175.3	-69.7	165.6	0	0	0	111.8	Q288 L289 K290 E294 V295 V296 L350 L351 L354 L401 I412 I415 L416	Q288-L292 VanDerWaalsContact O-CG 3.31Å; Q288-L292 WeakPolarHBondContact O-CG 3.21Å; Q288-L292 PolarHBondContact O-N 2.93Å; L289-L292 PolarHBondContact O-N 3.14Å; K290-L292 VanDerWaalsContact C-N 3.32Å; K290-L292 PolarHBondContact O-N 2.91Å; L292-E294 VanDerWaalsContact C-N 3.32Å; L292-E294 PolarHBondContact O-N 3.38Å; L292-V295 PolarHBondContact O-N 3.49Å; L292-V296 WeakPolarHBondContact O-CB 3.24Å; L292-V296 WeakPolarHBondContact O-CG2 3.48Å; L292-V296 PolarHBondContact O-N 3.08Å; L292-L350 HydrophobicContact CD1-CB 3.86Å; L292-L350 HydrophobicContact CD1-CD1 4.13Å; L292-L351 HydrophobicContact CD1-CD2 4.23Å; L292-L351 HydrophobicContact CD2-CD2 4.49Å; L292-L354 HydrophobicContact CB-CD1 3.64Å; L292-L354 HydrophobicContact CD1-CD1 4.45Å; L292-L401 HydrophobicContact CD2-CD1 4.4Å; L292-I412 HydrophobicContact CD2-CD1 4.43Å; L292-I412 HydrophobicContact CD2-CG2 3.95Å; L292-I415 HydrophobicContact CD1-CG2 3.84Å; L292-I415 HydrophobicContact CD2-CG2 4.29Å; L292-I415 HydrophobicContact CG-CG2 4.2Å; L292-L416 HydrophobicContact CD2-CD1 4.04Å; L292-L416 HydrophobicContact CD2-CD2 4.34Å; L292-L416 HydrophobicContact CD2-CG 4.16Å
293	L	95.7	Very high	94.1	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-39.8	177.6	-175.8	66.5	0	0	0	111.9	L289 K290 V295 V296 D297 L300 F304 M312 L354	L289-L293 WeakPolarHBondContact O-CB 3.49Å; L289-L293 PolarHBondContact O-N 3.5Å; K290-L293 WeakPolarHBondContact O-CB 3.37Å; K290-L293 PolarHBondContact O-N 3.34Å; K290-L293 VanDerWaalsContact O-N 3.15Å; L293-V295 PolarHBondContact O-N 3.26Å; L293-V296 PolarHBondContact O-N 2.97Å; L293-D297 HydrophobicContact CD1-CB 4.09Å; L293-D297 CarbonylContact O-C 3.56Å; L293-D297 WeakPolarHBondContact O-CA 3.21Å; L293-D297 PolarHBondContact O-N 3.29Å; L293-L300 HydrophobicContact CD1-CB 4.49Å; L293-L300 HydrophobicContact CD1-CD2 4.17Å; L293-L300 HydrophobicContact CD1-CG 4.47Å; L293-F304 HydrophobicContact CD2-CD2 3.56Å; L293-F304 HydrophobicContact CD2-CE2 3.78Å; L293-M312 HydrophobicContact CD2-CE 3.86Å; L293-M312 HydrophobicContact CD2-SD 4.17Å; L293-L354 HydrophobicContact CB-CD2 3.7Å; L293-L354 HydrophobicContact CD1-CD2 3.77Å; L293-L354 HydrophobicContact CG-CD2 4.32Å
294	E	94.3	Very high	94.5	Very high	41 Å²	41	34.8 Å²	34.8	19%	0.192	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-30.9	177	-73.4	168.7	176.8	0	0	112.9	K290 C291 L292 P298 S301	K290-E294 WeakPolarHBondContact CE-OE1 3.36Å; K290-E294 IonicContact NZ-OE1 3.11Å; K290-E294 PolarHBondContact NZ-OE1 2.87Å; K290-E294 WeakPolarHBondContact O-CG 3.25Å; K290-E294 PolarHBondContact O-N 2.98Å; C291-E294 PolarHBondContact O-N 2.65Å; L292-E294 VanDerWaalsContact C-N 3.32Å; L292-E294 PolarHBondContact O-N 3.38Å; E294-P298 WeakPolarHBondContact O-CG 3.39Å; E294-S301 WeakPolarHBondContact CG-OG 3.15Å
295	V	93.4	Very high	94.5	Very high	29 Å²	29	37.2 Å²	37.2	18%	0.176	19%	0.186	C	C	.	.	H	α-helix	trans	-88.1	-41.6	177.3	177.1	0	0	0	0	112.3	L96 C291 L292 L293 L401 L408 I412	L96-V295 HydrophobicContact CD2-CG1 3.94Å; C291-V295 PolarHBondContact O-N 3.4Å; L292-V295 PolarHBondContact O-N 3.49Å; L293-V295 PolarHBondContact O-N 3.26Å; V295-L401 HydrophobicContact CG1-CD2 3.93Å; V295-L408 HydrophobicContact CG1-CD2 3.99Å; V295-I412 HydrophobicContact CG2-CD1 4.02Å; V295-I412 HydrophobicContact CG2-CG1 3.89Å
296	V	94.1	Very high	94.3	Very high	22 Å²	22	45.1 Å²	45.1	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-76.8	-42.8	-174.7	174.6	0	0	0	0	111.8	L98 L292 L293 L354 I397 L401	L98-V296 HydrophobicContact CD1-CG2 4.5Å; L292-V296 WeakPolarHBondContact O-CB 3.24Å; L292-V296 WeakPolarHBondContact O-CG2 3.48Å; L292-V296 PolarHBondContact O-N 3.08Å; L293-V296 PolarHBondContact O-N 2.97Å; V296-L354 HydrophobicContact CG2-CD1 4.13Å; V296-I397 HydrophobicContact CG1-CD1 4.28Å; V296-I397 HydrophobicContact CG1-CG1 4.29Å; V296-I397 HydrophobicContact CG1-CG2 4.15Å; V296-I397 HydrophobicContact CG2-CG2 3.75Å; V296-L401 HydrophobicContact CG2-CD1 4.02Å; V296-L401 HydrophobicContact CG2-CD2 4.21Å; V296-L401 HydrophobicContact CG2-CG 4.43Å
297	D	94.5	Very high	94.1	Very high	21 Å²	21	47.1 Å²	47.1	11%	0.112	23%	0.225	C	C	.	.			trans	-142.9	82	179.8	-160.9	-40.9	0	0	0	111.6	L293 E299 L300 S301 K361	L293-D297 HydrophobicContact CD1-CB 4.09Å; L293-D297 CarbonylContact O-C 3.56Å; L293-D297 WeakPolarHBondContact O-CA 3.21Å; L293-D297 PolarHBondContact O-N 3.29Å; D297-E299 PolarHBondContact O-N 2.96Å; D297-E299 PolarHBondContact OD1-N 3.43Å; D297-L300 HydrophobicContact CB-CB 4.1Å; D297-L300 PolarHBondContact O-N 2.96Å; D297-L300 WeakPolarHBondContact OD1-CB 3.5Å; D297-L300 PolarHBondContact OD1-N 3.13Å; D297-S301 PolarHBondContact O-N 3.44Å; D297-K361 IonicContact OD1-NZ 3.32Å; D297-K361 PolarHBondContact OD1-NZ 3.23Å; D297-K361 WeakPolarHBondContact OD2-CD 3.21Å; D297-K361 WeakPolarHBondContact OD2-CE 3.22Å; D297-K361 IonicContact OD2-NZ 3.17Å; D297-K361 PolarHBondContact OD2-NZ 3.26Å
298	P	93.9	Very high	93.7	Very high	81 Å²	81	42.4 Å²	42.4	53%	0.526	21%	0.21	S	C	.	.	H	α-helix	trans	-59.1	-32.9	-178.7	-21.4	29.1	0	0	0	113.5	E294 D302	E294-P298 WeakPolarHBondContact O-CG 3.39Å; P298-D302 WeakPolarHBondContact O-CB 3.19Å; P298-D302 PolarHBondContact O-N 2.93Å
299	E	95.1	Very high	93.3	Very high	115 Å²	115	40.7 Å²	40.7	54%	0.537	20%	0.201	S	C	.	.	H	α-helix	trans	-67.2	-47.2	179.5	178.9	-175	-160.4	0	0	111	D297 S301 Y303 K361 L365	D297-E299 PolarHBondContact O-N 2.96Å; D297-E299 PolarHBondContact OD1-N 3.43Å; E299-S301 VanDerWaalsContact C-N 3.34Å; E299-Y303 WeakPolarHBondContact O-CB 3.35Å; E299-Y303 PolarHBondContact O-N 3.28Å; E299-K361 WeakPolarHBondContact OE2-CE 3.31Å; E299-K361 IonicContact OE2-NZ 2.82Å; E299-K361 PolarHBondContact OE2-NZ 2.84Å; E299-L365 HydrophobicContact CG-CD1 4.44Å
300	L	95.6	Very high	93	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-38	177.3	-174.9	58.5	0	0	0	111.4	L293 D297 Y303 F304 L357 K361	L293-L300 HydrophobicContact CD1-CB 4.49Å; L293-L300 HydrophobicContact CD1-CD2 4.17Å; L293-L300 HydrophobicContact CD1-CG 4.47Å; D297-L300 HydrophobicContact CB-CB 4.1Å; D297-L300 PolarHBondContact O-N 2.96Å; D297-L300 WeakPolarHBondContact OD1-CB 3.5Å; D297-L300 PolarHBondContact OD1-N 3.13Å; L300-Y303 WeakPolarHBondContact O-CB 3.43Å; L300-Y303 PolarHBondContact O-N 2.75Å; L300-F304 HydrophobicContact CD1-CD1 4.39Å; L300-F304 HydrophobicContact CD1-CE1 3.81Å; L300-F304 HydrophobicContact CD1-CE2 4.05Å; L300-F304 HydrophobicContact CD1-CZ 3.61Å; L300-F304 HydrophobicContact CD2-CE2 4.13Å; L300-F304 HydrophobicContact CD2-CZ 4.15Å; L300-F304 HydrophobicContact CG-CD2 4.31Å; L300-F304 HydrophobicContact CG-CE1 4.43Å; L300-F304 HydrophobicContact CG-CE2 3.77Å; L300-F304 HydrophobicContact CG-CZ 3.85Å; L300-F304 WeakPolarHBondContact O-CG 3.39Å; L300-F304 PolarHBondContact O-N 2.97Å; L300-L357 HydrophobicContact CD2-CB 4.18Å; L300-K361 HydrophobicContact CB-CD 4.27Å; L300-K361 HydrophobicContact CD1-CG 4.33Å; L300-K361 HydrophobicContact CD2-CB 4.21Å; L300-K361 HydrophobicContact CD2-CG 4.44Å
301	S	95	Very high	92.5	Very high	13 Å²	13	43 Å²	43	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-49.8	175.7	-170.2	0	0	0	0	112.4	E294 D297 E299 Y303 F304 H305	E294-S301 WeakPolarHBondContact CG-OG 3.15Å; D297-S301 PolarHBondContact O-N 3.44Å; E299-S301 VanDerWaalsContact C-N 3.34Å; S301-Y303 VanDerWaalsContact C-N 3.28Å; S301-Y303 PolarHBondContact O-N 3.46Å; S301-F304 PolarHBondContact O-N 3.2Å; S301-F304 VanDerWaalsContact O-N 3.16Å; S301-H305 PolarHBondContact O-N 3.02Å
302	D	94.6	Very high	92.3	Very high	64 Å²	64	42.6 Å²	42.6	34%	0.342	21%	0.212	S	C	.	.	H	α-helix	trans	-61.6	-38.4	176.7	171.5	64.8	0	0	0	111.3	P298 F304 H305 R306	P298-D302 WeakPolarHBondContact O-CB 3.19Å; P298-D302 PolarHBondContact O-N 2.93Å; D302-F304 PolarHBondContact O-N 2.73Å; D302-H305 PolarHBondContact O-N 2.96Å; D302-R306 VanDerWaalsContact CG-NE 3.29Å; D302-R306 WeakPolarHBondContact O-CG 3.43Å; D302-R306 PolarHBondContact O-N 3.47Å; D302-R306 IonicContact OD1-CZ 2.95Å; D302-R306 IonicContact OD1-NE 2.76Å; D302-R306 PolarHBondContact OD1-NE 3.36Å; D302-R306 IonicContact OD1-NH2 2.94Å; D302-R306 PolarHBondContact OD1-NH2 3.31Å; D302-R306 IonicContact OD2-CZ 2.84Å; D302-R306 IonicContact OD2-NE 3.61Å; D302-R306 PolarHBondContact OD2-NE 3.14Å; D302-R306 IonicContact OD2-NH1 2.79Å; D302-R306 IonicContact OD2-NH2 3.87Å; D302-R306 PolarHBondContact OD2-NH2 2.73Å
303	Y	95.5	Very high	91.9	Very high	36 Å²	36	44.4 Å²	44.4	14%	0.141	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-47	173	-174	-90.8	0	0	0	112.2	E299 L300 S301 H305 R306 N307 I364 L365 R368 F369	E299-Y303 WeakPolarHBondContact O-CB 3.35Å; E299-Y303 PolarHBondContact O-N 3.28Å; L300-Y303 WeakPolarHBondContact O-CB 3.43Å; L300-Y303 PolarHBondContact O-N 2.75Å; S301-Y303 VanDerWaalsContact C-N 3.28Å; S301-Y303 PolarHBondContact O-N 3.46Å; Y303-H305 VanDerWaalsContact C-N 3.32Å; Y303-H305 PolarHBondContact O-N 3.31Å; Y303-R306 PolarHBondContact O-N 2.89Å; Y303-N307 WeakPolarHBondContact CE1-ND2 3.46Å; Y303-N307 WeakPolarHBondContact CE2-ND2 3.35Å; Y303-N307 WeakPolarHBondContact O-CB 3.3Å; Y303-N307 PolarHBondContact O-N 3.29Å; Y303-N307 VanDerWaalsContact O-N 3.17Å; Y303-N307 PolarHBondContact O-ND2 2.95Å; Y303-I364 HydrophobicContact CD1-CG2 4.25Å; Y303-I364 HydrophobicContact CE1-CG2 3.87Å; Y303-L365 HydrophobicContact CD1-CD2 3.83Å; Y303-L365 HydrophobicContact CD2-CD2 3.29Å; Y303-L365 HydrophobicContact CE1-CD2 4.33Å; Y303-L365 HydrophobicContact CE2-CD2 3.84Å; Y303-L365 HydrophobicContact CG-CD2 3.29Å; Y303-R368 WeakPolarHBondContact OH-CA 3.32Å; Y303-R368 PolarHBondContact OH-O 3.02Å; Y303-F369 WeakPolarHBondContact CE1-O 3.44Å; Y303-F369 PolarHBondContact OH-N 3.01Å; Y303-F369 PolarHBondContact OH-O 2.97Å
304	F	94	Very high	91.5	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-38.1	176.1	-69.6	-23.3	0	0	0	112.3	L293 L300 S301 D302 N307 G308 S309 Q310 M312 F314 L357 I364 I374	L293-F304 HydrophobicContact CD2-CD2 3.56Å; L293-F304 HydrophobicContact CD2-CE2 3.78Å; L300-F304 HydrophobicContact CD1-CD1 4.39Å; L300-F304 HydrophobicContact CD1-CE1 3.81Å; L300-F304 HydrophobicContact CD1-CE2 4.05Å; L300-F304 HydrophobicContact CD1-CZ 3.61Å; L300-F304 HydrophobicContact CD2-CE2 4.13Å; L300-F304 HydrophobicContact CD2-CZ 4.15Å; L300-F304 HydrophobicContact CG-CD2 4.31Å; L300-F304 HydrophobicContact CG-CE1 4.43Å; L300-F304 HydrophobicContact CG-CE2 3.77Å; L300-F304 HydrophobicContact CG-CZ 3.85Å; L300-F304 WeakPolarHBondContact O-CG 3.39Å; L300-F304 PolarHBondContact O-N 2.97Å; S301-F304 PolarHBondContact O-N 3.2Å; S301-F304 VanDerWaalsContact O-N 3.16Å; D302-F304 PolarHBondContact O-N 2.73Å; F304-N307 CarbonylContact O-C 3.57Å; F304-N307 PolarHBondContact O-N 3Å; F304-G308 PolarHBondContact O-N 2.62Å; F304-S309 CarbonylContact O-C 3.53Å; F304-S309 WeakPolarHBondContact O-CA 3.45Å; F304-S309 PolarHBondContact O-N 3.44Å; F304-Q310 PolarHBondContact O-N 3.23Å; F304-M312 HydrophobicContact CD2-CE 4.28Å; F304-M312 HydrophobicContact CD2-SD 3.94Å; F304-M312 HydrophobicContact CE2-CE 4.18Å; F304-M312 HydrophobicContact CE2-SD 4.41Å; F304-F314 AromaticContact CD2-CZ 3.98Å; F304-F314 HydrophobicContact CD2-CZ 3.98Å; F304-F314 HydrophobicContact CE1-CZ 4.41Å; F304-F314 HydrophobicContact CE2-CE2 4.33Å; F304-F314 AromaticContact CE2-CZ 3.73Å; F304-F314 HydrophobicContact CE2-CZ 3.73Å; F304-F314 HydrophobicContact CG-CZ 4.44Å; F304-F314 HydrophobicContact CZ-CE2 4.42Å; F304-F314 AromaticContact CZ-CZ 3.97Å; F304-F314 HydrophobicContact CZ-CZ 3.97Å; F304-L357 HydrophobicContact CE2-CD1 4.36Å; F304-L357 HydrophobicContact CE2-CD2 4.45Å; F304-L357 HydrophobicContact CZ-CD2 4.27Å; F304-I364 HydrophobicContact CE1-CG2 4.2Å; F304-I364 HydrophobicContact CZ-CD1 4.46Å; F304-I374 HydrophobicContact CD1-CD1 3.7Å; F304-I374 HydrophobicContact CE1-CD1 3.74Å; F304-I374 HydrophobicContact CE1-CG1 4.35Å; F304-I374 HydrophobicContact CE1-CG2 4.38Å
305	H	91.9	Very high	91.4	Very high	110 Å²	110	42.3 Å²	42.3	51%	0.509	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-49.9	175.4	-173.1	79.9	0	0	0	112.4	S301 D302 Y303 N307 G308 Q310	S301-H305 PolarHBondContact O-N 3.02Å; D302-H305 PolarHBondContact O-N 2.96Å; Y303-H305 VanDerWaalsContact C-N 3.32Å; Y303-H305 PolarHBondContact O-N 3.31Å; H305-N307 PolarHBondContact O-N 3.36Å; H305-G308 PolarHBondContact O-N 3.07Å; H305-Q310 HydrophobicContact CB-CB 4.42Å
306	R	91.2	Very high	91.2	Very high	182 Å²	182	41.7 Å²	41.7	69%	0.687	21%	0.205	S	C	*	.	H	α-helix	trans	-63.2	-26.7	179	-68.3	174.7	-169.5	-172.5	4	113.5	D302 Y303	D302-R306 VanDerWaalsContact CG-NE 3.29Å; D302-R306 WeakPolarHBondContact O-CG 3.43Å; D302-R306 PolarHBondContact O-N 3.47Å; D302-R306 IonicContact OD1-CZ 2.95Å; D302-R306 IonicContact OD1-NE 2.76Å; D302-R306 PolarHBondContact OD1-NE 3.36Å; D302-R306 IonicContact OD1-NH2 2.94Å; D302-R306 PolarHBondContact OD1-NH2 3.31Å; D302-R306 IonicContact OD2-CZ 2.84Å; D302-R306 IonicContact OD2-NE 3.61Å; D302-R306 PolarHBondContact OD2-NE 3.14Å; D302-R306 IonicContact OD2-NH1 2.79Å; D302-R306 IonicContact OD2-NH2 3.87Å; D302-R306 PolarHBondContact OD2-NH2 2.73Å; Y303-R306 PolarHBondContact O-N 2.89Å
307	N	88.4	Confident	90.9	Very high	48 Å²	48	41.9 Å²	41.9	26%	0.257	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	15.8	-179.4	-70.1	-73.4	0	0	0	113.7	Y303 F304 H305 S309	Y303-N307 WeakPolarHBondContact CE1-ND2 3.46Å; Y303-N307 WeakPolarHBondContact CE2-ND2 3.35Å; Y303-N307 WeakPolarHBondContact O-CB 3.3Å; Y303-N307 PolarHBondContact O-N 3.29Å; Y303-N307 VanDerWaalsContact O-N 3.17Å; Y303-N307 PolarHBondContact O-ND2 2.95Å; F304-N307 CarbonylContact O-C 3.57Å; F304-N307 PolarHBondContact O-N 3Å; H305-N307 PolarHBondContact O-N 3.36Å; N307-S309 PolarHBondContact O-N 3.33Å; N307-S309 PolarHBondContact O-OG 2.89Å
308	G	84.3	Confident	91	Very high	16 Å²	16	40.9 Å²	40.9	17%	0.165	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	16.6	177.4	0	0	0	0	0	114.8	Q73 F304 H305 Q310	Q73-G308 PolarHBondContact NE2-O 3.34Å; Q73-G308 PolarHBondContact OE1-O 3.38Å; F304-G308 PolarHBondContact O-N 2.62Å; H305-G308 PolarHBondContact O-N 3.07Å; G308-Q310 VanDerWaalsContact CA-OE1 3.31Å; G308-Q310 PolarHBondContact O-OE1 3.14Å
309	S	87.9	Confident	90.9	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.173	C	C	.	.			trans	-106.2	11.5	-172.3	-54.4	0	0	0	0	113.5	F304 N307 N311 M312 F314 F371	F304-S309 CarbonylContact O-C 3.53Å; F304-S309 WeakPolarHBondContact O-CA 3.45Å; F304-S309 PolarHBondContact O-N 3.44Å; N307-S309 PolarHBondContact O-N 3.33Å; N307-S309 PolarHBondContact O-OG 2.89Å; S309-N311 PolarHBondContact O-N 3.03Å; S309-M312 PolarHBondContact O-N 2.78Å; S309-F314 WeakPolarHBondContact O-CE1 3.03Å; S309-F371 WeakPolarHBondContact OG-CA 3.41Å; S309-F371 WeakPolarHBondContact OG-CB 3.39Å; S309-F371 WeakPolarHBondContact OG-CD2 3.21Å
310	Q	88.6	Confident	90.6	Very high	63 Å²	63	32 Å²	32	29%	0.294	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.1	-177.6	70.7	-79.3	18.5	0	0	115.1	K290 F304 H305 G308 M312	K290-Q310 VanDerWaalsContact CD-O 3.31Å; K290-Q310 WeakPolarHBondContact CD-O 3.45Å; F304-Q310 PolarHBondContact O-N 3.23Å; H305-Q310 HydrophobicContact CB-CB 4.42Å; G308-Q310 VanDerWaalsContact CA-OE1 3.31Å; G308-Q310 PolarHBondContact O-OE1 3.14Å; Q310-M312 PolarHBondContact O-N 2.88Å
311	N	85.6	Confident	90.5	Very high	44 Å²	44	32 Å²	32	24%	0.235	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-8.9	177.8	57.4	38	0	0	0	113.1	S309 F313	S309-N311 PolarHBondContact O-N 3.03Å; N311-F313 HydrophobicContact CB-CD2 3.82Å; N311-F313 HydrophobicContact CB-CE1 4.44Å; N311-F313 HydrophobicContact CB-CE2 3.75Å; N311-F313 HydrophobicContact CB-CG 4.18Å; N311-F313 HydrophobicContact CB-CZ 4.07Å; N311-F313 VanDerWaalsContact CG-CE2 3.47Å; N311-F313 WeakPolarHBondContact ND2-CD2 3.31Å; N311-F313 WeakPolarHBondContact ND2-CE2 3.49Å; N311-F313 PolarHBondContact O-N 3.09Å; N311-F313 VanDerWaalsContact O-N 3.11Å; N311-F313 WeakPolarHBondContact OD1-CB 3.43Å; N311-F313 WeakPolarHBondContact OD1-CD2 3.46Å; N311-F313 WeakPolarHBondContact OD1-CG 3.47Å; N311-F313 PolarHBondContact OD1-N 3Å
312	M	90.5	Very high	90.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	15%	0.15	C	C	.	.			trans	57.5	21.8	-179.3	-52.2	-58.9	-75.6	0	0	113.9	L286 L289 K290 L293 F304 S309 Q310 F314 C315 L357	L286-M312 HydrophobicContact CD2-CB 4.08Å; L286-M312 WeakPolarHBondContact CD2-O 3.37Å; L289-M312 HydrophobicContact CD2-CB 4.12Å; L289-M312 HydrophobicContact CD2-CE 3.94Å; L289-M312 HydrophobicContact CD2-CG 4.42Å; L289-M312 HydrophobicContact CG-CE 3.98Å; L289-M312 HydrophobicContact CG-CG 4.43Å; K290-M312 HydrophobicContact CB-CG 4.09Å; L293-M312 HydrophobicContact CD2-CE 3.86Å; L293-M312 HydrophobicContact CD2-SD 4.17Å; F304-M312 HydrophobicContact CD2-CE 4.28Å; F304-M312 HydrophobicContact CD2-SD 3.94Å; F304-M312 HydrophobicContact CE2-CE 4.18Å; F304-M312 HydrophobicContact CE2-SD 4.41Å; S309-M312 PolarHBondContact O-N 2.78Å; Q310-M312 PolarHBondContact O-N 2.88Å; M312-F314 HydrophobicContact CE-CE2 4.01Å; M312-F314 HydrophobicContact CE-CZ 3.78Å; M312-F314 PolarHBondContact O-N 2.94Å; M312-F314 VanDerWaalsContact O-N 3.08Å; M312-F314 HydrophobicContact SD-CE1 4.32Å; M312-F314 HydrophobicContact SD-CE2 4.47Å; M312-F314 HydrophobicContact SD-CZ 3.7Å; M312-C315 WeakPolarHBondContact O-CB 3.39Å; M312-C315 PolarHBondContact O-N 3.28Å; M312-L357 HydrophobicContact CE-CD1 3.5Å
313	F	86.5	Confident	90.6	Very high	38 Å²	38	29.2 Å²	29.2	17%	0.167	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-60.9	-26.2	-174.1	-74.7	-40.2	0	0	0	113.2	Y62 M66 L286 N311 C315 F316	Y62-F313 PolarHBondContact OH-O 3.19Å; M66-F313 HydrophobicContact CE-CD2 4.38Å; M66-F313 HydrophobicContact CE-CG 4.45Å; M66-F313 HydrophobicContact SD-CB 3.58Å; M66-F313 VanDerWaalsContact SD-CB 3.58Å; M66-F313 HydrophobicContact SD-CD2 4.02Å; M66-F313 HydrophobicContact SD-CG 3.97Å; L286-F313 HydrophobicContact CD1-CD1 3.72Å; L286-F313 HydrophobicContact CD1-CE1 3.98Å; N311-F313 HydrophobicContact CB-CD2 3.82Å; N311-F313 HydrophobicContact CB-CE1 4.44Å; N311-F313 HydrophobicContact CB-CE2 3.75Å; N311-F313 HydrophobicContact CB-CG 4.18Å; N311-F313 HydrophobicContact CB-CZ 4.07Å; N311-F313 VanDerWaalsContact CG-CE2 3.47Å; N311-F313 WeakPolarHBondContact ND2-CD2 3.31Å; N311-F313 WeakPolarHBondContact ND2-CE2 3.49Å; N311-F313 PolarHBondContact O-N 3.09Å; N311-F313 VanDerWaalsContact O-N 3.11Å; N311-F313 WeakPolarHBondContact OD1-CB 3.43Å; N311-F313 WeakPolarHBondContact OD1-CD2 3.46Å; N311-F313 WeakPolarHBondContact OD1-CG 3.47Å; N311-F313 PolarHBondContact OD1-N 3Å; F313-C315 PolarHBondContact O-N 3.2Å; F313-C315 VanDerWaalsContact O-N 3.14Å; F313-F316 WeakPolarHBondContact O-CB 3.32Å; F313-F316 PolarHBondContact O-N 2.92Å
314	F	87.2	Confident	90.5	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-60.7	-17.5	172.6	53.1	-96	0	0	0	113.6	F304 S309 M312 L357 I374 L375 V378	F304-F314 AromaticContact CD2-CZ 3.98Å; F304-F314 HydrophobicContact CD2-CZ 3.98Å; F304-F314 HydrophobicContact CE1-CZ 4.41Å; F304-F314 HydrophobicContact CE2-CE2 4.33Å; F304-F314 AromaticContact CE2-CZ 3.73Å; F304-F314 HydrophobicContact CE2-CZ 3.73Å; F304-F314 HydrophobicContact CG-CZ 4.44Å; F304-F314 HydrophobicContact CZ-CE2 4.42Å; F304-F314 AromaticContact CZ-CZ 3.97Å; F304-F314 HydrophobicContact CZ-CZ 3.97Å; S309-F314 WeakPolarHBondContact O-CE1 3.03Å; M312-F314 HydrophobicContact CE-CE2 4.01Å; M312-F314 HydrophobicContact CE-CZ 3.78Å; M312-F314 PolarHBondContact O-N 2.94Å; M312-F314 VanDerWaalsContact O-N 3.08Å; M312-F314 HydrophobicContact SD-CE1 4.32Å; M312-F314 HydrophobicContact SD-CE2 4.47Å; M312-F314 HydrophobicContact SD-CZ 3.7Å; F314-L357 HydrophobicContact CD2-CD2 4.5Å; F314-L357 HydrophobicContact CE2-CD1 4.36Å; F314-L357 HydrophobicContact CE2-CD2 3.78Å; F314-I374 HydrophobicContact CD1-CG2 3.79Å; F314-I374 HydrophobicContact CD2-CG2 4.14Å; F314-I374 HydrophobicContact CE1-CG2 3.99Å; F314-I374 HydrophobicContact CE2-CG2 4.31Å; F314-I374 HydrophobicContact CG-CG2 3.88Å; F314-I374 HydrophobicContact CZ-CG2 4.24Å; F314-L375 HydrophobicContact CB-CB 4.48Å; F314-L375 HydrophobicContact CB-CD1 3.84Å; F314-V378 HydrophobicContact CB-CG1 4.49Å; F314-V378 HydrophobicContact CD2-CG2 3.95Å; F314-V378 WeakPolarHBondContact O-CG1 3.43Å
315	C	92.3	Very high	90.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-91.9	-0.2	172.7	-61.2	0	0	0	0	113.8	L286 L289 M312 F313 R317 W318 I319	L286-C315 HydrophobicContact CD2-CB 4.36Å; L289-C315 HydrophobicContact CD2-CB 3.74Å; M312-C315 WeakPolarHBondContact O-CB 3.39Å; M312-C315 PolarHBondContact O-N 3.28Å; F313-C315 PolarHBondContact O-N 3.2Å; F313-C315 VanDerWaalsContact O-N 3.14Å; C315-R317 VanDerWaalsContact C-N 3.34Å; C315-R317 PolarHBondContact O-N 3.39Å; C315-W318 HydrophobicContact CB-CD2 4.48Å; C315-W318 HydrophobicContact CB-CE3 3.95Å; C315-W318 WeakPolarHBondContact O-CB 3.45Å; C315-W318 PolarHBondContact O-N 3.07Å; C315-W318 VanDerWaalsContact O-N 3.16Å; C315-W318 VanDerWaalsContact SG-CE3 3.59Å; C315-W318 VanDerWaalsContact SG-CZ3 3.57Å; C315-I319 PolarHBondContact O-N 2.85Å
316	F	88.6	Confident	90.6	Very high	17 Å²	17	27.4 Å²	27.4	8%	0.075	12%	0.122	C	C	.	.	H	α-helix	trans	-57.6	-46.5	-175.9	176.3	-89	0	0	0	112	Y62 I282 L286 F313 W318 I319 L320	Y62-F316 AromaticContact CD2-CD1 3.82Å; Y62-F316 HydrophobicContact CD2-CD1 3.82Å; Y62-F316 HydrophobicContact CD2-CE1 4.06Å; Y62-F316 HydrophobicContact CD2-CG 4.33Å; Y62-F316 HydrophobicContact CE1-CD1 4.46Å; Y62-F316 HydrophobicContact CE2-CB 3.72Å; Y62-F316 AromaticContact CE2-CD1 3.48Å; Y62-F316 HydrophobicContact CE2-CD1 3.48Å; Y62-F316 VanDerWaalsContact CE2-CD1 3.48Å; Y62-F316 HydrophobicContact CE2-CD2 4.42Å; Y62-F316 HydrophobicContact CE2-CE1 4.18Å; Y62-F316 AromaticContact CE2-CG 3.64Å; Y62-F316 HydrophobicContact CE2-CG 3.64Å; Y62-F316 HydrophobicContact CG-CD1 4.44Å; Y62-F316 AromaticContact CZ-CD1 3.86Å; Y62-F316 WeakPolarHBondContact OH-CB 3.32Å; I282-F316 HydrophobicContact CB-CE2 4.4Å; I282-F316 HydrophobicContact CG1-CD2 3.65Å; I282-F316 HydrophobicContact CG1-CE2 3.58Å; I282-F316 HydrophobicContact CG1-CZ 4.48Å; I282-F316 HydrophobicContact CG2-CE2 3.92Å; L286-F316 HydrophobicContact CD1-CD2 4.33Å; F313-F316 WeakPolarHBondContact O-CB 3.32Å; F313-F316 PolarHBondContact O-N 2.92Å; F316-W318 VanDerWaalsContact C-N 3.29Å; F316-W318 PolarHBondContact O-N 3.05Å; F316-I319 PolarHBondContact O-N 2.63Å; F316-L320 HydrophobicContact CD1-CD2 4.45Å; F316-L320 HydrophobicContact CE1-CB 4.31Å; F316-L320 HydrophobicContact CE1-CD2 3.59Å; F316-L320 HydrophobicContact CE1-CG 4.49Å; F316-L320 HydrophobicContact CZ-CD2 4.02Å; F316-L320 WeakPolarHBondContact O-CB 3.36Å; F316-L320 PolarHBondContact O-N 2.83Å
317	R	88.4	Confident	90.8	Very high	25 Å²	25	18.8 Å²	18.8	9%	0.094	9%	0.09	C	C	.	.	H	α-helix	trans	-60.6	-40.4	178.8	-171.9	173.9	80.6	-171.2	1.9	111.5	M59 E63 C315 I319 I321 E326	M59-R317 HydrophobicContact CE-CG 4.41Å; E63-R317 IonicContact OE1-NH1 2.65Å; C315-R317 VanDerWaalsContact C-N 3.34Å; C315-R317 PolarHBondContact O-N 3.39Å; R317-I319 VanDerWaalsContact C-N 3.34Å; R317-I319 PolarHBondContact O-N 3.18Å; R317-I321 HydrophobicContact CG-CD1 3.94Å; R317-I321 HydrophobicContact CG-CG1 4.17Å; R317-I321 WeakPolarHBondContact O-CG1 3.46Å; R317-I321 PolarHBondContact O-N 2.9Å; R317-E326 IonicContact CZ-OE1 3.71Å; R317-E326 IonicContact NE-OE1 3.39Å; R317-E326 PolarHBondContact NE-OE1 3.43Å; R317-E326 VanDerWaalsContact NH2-CD 3.31Å; R317-E326 IonicContact NH2-OE1 2.63Å; R317-E326 PolarHBondContact NH2-OE1 2.92Å; R317-E326 IonicContact NH2-OE2 3.86Å; R317-E326 PolarHBondContact NH2-OE2 3.5Å
318	W	95	Very high	91.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.2	-46.3	178.3	-64.7	-5.5	0	0	0	111.9	C315 F316 L322 F323 E326 C353 I356 L357 V378 L381	C315-W318 HydrophobicContact CB-CD2 4.48Å; C315-W318 HydrophobicContact CB-CE3 3.95Å; C315-W318 WeakPolarHBondContact O-CB 3.45Å; C315-W318 PolarHBondContact O-N 3.07Å; C315-W318 VanDerWaalsContact O-N 3.16Å; C315-W318 VanDerWaalsContact SG-CE3 3.59Å; C315-W318 VanDerWaalsContact SG-CZ3 3.57Å; F316-W318 VanDerWaalsContact C-N 3.29Å; F316-W318 PolarHBondContact O-N 3.05Å; W318-L322 CarbonylContact O-C 3.54Å; W318-L322 WeakPolarHBondContact O-CA 3.37Å; W318-L322 PolarHBondContact O-N 3.11Å; W318-L322 VanDerWaalsContact O-N 3.08Å; W318-F323 HydrophobicContact CB-CD1 3.61Å; W318-F323 HydrophobicContact CB-CE1 3.52Å; W318-F323 HydrophobicContact CB-CZ 4.33Å; W318-F323 HydrophobicContact CD2-CD1 4.33Å; W318-F323 HydrophobicContact CD2-CE1 4.14Å; W318-F323 HydrophobicContact CE3-CE1 4.14Å; W318-F323 AromaticContact CG-CD1 3.86Å; W318-F323 HydrophobicContact CG-CD1 3.86Å; W318-F323 AromaticContact CG-CE1 3.94Å; W318-F323 HydrophobicContact CG-CE1 3.94Å; W318-F323 PolarHBondContact O-N 2.65Å; W318-E326 VanDerWaalsContact CD1-CD 3.45Å; W318-E326 VanDerWaalsContact CD1-CG 3.41Å; W318-E326 VanDerWaalsContact CD1-OE1 3.25Å; W318-E326 HydrophobicContact CG-CG 4.38Å; W318-E326 VanDerWaalsContact NE1-CD 3.28Å; W318-E326 PolarHBondContact NE1-OE1 3.13Å; W318-C353 HydrophobicContact CE3-CB 4.18Å; W318-C353 HydrophobicContact CZ3-CB 4.45Å; W318-I356 HydrophobicContact CE3-CD1 4.41Å; W318-I356 HydrophobicContact CH2-CB 3.91Å; W318-I356 HydrophobicContact CH2-CD1 4.44Å; W318-I356 HydrophobicContact CH2-CG2 3.36Å; W318-I356 HydrophobicContact CZ2-CG2 3.8Å; W318-I356 HydrophobicContact CZ3-CB 4.07Å; W318-I356 HydrophobicContact CZ3-CD1 4.34Å; W318-I356 HydrophobicContact CZ3-CG2 4.05Å; W318-L357 HydrophobicContact CH2-CD2 4.11Å; W318-L357 HydrophobicContact CH2-CG 4.41Å; W318-L357 HydrophobicContact CZ3-CD2 4.19Å; W318-L357 HydrophobicContact CZ3-CG 4.12Å; W318-V378 HydrophobicContact CH2-CG1 4.16Å; W318-V378 HydrophobicContact CH2-CG2 4.36Å; W318-V378 HydrophobicContact CZ2-CB 4.35Å; W318-V378 HydrophobicContact CZ2-CG1 3.42Å; W318-V378 VanDerWaalsContact CZ2-CG1 3.42Å; W318-V378 HydrophobicContact CZ2-CG2 4.32Å; W318-L381 HydrophobicContact CZ2-CD1 4.34Å
319	I	92.9	Very high	91.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-76.3	-42.2	-177.3	-59.4	172.7	0	0	0	111.4	I282 Q285 L286 L289 C315 F316 R317 I321 L350	I282-I319 HydrophobicContact CD1-CB 3.65Å; I282-I319 HydrophobicContact CD1-CG2 3.33Å; Q285-I319 HydrophobicContact CB-CD1 4.34Å; Q285-I319 HydrophobicContact CB-CG2 4.16Å; L286-I319 HydrophobicContact CD2-CD1 3.79Å; L286-I319 HydrophobicContact CG-CD1 4.33Å; L289-I319 HydrophobicContact CD2-CD1 4.37Å; C315-I319 PolarHBondContact O-N 2.85Å; F316-I319 PolarHBondContact O-N 2.63Å; R317-I319 VanDerWaalsContact C-N 3.34Å; R317-I319 PolarHBondContact O-N 3.18Å; I319-I321 PolarHBondContact O-N 2.82Å; I319-L350 HydrophobicContact CD1-CD2 3.94Å; I319-L350 HydrophobicContact CG1-CD2 4.37Å
320	L	89.6	Confident	91.8	Very high	11 Å²	11	22.9 Å²	22.9	6%	0.058	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-46.5	-175.2	-178.5	65.6	0	0	0	112.4	M59 N274 F275 F316	M59-L320 HydrophobicContact SD-CD2 4.31Å; N274-L320 HydrophobicContact CB-CD1 4.16Å; F275-L320 HydrophobicContact CD1-CD1 3.92Å; F275-L320 HydrophobicContact CE1-CD1 3.68Å; F275-L320 HydrophobicContact CE1-CG 4.03Å; F275-L320 HydrophobicContact CZ-CD1 4.08Å; F275-L320 HydrophobicContact CZ-CG 4.39Å; F275-L320 WeakPolarHBondContact CZ-O 3.4Å; F316-L320 HydrophobicContact CD1-CD2 4.45Å; F316-L320 HydrophobicContact CE1-CB 4.31Å; F316-L320 HydrophobicContact CE1-CD2 3.59Å; F316-L320 HydrophobicContact CE1-CG 4.49Å; F316-L320 HydrophobicContact CZ-CD2 4.02Å; F316-L320 WeakPolarHBondContact O-CB 3.36Å; F316-L320 PolarHBondContact O-N 2.83Å
321	I	91.9	Very high	92.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	24.5	-177.5	56.1	165.1	0	0	0	112.5	D245 L246 R317 I319 F323 K324 R325	D245-I321 HydrophobicContact CB-CG2 4.46Å; L246-I321 HydrophobicContact CD2-CB 4.27Å; R317-I321 HydrophobicContact CG-CD1 3.94Å; R317-I321 HydrophobicContact CG-CG1 4.17Å; R317-I321 WeakPolarHBondContact O-CG1 3.46Å; R317-I321 PolarHBondContact O-N 2.9Å; I319-I321 PolarHBondContact O-N 2.82Å; I321-F323 VanDerWaalsContact C-N 3.28Å; I321-F323 PolarHBondContact O-N 3.44Å; I321-F323 VanDerWaalsContact O-N 3.14Å; I321-K324 HydrophobicContact CB-CB 4.46Å; I321-K324 HydrophobicContact CD1-CB 4.34Å; I321-K324 VanDerWaalsContact O-CB 3.26Å; I321-K324 WeakPolarHBondContact O-CB 3.22Å; I321-K324 PolarHBondContact O-N 2.69Å; I321-R325 HydrophobicContact CD1-CB 3.9Å; I321-R325 HydrophobicContact CD1-CG 3.49Å; I321-R325 VanDerWaalsContact CD1-CG 3.49Å
322	L	95.5	Very high	92.6	Very high	18 Å²	18	20.3 Å²	20.3	9%	0.094	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.1	53.6	175.4	-65.6	171.6	0	0	0	112.8	F267 C271 W318 K324 I332 W336 H349	F267-L322 HydrophobicContact CE2-CD1 3.38Å; F267-L322 HydrophobicContact CZ-CD1 3.68Å; C271-L322 HydrophobicContact CB-CD1 4.36Å; W318-L322 CarbonylContact O-C 3.54Å; W318-L322 WeakPolarHBondContact O-CA 3.37Å; W318-L322 PolarHBondContact O-N 3.11Å; W318-L322 VanDerWaalsContact O-N 3.08Å; L322-K324 PolarHBondContact O-N 3.36Å; L322-K324 VanDerWaalsContact O-N 3.14Å; L322-I332 WeakPolarHBondContact O-CD1 3.22Å; L322-W336 PolarHBondContact O-NE1 2.88Å; L322-H349 HydrophobicContact CD2-CB 4.24Å
323	F	96.5	Very high	92.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	10.2	177.1	-46.3	-88.7	0	0	0	116.7	W318 I321 R325 E326 F327 I332 L335 H349 I352 C353 I356	W318-F323 HydrophobicContact CB-CD1 3.61Å; W318-F323 HydrophobicContact CB-CE1 3.52Å; W318-F323 HydrophobicContact CB-CZ 4.33Å; W318-F323 HydrophobicContact CD2-CD1 4.33Å; W318-F323 HydrophobicContact CD2-CE1 4.14Å; W318-F323 HydrophobicContact CE3-CE1 4.14Å; W318-F323 AromaticContact CG-CD1 3.86Å; W318-F323 HydrophobicContact CG-CD1 3.86Å; W318-F323 AromaticContact CG-CE1 3.94Å; W318-F323 HydrophobicContact CG-CE1 3.94Å; W318-F323 PolarHBondContact O-N 2.65Å; I321-F323 VanDerWaalsContact C-N 3.28Å; I321-F323 PolarHBondContact O-N 3.44Å; I321-F323 VanDerWaalsContact O-N 3.14Å; F323-R325 PolarHBondContact O-N 2.97Å; F323-E326 HydrophobicContact CB-CB 4.49Å; F323-E326 HydrophobicContact CB-CG 4.35Å; F323-E326 PolarHBondContact O-N 3.44Å; F323-F327 HydrophobicContact CB-CD2 3.71Å; F323-F327 HydrophobicContact CB-CE2 3.71Å; F323-F327 HydrophobicContact CG-CE2 4.26Å; F323-I332 HydrophobicContact CB-CD1 4.33Å; F323-L335 HydrophobicContact CB-CD2 3.76Å; F323-L335 HydrophobicContact CD2-CD2 3.71Å; F323-L335 HydrophobicContact CG-CD2 3.98Å; F323-H349 HydrophobicContact CE2-CB 4.12Å; F323-H349 WeakPolarHBondContact CZ-O 3.26Å; F323-I352 HydrophobicContact CD1-CG2 4.38Å; F323-I352 HydrophobicContact CD2-CG2 4.22Å; F323-I352 HydrophobicContact CE1-CG2 3.81Å; F323-I352 HydrophobicContact CE2-CB 4.06Å; F323-I352 HydrophobicContact CE2-CG2 3.65Å; F323-I352 HydrophobicContact CZ-CB 3.84Å; F323-I352 HydrophobicContact CZ-CG2 3.42Å; F323-I352 VanDerWaalsContact CZ-CG2 3.42Å; F323-C353 VanDerWaalsContact CZ-SG 3.5Å; F323-I356 HydrophobicContact CD1-CD1 3.85Å; F323-I356 HydrophobicContact CE1-CD1 3.71Å
324	K	94.7	Very high	93.1	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.026	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-32.4	-177.8	173	59.4	176	64	0	114.7	D204 D245 P249 I321 L322 E326 I332 W336	D204-K324 VanDerWaalsContact CG-NZ 3.26Å; D204-K324 IonicContact OD1-NZ 2.7Å; D204-K324 PolarHBondContact OD1-NZ 3.4Å; D204-K324 WeakPolarHBondContact OD2-CE 3.4Å; D204-K324 IonicContact OD2-NZ 2.84Å; D204-K324 PolarHBondContact OD2-NZ 3.39Å; D245-K324 HydrophobicContact CB-CG 3.96Å; D245-K324 WeakPolarHBondContact O-CE 3.35Å; D245-K324 WeakPolarHBondContact O-CG 3.34Å; P249-K324 HydrophobicContact CG-CD 3.71Å; I321-K324 HydrophobicContact CB-CB 4.46Å; I321-K324 HydrophobicContact CD1-CB 4.34Å; I321-K324 VanDerWaalsContact O-CB 3.26Å; I321-K324 WeakPolarHBondContact O-CB 3.22Å; I321-K324 PolarHBondContact O-N 2.69Å; L322-K324 PolarHBondContact O-N 3.36Å; L322-K324 VanDerWaalsContact O-N 3.14Å; K324-E326 VanDerWaalsContact C-N 3.34Å; K324-I332 HydrophobicContact CD-CG1 4.26Å; K324-I332 HydrophobicContact CD-CG2 4.32Å; K324-W336 HydrophobicContact CB-CZ2 4.07Å; K324-W336 HydrophobicContact CD-CH2 4.4Å; K324-W336 HydrophobicContact CD-CZ2 4.43Å
325	R	92.5	Very high	93.4	Very high	103 Å²	103	19.3 Å²	19.3	39%	0.389	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6	179	-77.2	-179.5	-176.4	-98.1	-6.6	114.2	D245 I321 F323 S382	D245-R325 IonicContact OD1-CZ 2.78Å; D245-R325 IonicContact OD1-NE 3.48Å; D245-R325 IonicContact OD1-NH2 2.92Å; D245-R325 PolarHBondContact OD1-NH2 2.96Å; D245-R325 IonicContact OD2-CZ 2.72Å; D245-R325 VanDerWaalsContact OD2-CZ 3.3Å; D245-R325 IonicContact OD2-NE 3.22Å; D245-R325 PolarHBondContact OD2-NE 3.27Å; D245-R325 IonicContact OD2-NH2 3.46Å; D245-R325 PolarHBondContact OD2-NH2 2.96Å; I321-R325 HydrophobicContact CD1-CB 3.9Å; I321-R325 HydrophobicContact CD1-CG 3.49Å; I321-R325 VanDerWaalsContact CD1-CG 3.49Å; F323-R325 PolarHBondContact O-N 2.97Å; R325-S382 WeakPolarHBondContact O-CB 3.26Å; R325-S382 PolarHBondContact O-OG 3.46Å
326	E	93.8	Very high	93.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-16.6	-176.7	-43.5	-47.3	146.4	0	0	112.9	R317 W318 F323 K324 M383 I385	R317-E326 IonicContact CZ-OE1 3.71Å; R317-E326 IonicContact NE-OE1 3.39Å; R317-E326 PolarHBondContact NE-OE1 3.43Å; R317-E326 VanDerWaalsContact NH2-CD 3.31Å; R317-E326 IonicContact NH2-OE1 2.63Å; R317-E326 PolarHBondContact NH2-OE1 2.92Å; R317-E326 IonicContact NH2-OE2 3.86Å; R317-E326 PolarHBondContact NH2-OE2 3.5Å; W318-E326 VanDerWaalsContact CD1-CD 3.45Å; W318-E326 VanDerWaalsContact CD1-CG 3.41Å; W318-E326 VanDerWaalsContact CD1-OE1 3.25Å; W318-E326 HydrophobicContact CG-CG 4.38Å; W318-E326 VanDerWaalsContact NE1-CD 3.28Å; W318-E326 PolarHBondContact NE1-OE1 3.13Å; F323-E326 HydrophobicContact CB-CB 4.49Å; F323-E326 HydrophobicContact CB-CG 4.35Å; F323-E326 PolarHBondContact O-N 3.44Å; K324-E326 VanDerWaalsContact C-N 3.34Å; E326-M383 PolarHBondContact O-N 3.49Å; E326-I385 HydrophobicContact CB-CD1 3.96Å
327	F	95.8	Very high	93.7	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.009	9%	0.089	C	C	.	.	S	Bend	trans	-127.1	154.9	-170.9	-69.7	-72.1	0	0	0	112.5	F323 D331 I332 L335 I385 V387	F323-F327 HydrophobicContact CB-CD2 3.71Å; F323-F327 HydrophobicContact CB-CE2 3.71Å; F323-F327 HydrophobicContact CG-CE2 4.26Å; F327-D331 HydrophobicContact CB-CB 3.84Å; F327-D331 HydrophobicContact CD1-CB 3.87Å; F327-D331 HydrophobicContact CG-CB 4.21Å; F327-I332 HydrophobicContact CB-CB 4.16Å; F327-I332 HydrophobicContact CB-CD1 4.22Å; F327-I332 HydrophobicContact CD2-CD1 4.16Å; F327-L335 HydrophobicContact CD2-CD2 3.87Å; F327-L335 HydrophobicContact CE2-CD2 3.7Å; F327-I385 HydrophobicContact CD1-CB 4.4Å; F327-I385 HydrophobicContact CE1-CB 3.64Å; F327-I385 HydrophobicContact CE1-CG2 3.59Å; F327-I385 HydrophobicContact CZ-CB 3.97Å; F327-I385 HydrophobicContact CZ-CD1 4.47Å; F327-I385 HydrophobicContact CZ-CG2 3.61Å; F327-V387 HydrophobicContact CD1-CB 4.07Å; F327-V387 HydrophobicContact CD1-CG2 4.49Å; F327-V387 HydrophobicContact CE1-CB 3.78Å; F327-V387 HydrophobicContact CE1-CG2 4.21Å
328	S	95.2	Very high	93.8	Very high	44 Å²	44	18.2 Å²	18.2	31%	0.308	9%	0.089	S	C	.	.			trans	-67.4	171	169.5	76.9	0	0	0	0	111.1	E330 D331 I332	S328-E330 PolarHBondContact O-N 3.31Å; S328-D331 WeakPolarHBondContact CB-OD2 3.42Å; S328-D331 PolarHBondContact O-N 3.04Å; S328-D331 PolarHBondContact OG-N 3.39Å; S328-D331 PolarHBondContact OG-OD2 3.39Å; S328-I332 WeakPolarHBondContact O-CB 3.35Å; S328-I332 WeakPolarHBondContact O-CG2 3.02Å; S328-I332 PolarHBondContact O-N 2.54Å
329	F	94.2	Very high	93.6	Very high	21 Å²	21	19.3 Å²	19.3	9%	0.092	10%	0.095	C	C	.	.	H	α-helix	trans	-60.3	-46.1	176.8	-91.8	-122.6	0	0	0	111.7	D204 H207 F210 S248 Y252 D331 I332 F333	D204-F329 HydrophobicContact CB-CE2 4.27Å; D204-F329 HydrophobicContact CB-CZ 4.2Å; D204-F329 WeakPolarHBondContact OD2-CZ 3.35Å; H207-F329 AromaticContact CD2-CD2 3.66Å; H207-F329 AromaticContact CD2-CE2 3.86Å; H207-F329 AromaticContact CD2-CG 3.79Å; H207-F329 AromaticContact NE2-CD1 3.87Å; H207-F329 AromaticContact NE2-CG 3.79Å; F210-F329 HydrophobicContact CE2-CE1 4.26Å; F210-F329 HydrophobicContact CE2-CZ 4.03Å; S248-F329 WeakPolarHBondContact OG-CZ 3.26Å; Y252-F329 HydrophobicContact CD1-CD1 4.01Å; Y252-F329 HydrophobicContact CD1-CE1 4.46Å; Y252-F329 HydrophobicContact CE1-CD1 4.44Å; Y252-F329 HydrophobicContact CG-CD1 4.05Å; Y252-F329 HydrophobicContact CG-CE1 4.08Å; F329-D331 VanDerWaalsContact C-N 3.34Å; F329-D331 PolarHBondContact O-N 2.87Å; F329-I332 WeakPolarHBondContact O-CG2 3.21Å; F329-I332 PolarHBondContact O-N 3.21Å; F329-F333 HydrophobicContact CB-CE1 4.33Å; F329-F333 HydrophobicContact CB-CE2 4.16Å; F329-F333 HydrophobicContact CB-CZ 3.78Å; F329-F333 HydrophobicContact CD1-CE1 4.03Å; F329-F333 AromaticContact CD1-CZ 3.7Å; F329-F333 HydrophobicContact CD1-CZ 3.7Å; F329-F333 HydrophobicContact CG-CZ 4.18Å; F329-F333 WeakPolarHBondContact O-CD1 3.28Å; F329-F333 WeakPolarHBondContact O-CD2 3.45Å; F329-F333 WeakPolarHBondContact O-CE1 3.3Å; F329-F333 VanDerWaalsContact O-CE2 3.32Å; F329-F333 WeakPolarHBondContact O-CE2 3.33Å; F329-F333 WeakPolarHBondContact O-CG 3.4Å; F329-F333 WeakPolarHBondContact O-CZ 3.1Å; F329-F333 PolarHBondContact O-N 2.98Å; F329-F333 VanDerWaalsContact O-N 3.11Å
330	E	93.2	Very high	93.5	Very high	85 Å²	85	19.7 Å²	19.7	40%	0.397	10%	0.096	S	C	.	.	H	α-helix	trans	-65.7	-37.8	179.6	-71.3	-60.7	147.5	0	0	112.6	H134 R137 S328 L334	H134-E330 IonicContact CE1-OE1 2.79Å; H134-E330 IonicContact ND1-OE1 3.98Å; H134-E330 PolarHBondContact ND1-OE1 3.17Å; H134-E330 VanDerWaalsContact ND1-OE1 3.13Å; H134-E330 IonicContact ND1-OE2 2.95Å; R137-E330 IonicContact CZ-OE2 2.95Å; R137-E330 IonicContact NH1-OE1 3.3Å; R137-E330 IonicContact NH1-OE2 2.67Å; R137-E330 PolarHBondContact NH1-OE2 3.12Å; R137-E330 IonicContact NH2-OE2 2.79Å; R137-E330 PolarHBondContact NH2-OE2 3.1Å; S328-E330 PolarHBondContact O-N 3.31Å; E330-L334 PolarHBondContact O-N 3.24Å
331	D	94.5	Very high	93.3	Very high	52 Å²	52	19.5 Å²	19.5	28%	0.278	10%	0.096	S	C	.	.	H	α-helix	trans	-70.1	-42.1	178.1	-64	-41.4	0	0	0	112	F327 S328 F329 F333 L334 L335 V387	F327-D331 HydrophobicContact CB-CB 3.84Å; F327-D331 HydrophobicContact CD1-CB 3.87Å; F327-D331 HydrophobicContact CG-CB 4.21Å; S328-D331 WeakPolarHBondContact CB-OD2 3.42Å; S328-D331 PolarHBondContact O-N 3.04Å; S328-D331 PolarHBondContact OG-N 3.39Å; S328-D331 PolarHBondContact OG-OD2 3.39Å; F329-D331 VanDerWaalsContact C-N 3.34Å; F329-D331 PolarHBondContact O-N 2.87Å; D331-F333 VanDerWaalsContact C-N 3.3Å; D331-F333 PolarHBondContact O-N 3.09Å; D331-L334 PolarHBondContact O-N 2.8Å; D331-L335 PolarHBondContact O-N 3.33Å; D331-V387 HydrophobicContact CB-CB 4.07Å; D331-V387 HydrophobicContact CB-CG1 3.95Å; D331-V387 VanDerWaalsContact OD1-CG1 3.29Å; D331-V387 WeakPolarHBondContact OD1-CG1 3.43Å
332	I	96	Very high	92.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.2	-32.5	-179.1	-160.7	65.8	0	0	0	111.5	P249 L322 F323 K324 F327 S328 F329 L335 W336	P249-I332 HydrophobicContact CG-CG2 4.33Å; L322-I332 WeakPolarHBondContact O-CD1 3.22Å; F323-I332 HydrophobicContact CB-CD1 4.33Å; K324-I332 HydrophobicContact CD-CG1 4.26Å; K324-I332 HydrophobicContact CD-CG2 4.32Å; F327-I332 HydrophobicContact CB-CB 4.16Å; F327-I332 HydrophobicContact CB-CD1 4.22Å; F327-I332 HydrophobicContact CD2-CD1 4.16Å; S328-I332 WeakPolarHBondContact O-CB 3.35Å; S328-I332 WeakPolarHBondContact O-CG2 3.02Å; S328-I332 PolarHBondContact O-N 2.54Å; F329-I332 WeakPolarHBondContact O-CG2 3.21Å; F329-I332 PolarHBondContact O-N 3.21Å; I332-L335 HydrophobicContact CD1-CB 4.47Å; I332-L335 HydrophobicContact CD1-CD2 3.92Å; I332-L335 PolarHBondContact O-N 3.43Å; I332-W336 HydrophobicContact CD1-CZ2 4.41Å; I332-W336 HydrophobicContact CG1-CD2 3.98Å; I332-W336 HydrophobicContact CG1-CG 4.3Å; I332-W336 HydrophobicContact CG1-CZ2 3.85Å; I332-W336 WeakPolarHBondContact O-CB 3.28Å; I332-W336 PolarHBondContact O-N 2.86Å
333	F	94.7	Very high	91.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.1	-51	172.8	-56.8	-26.4	0	0	0	110.7	R137 W141 P249 Y252 I253 F329 D331 L335 W336 E337	R137-F333 VanDerWaalsContact NH1-CD2 3.28Å; W141-F333 HydrophobicContact CH2-CB 4.45Å; W141-F333 AromaticContact CH2-CD1 3.61Å; W141-F333 HydrophobicContact CH2-CD1 3.61Å; W141-F333 HydrophobicContact CH2-CE1 4.23Å; W141-F333 HydrophobicContact CH2-CG 4.23Å; W141-F333 HydrophobicContact CZ2-CB 4Å; W141-F333 HydrophobicContact CZ2-CD1 4.03Å; W141-F333 HydrophobicContact CZ2-CG 4.2Å; P249-F333 HydrophobicContact CB-CD1 4.32Å; P249-F333 HydrophobicContact CB-CE1 3.84Å; Y252-F333 HydrophobicContact CD1-CE1 4.3Å; Y252-F333 HydrophobicContact CD1-CE2 4.17Å; Y252-F333 AromaticContact CD1-CZ 3.43Å; Y252-F333 HydrophobicContact CD1-CZ 3.43Å; Y252-F333 VanDerWaalsContact CD1-CZ 3.43Å; Y252-F333 AromaticContact CE1-CE2 3.88Å; Y252-F333 HydrophobicContact CE1-CE2 3.88Å; Y252-F333 AromaticContact CE1-CZ 3.59Å; Y252-F333 HydrophobicContact CE1-CZ 3.59Å; I253-F333 HydrophobicContact CD1-CD2 4.26Å; I253-F333 HydrophobicContact CD1-CE1 4.18Å; I253-F333 HydrophobicContact CD1-CE2 3.84Å; I253-F333 HydrophobicContact CD1-CZ 3.78Å; I253-F333 HydrophobicContact CG1-CD1 4.44Å; I253-F333 HydrophobicContact CG1-CE1 4.01Å; I253-F333 HydrophobicContact CG1-CZ 4.07Å; F329-F333 HydrophobicContact CB-CE1 4.33Å; F329-F333 HydrophobicContact CB-CE2 4.16Å; F329-F333 HydrophobicContact CB-CZ 3.78Å; F329-F333 HydrophobicContact CD1-CE1 4.03Å; F329-F333 AromaticContact CD1-CZ 3.7Å; F329-F333 HydrophobicContact CD1-CZ 3.7Å; F329-F333 HydrophobicContact CG-CZ 4.18Å; F329-F333 WeakPolarHBondContact O-CD1 3.28Å; F329-F333 WeakPolarHBondContact O-CD2 3.45Å; F329-F333 WeakPolarHBondContact O-CE1 3.3Å; F329-F333 VanDerWaalsContact O-CE2 3.32Å; F329-F333 WeakPolarHBondContact O-CE2 3.33Å; F329-F333 WeakPolarHBondContact O-CG 3.4Å; F329-F333 WeakPolarHBondContact O-CZ 3.1Å; F329-F333 PolarHBondContact O-N 2.98Å; F329-F333 VanDerWaalsContact O-N 3.11Å; D331-F333 VanDerWaalsContact C-N 3.3Å; D331-F333 PolarHBondContact O-N 3.09Å; F333-L335 VanDerWaalsContact C-N 3.32Å; F333-L335 PolarHBondContact O-N 3.11Å; F333-W336 PolarHBondContact O-N 3.48Å; F333-E337 WeakPolarHBondContact O-CB 3.47Å; F333-E337 WeakPolarHBondContact O-CG 3.34Å; F333-E337 PolarHBondContact O-N 3.02Å
334	L	92.5	Very high	90.8	Very high	22 Å²	22	27.2 Å²	27.2	12%	0.115	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-44.8	178.8	176.7	64.5	0	0	0	111.6	E330 D331 W336 E337 V338 V387 H388 L391	E330-L334 PolarHBondContact O-N 3.24Å; D331-L334 PolarHBondContact O-N 2.8Å; L334-W336 PolarHBondContact O-N 3.46Å; L334-E337 PolarHBondContact O-N 3.4Å; L334-V338 HydrophobicContact CD1-CG2 4.48Å; L334-V338 WeakPolarHBondContact O-CG2 3.39Å; L334-V338 PolarHBondContact O-N 2.87Å; L334-V338 VanDerWaalsContact O-N 3.11Å; L334-V387 HydrophobicContact CD2-CG1 4.01Å; L334-V387 HydrophobicContact CD2-CG2 4.42Å; L334-H388 WeakPolarHBondContact CD2-CE1 2.93Å; L334-L391 HydrophobicContact CD2-CD1 4.23Å; L334-L391 HydrophobicContact CG-CD1 4.16Å
335	L	94	Very high	89.4	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.6	-46.9	179.8	-171.7	67.5	0	0	0	111.6	F323 F327 D331 I332 F333 V338 L339 I352 V387 L391	F323-L335 HydrophobicContact CB-CD2 3.76Å; F323-L335 HydrophobicContact CD2-CD2 3.71Å; F323-L335 HydrophobicContact CG-CD2 3.98Å; F327-L335 HydrophobicContact CD2-CD2 3.87Å; F327-L335 HydrophobicContact CE2-CD2 3.7Å; D331-L335 PolarHBondContact O-N 3.33Å; I332-L335 HydrophobicContact CD1-CB 4.47Å; I332-L335 HydrophobicContact CD1-CD2 3.92Å; I332-L335 PolarHBondContact O-N 3.43Å; F333-L335 VanDerWaalsContact C-N 3.32Å; F333-L335 PolarHBondContact O-N 3.11Å; L335-V338 PolarHBondContact O-N 3.26Å; L335-L339 HydrophobicContact CG-CD1 4.3Å; L335-L339 WeakPolarHBondContact O-CG 3.23Å; L335-L339 PolarHBondContact O-N 3.46Å; L335-I352 HydrophobicContact CD1-CD1 3.66Å; L335-I352 HydrophobicContact CD1-CG1 4.41Å; L335-I352 HydrophobicContact CD1-CG2 4.37Å; L335-V387 HydrophobicContact CB-CG2 4.19Å; L335-V387 HydrophobicContact CD1-CG2 4.35Å; L335-L391 HydrophobicContact CD1-CD2 3.74Å; L335-L391 HydrophobicContact CD1-CG 4.17Å
336	W	95.2	Very high	88.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.8	-38.6	-179.5	-73.6	0.6	0	0	0	112.6	L246 P249 F267 L322 K324 I332 F333 L334 V338 L339 W340	L246-W336 HydrophobicContact CD2-CH2 4.24Å; L246-W336 HydrophobicContact CD2-CZ2 3.93Å; L246-W336 WeakPolarHBondContact O-CH2 3.18Å; P249-W336 HydrophobicContact CB-CE3 4.29Å; P249-W336 HydrophobicContact CB-CH2 4.05Å; P249-W336 HydrophobicContact CB-CZ3 3.5Å; P249-W336 HydrophobicContact CG-CH2 3.57Å; P249-W336 HydrophobicContact CG-CZ3 3.58Å; F267-W336 HydrophobicContact CD1-CZ3 4.39Å; F267-W336 HydrophobicContact CE1-CD2 4.15Å; F267-W336 AromaticContact CE1-CE3 3.84Å; F267-W336 HydrophobicContact CE1-CE3 3.84Å; F267-W336 AromaticContact CE1-CH2 3.56Å; F267-W336 HydrophobicContact CE1-CH2 3.56Å; F267-W336 AromaticContact CE1-CZ2 3.87Å; F267-W336 HydrophobicContact CE1-CZ2 3.87Å; F267-W336 AromaticContact CE1-CZ3 3.5Å; F267-W336 HydrophobicContact CE1-CZ3 3.5Å; F267-W336 VanDerWaalsContact CE1-CZ3 3.5Å; F267-W336 AromaticContact CZ-CD2 4Å; F267-W336 HydrophobicContact CZ-CD2 4Å; F267-W336 AromaticContact CZ-CE2 3.84Å; F267-W336 HydrophobicContact CZ-CE3 4.16Å; F267-W336 HydrophobicContact CZ-CH2 4.08Å; F267-W336 AromaticContact CZ-CZ2 3.91Å; F267-W336 HydrophobicContact CZ-CZ2 3.91Å; F267-W336 HydrophobicContact CZ-CZ3 4.17Å; L322-W336 PolarHBondContact O-NE1 2.88Å; K324-W336 HydrophobicContact CB-CZ2 4.07Å; K324-W336 HydrophobicContact CD-CH2 4.4Å; K324-W336 HydrophobicContact CD-CZ2 4.43Å; I332-W336 HydrophobicContact CD1-CZ2 4.41Å; I332-W336 HydrophobicContact CG1-CD2 3.98Å; I332-W336 HydrophobicContact CG1-CG 4.3Å; I332-W336 HydrophobicContact CG1-CZ2 3.85Å; I332-W336 WeakPolarHBondContact O-CB 3.28Å; I332-W336 PolarHBondContact O-N 2.86Å; F333-W336 PolarHBondContact O-N 3.48Å; L334-W336 PolarHBondContact O-N 3.46Å; W336-V338 VanDerWaalsContact C-N 3.32Å; W336-V338 PolarHBondContact O-N 3.39Å; W336-L339 CarbonylContact O-C 3.47Å; W336-L339 PolarHBondContact O-N 3.21Å; W336-L339 VanDerWaalsContact O-N 3.11Å; W336-W340 HydrophobicContact CB-CD2 4.21Å; W336-W340 HydrophobicContact CB-CE3 4.32Å; W336-W340 HydrophobicContact CB-CH2 3.86Å; W336-W340 HydrophobicContact CB-CZ2 3.7Å; W336-W340 HydrophobicContact CB-CZ3 4.15Å; W336-W340 HydrophobicContact CD2-CH2 4.27Å; W336-W340 AromaticContact CD2-CZ2 3.95Å; W336-W340 HydrophobicContact CD2-CZ2 3.95Å; W336-W340 AromaticContact CE3-CH2 3.6Å; W336-W340 HydrophobicContact CE3-CH2 3.6Å; W336-W340 AromaticContact CE3-CZ2 3.61Å; W336-W340 HydrophobicContact CE3-CZ2 3.61Å; W336-W340 HydrophobicContact CG-CH2 4.42Å; W336-W340 HydrophobicContact CG-CZ2 4.03Å; W336-W340 HydrophobicContact CZ3-CH2 4.46Å; W336-W340 HydrophobicContact CZ3-CZ2 4.45Å; W336-W340 WeakPolarHBondContact O-CB 3.4Å; W336-W340 VanDerWaalsContact O-CD2 3.24Å; W336-W340 PolarHBondContact O-N 3.07Å
337	E	92.1	Very high	88.3	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-55.5	-49.6	173	-72.2	166	179	0	0	110.4	I132 R137 W141 F333 L334 L339 W340 T341	I132-E337 HydrophobicContact CD1-CB 4.44Å; I132-E337 HydrophobicContact CD1-CG 3.94Å; I132-E337 PolarHBondContact N-OE2 3.24Å; R137-E337 VanDerWaalsContact CD-OE1 3.3Å; R137-E337 WeakPolarHBondContact CD-OE1 3.43Å; R137-E337 WeakPolarHBondContact CG-OE1 3.38Å; R137-E337 IonicContact CZ-OE1 2.68Å; R137-E337 IonicContact NE-OE1 3.37Å; R137-E337 PolarHBondContact NE-OE1 2.9Å; W141-E337 HydrophobicContact CZ2-CG 4.29Å; W141-E337 PolarHBondContact NE1-OE1 3.39Å; F333-E337 WeakPolarHBondContact O-CB 3.47Å; F333-E337 WeakPolarHBondContact O-CG 3.34Å; F333-E337 PolarHBondContact O-N 3.02Å; L334-E337 PolarHBondContact O-N 3.4Å; E337-L339 VanDerWaalsContact C-N 3.3Å; E337-L339 PolarHBondContact O-N 3.32Å; E337-W340 PolarHBondContact O-N 2.97Å; E337-W340 VanDerWaalsContact O-N 3.13Å; E337-T341 WeakPolarHBondContact O-CG2 3.17Å; E337-T341 PolarHBondContact O-N 3.36Å
338	V	89.6	Confident	88.2	Confident	17 Å²	17	32.6 Å²	32.6	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-62.3	-36.9	176.5	174.8	0	0	0	0	112.3	L334 L335 W336 W340 T341 F348 L391	L334-V338 HydrophobicContact CD1-CG2 4.48Å; L334-V338 WeakPolarHBondContact O-CG2 3.39Å; L334-V338 PolarHBondContact O-N 2.87Å; L334-V338 VanDerWaalsContact O-N 3.11Å; L335-V338 PolarHBondContact O-N 3.26Å; W336-V338 VanDerWaalsContact C-N 3.32Å; W336-V338 PolarHBondContact O-N 3.39Å; V338-W340 VanDerWaalsContact C-N 3.33Å; V338-T341 PolarHBondContact O-OG1 2.91Å; V338-F348 HydrophobicContact CG1-CD1 4.42Å; V338-F348 HydrophobicContact CG1-CE1 3.85Å; V338-L391 HydrophobicContact CB-CD2 4.34Å; V338-L391 HydrophobicContact CG1-CD2 4Å; V338-L391 HydrophobicContact CG2-CD1 4.17Å
339	L	91.8	Very high	88.2	Confident	23 Å²	23	31.6 Å²	31.6	12%	0.12	17%	0.171	C	C	.	.	H	α-helix	trans	-70.1	-30	176.3	-75.5	169.1	0	0	0	112.8	R270 L335 W336 E337 F348 H349 I352	R270-L339 PolarHBondContact NH2-O 2.7Å; L335-L339 HydrophobicContact CG-CD1 4.3Å; L335-L339 WeakPolarHBondContact O-CG 3.23Å; L335-L339 PolarHBondContact O-N 3.46Å; W336-L339 CarbonylContact O-C 3.47Å; W336-L339 PolarHBondContact O-N 3.21Å; W336-L339 VanDerWaalsContact O-N 3.11Å; E337-L339 VanDerWaalsContact C-N 3.3Å; E337-L339 PolarHBondContact O-N 3.32Å; L339-F348 HydrophobicContact CD2-CB 4.24Å; L339-F348 HydrophobicContact CD2-CD1 3.93Å; L339-H349 HydrophobicContact CD2-CB 4.05Å; L339-I352 HydrophobicContact CD1-CD1 4.42Å; L339-I352 HydrophobicContact CD2-CD1 3.97Å; L339-I352 HydrophobicContact CG-CD1 4.28Å
340	W	91.6	Very high	88.3	Confident	8 Å²	8	30.6 Å²	30.6	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-89.2	-16	-177.8	-59.3	-26.1	0	0	0	113.9	W141 L144 L145 L250 F267 W336 E337 V338 D342	W141-W340 HydrophobicContact CD2-CH2 4.39Å; W141-W340 AromaticContact CD2-CZ3 3.66Å; W141-W340 HydrophobicContact CD2-CZ3 3.66Å; W141-W340 AromaticContact CE2-CZ3 3.68Å; W141-W340 HydrophobicContact CE3-CH2 4.18Å; W141-W340 AromaticContact CE3-CZ3 3.91Å; W141-W340 HydrophobicContact CE3-CZ3 3.91Å; W141-W340 HydrophobicContact CG-CZ3 4.13Å; W141-W340 HydrophobicContact CH2-CH2 4.15Å; W141-W340 HydrophobicContact CH2-CZ3 4.12Å; W141-W340 HydrophobicContact CZ2-CH2 4.37Å; W141-W340 AromaticContact CZ2-CZ3 3.9Å; W141-W340 HydrophobicContact CZ2-CZ3 3.9Å; W141-W340 HydrophobicContact CZ3-CH2 4.1Å; W141-W340 HydrophobicContact CZ3-CZ3 4.16Å; L144-W340 HydrophobicContact CB-CB 3.97Å; L144-W340 HydrophobicContact CB-CE3 4.34Å; L144-W340 HydrophobicContact CD1-CE3 4.41Å; L144-W340 HydrophobicContact CD2-CB 4.3Å; L145-W340 HydrophobicContact CD1-CH2 4.02Å; L145-W340 HydrophobicContact CD1-CZ2 4.46Å; L145-W340 HydrophobicContact CD1-CZ3 4.06Å; L145-W340 HydrophobicContact CD2-CD2 3.68Å; L145-W340 HydrophobicContact CD2-CE3 4.02Å; L145-W340 HydrophobicContact CD2-CG 4.18Å; L145-W340 HydrophobicContact CD2-CH2 4.08Å; L145-W340 HydrophobicContact CD2-CZ2 3.76Å; L145-W340 HydrophobicContact CD2-CZ3 4.2Å; L145-W340 HydrophobicContact CG-CD2 4.32Å; L145-W340 HydrophobicContact CG-CE3 4.17Å; L145-W340 HydrophobicContact CG-CH2 4.39Å; L145-W340 HydrophobicContact CG-CZ3 4.21Å; L250-W340 HydrophobicContact CD2-CH2 4Å; F267-W340 AromaticContact CD1-CZ2 3.96Å; F267-W340 HydrophobicContact CD1-CZ2 3.96Å; F267-W340 HydrophobicContact CD2-CZ2 4.12Å; F267-W340 AromaticContact CD2-NE1 3.75Å; F267-W340 AromaticContact CE1-CZ2 3.88Å; F267-W340 HydrophobicContact CE1-CZ2 3.88Å; F267-W340 HydrophobicContact CE2-CZ2 4.04Å; F267-W340 AromaticContact CE2-NE1 3.61Å; F267-W340 HydrophobicContact CG-CZ2 4.09Å; F267-W340 AromaticContact CZ-CZ2 3.92Å; F267-W340 HydrophobicContact CZ-CZ2 3.92Å; W336-W340 HydrophobicContact CB-CD2 4.21Å; W336-W340 HydrophobicContact CB-CE3 4.32Å; W336-W340 HydrophobicContact CB-CH2 3.86Å; W336-W340 HydrophobicContact CB-CZ2 3.7Å; W336-W340 HydrophobicContact CB-CZ3 4.15Å; W336-W340 HydrophobicContact CD2-CH2 4.27Å; W336-W340 AromaticContact CD2-CZ2 3.95Å; W336-W340 HydrophobicContact CD2-CZ2 3.95Å; W336-W340 AromaticContact CE3-CH2 3.6Å; W336-W340 HydrophobicContact CE3-CH2 3.6Å; W336-W340 AromaticContact CE3-CZ2 3.61Å; W336-W340 HydrophobicContact CE3-CZ2 3.61Å; W336-W340 HydrophobicContact CG-CH2 4.42Å; W336-W340 HydrophobicContact CG-CZ2 4.03Å; W336-W340 HydrophobicContact CZ3-CH2 4.46Å; W336-W340 HydrophobicContact CZ3-CZ2 4.45Å; W336-W340 WeakPolarHBondContact O-CB 3.4Å; W336-W340 VanDerWaalsContact O-CD2 3.24Å; W336-W340 PolarHBondContact O-N 3.07Å; E337-W340 PolarHBondContact O-N 2.97Å; E337-W340 VanDerWaalsContact O-N 3.13Å; V338-W340 VanDerWaalsContact C-N 3.33Å; W340-D342 PolarHBondContact O-N 3.43Å
341	T	85	Confident	88.5	Confident	7 Å²	7	26.6 Å²	26.6	4%	0.043	15%	0.148	C	C	.	.	S	Bend	trans	-69.7	-16.1	173.4	57.7	0	0	0	0	112.8	P128 L144 E337 V338 C343	P128-T341 VanDerWaalsContact O-CG2 3.24Å; P128-T341 WeakPolarHBondContact O-CG2 3.44Å; L144-T341 HydrophobicContact CD2-CG2 3.94Å; E337-T341 WeakPolarHBondContact O-CG2 3.17Å; E337-T341 PolarHBondContact O-N 3.36Å; V338-T341 PolarHBondContact O-OG1 2.91Å; T341-C343 VanDerWaalsContact CB-SG 3.57Å; T341-C343 PolarHBondContact O-N 3.27Å; T341-C343 PolarHBondContact OG1-SG 3.28Å; T341-C343 VanDerWaalsContact OG1-SG 3.33Å
342	D	81.4	Confident	88.6	Confident	81 Å²	81	24.1 Å²	24.1	43%	0.433	14%	0.135	S	C	.	.			trans	52.5	27.2	-178.3	-67.1	-50.9	0	0	0	113	R270 W340 I344	R270-D342 IonicContact CZ-OD1 2.65Å; R270-D342 IonicContact CZ-OD2 2.98Å; R270-D342 IonicContact NH1-OD1 3.5Å; R270-D342 IonicContact NH1-OD2 2.79Å; R270-D342 PolarHBondContact NH1-OD2 3.07Å; R270-D342 VanDerWaalsContact NH2-CG 3.27Å; R270-D342 IonicContact NH2-OD1 3.24Å; R270-D342 PolarHBondContact NH2-OD1 2.91Å; R270-D342 IonicContact NH2-OD2 3.54Å; R270-D342 PolarHBondContact NH2-OD2 3.2Å; R270-D342 VanDerWaalsContact NH2-OD2 3.14Å; W340-D342 PolarHBondContact O-N 3.43Å; D342-I344 PolarHBondContact O-N 3.39Å
343	C	73.7	Confident	88.7	Confident	72 Å²	72	24.1 Å²	24.1	49%	0.486	14%	0.135	S	C	.	.			trans	-66.7	-26	-179.9	-69.8	0	0	0	0	112.7	T341	T341-C343 VanDerWaalsContact CB-SG 3.57Å; T341-C343 PolarHBondContact O-N 3.27Å; T341-C343 PolarHBondContact OG1-SG 3.28Å; T341-C343 VanDerWaalsContact OG1-SG 3.33Å
344	I	75	Confident	88.8	Confident	27 Å²	27	24.2 Å²	24.2	14%	0.138	14%	0.135	C	C	.	.	S	Bend	trans	-111.4	107.3	173.3	-65.7	172.1	0	0	0	106.9	D342 T346 F348 E395 Y398	D342-I344 PolarHBondContact O-N 3.39Å; I344-T346 PolarHBondContact O-N 3.41Å; I344-F348 HydrophobicContact CB-CB 4.36Å; I344-F348 HydrophobicContact CB-CD2 4.11Å; I344-F348 HydrophobicContact CB-CG 4.23Å; I344-F348 HydrophobicContact CD1-CD2 3.59Å; I344-F348 HydrophobicContact CD1-CE1 4.37Å; I344-F348 HydrophobicContact CD1-CE2 3.35Å; I344-F348 HydrophobicContact CD1-CG 4.23Å; I344-F348 HydrophobicContact CD1-CZ 3.78Å; I344-F348 HydrophobicContact CG1-CD2 4.45Å; I344-F348 HydrophobicContact CG2-CB 4.2Å; I344-F348 HydrophobicContact CG2-CD2 3.82Å; I344-F348 HydrophobicContact CG2-CG 4.24Å; I344-E395 HydrophobicContact CD1-CG 4.24Å; I344-Y398 HydrophobicContact CD1-CD1 4.34Å; I344-Y398 HydrophobicContact CD1-CG 4.42Å; I344-Y398 HydrophobicContact CG1-CD1 4.35Å; I344-Y398 HydrophobicContact CG1-CE1 4.43Å; I344-Y398 HydrophobicContact CG2-CD1 4.24Å; I344-Y398 HydrophobicContact CG2-CD2 3.48Å; I344-Y398 VanDerWaalsContact CG2-CD2 3.48Å; I344-Y398 HydrophobicContact CG2-CE1 4.26Å; I344-Y398 HydrophobicContact CG2-CE2 3.49Å; I344-Y398 VanDerWaalsContact CG2-CE2 3.49Å; I344-Y398 HydrophobicContact CG2-CG 3.86Å
345	D	65.3	Low	89	Confident	106 Å²	106	23.2 Å²	23.2	57%	0.567	13%	0.13	S	C	*	.			trans	-64.6	100.3	-173.9	-80.5	-46.4	0	0	0	111.4
346	T	74.3	Confident	89.2	Confident	70 Å²	70	23.2 Å²	23.2	43%	0.429	13%	0.13	S	C	.	.	S	Bend	trans	79.2	134	163.3	-13.8	0	0	0	0	118.2	I344 F348 S417	I344-T346 PolarHBondContact O-N 3.41Å; T346-F348 VanDerWaalsContact C-N 3.29Å; T346-F348 PolarHBondContact O-N 3.21Å; T346-S417 PolarHBondContact OG1-OG 2.88Å
347	N	89.6	Confident	89.3	Confident	35 Å²	35	23.3 Å²	23.3	19%	0.187	13%	0.13	C	C	.	.			trans	60.2	24.8	176.2	-61	-42.2	0	0	0	116.3	H349 L350 I415	N347-H349 PolarHBondContact O-N 3.09Å; N347-H349 VanDerWaalsContact O-N 3.15Å; N347-H349 PolarHBondContact OD1-CE1 2.89Å; N347-L350 HydrophobicContact CB-CD1 3.97Å; N347-L350 HydrophobicContact CB-CG 4.13Å; N347-L350 WeakPolarHBondContact O-CB 3.18Å; N347-L350 PolarHBondContact O-N 3.36Å; N347-I415 HydrophobicContact CB-CG2 4.41Å; N347-I415 PolarHBondContact ND2-O 3.38Å
348	F	93.6	Very high	89.5	Confident	13 Å²	13	26 Å²	26	6%	0.057	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-29.9	177.3	-172.8	-122.5	0	0	0	113.4	V338 L339 I344 T346 L350 L351 I352 L391 A394	V338-F348 HydrophobicContact CG1-CD1 4.42Å; V338-F348 HydrophobicContact CG1-CE1 3.85Å; L339-F348 HydrophobicContact CD2-CB 4.24Å; L339-F348 HydrophobicContact CD2-CD1 3.93Å; I344-F348 HydrophobicContact CB-CB 4.36Å; I344-F348 HydrophobicContact CB-CD2 4.11Å; I344-F348 HydrophobicContact CB-CG 4.23Å; I344-F348 HydrophobicContact CD1-CD2 3.59Å; I344-F348 HydrophobicContact CD1-CE1 4.37Å; I344-F348 HydrophobicContact CD1-CE2 3.35Å; I344-F348 HydrophobicContact CD1-CG 4.23Å; I344-F348 HydrophobicContact CD1-CZ 3.78Å; I344-F348 HydrophobicContact CG1-CD2 4.45Å; I344-F348 HydrophobicContact CG2-CB 4.2Å; I344-F348 HydrophobicContact CG2-CD2 3.82Å; I344-F348 HydrophobicContact CG2-CG 4.24Å; T346-F348 VanDerWaalsContact C-N 3.29Å; T346-F348 PolarHBondContact O-N 3.21Å; F348-L350 PolarHBondContact O-N 3.35Å; F348-L351 HydrophobicContact CD2-CB 4.23Å; F348-L351 HydrophobicContact CD2-CD1 4.16Å; F348-L351 HydrophobicContact CE2-CB 4.45Å; F348-L351 WeakPolarHBondContact O-CB 3.32Å; F348-L351 PolarHBondContact O-N 3.44Å; F348-I352 HydrophobicContact CD1-CD1 3.88Å; F348-I352 HydrophobicContact CD1-CG1 4.42Å; F348-I352 HydrophobicContact CE1-CD1 3.87Å; F348-I352 HydrophobicContact CE1-CG1 4.18Å; F348-I352 HydrophobicContact CZ-CG1 4.47Å; F348-I352 PolarHBondContact O-N 2.97Å; F348-L391 HydrophobicContact CE1-CD2 3.99Å; F348-L391 HydrophobicContact CZ-CD2 4.42Å; F348-A394 HydrophobicContact CE2-CB 3.81Å; F348-A394 HydrophobicContact CZ-CB 3.78Å
349	H	95.5	Very high	89.8	Confident	24 Å²	24	27.7 Å²	27.7	11%	0.111	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-29.1	172.9	64.2	-70	0	0	0	113.2	Q285 L322 F323 L339 N347 I352 C353	Q285-H349 PolarHBondContact OE1-NE2 3.04Å; L322-H349 HydrophobicContact CD2-CB 4.24Å; F323-H349 HydrophobicContact CE2-CB 4.12Å; F323-H349 WeakPolarHBondContact CZ-O 3.26Å; L339-H349 HydrophobicContact CD2-CB 4.05Å; N347-H349 PolarHBondContact O-N 3.09Å; N347-H349 VanDerWaalsContact O-N 3.15Å; N347-H349 PolarHBondContact OD1-CE1 2.89Å; H349-I352 WeakPolarHBondContact O-CB 3.21Å; H349-I352 PolarHBondContact O-N 3.34Å; H349-C353 PolarHBondContact O-N 3.28Å; H349-C353 VanDerWaalsContact O-N 3.1Å; H349-C353 PolarHBondContact O-SG 2.88Å
350	L	96.8	Very high	90.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.8	-35.4	173.6	-56.4	-173.8	0	0	0	111.4	Q285 Q288 L289 L292 I319 N347 F348 I352 C353 L354 I415	Q285-L350 HydrophobicContact CB-CD2 4.17Å; Q288-L350 HydrophobicContact CB-CD1 3.7Å; L289-L350 HydrophobicContact CB-CD2 4.5Å; L292-L350 HydrophobicContact CD1-CB 3.86Å; L292-L350 HydrophobicContact CD1-CD1 4.13Å; I319-L350 HydrophobicContact CD1-CD2 3.94Å; I319-L350 HydrophobicContact CG1-CD2 4.37Å; N347-L350 HydrophobicContact CB-CD1 3.97Å; N347-L350 HydrophobicContact CB-CG 4.13Å; N347-L350 WeakPolarHBondContact O-CB 3.18Å; N347-L350 PolarHBondContact O-N 3.36Å; F348-L350 PolarHBondContact O-N 3.35Å; L350-I352 VanDerWaalsContact C-N 3.3Å; L350-C353 VanDerWaalsContact O-CB 3.32Å; L350-C353 WeakPolarHBondContact O-CB 3.42Å; L350-C353 PolarHBondContact O-N 3.11Å; L350-L354 WeakPolarHBondContact O-CG 3.44Å; L350-L354 PolarHBondContact O-N 3.42Å; L350-L354 VanDerWaalsContact O-N 3.11Å; L350-I415 HydrophobicContact CD1-CG2 4.34Å
351	L	96.1	Very high	90.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.6	-32	174.1	-57.8	-172.8	0	0	0	111.7	L292 F348 L354 A355 A394 I397 Y398 L401 L416	L292-L351 HydrophobicContact CD1-CD2 4.23Å; L292-L351 HydrophobicContact CD2-CD2 4.49Å; F348-L351 HydrophobicContact CD2-CB 4.23Å; F348-L351 HydrophobicContact CD2-CD1 4.16Å; F348-L351 HydrophobicContact CE2-CB 4.45Å; F348-L351 WeakPolarHBondContact O-CB 3.32Å; F348-L351 PolarHBondContact O-N 3.44Å; L351-L354 HydrophobicContact CD2-CD1 3.87Å; L351-L354 PolarHBondContact O-N 3.11Å; L351-A355 WeakPolarHBondContact O-CB 3.4Å; L351-A355 PolarHBondContact O-N 2.92Å; L351-A394 HydrophobicContact CB-CB 4.24Å; L351-I397 HydrophobicContact CD2-CG2 4.04Å; L351-Y398 HydrophobicContact CD1-CD2 4.07Å; L351-Y398 HydrophobicContact CD1-CG 4.34Å; L351-L401 HydrophobicContact CD2-CD1 4.36Å; L351-L416 HydrophobicContact CD1-CD2 4.15Å; L351-L416 HydrophobicContact CD2-CD2 4.16Å; L351-L416 HydrophobicContact CG-CD2 4.25Å
352	I	96.8	Very high	90.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-41.9	170.2	-68.2	160.6	0	0	0	110.8	F323 L335 L339 F348 H349 L350 L354 A355 I356 V390 L391 A394	F323-I352 HydrophobicContact CD1-CG2 4.38Å; F323-I352 HydrophobicContact CD2-CG2 4.22Å; F323-I352 HydrophobicContact CE1-CG2 3.81Å; F323-I352 HydrophobicContact CE2-CB 4.06Å; F323-I352 HydrophobicContact CE2-CG2 3.65Å; F323-I352 HydrophobicContact CZ-CB 3.84Å; F323-I352 HydrophobicContact CZ-CG2 3.42Å; F323-I352 VanDerWaalsContact CZ-CG2 3.42Å; L335-I352 HydrophobicContact CD1-CD1 3.66Å; L335-I352 HydrophobicContact CD1-CG1 4.41Å; L335-I352 HydrophobicContact CD1-CG2 4.37Å; L339-I352 HydrophobicContact CD1-CD1 4.42Å; L339-I352 HydrophobicContact CD2-CD1 3.97Å; L339-I352 HydrophobicContact CG-CD1 4.28Å; F348-I352 HydrophobicContact CD1-CD1 3.88Å; F348-I352 HydrophobicContact CD1-CG1 4.42Å; F348-I352 HydrophobicContact CE1-CD1 3.87Å; F348-I352 HydrophobicContact CE1-CG1 4.18Å; F348-I352 HydrophobicContact CZ-CG1 4.47Å; F348-I352 PolarHBondContact O-N 2.97Å; H349-I352 WeakPolarHBondContact O-CB 3.21Å; H349-I352 PolarHBondContact O-N 3.34Å; L350-I352 VanDerWaalsContact C-N 3.3Å; I352-L354 VanDerWaalsContact C-N 3.33Å; I352-L354 PolarHBondContact O-N 3.35Å; I352-A355 WeakPolarHBondContact O-CB 3.49Å; I352-A355 PolarHBondContact O-N 3.23Å; I352-I356 HydrophobicContact CG2-CD1 4.21Å; I352-I356 WeakPolarHBondContact O-CG1 3.32Å; I352-I356 PolarHBondContact O-N 2.84Å; I352-V390 HydrophobicContact CG2-CG1 3.78Å; I352-L391 HydrophobicContact CD1-CD2 4.35Å; I352-A394 HydrophobicContact CG1-CB 3.97Å
353	C	97.9	Very high	91.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.2	-46.6	172.8	-68.3	0	0	0	0	111.5	L289 W318 F323 H349 L350 A355 I356 L357	L289-C353 HydrophobicContact CD1-CB 3.59Å; L289-C353 HydrophobicContact CD2-CB 3.9Å; L289-C353 HydrophobicContact CG-CB 4.42Å; W318-C353 HydrophobicContact CE3-CB 4.18Å; W318-C353 HydrophobicContact CZ3-CB 4.45Å; F323-C353 VanDerWaalsContact CZ-SG 3.5Å; H349-C353 PolarHBondContact O-N 3.28Å; H349-C353 VanDerWaalsContact O-N 3.1Å; H349-C353 PolarHBondContact O-SG 2.88Å; L350-C353 VanDerWaalsContact O-CB 3.32Å; L350-C353 WeakPolarHBondContact O-CB 3.42Å; L350-C353 PolarHBondContact O-N 3.11Å; C353-A355 VanDerWaalsContact C-N 3.35Å; C353-I356 PolarHBondContact O-N 3.49Å; C353-L357 VanDerWaalsContact O-CG 3.3Å; C353-L357 WeakPolarHBondContact O-CG 3.15Å; C353-L357 PolarHBondContact O-N 2.86Å
354	L	97.2	Very high	92.6	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-42.6	178.2	-63	173.3	0	0	0	111.8	L289 L292 L293 V296 L350 L351 I352 I356 L357 E358 I397	L289-L354 HydrophobicContact CD1-CD2 3.59Å; L289-L354 HydrophobicContact CD1-CG 3.81Å; L292-L354 HydrophobicContact CB-CD1 3.64Å; L292-L354 HydrophobicContact CD1-CD1 4.45Å; L293-L354 HydrophobicContact CB-CD2 3.7Å; L293-L354 HydrophobicContact CD1-CD2 3.77Å; L293-L354 HydrophobicContact CG-CD2 4.32Å; V296-L354 HydrophobicContact CG2-CD1 4.13Å; L350-L354 WeakPolarHBondContact O-CG 3.44Å; L350-L354 PolarHBondContact O-N 3.42Å; L350-L354 VanDerWaalsContact O-N 3.11Å; L351-L354 HydrophobicContact CD2-CD1 3.87Å; L351-L354 PolarHBondContact O-N 3.11Å; I352-L354 VanDerWaalsContact C-N 3.33Å; I352-L354 PolarHBondContact O-N 3.35Å; L354-I356 VanDerWaalsContact C-N 3.34Å; L354-I356 PolarHBondContact O-N 3.15Å; L354-L357 PolarHBondContact O-N 3.4Å; L354-L357 VanDerWaalsContact O-N 3.17Å; L354-E358 WeakPolarHBondContact O-CB 3.31Å; L354-E358 PolarHBondContact O-N 2.65Å; L354-I397 HydrophobicContact CB-CD1 4.12Å
355	A	97	Very high	93.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.8	-45.2	177.8	0	0	0	0	0	111.9	L351 I352 C353 E358 T359 V390 I393 A394 I397	L351-A355 WeakPolarHBondContact O-CB 3.4Å; L351-A355 PolarHBondContact O-N 2.92Å; I352-A355 WeakPolarHBondContact O-CB 3.49Å; I352-A355 PolarHBondContact O-N 3.23Å; C353-A355 VanDerWaalsContact C-N 3.35Å; A355-E358 PolarHBondContact O-N 3.37Å; A355-T359 WeakPolarHBondContact O-CG2 3.37Å; A355-T359 PolarHBondContact O-N 3.17Å; A355-V390 HydrophobicContact CB-CG1 3.91Å; A355-V390 WeakPolarHBondContact CB-O 2.8Å; A355-I393 HydrophobicContact CB-CB 3.85Å; A355-I393 HydrophobicContact CB-CG2 3.45Å; A355-I393 VanDerWaalsContact CB-CG2 3.45Å; A355-A394 HydrophobicContact CB-CB 3.91Å; A355-I397 HydrophobicContact CB-CD1 4.47Å
356	I	98	Very high	95.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-48.3	174.8	-62.7	165	0	0	0	109.9	W318 F323 I352 C353 L354 E358 T359 Q360 L381 I385 V390	W318-I356 HydrophobicContact CE3-CD1 4.41Å; W318-I356 HydrophobicContact CH2-CB 3.91Å; W318-I356 HydrophobicContact CH2-CD1 4.44Å; W318-I356 HydrophobicContact CH2-CG2 3.36Å; W318-I356 HydrophobicContact CZ2-CG2 3.8Å; W318-I356 HydrophobicContact CZ3-CB 4.07Å; W318-I356 HydrophobicContact CZ3-CD1 4.34Å; W318-I356 HydrophobicContact CZ3-CG2 4.05Å; F323-I356 HydrophobicContact CD1-CD1 3.85Å; F323-I356 HydrophobicContact CE1-CD1 3.71Å; I352-I356 HydrophobicContact CG2-CD1 4.21Å; I352-I356 WeakPolarHBondContact O-CG1 3.32Å; I352-I356 PolarHBondContact O-N 2.84Å; C353-I356 PolarHBondContact O-N 3.49Å; L354-I356 VanDerWaalsContact C-N 3.34Å; L354-I356 PolarHBondContact O-N 3.15Å; I356-E358 VanDerWaalsContact C-N 3.29Å; I356-E358 PolarHBondContact O-N 3.5Å; I356-T359 PolarHBondContact O-N 3.49Å; I356-T359 PolarHBondContact O-OG1 2.7Å; I356-Q360 WeakPolarHBondContact O-CG 3.47Å; I356-Q360 PolarHBondContact O-N 2.65Å; I356-L381 HydrophobicContact CG2-CD1 4.04Å; I356-I385 HydrophobicContact CD1-CD1 4.01Å; I356-I385 HydrophobicContact CG1-CD1 4.27Å; I356-I385 HydrophobicContact CG1-CG2 4.28Å; I356-I385 HydrophobicContact CG2-CD1 3.93Å; I356-V390 HydrophobicContact CD1-CG1 4.47Å; I356-V390 HydrophobicContact CG1-CG1 3.77Å; I356-V390 HydrophobicContact CG1-CG2 3.9Å
357	L	97.5	Very high	96.1	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-37.3	-178.5	-68.1	170.6	0	0	0	112.8	L300 F304 M312 F314 W318 C353 L354 Q360 K361	L300-L357 HydrophobicContact CD2-CB 4.18Å; F304-L357 HydrophobicContact CE2-CD1 4.36Å; F304-L357 HydrophobicContact CE2-CD2 4.45Å; F304-L357 HydrophobicContact CZ-CD2 4.27Å; M312-L357 HydrophobicContact CE-CD1 3.5Å; F314-L357 HydrophobicContact CD2-CD2 4.5Å; F314-L357 HydrophobicContact CE2-CD1 4.36Å; F314-L357 HydrophobicContact CE2-CD2 3.78Å; W318-L357 HydrophobicContact CH2-CD2 4.11Å; W318-L357 HydrophobicContact CH2-CG 4.41Å; W318-L357 HydrophobicContact CZ3-CD2 4.19Å; W318-L357 HydrophobicContact CZ3-CG 4.12Å; C353-L357 VanDerWaalsContact O-CG 3.3Å; C353-L357 WeakPolarHBondContact O-CG 3.15Å; C353-L357 PolarHBondContact O-N 2.86Å; L354-L357 PolarHBondContact O-N 3.4Å; L354-L357 VanDerWaalsContact O-N 3.17Å; L357-Q360 CarbonylContact O-C 3.4Å; L357-Q360 PolarHBondContact O-N 2.47Å; L357-Q360 VanDerWaalsContact O-N 3.09Å; L357-K361 PolarHBondContact O-N 3.16Å
358	E	96.2	Very high	96.2	Very high	59 Å²	59	44.3 Å²	44.3	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-61.3	-44.5	176.7	-171	-178.7	142.3	0	0	111.7	R101 L354 A355 I356 Q360 K361	R101-E358 IonicContact CZ-OE1 3.4Å; R101-E358 VanDerWaalsContact CZ-OE1 3.32Å; R101-E358 IonicContact CZ-OE2 2.78Å; R101-E358 VanDerWaalsContact NH1-CD 3.3Å; R101-E358 IonicContact NH1-OE1 2.65Å; R101-E358 PolarHBondContact NH1-OE1 2.95Å; R101-E358 IonicContact NH1-OE2 3.23Å; R101-E358 PolarHBondContact NH1-OE2 3.44Å; R101-E358 VanDerWaalsContact NH2-CD 3.31Å; R101-E358 IonicContact NH2-OE1 2.8Å; R101-E358 PolarHBondContact NH2-OE1 2.75Å; R101-E358 VanDerWaalsContact NH2-OE1 3.17Å; R101-E358 IonicContact NH2-OE2 3.14Å; R101-E358 PolarHBondContact NH2-OE2 3.34Å; L354-E358 WeakPolarHBondContact O-CB 3.31Å; L354-E358 PolarHBondContact O-N 2.65Å; A355-E358 PolarHBondContact O-N 3.37Å; I356-E358 VanDerWaalsContact C-N 3.29Å; I356-E358 PolarHBondContact O-N 3.5Å; E358-Q360 PolarHBondContact O-N 2.7Å; E358-Q360 VanDerWaalsContact O-N 3.08Å; E358-K361 WeakPolarHBondContact O-CB 3.35Å; E358-K361 PolarHBondContact O-N 3.44Å; E358-K361 VanDerWaalsContact O-N 3.15Å
359	T	96.4	Very high	96.1	Very high	52 Å²	52	45.1 Å²	45.1	32%	0.319	21%	0.214	S	C	.	.	H	α-helix	trans	-60.6	-22.2	176.3	67.6	0	0	0	0	113.1	A355 I356 I393	A355-T359 WeakPolarHBondContact O-CG2 3.37Å; A355-T359 PolarHBondContact O-N 3.17Å; I356-T359 PolarHBondContact O-N 3.49Å; I356-T359 PolarHBondContact O-OG1 2.7Å; T359-I393 HydrophobicContact CG2-CD1 3.62Å
360	Q	96.6	Very high	95.8	Very high	39 Å²	39	44.7 Å²	44.7	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-102.2	-8.8	-177.2	-56.5	-52.2	-51.6	0	0	113.6	I356 L357 E358 E362 Y363 I364 H377 L381	I356-Q360 WeakPolarHBondContact O-CG 3.47Å; I356-Q360 PolarHBondContact O-N 2.65Å; L357-Q360 CarbonylContact O-C 3.4Å; L357-Q360 PolarHBondContact O-N 2.47Å; L357-Q360 VanDerWaalsContact O-N 3.09Å; E358-Q360 PolarHBondContact O-N 2.7Å; E358-Q360 VanDerWaalsContact O-N 3.08Å; Q360-E362 PolarHBondContact O-N 3.39Å; Q360-Y363 PolarHBondContact O-N 2.95Å; Q360-I364 HydrophobicContact CB-CD1 3.81Å; Q360-I364 HydrophobicContact CB-CG1 4.32Å; Q360-I364 VanDerWaalsContact O-CG1 3.3Å; Q360-I364 WeakPolarHBondContact O-CG1 3.08Å; Q360-I364 PolarHBondContact O-N 3.26Å; Q360-H377 PolarHBondContact OE1-NE2 2.94Å; Q360-L381 HydrophobicContact CG-CD1 3.67Å; Q360-L381 HydrophobicContact CG-CD2 4.09Å
361	K	96.2	Very high	95.1	Very high	34 Å²	34	45.2 Å²	45.2	15%	0.148	22%	0.219	C	C	.	.	H	α-helix	trans	-52.1	-56.8	-172.9	171.9	173.5	174.9	179	0	112.4	D297 E299 L300 L357 E358 Y363 I364 L365	D297-K361 IonicContact OD1-NZ 3.32Å; D297-K361 PolarHBondContact OD1-NZ 3.23Å; D297-K361 WeakPolarHBondContact OD2-CD 3.21Å; D297-K361 WeakPolarHBondContact OD2-CE 3.22Å; D297-K361 IonicContact OD2-NZ 3.17Å; D297-K361 PolarHBondContact OD2-NZ 3.26Å; E299-K361 WeakPolarHBondContact OE2-CE 3.31Å; E299-K361 IonicContact OE2-NZ 2.82Å; E299-K361 PolarHBondContact OE2-NZ 2.84Å; L300-K361 HydrophobicContact CB-CD 4.27Å; L300-K361 HydrophobicContact CD1-CG 4.33Å; L300-K361 HydrophobicContact CD2-CB 4.21Å; L300-K361 HydrophobicContact CD2-CG 4.44Å; L357-K361 PolarHBondContact O-N 3.16Å; E358-K361 WeakPolarHBondContact O-CB 3.35Å; E358-K361 PolarHBondContact O-N 3.44Å; E358-K361 VanDerWaalsContact O-N 3.15Å; K361-Y363 PolarHBondContact O-N 3.05Å; K361-I364 PolarHBondContact O-N 3.04Å; K361-L365 HydrophobicContact CD-CD1 4.36Å; K361-L365 HydrophobicContact CG-CD1 3.72Å; K361-L365 HydrophobicContact CG-CG 4.25Å; K361-L365 VanDerWaalsContact O-CG 3.32Å; K361-L365 WeakPolarHBondContact O-CG 3.26Å; K361-L365 PolarHBondContact O-N 3.01Å
362	E	96.6	Very high	94.4	Very high	169 Å²	169	46.8 Å²	46.8	79%	0.79	23%	0.23	S	C	*	.	H	α-helix	trans	-58.2	-41	-174.4	-65.6	-171.3	167.7	0	0	111.3	Q360 A366	Q360-E362 PolarHBondContact O-N 3.39Å; E362-A366 WeakPolarHBondContact O-CB 3.44Å; E362-A366 PolarHBondContact O-N 3.34Å
363	Y	96.6	Very high	94.1	Very high	114 Å²	114	50 Å²	50	45%	0.447	25%	0.247	S	C	.	.	H	α-helix	trans	-68.2	-46.1	179	-172.8	-106.2	0	0	0	112.1	Q360 K361 L365 A366 Q367 F369 H377	Q360-Y363 PolarHBondContact O-N 2.95Å; K361-Y363 PolarHBondContact O-N 3.05Å; Y363-L365 VanDerWaalsContact C-N 3.33Å; Y363-L365 PolarHBondContact O-N 3.12Å; Y363-A366 PolarHBondContact O-N 3.48Å; Y363-Q367 HydrophobicContact CD1-CG 4.35Å; Y363-Q367 HydrophobicContact CD2-CG 4.14Å; Y363-Q367 HydrophobicContact CE1-CG 4.06Å; Y363-Q367 HydrophobicContact CE2-CG 3.8Å; Y363-Q367 HydrophobicContact CG-CG 4.41Å; Y363-Q367 WeakPolarHBondContact O-CB 3.41Å; Y363-Q367 VanDerWaalsContact O-CG 3.31Å; Y363-Q367 WeakPolarHBondContact O-CG 3.41Å; Y363-Q367 PolarHBondContact O-N 2.68Å; Y363-F369 AromaticContact CD1-CE2 3.87Å; Y363-F369 HydrophobicContact CD1-CE2 3.87Å; Y363-F369 HydrophobicContact CD1-CZ 4.16Å; Y363-F369 AromaticContact CE1-CE2 3.68Å; Y363-F369 HydrophobicContact CE1-CE2 3.68Å; Y363-F369 AromaticContact CE1-CZ 3.56Å; Y363-F369 HydrophobicContact CE1-CZ 3.56Å; Y363-H377 AromaticContact CD1-CE1 3.35Å; Y363-H377 WeakPolarHBondContact CD1-CE1 3.32Å; Y363-H377 AromaticContact CD1-ND1 3.82Å; Y363-H377 AromaticContact CD1-NE2 3.76Å; Y363-H377 AromaticContact CE1-CE1 3.47Å; Y363-H377 VanDerWaalsContact CE1-CE1 3.47Å; Y363-H377 WeakPolarHBondContact CE1-CE1 3.43Å; Y363-H377 AromaticContact CE1-ND1 3.56Å
364	I	96	Very high	93.7	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-46.7	177.6	-70.1	169	0	0	0	110.7	Y303 F304 Q360 K361 R368 F369 I374	Y303-I364 HydrophobicContact CD1-CG2 4.25Å; Y303-I364 HydrophobicContact CE1-CG2 3.87Å; F304-I364 HydrophobicContact CE1-CG2 4.2Å; F304-I364 HydrophobicContact CZ-CD1 4.46Å; Q360-I364 HydrophobicContact CB-CD1 3.81Å; Q360-I364 HydrophobicContact CB-CG1 4.32Å; Q360-I364 VanDerWaalsContact O-CG1 3.3Å; Q360-I364 WeakPolarHBondContact O-CG1 3.08Å; Q360-I364 PolarHBondContact O-N 3.26Å; K361-I364 PolarHBondContact O-N 3.04Å; I364-R368 PolarHBondContact O-N 2.75Å; I364-R368 VanDerWaalsContact O-N 3.13Å; I364-F369 HydrophobicContact CB-CD2 4.36Å; I364-F369 HydrophobicContact CG1-CD2 4.07Å; I364-F369 HydrophobicContact CG2-CB 4.36Å; I364-F369 HydrophobicContact CG2-CD2 4.48Å; I364-F369 PolarHBondContact O-N 3.18Å; I364-I374 HydrophobicContact CG2-CG1 4.33Å
365	L	95.7	Very high	93.2	Very high	40 Å²	40	50.3 Å²	50.3	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-44.4	-179.9	-65.4	-179.8	0	0	0	111.8	E299 Y303 K361 Y363 Q367 R368	E299-L365 HydrophobicContact CG-CD1 4.44Å; Y303-L365 HydrophobicContact CD1-CD2 3.83Å; Y303-L365 HydrophobicContact CD2-CD2 3.29Å; Y303-L365 HydrophobicContact CE1-CD2 4.33Å; Y303-L365 HydrophobicContact CE2-CD2 3.84Å; Y303-L365 HydrophobicContact CG-CD2 3.29Å; K361-L365 HydrophobicContact CD-CD1 4.36Å; K361-L365 HydrophobicContact CG-CD1 3.72Å; K361-L365 HydrophobicContact CG-CG 4.25Å; K361-L365 VanDerWaalsContact O-CG 3.32Å; K361-L365 WeakPolarHBondContact O-CG 3.26Å; K361-L365 PolarHBondContact O-N 3.01Å; Y363-L365 VanDerWaalsContact C-N 3.33Å; Y363-L365 PolarHBondContact O-N 3.12Å; L365-Q367 PolarHBondContact O-N 3.47Å; L365-R368 PolarHBondContact O-N 3.24Å
366	A	96.4	Very high	92.7	Very high	73 Å²	73	58 Å²	58	60%	0.603	28%	0.282	S	S	*	.	H	α-helix	trans	-63.2	-41.3	180	0	0	0	0	0	112.2	E362 Y363 R368	E362-A366 WeakPolarHBondContact O-CB 3.44Å; E362-A366 PolarHBondContact O-N 3.34Å; Y363-A366 PolarHBondContact O-N 3.48Å; A366-R368 VanDerWaalsContact C-N 3.27Å; A366-R368 PolarHBondContact O-N 3.42Å
367	Q	95	Very high	92.5	Very high	104 Å²	104	59 Å²	59	49%	0.486	29%	0.287	S	S	.	.	H	α-helix	trans	-79.5	-9.5	178.6	-62.7	-57.1	-49.8	0	0	113.6	Y363 L365 F369	Y363-Q367 HydrophobicContact CD1-CG 4.35Å; Y363-Q367 HydrophobicContact CD2-CG 4.14Å; Y363-Q367 HydrophobicContact CE1-CG 4.06Å; Y363-Q367 HydrophobicContact CE2-CG 3.8Å; Y363-Q367 HydrophobicContact CG-CG 4.41Å; Y363-Q367 WeakPolarHBondContact O-CB 3.41Å; Y363-Q367 VanDerWaalsContact O-CG 3.31Å; Y363-Q367 WeakPolarHBondContact O-CG 3.41Å; Y363-Q367 PolarHBondContact O-N 2.68Å; L365-Q367 PolarHBondContact O-N 3.47Å; Q367-F369 VanDerWaalsContact C-N 3.31Å; Q367-F369 HydrophobicContact CB-CD1 3.44Å; Q367-F369 VanDerWaalsContact CB-CD1 3.44Å; Q367-F369 HydrophobicContact CB-CD2 4.49Å; Q367-F369 HydrophobicContact CB-CE1 3.16Å; Q367-F369 HydrophobicContact CB-CE2 4.24Å; Q367-F369 HydrophobicContact CB-CG 4.13Å; Q367-F369 HydrophobicContact CB-CZ 3.6Å; Q367-F369 HydrophobicContact CG-CD1 4.48Å; Q367-F369 HydrophobicContact CG-CE1 3.76Å; Q367-F369 HydrophobicContact CG-CE2 4.5Å; Q367-F369 HydrophobicContact CG-CZ 3.76Å; Q367-F369 PolarHBondContact O-N 3.05Å
368	R	93.2	Very high	92.1	Very high	205 Å²	205	59 Å²	59	77%	0.774	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	46.2	-177.6	-56.1	-179.1	179.1	-176.7	-1.3	112.4	Y303 I364 L365 A366 G370	Y303-R368 WeakPolarHBondContact OH-CA 3.32Å; Y303-R368 PolarHBondContact OH-O 3.02Å; I364-R368 PolarHBondContact O-N 2.75Å; I364-R368 VanDerWaalsContact O-N 3.13Å; L365-R368 PolarHBondContact O-N 3.24Å; A366-R368 VanDerWaalsContact C-N 3.27Å; A366-R368 PolarHBondContact O-N 3.42Å; R368-G370 PolarHBondContact O-N 3.46Å
369	F	91.2	Very high	91.7	Very high	29 Å²	29	58.2 Å²	58.2	13%	0.127	28%	0.284	C	S	.	.			trans	-62.4	131.1	-179.9	-71	-17.3	0	0	0	112.3	Y303 Y363 I364 Q367 D373 I374 H377	Y303-F369 WeakPolarHBondContact CE1-O 3.44Å; Y303-F369 PolarHBondContact OH-N 3.01Å; Y303-F369 PolarHBondContact OH-O 2.97Å; Y363-F369 AromaticContact CD1-CE2 3.87Å; Y363-F369 HydrophobicContact CD1-CE2 3.87Å; Y363-F369 HydrophobicContact CD1-CZ 4.16Å; Y363-F369 AromaticContact CE1-CE2 3.68Å; Y363-F369 HydrophobicContact CE1-CE2 3.68Å; Y363-F369 AromaticContact CE1-CZ 3.56Å; Y363-F369 HydrophobicContact CE1-CZ 3.56Å; I364-F369 HydrophobicContact CB-CD2 4.36Å; I364-F369 HydrophobicContact CG1-CD2 4.07Å; I364-F369 HydrophobicContact CG2-CB 4.36Å; I364-F369 HydrophobicContact CG2-CD2 4.48Å; I364-F369 PolarHBondContact O-N 3.18Å; Q367-F369 VanDerWaalsContact C-N 3.31Å; Q367-F369 HydrophobicContact CB-CD1 3.44Å; Q367-F369 VanDerWaalsContact CB-CD1 3.44Å; Q367-F369 HydrophobicContact CB-CD2 4.49Å; Q367-F369 HydrophobicContact CB-CE1 3.16Å; Q367-F369 HydrophobicContact CB-CE2 4.24Å; Q367-F369 HydrophobicContact CB-CG 4.13Å; Q367-F369 HydrophobicContact CB-CZ 3.6Å; Q367-F369 HydrophobicContact CG-CD1 4.48Å; Q367-F369 HydrophobicContact CG-CE1 3.76Å; Q367-F369 HydrophobicContact CG-CE2 4.5Å; Q367-F369 HydrophobicContact CG-CZ 3.76Å; Q367-F369 PolarHBondContact O-N 3.05Å; F369-D373 HydrophobicContact CB-CB 3.68Å; F369-D373 HydrophobicContact CD1-CB 3.61Å; F369-D373 HydrophobicContact CD2-CB 4.49Å; F369-D373 HydrophobicContact CE1-CB 4.33Å; F369-D373 HydrophobicContact CG-CB 3.7Å; F369-I374 HydrophobicContact CB-CG1 3.78Å; F369-H377 HydrophobicContact CD2-CB 4.03Å; F369-H377 HydrophobicContact CE2-CB 3.63Å; F369-H377 AromaticContact CE2-CG 3.6Å; F369-H377 AromaticContact CE2-ND1 3.85Å; F369-H377 HydrophobicContact CZ-CB 4.49Å
370	G	87.8	Confident	91.5	Very high	16 Å²	16	58.9 Å²	58.9	17%	0.165	29%	0.292	C	S	.	.			trans	-86.6	-178.3	163.8	0	0	0	0	0	111.4	R368 S372 D373 I374	R368-G370 PolarHBondContact O-N 3.46Å; G370-S372 PolarHBondContact O-N 3.31Å; G370-D373 PolarHBondContact N-OD2 3.26Å; G370-D373 PolarHBondContact O-N 3.2Å; G370-I374 WeakPolarHBondContact O-CG1 3.41Å; G370-I374 PolarHBondContact O-N 3.41Å
371	F	82.5	Confident	91.3	Very high	11 Å²	11	57.7 Å²	57.7	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-50.6	-47.9	-177	-179.7	-88.4	0	0	0	114.1	A70 S309 D373 I374 L375	A70-F371 HydrophobicContact CB-CD1 3.28Å; A70-F371 HydrophobicContact CB-CE1 3.56Å; S309-F371 WeakPolarHBondContact OG-CA 3.41Å; S309-F371 WeakPolarHBondContact OG-CB 3.39Å; S309-F371 WeakPolarHBondContact OG-CD2 3.21Å; F371-D373 VanDerWaalsContact C-N 3.28Å; F371-D373 PolarHBondContact O-N 3.19Å; F371-I374 PolarHBondContact O-N 2.95Å; F371-L375 PolarHBondContact O-N 3.42Å
372	S	82.6	Confident	91.1	Very high	32 Å²	32	57.9 Å²	57.9	22%	0.224	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-38.7	178.7	-53	0	0	0	0	112.6	A70 G370 K376	A70-S372 WeakPolarHBondContact CB-OG 3.38Å; G370-S372 PolarHBondContact O-N 3.31Å; S372-K376 WeakPolarHBondContact O-CB 3.23Å; S372-K376 PolarHBondContact O-N 3.42Å; S372-K376 VanDerWaalsContact O-N 3.11Å
373	D	90.3	Very high	90.9	Very high	69 Å²	69	55.7 Å²	55.7	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-77.2	-38	-175.9	-54.2	-52.8	0	0	0	110.4	F369 G370 F371 K376 H377	F369-D373 HydrophobicContact CB-CB 3.68Å; F369-D373 HydrophobicContact CD1-CB 3.61Å; F369-D373 HydrophobicContact CD2-CB 4.49Å; F369-D373 HydrophobicContact CE1-CB 4.33Å; F369-D373 HydrophobicContact CG-CB 3.7Å; G370-D373 PolarHBondContact N-OD2 3.26Å; G370-D373 PolarHBondContact O-N 3.2Å; F371-D373 VanDerWaalsContact C-N 3.28Å; F371-D373 PolarHBondContact O-N 3.19Å; D373-K376 PolarHBondContact O-N 2.89Å; D373-H377 VanDerWaalsContact O-CB 3.25Å; D373-H377 WeakPolarHBondContact O-CB 3.33Å; D373-H377 PolarHBondContact O-N 3.32Å
374	I	89.4	Confident	90.9	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-50.4	172.3	-66.4	164	0	0	0	110.1	F304 F314 I364 F369 G370 F371 K376 H377 V378	F304-I374 HydrophobicContact CD1-CD1 3.7Å; F304-I374 HydrophobicContact CE1-CD1 3.74Å; F304-I374 HydrophobicContact CE1-CG1 4.35Å; F304-I374 HydrophobicContact CE1-CG2 4.38Å; F314-I374 HydrophobicContact CD1-CG2 3.79Å; F314-I374 HydrophobicContact CD2-CG2 4.14Å; F314-I374 HydrophobicContact CE1-CG2 3.99Å; F314-I374 HydrophobicContact CE2-CG2 4.31Å; F314-I374 HydrophobicContact CG-CG2 3.88Å; F314-I374 HydrophobicContact CZ-CG2 4.24Å; I364-I374 HydrophobicContact CG2-CG1 4.33Å; F369-I374 HydrophobicContact CB-CG1 3.78Å; G370-I374 WeakPolarHBondContact O-CG1 3.41Å; G370-I374 PolarHBondContact O-N 3.41Å; F371-I374 PolarHBondContact O-N 2.95Å; I374-K376 VanDerWaalsContact C-N 3.32Å; I374-K376 PolarHBondContact O-N 3.09Å; I374-H377 PolarHBondContact O-N 3.18Å; I374-V378 HydrophobicContact CG2-CG2 4.29Å; I374-V378 WeakPolarHBondContact O-CB 3.47Å; I374-V378 WeakPolarHBondContact O-CG2 3.41Å; I374-V378 PolarHBondContact O-N 2.79Å
375	L	86.1	Confident	90.9	Very high	9 Å²	9	57.1 Å²	57.1	5%	0.047	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-44.2	179	179.6	63.7	0	0	0	111.5	M66 F314 F371 N379	M66-L375 HydrophobicContact CB-CD2 3.78Å; F314-L375 HydrophobicContact CB-CB 4.48Å; F314-L375 HydrophobicContact CB-CD1 3.84Å; F371-L375 PolarHBondContact O-N 3.42Å; L375-N379 WeakPolarHBondContact O-CB 3.16Å; L375-N379 PolarHBondContact O-N 2.78Å
376	K	87.4	Confident	90.8	Very high	160 Å²	160	59.3 Å²	59.3	70%	0.696	31%	0.31	S	S	*	.	H	α-helix	trans	-64.2	-42.5	177.5	-173.5	-179.7	177.6	-175.5	0	111.7	S372 D373 I374 N379 S380	S372-K376 WeakPolarHBondContact O-CB 3.23Å; S372-K376 PolarHBondContact O-N 3.42Å; S372-K376 VanDerWaalsContact O-N 3.11Å; D373-K376 PolarHBondContact O-N 2.89Å; I374-K376 VanDerWaalsContact C-N 3.32Å; I374-K376 PolarHBondContact O-N 3.09Å; K376-N379 PolarHBondContact O-N 3.43Å; K376-S380 PolarHBondContact O-N 2.93Å
377	H	92.9	Very high	90.7	Very high	22 Å²	22	56 Å²	56	10%	0.102	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-52.8	177.7	-177.5	63.5	0	0	0	110.9	Q360 Y363 F369 D373 I374 N379 S380 L381	Q360-H377 PolarHBondContact OE1-NE2 2.94Å; Y363-H377 AromaticContact CD1-CE1 3.35Å; Y363-H377 WeakPolarHBondContact CD1-CE1 3.32Å; Y363-H377 AromaticContact CD1-ND1 3.82Å; Y363-H377 AromaticContact CD1-NE2 3.76Å; Y363-H377 AromaticContact CE1-CE1 3.47Å; Y363-H377 VanDerWaalsContact CE1-CE1 3.47Å; Y363-H377 WeakPolarHBondContact CE1-CE1 3.43Å; Y363-H377 AromaticContact CE1-ND1 3.56Å; F369-H377 HydrophobicContact CD2-CB 4.03Å; F369-H377 HydrophobicContact CE2-CB 3.63Å; F369-H377 AromaticContact CE2-CG 3.6Å; F369-H377 AromaticContact CE2-ND1 3.85Å; F369-H377 HydrophobicContact CZ-CB 4.49Å; D373-H377 VanDerWaalsContact O-CB 3.25Å; D373-H377 WeakPolarHBondContact O-CB 3.33Å; D373-H377 PolarHBondContact O-N 3.32Å; I374-H377 PolarHBondContact O-N 3.18Å; H377-N379 VanDerWaalsContact C-N 3.28Å; H377-N379 PolarHBondContact O-N 3.4Å; H377-S380 WeakPolarHBondContact O-CA 3.37Å; H377-S380 WeakPolarHBondContact O-CB 3.44Å; H377-S380 PolarHBondContact O-N 2.98Å; H377-S380 PolarHBondContact O-OG 2.91Å; H377-L381 WeakPolarHBondContact O-CG 3.35Å; H377-L381 PolarHBondContact O-N 3.44Å
378	V	90.2	Very high	90.6	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-53.6	-45.6	176.7	161	0	0	0	0	111.3	F314 W318 I374 S380 L381	F314-V378 HydrophobicContact CB-CG1 4.49Å; F314-V378 HydrophobicContact CD2-CG2 3.95Å; F314-V378 WeakPolarHBondContact O-CG1 3.43Å; W318-V378 HydrophobicContact CH2-CG1 4.16Å; W318-V378 HydrophobicContact CH2-CG2 4.36Å; W318-V378 HydrophobicContact CZ2-CB 4.35Å; W318-V378 HydrophobicContact CZ2-CG1 3.42Å; W318-V378 VanDerWaalsContact CZ2-CG1 3.42Å; W318-V378 HydrophobicContact CZ2-CG2 4.32Å; I374-V378 HydrophobicContact CG2-CG2 4.29Å; I374-V378 WeakPolarHBondContact O-CB 3.47Å; I374-V378 WeakPolarHBondContact O-CG2 3.41Å; I374-V378 PolarHBondContact O-N 2.79Å; V378-S380 VanDerWaalsContact C-N 3.28Å; V378-S380 PolarHBondContact O-N 3.44Å; V378-L381 WeakPolarHBondContact O-CB 3.38Å; V378-L381 PolarHBondContact O-N 3.15Å; V378-L381 VanDerWaalsContact O-N 3.16Å
379	N	86.6	Confident	90.6	Very high	42 Å²	42	51 Å²	51	23%	0.225	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-32	176.4	-77.1	-13.8	0	0	0	113.2	L375 K376 H377 L381 S382	L375-N379 WeakPolarHBondContact O-CB 3.16Å; L375-N379 PolarHBondContact O-N 2.78Å; K376-N379 PolarHBondContact O-N 3.43Å; H377-N379 VanDerWaalsContact C-N 3.28Å; H377-N379 PolarHBondContact O-N 3.4Å; N379-L381 VanDerWaalsContact C-N 3.26Å; N379-L381 PolarHBondContact O-N 3.15Å; N379-S382 WeakPolarHBondContact O-CB 3.41Å; N379-S382 PolarHBondContact O-N 2.97Å
380	S	91.7	Very high	90.8	Very high	67 Å²	67	49.8 Å²	49.8	47%	0.469	26%	0.262	S	S	.	.	H	α-helix	trans	-74.6	-14.2	177.3	75.8	0	0	0	0	113.9	K376 H377 V378 S382 N384	K376-S380 PolarHBondContact O-N 2.93Å; H377-S380 WeakPolarHBondContact O-CA 3.37Å; H377-S380 WeakPolarHBondContact O-CB 3.44Å; H377-S380 PolarHBondContact O-N 2.98Å; H377-S380 PolarHBondContact O-OG 2.91Å; V378-S380 VanDerWaalsContact C-N 3.28Å; V378-S380 PolarHBondContact O-N 3.44Å; S380-S382 PolarHBondContact O-N 3.25Å; S380-N384 PolarHBondContact O-ND2 2.92Å
381	L	93.7	Very high	91	Very high	14 Å²	14	49 Å²	49	7%	0.073	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19	174.4	-58.3	175.3	0	0	0	112.7	W318 I356 Q360 H377 V378 N379 M383 N384 I385	W318-L381 HydrophobicContact CZ2-CD1 4.34Å; I356-L381 HydrophobicContact CG2-CD1 4.04Å; Q360-L381 HydrophobicContact CG-CD1 3.67Å; Q360-L381 HydrophobicContact CG-CD2 4.09Å; H377-L381 WeakPolarHBondContact O-CG 3.35Å; H377-L381 PolarHBondContact O-N 3.44Å; V378-L381 WeakPolarHBondContact O-CB 3.38Å; V378-L381 PolarHBondContact O-N 3.15Å; V378-L381 VanDerWaalsContact O-N 3.16Å; N379-L381 VanDerWaalsContact C-N 3.26Å; N379-L381 PolarHBondContact O-N 3.15Å; L381-M383 PolarHBondContact O-N 2.99Å; L381-N384 WeakPolarHBondContact O-CA 3.27Å; L381-N384 WeakPolarHBondContact O-CB 2.95Å; L381-N384 PolarHBondContact O-N 3.28Å; L381-I385 HydrophobicContact CB-CD1 4.05Å; L381-I385 HydrophobicContact CB-CG1 3.98Å; L381-I385 WeakPolarHBondContact O-CG1 3.03Å
382	S	91.8	Very high	91.4	Very high	37 Å²	37	49.9 Å²	49.9	26%	0.259	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	129.2	178.5	174.6	0	0	0	0	111.3	R325 N379 S380 N384	R325-S382 WeakPolarHBondContact O-CB 3.26Å; R325-S382 PolarHBondContact O-OG 3.46Å; N379-S382 WeakPolarHBondContact O-CB 3.41Å; N379-S382 PolarHBondContact O-N 2.97Å; S380-S382 PolarHBondContact O-N 3.25Å; S382-N384 PolarHBondContact O-N 2.98Å; S382-N384 PolarHBondContact O-ND2 3.48Å; S382-N384 VanDerWaalsContact O-ND2 3.08Å
383	M	92.4	Very high	92	Very high	123 Å²	123	49.4 Å²	49.4	61%	0.606	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	5.2	-176.2	-54	-62.7	-163.1	0	0	115.9	E326 L381	E326-M383 PolarHBondContact O-N 3.49Å; L381-M383 PolarHBondContact O-N 2.99Å
384	N	95.4	Very high	92.2	Very high	129 Å²	129	46.1 Å²	46.1	69%	0.69	24%	0.241	S	C	*	.			trans	-117.2	10.4	-179.6	-61.9	-65.7	0	0	0	112.9	S380 L381 S382	S380-N384 PolarHBondContact O-ND2 2.92Å; L381-N384 WeakPolarHBondContact O-CA 3.27Å; L381-N384 WeakPolarHBondContact O-CB 2.95Å; L381-N384 PolarHBondContact O-N 3.28Å; S382-N384 PolarHBondContact O-N 2.98Å; S382-N384 PolarHBondContact O-ND2 3.48Å; S382-N384 VanDerWaalsContact O-ND2 3.08Å
385	I	95.9	Very high	92.3	Very high	16 Å²	16	48.1 Å²	48.1	8%	0.082	25%	0.25	C	S	.	.			trans	-95	128.9	179.8	-53.2	-178	0	0	0	109.7	E326 F327 I356 L381 V387 V390	E326-I385 HydrophobicContact CB-CD1 3.96Å; F327-I385 HydrophobicContact CD1-CB 4.4Å; F327-I385 HydrophobicContact CE1-CB 3.64Å; F327-I385 HydrophobicContact CE1-CG2 3.59Å; F327-I385 HydrophobicContact CZ-CB 3.97Å; F327-I385 HydrophobicContact CZ-CD1 4.47Å; F327-I385 HydrophobicContact CZ-CG2 3.61Å; I356-I385 HydrophobicContact CD1-CD1 4.01Å; I356-I385 HydrophobicContact CG1-CD1 4.27Å; I356-I385 HydrophobicContact CG1-CG2 4.28Å; I356-I385 HydrophobicContact CG2-CD1 3.93Å; L381-I385 HydrophobicContact CB-CD1 4.05Å; L381-I385 HydrophobicContact CB-CG1 3.98Å; L381-I385 WeakPolarHBondContact O-CG1 3.03Å; I385-V387 PolarHBondContact O-N 2.69Å; I385-V390 HydrophobicContact CG2-CB 4.47Å; I385-V390 HydrophobicContact CG2-CG2 3.46Å; I385-V390 VanDerWaalsContact CG2-CG2 3.46Å
386	N	95.2	Very high	92.6	Very high	86 Å²	86	47.7 Å²	47.7	46%	0.46	25%	0.248	S	C	.	.			trans	-79.2	108.7	172.4	-175.9	-37.7	0	0	0	110.3	H388 E389 V390	N386-H388 VanDerWaalsContact C-N 3.34Å; N386-H388 PolarHBondContact O-N 3.01Å; N386-H388 PolarHBondContact OD1-N 3.31Å; N386-E389 HydrophobicContact CB-CB 3.92Å; N386-E389 PolarHBondContact O-N 2.87Å; N386-E389 PolarHBondContact OD1-N 2.99Å; N386-V390 WeakPolarHBondContact O-CG2 3.37Å; N386-V390 PolarHBondContact O-N 3.44Å
387	V	94.1	Very high	92.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-38	-177.1	66.6	0	0	0	0	113.1	F327 D331 L334 L335 I385 L391	F327-V387 HydrophobicContact CD1-CB 4.07Å; F327-V387 HydrophobicContact CD1-CG2 4.49Å; F327-V387 HydrophobicContact CE1-CB 3.78Å; F327-V387 HydrophobicContact CE1-CG2 4.21Å; D331-V387 HydrophobicContact CB-CB 4.07Å; D331-V387 HydrophobicContact CB-CG1 3.95Å; D331-V387 VanDerWaalsContact OD1-CG1 3.29Å; D331-V387 WeakPolarHBondContact OD1-CG1 3.43Å; L334-V387 HydrophobicContact CD2-CG1 4.01Å; L334-V387 HydrophobicContact CD2-CG2 4.42Å; L335-V387 HydrophobicContact CB-CG2 4.19Å; L335-V387 HydrophobicContact CD1-CG2 4.35Å; I385-V387 PolarHBondContact O-N 2.69Å; V387-L391 HydrophobicContact CG2-CD1 4.07Å; V387-L391 HydrophobicContact CG2-CG 4.41Å; V387-L391 WeakPolarHBondContact O-CB 2.81Å; V387-L391 VanDerWaalsContact O-CG 3.28Å; V387-L391 WeakPolarHBondContact O-CG 3.33Å; V387-L391 PolarHBondContact O-N 3.23Å
388	H	91.6	Very high	92.9	Very high	101 Å²	101	41 Å²	41	47%	0.468	22%	0.218	S	C	.	.	H	α-helix	trans	-69.5	-41.3	-178.6	-71	-78.6	0	0	0	111.8	L334 N386 A392	L334-H388 WeakPolarHBondContact CD2-CE1 2.93Å; N386-H388 VanDerWaalsContact C-N 3.34Å; N386-H388 PolarHBondContact O-N 3.01Å; N386-H388 PolarHBondContact OD1-N 3.31Å; H388-A392 WeakPolarHBondContact O-CB 3.5Å; H388-A392 PolarHBondContact O-N 3.19Å
389	E	93.5	Very high	93	Very high	105 Å²	105	43.9 Å²	43.9	49%	0.491	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-48.3	176.2	-178.9	174.6	-156	0	0	110.9	N386 L391 A392 I393	N386-E389 HydrophobicContact CB-CB 3.92Å; N386-E389 PolarHBondContact O-N 2.87Å; N386-E389 PolarHBondContact OD1-N 2.99Å; E389-L391 PolarHBondContact O-N 3.39Å; E389-A392 PolarHBondContact O-N 3.45Å; E389-I393 HydrophobicContact CG-CD1 3.91Å; E389-I393 WeakPolarHBondContact O-CG1 3.47Å; E389-I393 PolarHBondContact O-N 2.85Å
390	V	94.9	Very high	93.3	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-42.7	179.5	167.8	0	0	0	0	111.8	I352 A355 I356 I385 N386 I393 A394	I352-V390 HydrophobicContact CG2-CG1 3.78Å; A355-V390 HydrophobicContact CB-CG1 3.91Å; A355-V390 WeakPolarHBondContact CB-O 2.8Å; I356-V390 HydrophobicContact CD1-CG1 4.47Å; I356-V390 HydrophobicContact CG1-CG1 3.77Å; I356-V390 HydrophobicContact CG1-CG2 3.9Å; I385-V390 HydrophobicContact CG2-CB 4.47Å; I385-V390 HydrophobicContact CG2-CG2 3.46Å; I385-V390 VanDerWaalsContact CG2-CG2 3.46Å; N386-V390 WeakPolarHBondContact O-CG2 3.37Å; N386-V390 PolarHBondContact O-N 3.44Å; V390-I393 PolarHBondContact O-N 2.74Å; V390-A394 VanDerWaalsContact O-CB 3.32Å; V390-A394 WeakPolarHBondContact O-CB 3.42Å; V390-A394 PolarHBondContact O-N 3.16Å
391	L	92.5	Very high	93.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-43.8	175.4	-78.3	174	0	0	0	111.9	L334 L335 V338 F348 I352 V387 E389 A394 E395	L334-L391 HydrophobicContact CD2-CD1 4.23Å; L334-L391 HydrophobicContact CG-CD1 4.16Å; L335-L391 HydrophobicContact CD1-CD2 3.74Å; L335-L391 HydrophobicContact CD1-CG 4.17Å; V338-L391 HydrophobicContact CB-CD2 4.34Å; V338-L391 HydrophobicContact CG1-CD2 4Å; V338-L391 HydrophobicContact CG2-CD1 4.17Å; F348-L391 HydrophobicContact CE1-CD2 3.99Å; F348-L391 HydrophobicContact CZ-CD2 4.42Å; I352-L391 HydrophobicContact CD1-CD2 4.35Å; V387-L391 HydrophobicContact CG2-CD1 4.07Å; V387-L391 HydrophobicContact CG2-CG 4.41Å; V387-L391 WeakPolarHBondContact O-CB 2.81Å; V387-L391 VanDerWaalsContact O-CG 3.28Å; V387-L391 WeakPolarHBondContact O-CG 3.33Å; V387-L391 PolarHBondContact O-N 3.23Å; E389-L391 PolarHBondContact O-N 3.39Å; L391-A394 PolarHBondContact O-N 3.07Å; L391-E395 WeakPolarHBondContact O-CB 3.41Å; L391-E395 PolarHBondContact O-N 3.39Å
392	A	91.4	Very high	93.2	Very high	29 Å²	29	40.1 Å²	40.1	24%	0.24	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-39.8	178.6	0	0	0	0	0	112.2	H388 E389 G396	H388-A392 WeakPolarHBondContact O-CB 3.5Å; H388-A392 PolarHBondContact O-N 3.19Å; E389-A392 PolarHBondContact O-N 3.45Å; A392-G396 PolarHBondContact O-N 3.11Å
393	I	94.2	Very high	93.2	Very high	23 Å²	23	41.8 Å²	41.8	12%	0.118	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-48.4	174.6	-70.2	169.2	0	0	0	110.4	A355 T359 E389 V390 E395 G396 I397	A355-I393 HydrophobicContact CB-CB 3.85Å; A355-I393 HydrophobicContact CB-CG2 3.45Å; A355-I393 VanDerWaalsContact CB-CG2 3.45Å; T359-I393 HydrophobicContact CG2-CD1 3.62Å; E389-I393 HydrophobicContact CG-CD1 3.91Å; E389-I393 WeakPolarHBondContact O-CG1 3.47Å; E389-I393 PolarHBondContact O-N 2.85Å; V390-I393 PolarHBondContact O-N 2.74Å; I393-E395 PolarHBondContact O-N 2.89Å; I393-G396 CarbonylContact O-C 3.2Å; I393-G396 WeakPolarHBondContact O-CA 3.46Å; I393-G396 PolarHBondContact O-N 2.8Å; I393-G396 VanDerWaalsContact O-N 3.13Å; I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 HydrophobicContact CG2-CG1 4.37Å; I393-I397 WeakPolarHBondContact O-CG1 3.08Å; I393-I397 PolarHBondContact O-N 3.21Å
394	A	94.5	Very high	93.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-44.5	-179.1	0	0	0	0	0	112.1	F348 L351 I352 A355 V390 L391 G396 I397 Y398	F348-A394 HydrophobicContact CE2-CB 3.81Å; F348-A394 HydrophobicContact CZ-CB 3.78Å; L351-A394 HydrophobicContact CB-CB 4.24Å; I352-A394 HydrophobicContact CG1-CB 3.97Å; A355-A394 HydrophobicContact CB-CB 3.91Å; V390-A394 VanDerWaalsContact O-CB 3.32Å; V390-A394 WeakPolarHBondContact O-CB 3.42Å; V390-A394 PolarHBondContact O-N 3.16Å; L391-A394 PolarHBondContact O-N 3.07Å; A394-G396 VanDerWaalsContact C-N 3.34Å; A394-I397 PolarHBondContact O-N 3.34Å; A394-Y398 PolarHBondContact O-N 3.02Å
395	E	91.8	Very high	93	Very high	41 Å²	41	33.6 Å²	33.6	19%	0.192	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-40.2	174.8	-167.9	177.3	171	0	0	111.3	L104 R106 I344 L391 I393 I397 Y398 H399	L104-E395 HydrophobicContact CD1-CG 3.74Å; L104-E395 WeakPolarHBondContact CD1-OE1 3.23Å; R106-E395 IonicContact NH1-OE2 3.17Å; R106-E395 PolarHBondContact NH1-OE2 2.64Å; I344-E395 HydrophobicContact CD1-CG 4.24Å; L391-E395 WeakPolarHBondContact O-CB 3.41Å; L391-E395 PolarHBondContact O-N 3.39Å; I393-E395 PolarHBondContact O-N 2.89Å; E395-I397 PolarHBondContact O-N 3.47Å; E395-Y398 WeakPolarHBondContact O-CB 3.4Å; E395-Y398 PolarHBondContact O-N 3.15Å; E395-H399 PolarHBondContact O-CD2 3.41Å; E395-H399 PolarHBondContact O-N 3.38Å
396	G	92.7	Very high	92.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-44.4	172.9	0	0	0	0	0	113.2	A392 I393 A394 H399 Q400	A392-G396 PolarHBondContact O-N 3.11Å; I393-G396 CarbonylContact O-C 3.2Å; I393-G396 WeakPolarHBondContact O-CA 3.46Å; I393-G396 PolarHBondContact O-N 2.8Å; I393-G396 VanDerWaalsContact O-N 3.13Å; A394-G396 VanDerWaalsContact C-N 3.34Å; G396-H399 PolarHBondContact O-N 2.72Å; G396-Q400 WeakPolarHBondContact O-CG 3.35Å; G396-Q400 PolarHBondContact O-N 3.42Å
397	I	93.9	Very high	92.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-46.5	175.5	-67.6	165.4	0	0	0	110.1	V296 L351 L354 A355 I393 A394 E395 H399 Q400 L401	V296-I397 HydrophobicContact CG1-CD1 4.28Å; V296-I397 HydrophobicContact CG1-CG1 4.29Å; V296-I397 HydrophobicContact CG1-CG2 4.15Å; V296-I397 HydrophobicContact CG2-CG2 3.75Å; L351-I397 HydrophobicContact CD2-CG2 4.04Å; L354-I397 HydrophobicContact CB-CD1 4.12Å; A355-I397 HydrophobicContact CB-CD1 4.47Å; I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 HydrophobicContact CG2-CG1 4.37Å; I393-I397 WeakPolarHBondContact O-CG1 3.08Å; I393-I397 PolarHBondContact O-N 3.21Å; A394-I397 PolarHBondContact O-N 3.34Å; E395-I397 PolarHBondContact O-N 3.47Å; I397-H399 VanDerWaalsContact C-N 3.31Å; I397-H399 PolarHBondContact O-N 3Å; I397-Q400 PolarHBondContact O-N 3.28Å; I397-Q400 VanDerWaalsContact O-N 3.17Å; I397-L401 HydrophobicContact CG2-CD1 3.91Å; I397-L401 HydrophobicContact CG2-CG 4.41Å; I397-L401 WeakPolarHBondContact O-CG 3.41Å; I397-L401 PolarHBondContact O-N 3.16Å
398	Y	93.3	Very high	92.2	Very high	42 Å²	42	40.9 Å²	40.9	17%	0.165	22%	0.216	C	C	.	.	H	α-helix	trans	-53.7	-49.2	176.6	174.3	-102	0	0	0	111.4	I344 L351 A394 E395 Q400 L401 A402 F418	I344-Y398 HydrophobicContact CD1-CD1 4.34Å; I344-Y398 HydrophobicContact CD1-CG 4.42Å; I344-Y398 HydrophobicContact CG1-CD1 4.35Å; I344-Y398 HydrophobicContact CG1-CE1 4.43Å; I344-Y398 HydrophobicContact CG2-CD1 4.24Å; I344-Y398 HydrophobicContact CG2-CD2 3.48Å; I344-Y398 VanDerWaalsContact CG2-CD2 3.48Å; I344-Y398 HydrophobicContact CG2-CE1 4.26Å; I344-Y398 HydrophobicContact CG2-CE2 3.49Å; I344-Y398 VanDerWaalsContact CG2-CE2 3.49Å; I344-Y398 HydrophobicContact CG2-CG 3.86Å; L351-Y398 HydrophobicContact CD1-CD2 4.07Å; L351-Y398 HydrophobicContact CD1-CG 4.34Å; A394-Y398 PolarHBondContact O-N 3.02Å; E395-Y398 WeakPolarHBondContact O-CB 3.4Å; E395-Y398 PolarHBondContact O-N 3.15Å; Y398-Q400 PolarHBondContact O-N 2.92Å; Y398-L401 PolarHBondContact O-N 3.28Å; Y398-A402 WeakPolarHBondContact O-CB 3.19Å; Y398-A402 PolarHBondContact O-N 3.13Å; Y398-F418 HydrophobicContact CD2-CE1 4.28Å; Y398-F418 HydrophobicContact CD2-CZ 4.08Å; Y398-F418 AromaticContact CE2-CE1 3.46Å; Y398-F418 HydrophobicContact CE2-CE1 3.46Å; Y398-F418 VanDerWaalsContact CE2-CE1 3.46Å; Y398-F418 AromaticContact CE2-CZ 3.71Å; Y398-F418 HydrophobicContact CE2-CZ 3.71Å; Y398-F418 AromaticContact CZ-CE1 3.81Å
399	H	91.7	Very high	92.1	Very high	62 Å²	62	38.7 Å²	38.7	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-69.2	-30.7	179.9	-74.4	-59.7	0	0	0	114.2	L104 E395 G396 I397 A403	L104-H399 WeakPolarHBondContact CD1-CD2 3.36Å; L104-H399 WeakPolarHBondContact CD1-NE2 3.39Å; E395-H399 PolarHBondContact O-CD2 3.41Å; E395-H399 PolarHBondContact O-N 3.38Å; G396-H399 PolarHBondContact O-N 2.72Å; I397-H399 VanDerWaalsContact C-N 3.31Å; I397-H399 PolarHBondContact O-N 3Å; H399-A403 VanDerWaalsContact O-CB 3.32Å; H399-A403 WeakPolarHBondContact O-CB 3.42Å; H399-A403 PolarHBondContact O-N 3.39Å
400	Q	93	Very high	91.9	Very high	21 Å²	21	40.4 Å²	40.4	10%	0.098	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-46.8	172.2	-74.8	176.1	-73.6	0	0	110.5	P99 R101 G396 I397 Y398 A403	P99-Q400 HydrophobicContact CG-CB 4.47Å; P99-Q400 PolarHBondContact O-NE2 3.14Å; R101-Q400 HydrophobicContact CB-CG 4.35Å; G396-Q400 WeakPolarHBondContact O-CG 3.35Å; G396-Q400 PolarHBondContact O-N 3.42Å; I397-Q400 PolarHBondContact O-N 3.28Å; I397-Q400 VanDerWaalsContact O-N 3.17Å; Y398-Q400 PolarHBondContact O-N 2.92Å; Q400-A403 PolarHBondContact O-N 3.38Å
401	L	93.3	Very high	91.5	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.3	-43.5	179	-65.5	172.9	0	0	0	111.4	L98 L292 V295 V296 L351 I397 Y398 A403 V404 Q405 L408 L416 F418	L98-L401 HydrophobicContact CD1-CD2 4.35Å; L98-L401 HydrophobicContact CD2-CD2 3.91Å; L292-L401 HydrophobicContact CD2-CD1 4.4Å; V295-L401 HydrophobicContact CG1-CD2 3.93Å; V296-L401 HydrophobicContact CG2-CD1 4.02Å; V296-L401 HydrophobicContact CG2-CD2 4.21Å; V296-L401 HydrophobicContact CG2-CG 4.43Å; L351-L401 HydrophobicContact CD2-CD1 4.36Å; I397-L401 HydrophobicContact CG2-CD1 3.91Å; I397-L401 HydrophobicContact CG2-CG 4.41Å; I397-L401 WeakPolarHBondContact O-CG 3.41Å; I397-L401 PolarHBondContact O-N 3.16Å; Y398-L401 PolarHBondContact O-N 3.28Å; L401-A403 VanDerWaalsContact C-N 3.27Å; L401-A403 PolarHBondContact O-N 3.33Å; L401-V404 CarbonylContact O-C 3.56Å; L401-V404 WeakPolarHBondContact O-CG2 3.43Å; L401-V404 PolarHBondContact O-N 3.47Å; L401-V404 VanDerWaalsContact O-N 3.09Å; L401-Q405 PolarHBondContact O-N 3.46Å; L401-Q405 VanDerWaalsContact O-N 3.08Å; L401-L408 HydrophobicContact CB-CD1 4.14Å; L401-L408 HydrophobicContact CD2-CD1 4.44Å; L401-L408 HydrophobicContact CD2-CD2 3.88Å; L401-L408 WeakPolarHBondContact O-CD1 3.38Å; L401-L416 HydrophobicContact CB-CD1 4.13Å; L401-L416 HydrophobicContact CD1-CD1 3.51Å; L401-L416 HydrophobicContact CG-CD1 4.45Å; L401-F418 HydrophobicContact CB-CE2 3.96Å; L401-F418 HydrophobicContact CB-CZ 4.4Å
402	A	91.1	Very high	91.5	Very high	23 Å²	23	44.3 Å²	44.3	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-36.8	177.2	0	0	0	0	0	112.3	Y398 V404 Q405 F418	Y398-A402 WeakPolarHBondContact O-CB 3.19Å; Y398-A402 PolarHBondContact O-N 3.13Å; A402-V404 PolarHBondContact O-N 2.93Å; A402-Q405 WeakPolarHBondContact O-CB 3.45Å; A402-Q405 WeakPolarHBondContact O-CG 3.38Å; A402-Q405 PolarHBondContact O-N 3.21Å; A402-F418 HydrophobicContact CB-CE1 3.95Å; A402-F418 HydrophobicContact CB-CE2 4.36Å; A402-F418 HydrophobicContact CB-CZ 3.65Å
403	A	91.7	Very high	91.4	Very high	71 Å²	71	43 Å²	43	59%	0.587	23%	0.225	S	C	*	.	H	α-helix	trans	-65.1	-24.9	178.1	0	0	0	0	0	113.4	P99 H399 Q400 L401	P99-A403 HydrophobicContact CG-CB 3.96Å; H399-A403 VanDerWaalsContact O-CB 3.32Å; H399-A403 WeakPolarHBondContact O-CB 3.42Å; H399-A403 PolarHBondContact O-N 3.39Å; Q400-A403 PolarHBondContact O-N 3.38Å; L401-A403 VanDerWaalsContact C-N 3.27Å; L401-A403 PolarHBondContact O-N 3.33Å
404	V	92.3	Very high	91.3	Very high	16 Å²	16	45.5 Å²	45.5	10%	0.097	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	20.9	178.1	-59.9	0	0	0	0	112.3	L96 L98 P99 L401 A402 N406 E407 L408	L96-V404 HydrophobicContact CD1-CB 4.42Å; L96-V404 HydrophobicContact CD2-CG2 4.34Å; L98-V404 HydrophobicContact CD2-CG2 3.77Å; P99-V404 HydrophobicContact CG-CG1 4.38Å; L401-V404 CarbonylContact O-C 3.56Å; L401-V404 WeakPolarHBondContact O-CG2 3.43Å; L401-V404 PolarHBondContact O-N 3.47Å; L401-V404 VanDerWaalsContact O-N 3.09Å; A402-V404 PolarHBondContact O-N 2.93Å; V404-N406 PolarHBondContact O-N 3.18Å; V404-E407 WeakPolarHBondContact O-CA 3.49Å; V404-E407 PolarHBondContact O-N 3.01Å; V404-L408 HydrophobicContact CG2-CD2 4.08Å; V404-L408 HydrophobicContact CG2-CG 4.18Å; V404-L408 PolarHBondContact O-N 3.21Å
405	Q	90.9	Very high	91.1	Very high	65 Å²	65	45.7 Å²	45.7	30%	0.304	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.4	-171.4	65.7	-177.7	-32.2	0	0	114.8	L401 A402 E407 F418	L401-Q405 PolarHBondContact O-N 3.46Å; L401-Q405 VanDerWaalsContact O-N 3.08Å; A402-Q405 WeakPolarHBondContact O-CB 3.45Å; A402-Q405 WeakPolarHBondContact O-CG 3.38Å; A402-Q405 PolarHBondContact O-N 3.21Å; Q405-E407 VanDerWaalsContact C-N 3.32Å; Q405-F418 HydrophobicContact CB-CB 4.15Å; Q405-F418 HydrophobicContact CB-CD2 3.83Å; Q405-F418 HydrophobicContact CB-CE2 4.47Å; Q405-F418 HydrophobicContact CB-CG 4.08Å
406	N	89.3	Confident	91.1	Very high	110 Å²	110	43.9 Å²	43.9	59%	0.588	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.3	178.9	-61.9	-27.5	0	0	0	113.4	V404	V404-N406 PolarHBondContact O-N 3.18Å
407	E	90	Very high	90.9	Very high	136 Å²	136	47 Å²	47	64%	0.636	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.2	177.7	-60	177.2	-144.7	0	0	111.8	L96 V404 Q405	L96-E407 HydrophobicContact CD1-CB 3.49Å; L96-E407 VanDerWaalsContact CD1-CB 3.49Å; L96-E407 WeakPolarHBondContact CD1-OE2 3.4Å; V404-E407 WeakPolarHBondContact O-CA 3.49Å; V404-E407 PolarHBondContact O-N 3.01Å; Q405-E407 VanDerWaalsContact C-N 3.32Å
408	L	89.3	Confident	90.5	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.052	26%	0.263	C	S	.	.	S	Bend	trans	-71.5	144.2	179.1	-71.9	176.3	0	0	0	111.3	L96 V295 L401 V404 H410 I412 F418	L96-L408 HydrophobicContact CD2-CD2 3.65Å; V295-L408 HydrophobicContact CG1-CD2 3.99Å; L401-L408 HydrophobicContact CB-CD1 4.14Å; L401-L408 HydrophobicContact CD2-CD1 4.44Å; L401-L408 HydrophobicContact CD2-CD2 3.88Å; L401-L408 WeakPolarHBondContact O-CD1 3.38Å; V404-L408 HydrophobicContact CG2-CD2 4.08Å; V404-L408 HydrophobicContact CG2-CG 4.18Å; V404-L408 PolarHBondContact O-N 3.21Å; L408-H410 PolarHBondContact O-N 3.11Å; L408-I412 HydrophobicContact CD1-CG2 4.13Å; L408-I412 HydrophobicContact CD2-CG2 4.12Å; L408-F418 HydrophobicContact CD1-CD2 3.84Å; L408-F418 HydrophobicContact CD1-CE2 3.9Å
409	P	89.5	Confident	89.3	Confident	56 Å²	56	52.8 Å²	52.8	36%	0.364	29%	0.293	S	S	.	.			trans	-54.9	140.9	166.6	-22.1	32.2	0	0	0	110.8	E411 I412 A413	P409-E411 PolarHBondContact O-N 3.47Å; P409-E411 VanDerWaalsContact O-N 3.12Å; P409-I412 HydrophobicContact CB-CG1 4.16Å; P409-I412 HydrophobicContact CG-CG1 4.21Å; P409-I412 WeakPolarHBondContact O-CB 3.44Å; P409-I412 PolarHBondContact O-N 3.15Å; P409-A413 PolarHBondContact O-N 3.41Å; P409-A413 VanDerWaalsContact O-N 3.09Å
410	H	88.4	Confident	87.7	Confident	140 Å²	140	52 Å²	52	65%	0.648	29%	0.292	S	S	*	.	H	α-helix	trans	-53.3	-37.1	-178	178.7	-79.3	0	0	0	113	L408 I412 A413 S414	L408-H410 PolarHBondContact O-N 3.11Å; H410-I412 VanDerWaalsContact C-N 3.33Å; H410-I412 PolarHBondContact O-N 3.14Å; H410-A413 PolarHBondContact O-N 3.22Å; H410-S414 VanDerWaalsContact O-CB 3.26Å; H410-S414 WeakPolarHBondContact O-CB 3.49Å; H410-S414 PolarHBondContact O-N 2.91Å
411	E	87.6	Confident	85.6	Confident	78 Å²	78	55.3 Å²	55.3	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-61.2	-41.4	176.9	-170.2	169.3	-163.3	0	0	111.6	K287 P409 S414 I415	K287-E411 IonicContact NZ-OE1 3.95Å; K287-E411 PolarHBondContact NZ-OE1 2.82Å; P409-E411 PolarHBondContact O-N 3.47Å; P409-E411 VanDerWaalsContact O-N 3.12Å; E411-S414 PolarHBondContact O-N 2.67Å; E411-I415 HydrophobicContact CG-CD1 4.32Å; E411-I415 WeakPolarHBondContact O-CD1 3.31Å; E411-I415 WeakPolarHBondContact O-CG1 3.42Å; E411-I415 PolarHBondContact O-N 3.4Å
412	I	91.5	Very high	83.1	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.031	38%	0.378	C	S	.	.	H	α-helix	trans	-69.5	-45.5	179.4	-56.8	-64	0	0	0	111.1	C291 L292 V295 L408 P409 H410 S414 I415 L416	C291-I412 VanDerWaalsContact C-CD1 3.48Å; C291-I412 HydrophobicContact CB-CD1 3.75Å; C291-I412 VanDerWaalsContact O-CD1 3.3Å; C291-I412 WeakPolarHBondContact O-CD1 3.44Å; L292-I412 HydrophobicContact CD2-CD1 4.43Å; L292-I412 HydrophobicContact CD2-CG2 3.95Å; V295-I412 HydrophobicContact CG2-CD1 4.02Å; V295-I412 HydrophobicContact CG2-CG1 3.89Å; L408-I412 HydrophobicContact CD1-CG2 4.13Å; L408-I412 HydrophobicContact CD2-CG2 4.12Å; P409-I412 HydrophobicContact CB-CG1 4.16Å; P409-I412 HydrophobicContact CG-CG1 4.21Å; P409-I412 WeakPolarHBondContact O-CB 3.44Å; P409-I412 PolarHBondContact O-N 3.15Å; H410-I412 VanDerWaalsContact C-N 3.33Å; H410-I412 PolarHBondContact O-N 3.14Å; I412-S414 VanDerWaalsContact C-N 3.27Å; I412-S414 PolarHBondContact O-N 3.06Å; I412-I415 HydrophobicContact CD1-CD1 4.43Å; I412-I415 WeakPolarHBondContact O-CB 3.17Å; I412-I415 PolarHBondContact O-N 2.63Å; I412-I415 VanDerWaalsContact O-N 3.14Å; I412-L416 PolarHBondContact O-N 2.74Å
413	A	90.3	Very high	82.7	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-37.6	176.7	0	0	0	0	0	111.8	P409 H410 I415 L416 S417 F418 V420	P409-A413 PolarHBondContact O-N 3.41Å; P409-A413 VanDerWaalsContact O-N 3.09Å; H410-A413 PolarHBondContact O-N 3.22Å; A413-I415 VanDerWaalsContact C-N 3.35Å; A413-I415 PolarHBondContact O-N 3.32Å; A413-L416 CarbonylContact O-C 3.55Å; A413-L416 PolarHBondContact O-N 2.83Å; A413-S417 PolarHBondContact O-N 3.01Å; A413-F418 HydrophobicContact CB-CB 4.13Å; A413-F418 PolarHBondContact O-N 3.14Å; A413-V420 HydrophobicContact CB-CG2 3.09Å
414	S	90.6	Very high	82.2	Confident	77 Å²	77	66.1 Å²	66.1	54%	0.538	38%	0.377	S	S	.	.	H	α-helix	trans	-66.3	-33.2	173.9	-179.7	0	0	0	0	113.1	H410 E411 I412 L416	H410-S414 VanDerWaalsContact O-CB 3.26Å; H410-S414 WeakPolarHBondContact O-CB 3.49Å; H410-S414 PolarHBondContact O-N 2.91Å; E411-S414 PolarHBondContact O-N 2.67Å; I412-S414 VanDerWaalsContact C-N 3.27Å; I412-S414 PolarHBondContact O-N 3.06Å; S414-L416 VanDerWaalsContact C-N 3.3Å
415	I	91.3	Very high	81.6	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.021	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-36.5	177.2	-71.2	162.1	0	0	0	111	Q288 C291 L292 N347 L350 E411 I412 A413	Q288-I415 HydrophobicContact CB-CD1 3.74Å; Q288-I415 HydrophobicContact CB-CG1 4.04Å; Q288-I415 HydrophobicContact CB-CG2 4.17Å; Q288-I415 HydrophobicContact CG-CD1 3.72Å; Q288-I415 HydrophobicContact CG-CG1 3.68Å; Q288-I415 HydrophobicContact CG-CG2 4.48Å; C291-I415 HydrophobicContact CB-CD1 4.32Å; L292-I415 HydrophobicContact CD1-CG2 3.84Å; L292-I415 HydrophobicContact CD2-CG2 4.29Å; L292-I415 HydrophobicContact CG-CG2 4.2Å; N347-I415 HydrophobicContact CB-CG2 4.41Å; N347-I415 PolarHBondContact ND2-O 3.38Å; L350-I415 HydrophobicContact CD1-CG2 4.34Å; E411-I415 HydrophobicContact CG-CD1 4.32Å; E411-I415 WeakPolarHBondContact O-CD1 3.31Å; E411-I415 WeakPolarHBondContact O-CG1 3.42Å; E411-I415 PolarHBondContact O-N 3.4Å; I412-I415 HydrophobicContact CD1-CD1 4.43Å; I412-I415 WeakPolarHBondContact O-CB 3.17Å; I412-I415 PolarHBondContact O-N 2.63Å; I412-I415 VanDerWaalsContact O-N 3.14Å; A413-I415 VanDerWaalsContact C-N 3.35Å; A413-I415 PolarHBondContact O-N 3.32Å
416	L	90.9	Very high	81.1	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	12.2	-177.4	-59.3	178.1	0	0	0	113.3	L292 L351 L401 I412 A413 S414 F418	L292-L416 HydrophobicContact CD2-CD1 4.04Å; L292-L416 HydrophobicContact CD2-CD2 4.34Å; L292-L416 HydrophobicContact CD2-CG 4.16Å; L351-L416 HydrophobicContact CD1-CD2 4.15Å; L351-L416 HydrophobicContact CD2-CD2 4.16Å; L351-L416 HydrophobicContact CG-CD2 4.25Å; L401-L416 HydrophobicContact CB-CD1 4.13Å; L401-L416 HydrophobicContact CD1-CD1 3.51Å; L401-L416 HydrophobicContact CG-CD1 4.45Å; I412-L416 PolarHBondContact O-N 2.74Å; A413-L416 CarbonylContact O-C 3.55Å; A413-L416 PolarHBondContact O-N 2.83Å; S414-L416 VanDerWaalsContact C-N 3.3Å; L416-F418 HydrophobicContact CB-CD1 4.37Å; L416-F418 HydrophobicContact CB-CD2 4.08Å; L416-F418 HydrophobicContact CB-CE1 4.21Å; L416-F418 HydrophobicContact CB-CE2 3.9Å; L416-F418 HydrophobicContact CB-CG 4.31Å; L416-F418 HydrophobicContact CB-CZ 3.96Å; L416-F418 HydrophobicContact CD1-CD2 4.49Å; L416-F418 HydrophobicContact CD1-CE2 3.72Å; L416-F418 HydrophobicContact CD1-CZ 3.99Å; L416-F418 HydrophobicContact CG-CE2 4.48Å; L416-F418 PolarHBondContact O-N 3.26Å; L416-F418 VanDerWaalsContact O-N 3.09Å
417	S	88.4	Confident	80.6	Confident	64 Å²	64	66.5 Å²	66.5	45%	0.448	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	32.2	-179.8	-59.6	0	0	0	0	114.1	T346 A413	T346-S417 PolarHBondContact OG1-OG 2.88Å; A413-S417 PolarHBondContact O-N 3.01Å
418	F	85.4	Confident	80	Confident	19 Å²	19	61.9 Å²	61.9	8%	0.083	37%	0.369	C	S	.	.			trans	-75.1	132.4	174.3	-65.8	-28.2	0	0	0	110.5	Y398 L401 A402 Q405 L408 A413 L416 V420	Y398-F418 HydrophobicContact CD2-CE1 4.28Å; Y398-F418 HydrophobicContact CD2-CZ 4.08Å; Y398-F418 AromaticContact CE2-CE1 3.46Å; Y398-F418 HydrophobicContact CE2-CE1 3.46Å; Y398-F418 VanDerWaalsContact CE2-CE1 3.46Å; Y398-F418 AromaticContact CE2-CZ 3.71Å; Y398-F418 HydrophobicContact CE2-CZ 3.71Å; Y398-F418 AromaticContact CZ-CE1 3.81Å; L401-F418 HydrophobicContact CB-CE2 3.96Å; L401-F418 HydrophobicContact CB-CZ 4.4Å; A402-F418 HydrophobicContact CB-CE1 3.95Å; A402-F418 HydrophobicContact CB-CE2 4.36Å; A402-F418 HydrophobicContact CB-CZ 3.65Å; Q405-F418 HydrophobicContact CB-CB 4.15Å; Q405-F418 HydrophobicContact CB-CD2 3.83Å; Q405-F418 HydrophobicContact CB-CE2 4.47Å; Q405-F418 HydrophobicContact CB-CG 4.08Å; L408-F418 HydrophobicContact CD1-CD2 3.84Å; L408-F418 HydrophobicContact CD1-CE2 3.9Å; A413-F418 HydrophobicContact CB-CB 4.13Å; A413-F418 PolarHBondContact O-N 3.14Å; L416-F418 HydrophobicContact CB-CD1 4.37Å; L416-F418 HydrophobicContact CB-CD2 4.08Å; L416-F418 HydrophobicContact CB-CE1 4.21Å; L416-F418 HydrophobicContact CB-CE2 3.9Å; L416-F418 HydrophobicContact CB-CG 4.31Å; L416-F418 HydrophobicContact CB-CZ 3.96Å; L416-F418 HydrophobicContact CD1-CD2 4.49Å; L416-F418 HydrophobicContact CD1-CE2 3.72Å; L416-F418 HydrophobicContact CD1-CZ 3.99Å; L416-F418 HydrophobicContact CG-CE2 4.48Å; L416-F418 PolarHBondContact O-N 3.26Å; L416-F418 VanDerWaalsContact O-N 3.09Å; F418-V420 VanDerWaalsContact C-N 3.33Å; F418-V420 PolarHBondContact O-N 2.68Å
419	N	69.4	Low	79.3	Confident	147 Å²	147	65.6 Å²	65.6	79%	0.786	39%	0.391	S	S	*	.			trans	-75.4	87.8	174.2	-74.1	-40.5	0	0	0	109	S421	N419-S421 PolarHBondContact O-N 2.62Å; N419-S421 VanDerWaalsContact O-N 3.13Å
420	V	56.9	Low	78.5	Confident	44 Å²	44	66.3 Å²	66.3	27%	0.267	39%	0.394	S	S	.	.			trans	-70.4	108.8	169.8	-165.8	0	0	0	0	107.3	A413 F418 C422	A413-V420 HydrophobicContact CB-CG2 3.09Å; F418-V420 VanDerWaalsContact C-N 3.33Å; F418-V420 PolarHBondContact O-N 2.68Å; V420-C422 PolarHBondContact O-N 3.15Å; V420-C422 VanDerWaalsContact O-N 3.1Å
421	S	50.4	Low	77.7	Confident	92 Å²	92	60.2 Å²	60.2	64%	0.643	37%	0.372	S	S	*	.			trans	-67.7	105.7	165.9	41.3	0	0	0	0	108.2	N419	N419-S421 PolarHBondContact O-N 2.62Å; N419-S421 VanDerWaalsContact O-N 3.13Å
422	C	39.4	Very low	76.8	Confident	187 Å²	187	58.5 Å²	58.5	100%	1.264	37%	0.373	S	S	*	.			trans	-57.1	0	171.3	-71	0	0	0	0	112.8	V420	V420-C422 PolarHBondContact O-N 3.15Å; V420-C422 VanDerWaalsContact O-N 3.1Å

Retrieved 422 of 422 residues in 175.6 ms (Link to these results)

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