A0A3Q0KLM7_SCHMA Loading...

Putative sodium-dependent neurotransmitter transporter

AlphaFold DB (A0A5K4ELJ6), UniProt , Accession A0A3Q0KLM7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 606 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.8	Very low	28.2	Very low	256 Å²	256	138.5 Å²	138.5	100%	1.261	83%	0.829	S	S	*	*				0	115.1	0	-74.6	177.8	177.3	0	0	107.9
2	G	27.2	Very low	27.9	Very low	79 Å²	79	142.6 Å²	142.6	81%	0.814	83%	0.828	S	S	*	*			trans	-162.1	95.9	-180	0	0	0	0	0	108.8
3	G	26.3	Very low	28.1	Very low	73 Å²	73	148.2 Å²	148.2	75%	0.753	83%	0.827	S	S	*	*			trans	-69.3	147.7	-171.4	0	0	0	0	0	113.7	L5	G3-L5 PolarHBondContact O-N 3.33Å
4	I	29.5	Very low	28	Very low	171 Å²	171	152 Å²	152	88%	0.877	83%	0.831	S	S	*	*			trans	-72.1	102	174.6	-61.1	165	0	0	0	107.5
5	L	29.1	Very low	28.1	Very low	176 Å²	176	149.9 Å²	149.9	92%	0.921	83%	0.825	S	S	*	*			trans	-91.8	103.2	170.3	-88.3	161.3	0	0	0	109.2	G3	G3-L5 PolarHBondContact O-N 3.33Å
6	C	26.7	Very low	28.1	Very low	108 Å²	108	151 Å²	151	73%	0.73	83%	0.828	S	S	*	*			trans	-89.2	113.9	170.8	-166.7	0	0	0	0	108.6
7	K	27.9	Very low	28.3	Very low	187 Å²	187	148.6 Å²	148.6	81%	0.813	83%	0.825	S	S	*	*			trans	-138	113	163.8	-143.4	177.6	-175.7	-178	0	108.8
8	N	32.3	Very low	28.4	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	82%	0.82	S	S	*	*	S	Bend	trans	66.6	42.7	175.1	-59.4	-10.3	0	0	0	117.8	V10	N8-V10 VanDerWaalsContact C-N 3.28Å; N8-V10 PolarHBondContact O-N 3.41Å; N8-V10 VanDerWaalsContact O-N 3.09Å
9	G	33.3	Very low	28.7	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	81%	0.811	S	S	*	*	S	Bend	trans	73.3	5.4	155.5	0	0	0	0	0	117.4
10	V	26.7	Very low	29.2	Very low	98 Å²	98	146.7 Å²	146.7	59%	0.594	81%	0.813	S	S	*	*			trans	-118.6	114.5	177.1	-176.1	0	0	0	0	109.8	N8 F12	N8-V10 VanDerWaalsContact C-N 3.28Å; N8-V10 PolarHBondContact O-N 3.41Å; N8-V10 VanDerWaalsContact O-N 3.09Å; V10-F12 HydrophobicContact CB-CE2 4.21Å; V10-F12 HydrophobicContact CG1-CD2 4.21Å; V10-F12 HydrophobicContact CG1-CE2 3.83Å; V10-F12 HydrophobicContact CG1-CZ 4.32Å; V10-F12 PolarHBondContact O-N 2.68Å
11	L	26.1	Very low	29.3	Very low	150 Å²	150	146.5 Å²	146.5	79%	0.785	81%	0.811	S	S	*	*			trans	-68.5	109.8	172.7	-106.9	99.9	0	0	0	109.5
12	F	25.4	Very low	29.7	Very low	188 Å²	188	138.8 Å²	138.8	83%	0.825	78%	0.775	S	S	*	*			trans	-91.2	109.3	166.8	-80.5	-86.5	0	0	0	109.9	V10	V10-F12 HydrophobicContact CB-CE2 4.21Å; V10-F12 HydrophobicContact CG1-CD2 4.21Å; V10-F12 HydrophobicContact CG1-CE2 3.83Å; V10-F12 HydrophobicContact CG1-CZ 4.32Å; V10-F12 PolarHBondContact O-N 2.68Å
13	W	29.7	Very low	30.2	Very low	216 Å²	216	140.1 Å²	140.1	82%	0.818	77%	0.769	S	S	*	*			trans	-79	120.1	166.7	-86.9	73.9	0	0	0	108.9	T15	W13-T15 PolarHBondContact O-N 2.79Å; W13-T15 VanDerWaalsContact O-N 3.1Å
14	K	27.9	Very low	30.7	Very low	201 Å²	201	142 Å²	142	87%	0.874	77%	0.766	S	S	*	*			trans	-75.9	96.4	169.3	-160.8	175.9	-173.8	-178.8	0	107.4	L16	K14-L16 PolarHBondContact O-N 3.5Å
15	T	28.8	Very low	30.7	Very low	121 Å²	121	143.3 Å²	143.3	74%	0.742	77%	0.766	S	S	*	*			trans	-61.3	116.1	171.9	-33.2	0	0	0	0	108	W13 S17	W13-T15 PolarHBondContact O-N 2.79Å; W13-T15 VanDerWaalsContact O-N 3.1Å; T15-S17 VanDerWaalsContact C-N 3.3Å; T15-S17 PolarHBondContact O-N 2.85Å
16	L	28.3	Very low	30.7	Very low	167 Å²	167	144.4 Å²	144.4	87%	0.874	76%	0.763	S	S	*	*			trans	-68.6	96	161.5	-93.5	127.3	0	0	0	106.7	K14 V18	K14-L16 PolarHBondContact O-N 3.5Å; L16-V18 PolarHBondContact O-N 2.98Å
17	S	30.6	Very low	30.8	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	76%	0.759	S	S	*	*			trans	-69.6	111.1	166.4	49	0	0	0	0	108.1	T15	T15-S17 VanDerWaalsContact C-N 3.3Å; T15-S17 PolarHBondContact O-N 2.85Å
18	V	31.4	Very low	30.7	Very low	122 Å²	122	141.8 Å²	141.8	74%	0.739	76%	0.758	S	S	*	*			trans	-75.2	121.8	167.5	176.8	0	0	0	0	107	L16 L20	L16-V18 PolarHBondContact O-N 2.98Å; V18-L20 PolarHBondContact O-N 3.4Å
19	D	34.2	Very low	30.4	Very low	120 Å²	120	142.7 Å²	142.7	64%	0.642	76%	0.76	S	S	*	*			trans	-76.6	110.5	176.8	-163.3	-14.3	0	0	0	109	N21	D19-N21 PolarHBondContact O-N 3.01Å; D19-N21 PolarHBondContact OD1-N 3.31Å
20	L	37.5	Very low	30.1	Very low	165 Å²	165	146.5 Å²	146.5	86%	0.864	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-0.7	-179.2	-73.9	167.1	0	0	0	113.1	V18	V18-L20 PolarHBondContact O-N 3.4Å
21	N	32.5	Very low	30.1	Very low	142 Å²	142	149.6 Å²	149.6	76%	0.759	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	10.6	177.5	-75	-28.1	0	0	0	114.1	D19 P23	D19-N21 PolarHBondContact O-N 3.01Å; D19-N21 PolarHBondContact OD1-N 3.31Å; N21-P23 WeakPolarHBondContact O-CD 3.01Å; N21-P23 VanDerWaalsContact O-N 3.16Å
22	D	33.1	Very low	30	Very low	94 Å²	94	148.7 Å²	148.7	50%	0.503	78%	0.775	S	S	.	*			trans	-63.2	112.5	171.3	-167.8	-29.2	0	0	0	110.1	T24	D22-T24 VanDerWaalsContact CG-OG1 3.24Å; D22-T24 PolarHBondContact O-N 3.06Å; D22-T24 VanDerWaalsContact O-N 3.14Å; D22-T24 WeakPolarHBondContact OD1-CB 3.35Å; D22-T24 PolarHBondContact OD1-N 3.43Å; D22-T24 VanDerWaalsContact OD1-N 3.12Å; D22-T24 PolarHBondContact OD1-OG1 2.83Å
23	P	36.5	Very low	30	Very low	108 Å²	108	148.8 Å²	148.8	70%	0.701	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-75.7	3	-173	28.2	-27.9	0	0	0	113.8	N21 F25	N21-P23 WeakPolarHBondContact O-CD 3.01Å; N21-P23 VanDerWaalsContact O-N 3.16Å; P23-F25 PolarHBondContact O-N 3.15Å
24	T	37.3	Very low	29.8	Very low	112 Å²	112	144.6 Å²	144.6	69%	0.687	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-69.1	-7.4	173.6	49.6	0	0	0	0	114.3	D22	D22-T24 VanDerWaalsContact CG-OG1 3.24Å; D22-T24 PolarHBondContact O-N 3.06Å; D22-T24 VanDerWaalsContact O-N 3.14Å; D22-T24 WeakPolarHBondContact OD1-CB 3.35Å; D22-T24 PolarHBondContact OD1-N 3.43Å; D22-T24 VanDerWaalsContact OD1-N 3.12Å; D22-T24 PolarHBondContact OD1-OG1 2.83Å
25	F	29.9	Very low	29.7	Very low	199 Å²	199	138.6 Å²	138.6	87%	0.873	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-103.3	10.2	-179.5	-128.1	-92.1	0	0	0	115.3	P23	P23-F25 PolarHBondContact O-N 3.15Å
26	K	29.3	Very low	29.5	Very low	199 Å²	199	138.9 Å²	138.9	87%	0.865	78%	0.783	S	S	*	*			trans	-108.6	16.6	-173.5	-106.8	-174	-176.7	178.7	0	116.9
27	S	27.7	Very low	29.5	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	78%	0.777	S	S	*	*			trans	-109	138.3	166.6	57.4	0	0	0	0	109.9
28	D	27	Very low	29.2	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	78%	0.784	S	S	*	*			trans	107.6	31.6	172.7	-50.9	-8.3	0	0	0	116.5
29	M	25.3	Very low	29	Very low	171 Å²	171	141.2 Å²	141.2	84%	0.842	79%	0.789	S	S	*	*			trans	-114.9	73.2	152.3	-95.5	-175.1	54.2	0	0	109.7	L31	M29-L31 PolarHBondContact O-N 3.35Å
30	D	27.2	Very low	28.7	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	80%	0.804	S	S	*	*			trans	-69.1	114.8	164.8	-79.3	-30.3	0	0	0	109.2	V32	D30-V32 PolarHBondContact O-N 3.48Å; D30-V32 VanDerWaalsContact O-N 3.16Å
31	L	26.1	Very low	28.3	Very low	162 Å²	162	141.3 Å²	141.3	85%	0.848	80%	0.795	S	S	*	*			trans	-62.8	105.6	173	-74.7	155	0	0	0	109.2	M29 E33	M29-L31 PolarHBondContact O-N 3.35Å; L31-E33 PolarHBondContact O-N 3.03Å
32	V	24.5	Very low	28.1	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	80%	0.796	S	S	*	*			trans	-75	107.7	167.3	178.3	0	0	0	0	108.3	D30 C34	D30-V32 PolarHBondContact O-N 3.48Å; D30-V32 VanDerWaalsContact O-N 3.16Å; V32-C34 PolarHBondContact O-N 3.47Å
33	E	24.9	Very low	27.9	Very low	190 Å²	190	143.6 Å²	143.6	89%	0.888	81%	0.814	S	S	*	*			trans	-61.8	111.4	170.4	-86.1	-178.4	143.1	0	0	110.6	L31 G35	L31-E33 PolarHBondContact O-N 3.03Å; E33-G35 PolarHBondContact O-N 3.11Å
34	C	24.9	Very low	27.7	Very low	128 Å²	128	145.1 Å²	145.1	87%	0.865	82%	0.817	S	S	*	*			trans	-78.4	109.5	169.7	-93.3	0	0	0	0	110.3	V32	V32-C34 PolarHBondContact O-N 3.47Å
35	G	27.3	Very low	27.6	Very low	75 Å²	75	149.5 Å²	149.5	77%	0.773	83%	0.826	S	S	*	*			trans	-59.1	137.7	174.9	0	0	0	0	0	113.7	E33 G37	E33-G35 PolarHBondContact O-N 3.11Å; G35-G37 PolarHBondContact O-N 3.17Å
36	S	23.8	Very low	27.8	Very low	128 Å²	128	145 Å²	145	90%	0.895	81%	0.81	S	S	*	*			trans	-77.8	86	179.8	43.7	0	0	0	0	112.1
37	G	27.9	Very low	28.3	Very low	72 Å²	72	139.3 Å²	139.3	74%	0.742	79%	0.794	S	S	*	*			trans	-101.3	100	171.2	0	0	0	0	0	112.3	G35 L39	G35-G37 PolarHBondContact O-N 3.17Å; G37-L39 PolarHBondContact O-N 3.35Å
38	K	24.6	Very low	29.3	Very low	214 Å²	214	139 Å²	139	93%	0.93	79%	0.792	S	S	*	*			trans	-64.9	119.9	168.1	-72.9	178.2	176.6	178.1	0	109.5
39	L	27.7	Very low	30	Very low	163 Å²	163	135.8 Å²	135.8	85%	0.853	78%	0.781	S	S	*	*			trans	-127.4	100.2	165.7	-148.5	81.2	0	0	0	109.4	G37	G37-L39 PolarHBondContact O-N 3.35Å
40	H	27.4	Very low	30.8	Very low	204 Å²	204	132 Å²	132	94%	0.944	76%	0.761	S	S	*	*			trans	-78.7	117.1	159.9	-87	-41.4	0	0	0	107.5
41	A	30.4	Very low	31.4	Very low	83 Å²	83	130.6 Å²	130.6	69%	0.686	75%	0.75	S	S	*	*			trans	-134.2	123.1	166.4	0	0	0	0	0	108.9
42	S	27.3	Very low	32	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	74%	0.737	S	S	*	*			trans	-55.5	142.7	-179.6	-74.9	0	0	0	0	113.1	D44	S42-D44 PolarHBondContact O-N 3.32Å; S42-D44 VanDerWaalsContact O-N 3.13Å
43	I	28.8	Very low	32.7	Very low	171 Å²	171	128.5 Å²	128.5	88%	0.877	73%	0.731	S	S	*	*			trans	-75.3	91.9	172.9	-59.7	168.1	0	0	0	107.5
44	D	32.2	Very low	33.5	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	71%	0.71	S	S	*	*			trans	-115.5	136.9	164.2	-90.8	-41.5	0	0	0	110.4	S42 L46	S42-D44 PolarHBondContact O-N 3.32Å; S42-D44 VanDerWaalsContact O-N 3.13Å; D44-L46 PolarHBondContact O-N 3.29Å
45	K	36.1	Very low	34.2	Very low	203 Å²	203	121.6 Å²	121.6	88%	0.883	69%	0.689	S	S	*	*			trans	-35.7	115.9	-168	-67.3	168.4	177.9	175.5	0	114.8
46	L	33.9	Very low	34.7	Very low	104 Å²	104	124.4 Å²	124.4	55%	0.545	68%	0.681	S	S	.	*			trans	-65.1	130.1	172.8	-75.9	151.3	0	0	0	110.9	D44 E50	D44-L46 PolarHBondContact O-N 3.29Å; L46-E50 WeakPolarHBondContact CD2-OE2 3.35Å
47	P	39	Very low	35.6	Very low	81 Å²	81	121.4 Å²	121.4	53%	0.526	66%	0.661	S	S	.	*			trans	-69.7	147.2	180	25.9	-31.3	0	0	0	112.3	S49 E50	P47-S49 PolarHBondContact O-N 2.8Å; P47-S49 VanDerWaalsContact O-N 3.07Å; P47-E50 PolarHBondContact O-N 3.28Å
48	S	48.6	Very low	36.2	Very low	84 Å²	84	123.5 Å²	123.5	59%	0.587	65%	0.651	S	S	*	*	H	α-helix	trans	-55	-29	-171.2	50.9	0	0	0	0	115.2	E50 Q51 E52	S48-E50 VanDerWaalsContact C-N 3.32Å; S48-E50 PolarHBondContact O-N 3.36Å; S48-Q51 PolarHBondContact O-N 3.45Å; S48-E52 PolarHBondContact O-N 2.94Å
49	S	41.5	Very low	37	Very low	82 Å²	82	118.3 Å²	118.3	57%	0.573	63%	0.633	S	S	*	*	H	α-helix	trans	-66.5	-31.6	178.7	57.7	0	0	0	0	113.2	P47 L53	P47-S49 PolarHBondContact O-N 2.8Å; P47-S49 VanDerWaalsContact O-N 3.07Å; S49-L53 WeakPolarHBondContact O-CB 3.47Å; S49-L53 PolarHBondContact O-N 3.46Å; S49-L53 VanDerWaalsContact O-N 3.13Å
50	E	43.8	Very low	37.5	Very low	90 Å²	90	113.1 Å²	113.1	42%	0.421	61%	0.614	S	S	.	*	H	α-helix	trans	-77.8	-31.9	175.6	-113.2	-177.9	170.3	0	0	111.6	L46 P47 S48 K54	L46-E50 WeakPolarHBondContact CD2-OE2 3.35Å; P47-E50 PolarHBondContact O-N 3.28Å; S48-E50 VanDerWaalsContact C-N 3.32Å; S48-E50 PolarHBondContact O-N 3.36Å; E50-K54 WeakPolarHBondContact O-CB 3.49Å; E50-K54 VanDerWaalsContact O-CG 3.31Å; E50-K54 WeakPolarHBondContact O-CG 3.44Å; E50-K54 PolarHBondContact O-N 3.09Å
51	Q	39.2	Very low	37.9	Very low	125 Å²	125	108.2 Å²	108.2	58%	0.584	59%	0.591	S	S	*	*	H	α-helix	trans	-66.5	-43.1	172.7	-103.6	178.4	-26.5	0	0	111.5	S48 K54 T55	S48-Q51 PolarHBondContact O-N 3.45Å; Q51-K54 PolarHBondContact O-N 2.78Å; Q51-T55 PolarHBondContact O-N 3.15Å; Q51-T55 PolarHBondContact O-OG1 2.76Å
52	E	38	Very low	38.1	Very low	123 Å²	123	111 Å²	111	58%	0.575	58%	0.584	S	S	*	*	H	α-helix	trans	-64.7	-39.5	174.8	-75.3	-178.6	173.4	0	0	112.4	S48 T55 H56	S48-E52 PolarHBondContact O-N 2.94Å; E52-T55 WeakPolarHBondContact CA-OG1 3.37Å; E52-T55 PolarHBondContact O-OG1 3.14Å; E52-T55 VanDerWaalsContact O-OG1 3.09Å; E52-H56 WeakPolarHBondContact O-CB 3.15Å; E52-H56 PolarHBondContact O-CD2 3.28Å; E52-H56 PolarHBondContact O-N 3.45Å
53	L	39.5	Very low	38.7	Very low	126 Å²	126	108.3 Å²	108.3	66%	0.66	57%	0.565	S	S	*	*	H	α-helix	trans	-67	-39.9	175.7	-166	77.3	0	0	0	111.6	S49 S57	S49-L53 WeakPolarHBondContact O-CB 3.47Å; S49-L53 PolarHBondContact O-N 3.46Å; S49-L53 VanDerWaalsContact O-N 3.13Å; L53-S57 WeakPolarHBondContact O-CB 3.42Å; L53-S57 PolarHBondContact O-N 3.31Å
54	K	40.7	Very low	39.5	Very low	106 Å²	106	103 Å²	103	46%	0.461	54%	0.537	S	S	.	.	H	α-helix	trans	-66	-46.7	175	-79.6	178.3	-178.4	176.3	0	111.6	E50 Q51 H56 S57 E58	E50-K54 WeakPolarHBondContact O-CB 3.49Å; E50-K54 VanDerWaalsContact O-CG 3.31Å; E50-K54 WeakPolarHBondContact O-CG 3.44Å; E50-K54 PolarHBondContact O-N 3.09Å; Q51-K54 PolarHBondContact O-N 2.78Å; K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 PolarHBondContact O-N 2.97Å; K54-S57 PolarHBondContact O-N 2.91Å; K54-E58 VanDerWaalsContact O-CB 3.29Å; K54-E58 WeakPolarHBondContact O-CB 3.27Å; K54-E58 VanDerWaalsContact O-CG 3.29Å; K54-E58 WeakPolarHBondContact O-CG 3.25Å; K54-E58 PolarHBondContact O-N 3.12Å
55	T	40	Very low	40.6	Very low	67 Å²	67	99.4 Å²	99.4	41%	0.411	52%	0.517	S	S	.	.	H	α-helix	trans	-64.1	-38.4	176.7	44.6	0	0	0	0	112	Q51 E52 E58 D59	Q51-T55 PolarHBondContact O-N 3.15Å; Q51-T55 PolarHBondContact O-OG1 2.76Å; E52-T55 WeakPolarHBondContact CA-OG1 3.37Å; E52-T55 PolarHBondContact O-OG1 3.14Å; E52-T55 VanDerWaalsContact O-OG1 3.09Å; T55-E58 PolarHBondContact O-N 3.03Å; T55-D59 VanDerWaalsContact O-CB 3.22Å; T55-D59 WeakPolarHBondContact O-CB 3.3Å; T55-D59 PolarHBondContact O-N 3.42Å
56	H	39.2	Very low	42	Very low	134 Å²	134	90.3 Å²	90.3	62%	0.62	48%	0.479	S	S	*	.	H	α-helix	trans	-65.7	-38.4	173.7	-83.2	-55.1	0	0	0	113.3	E52 K54 A60	E52-H56 WeakPolarHBondContact O-CB 3.15Å; E52-H56 PolarHBondContact O-CD2 3.28Å; E52-H56 PolarHBondContact O-N 3.45Å; K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 PolarHBondContact O-N 2.97Å; H56-A60 VanDerWaalsContact O-CB 3.24Å; H56-A60 WeakPolarHBondContact O-CB 3.3Å; H56-A60 PolarHBondContact O-N 3.24Å
57	S	42.1	Very low	44.3	Very low	65 Å²	65	89.1 Å²	89.1	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-69.3	-43.2	175.2	-172.2	0	0	0	0	111.8	L53 K54 A60 Q61	L53-S57 WeakPolarHBondContact O-CB 3.42Å; L53-S57 PolarHBondContact O-N 3.31Å; K54-S57 PolarHBondContact O-N 2.91Å; S57-A60 PolarHBondContact O-N 2.86Å; S57-Q61 WeakPolarHBondContact O-CB 3.31Å; S57-Q61 PolarHBondContact O-N 2.97Å
58	E	41.1	Very low	46.4	Very low	116 Å²	116	86.2 Å²	86.2	54%	0.542	46%	0.456	S	S	.	.	H	α-helix	trans	-66.2	-42.9	177	-75.3	176.1	-177.1	0	0	111.3	K54 T55 A60 Q61 R62	K54-E58 VanDerWaalsContact O-CB 3.29Å; K54-E58 WeakPolarHBondContact O-CB 3.27Å; K54-E58 VanDerWaalsContact O-CG 3.29Å; K54-E58 WeakPolarHBondContact O-CG 3.25Å; K54-E58 PolarHBondContact O-N 3.12Å; T55-E58 PolarHBondContact O-N 3.03Å; E58-A60 VanDerWaalsContact C-N 3.34Å; E58-A60 PolarHBondContact O-N 3.49Å; E58-Q61 PolarHBondContact O-N 3.33Å; E58-R62 WeakPolarHBondContact O-CB 3.34Å; E58-R62 PolarHBondContact O-N 3.37Å
59	D	40	Very low	48	Very low	105 Å²	105	87 Å²	87	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-65.4	-38	175.3	-82.9	-24	0	0	0	111.6	T55 S63	T55-D59 VanDerWaalsContact O-CB 3.22Å; T55-D59 WeakPolarHBondContact O-CB 3.3Å; T55-D59 PolarHBondContact O-N 3.42Å; D59-S63 WeakPolarHBondContact O-CB 3.25Å; D59-S63 PolarHBondContact O-N 3.2Å
60	A	38.7	Very low	50.2	Low	54 Å²	54	85 Å²	85	45%	0.446	44%	0.439	S	S	.	.	H	α-helix	trans	-64.1	-47.2	173.9	0	0	0	0	0	111.2	H56 S57 E58 S63 E64	H56-A60 VanDerWaalsContact O-CB 3.24Å; H56-A60 WeakPolarHBondContact O-CB 3.3Å; H56-A60 PolarHBondContact O-N 3.24Å; S57-A60 PolarHBondContact O-N 2.86Å; E58-A60 VanDerWaalsContact C-N 3.34Å; E58-A60 PolarHBondContact O-N 3.49Å; A60-S63 PolarHBondContact O-N 3.36Å; A60-S63 PolarHBondContact O-OG 3.27Å; A60-E64 PolarHBondContact O-N 3.04Å
61	Q	36.7	Very low	52.4	Low	100 Å²	100	85.5 Å²	85.5	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-41.5	175.9	-79.8	-179.9	-69.6	0	0	112.7	S57 E58 S63 E64 L65	S57-Q61 WeakPolarHBondContact O-CB 3.31Å; S57-Q61 PolarHBondContact O-N 2.97Å; E58-Q61 PolarHBondContact O-N 3.33Å; Q61-S63 PolarHBondContact O-N 2.9Å; Q61-E64 WeakPolarHBondContact O-CA 3.1Å; Q61-E64 WeakPolarHBondContact O-CB 3.41Å; Q61-E64 PolarHBondContact O-N 3.35Å; Q61-L65 PolarHBondContact O-N 3.07Å; Q61-L65 VanDerWaalsContact O-N 3.09Å
62	R	34.7	Very low	55	Low	141 Å²	141	84 Å²	84	53%	0.532	45%	0.448	S	S	.	.	H	α-helix	trans	-67.9	-26.5	177.9	-167.5	176	-103.4	-157.2	-4.5	111.7	E58 S66 E586	E58-R62 WeakPolarHBondContact O-CB 3.34Å; E58-R62 PolarHBondContact O-N 3.37Å; R62-S66 PolarHBondContact O-N 2.63Å; R62-E586 IonicContact CZ-OE1 3.89Å; R62-E586 IonicContact NE-OE1 3.88Å; R62-E586 IonicContact NH2-OE1 2.7Å; R62-E586 PolarHBondContact NH2-OE1 3.37Å; R62-E586 IonicContact NH2-OE2 3.64Å
63	S	39.5	Very low	57.6	Low	56 Å²	56	78.2 Å²	78.2	39%	0.392	42%	0.421	S	S	.	.	H	α-helix	trans	-72.4	-29	167	88	0	0	0	0	113	D59 A60 Q61 S66	D59-S63 WeakPolarHBondContact O-CB 3.25Å; D59-S63 PolarHBondContact O-N 3.2Å; A60-S63 PolarHBondContact O-N 3.36Å; A60-S63 PolarHBondContact O-OG 3.27Å; Q61-S63 PolarHBondContact O-N 2.9Å; S63-S66 PolarHBondContact O-OG 3.16Å
64	E	44.9	Very low	60.2	Low	61 Å²	61	72.4 Å²	72.4	29%	0.285	39%	0.39	S	S	.	.	H	α-helix	trans	-73.5	-32.5	176.4	-72.1	-165.2	149.3	0	0	112.2	A60 Q61 K564	A60-E64 PolarHBondContact O-N 3.04Å; Q61-E64 WeakPolarHBondContact O-CA 3.1Å; Q61-E64 WeakPolarHBondContact O-CB 3.41Å; Q61-E64 PolarHBondContact O-N 3.35Å; E64-K564 IonicContact OE1-NZ 3.79Å; E64-K564 PolarHBondContact OE1-NZ 3.24Å; E64-K564 IonicContact OE2-NZ 2.91Å
65	L	55.3	Low	62.7	Low	64 Å²	64	70.5 Å²	70.5	34%	0.335	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4.2	177.7	-92.2	146	0	0	0	114.8	Q61 T67 D579 E582	Q61-L65 PolarHBondContact O-N 3.07Å; Q61-L65 VanDerWaalsContact O-N 3.09Å; L65-T67 PolarHBondContact O-N 2.84Å; L65-D579 HydrophobicContact CD2-CB 3.58Å; L65-D579 VanDerWaalsContact CD2-O 3.31Å; L65-D579 WeakPolarHBondContact CD2-O 3.42Å; L65-D579 HydrophobicContact CG-CB 4.46Å; L65-E582 WeakPolarHBondContact CD1-OE2 3.3Å
66	S	66.7	Low	65.4	Low	13 Å²	13	68.3 Å²	68.3	9%	0.091	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-64.2	120.4	-170.5	66.8	0	0	0	0	112.3	R62 S63 I227 Y303	R62-S66 PolarHBondContact O-N 2.63Å; S63-S66 PolarHBondContact O-OG 3.16Å; S66-I227 WeakPolarHBondContact O-CG2 3.23Å; S66-I227 WeakPolarHBondContact OG-CG2 3.28Å; S66-Y303 WeakPolarHBondContact O-CD1 3.39Å
67	T	80.8	Confident	68.2	Low	79 Å²	79	62 Å²	62	49%	0.485	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-94.3	172.7	168.3	54.3	0	0	0	0	110.7	L65	L65-T67 PolarHBondContact O-N 2.84Å
68	F	84.1	Confident	70.7	Confident	20 Å²	20	58.9 Å²	58.9	9%	0.088	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-64.1	141.2	168.3	-73.7	-90.6	0	0	0	110.9	V74 I227 E231 Y300 F304	F68-V74 HydrophobicContact CB-CG2 3.4Å; F68-V74 VanDerWaalsContact CB-CG2 3.4Å; F68-V74 HydrophobicContact CD1-CG2 3.89Å; F68-V74 HydrophobicContact CD2-CG2 3.69Å; F68-V74 HydrophobicContact CE2-CG2 4.34Å; F68-V74 HydrophobicContact CG-CB 4.47Å; F68-V74 HydrophobicContact CG-CG2 3.39Å; F68-I227 HydrophobicContact CD1-CG1 4.21Å; F68-I227 HydrophobicContact CD2-CG1 4.12Å; F68-I227 HydrophobicContact CE1-CD1 4.02Å; F68-I227 HydrophobicContact CE1-CG1 3.88Å; F68-I227 HydrophobicContact CE2-CD1 3.95Å; F68-I227 HydrophobicContact CE2-CG1 3.79Å; F68-I227 HydrophobicContact CG-CG1 4.35Å; F68-I227 HydrophobicContact CZ-CD1 3.57Å; F68-I227 HydrophobicContact CZ-CG1 3.7Å; F68-E231 HydrophobicContact CD1-CB 4.11Å; F68-E231 HydrophobicContact CD1-CG 4.04Å; F68-E231 HydrophobicContact CE1-CB 4.4Å; F68-Y300 AromaticContact CZ-CD1 3.83Å; F68-Y300 HydrophobicContact CZ-CD1 3.83Å; F68-F304 HydrophobicContact CD2-CD1 4.11Å; F68-F304 HydrophobicContact CD2-CE1 4.03Å; F68-F304 AromaticContact CE2-CD1 3.98Å; F68-F304 HydrophobicContact CE2-CD1 3.98Å; F68-F304 AromaticContact CE2-CE1 3.61Å; F68-F304 HydrophobicContact CE2-CE1 3.61Å; F68-F304 HydrophobicContact CZ-CE1 4.4Å
69	N	82.2	Confident	73.3	Confident	101 Å²	101	54.2 Å²	54.2	54%	0.54	30%	0.298	S	S	.	.	S	Bend	trans	-75.9	-26.3	-179.9	-58.5	-63.3	0	0	0	112.5	E231	N69-E231 WeakPolarHBondContact CB-OE2 3.21Å; N69-E231 PolarHBondContact N-OE1 3.44Å; N69-E231 PolarHBondContact N-OE2 2.99Å; N69-E231 PolarHBondContact ND2-OE2 3.45Å
70	S	88	Confident	75.9	Confident	38 Å²	38	49.2 Å²	49.2	27%	0.266	27%	0.271	S	S	.	.			trans	-145.4	147.7	-172	71	0	0	0	0	113.5	I72 G73 V74 E231	S70-I72 VanDerWaalsContact C-N 3.26Å; S70-I72 PolarHBondContact O-N 3.27Å; S70-I72 WeakPolarHBondContact OG-CG2 3.4Å; S70-G73 PolarHBondContact O-N 3.19Å; S70-G73 WeakPolarHBondContact OG-CA 3.4Å; S70-G73 PolarHBondContact OG-N 3.25Å; S70-V74 WeakPolarHBondContact O-CG2 3.45Å; S70-V74 PolarHBondContact O-N 3.5Å; S70-E231 PolarHBondContact N-OE1 2.88Å; S70-E231 PolarHBondContact OG-OE1 3.18Å
71	S	88.8	Confident	78.5	Confident	102 Å²	102	46.8 Å²	46.8	71%	0.713	25%	0.252	S	S	*	.	H	α-helix	trans	-61.9	-34.2	174.2	-59.5	0	0	0	0	112.6	L75	S71-L75 PolarHBondContact O-N 3.36Å; S71-L75 VanDerWaalsContact O-N 3.09Å
72	I	93.3	Very high	81.3	Confident	94 Å²	94	42.4 Å²	42.4	48%	0.482	23%	0.232	S	C	.	.	H	α-helix	trans	-69.9	-38.1	175.2	-172.1	59.4	0	0	0	111.3	S70 V74 L75 L76	S70-I72 VanDerWaalsContact C-N 3.26Å; S70-I72 PolarHBondContact O-N 3.27Å; S70-I72 WeakPolarHBondContact OG-CG2 3.4Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 2.84Å; I72-L75 HydrophobicContact CD1-CD2 4.19Å; I72-L75 PolarHBondContact O-N 2.99Å; I72-L76 HydrophobicContact CD1-CD1 4.34Å; I72-L76 HydrophobicContact CD1-CG 4.17Å; I72-L76 HydrophobicContact CG1-CD1 3.99Å; I72-L76 HydrophobicContact CG1-CG 4.25Å; I72-L76 WeakPolarHBondContact O-CB 3.43Å; I72-L76 WeakPolarHBondContact O-CG 3.17Å; I72-L76 PolarHBondContact O-N 3.33Å
73	G	93.6	Very high	84.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-37.7	175	0	0	0	0	0	112.7	S70 S77	S70-G73 PolarHBondContact O-N 3.19Å; S70-G73 WeakPolarHBondContact OG-CA 3.4Å; S70-G73 PolarHBondContact OG-N 3.25Å; G73-S77 VanDerWaalsContact O-CB 3.25Å; G73-S77 WeakPolarHBondContact O-CB 3.42Å; G73-S77 PolarHBondContact O-N 3.34Å; G73-S77 PolarHBondContact O-OG 2.88Å
74	V	93.3	Very high	86.6	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-54.7	169.3	173.1	0	0	0	0	110.3	F68 S70 I72 L76 S77 C78 F304 L313	F68-V74 HydrophobicContact CB-CG2 3.4Å; F68-V74 VanDerWaalsContact CB-CG2 3.4Å; F68-V74 HydrophobicContact CD1-CG2 3.89Å; F68-V74 HydrophobicContact CD2-CG2 3.69Å; F68-V74 HydrophobicContact CE2-CG2 4.34Å; F68-V74 HydrophobicContact CG-CB 4.47Å; F68-V74 HydrophobicContact CG-CG2 3.39Å; S70-V74 WeakPolarHBondContact O-CG2 3.45Å; S70-V74 PolarHBondContact O-N 3.5Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 2.84Å; V74-L76 PolarHBondContact O-N 3.04Å; V74-S77 PolarHBondContact O-N 3.03Å; V74-C78 WeakPolarHBondContact O-CB 3.46Å; V74-C78 PolarHBondContact O-N 3.01Å; V74-C78 PolarHBondContact O-SG 2.86Å; V74-F304 HydrophobicContact CG1-CD1 4.48Å; V74-F304 HydrophobicContact CG1-CE1 3.5Å; V74-F304 HydrophobicContact CG1-CE2 4.34Å; V74-F304 HydrophobicContact CG1-CZ 3.41Å; V74-F304 VanDerWaalsContact CG1-CZ 3.41Å; V74-F304 HydrophobicContact CG2-CE1 4.28Å; V74-L313 HydrophobicContact CG1-CD1 3.89Å
75	L	95.1	Very high	88.8	Confident	67 Å²	67	30.7 Å²	30.7	35%	0.351	18%	0.178	S	C	.	.	H	α-helix	trans	-57.6	-49.7	-177.7	176.6	62.8	0	0	0	111.7	S71 I72 S77 C78 L79 L313 I317	S71-L75 PolarHBondContact O-N 3.36Å; S71-L75 VanDerWaalsContact O-N 3.09Å; I72-L75 HydrophobicContact CD1-CD2 4.19Å; I72-L75 PolarHBondContact O-N 2.99Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 2.92Å; L75-C78 PolarHBondContact O-N 3.39Å; L75-L79 HydrophobicContact CD1-CD1 4.13Å; L75-L79 HydrophobicContact CD1-CG 4.3Å; L75-L79 HydrophobicContact CG-CD1 4.06Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 WeakPolarHBondContact O-CG 3.46Å; L75-L79 PolarHBondContact O-N 3.05Å; L75-L313 HydrophobicContact CD1-CD2 4.26Å; L75-I317 HydrophobicContact CD1-CD1 3.76Å
76	L	96.6	Very high	90.4	Very high	21 Å²	21	28 Å²	28	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-36.2	-179.7	-68.4	176.8	0	0	0	112	I72 V74 L79 G80 M235 V238 P239	I72-L76 HydrophobicContact CD1-CD1 4.34Å; I72-L76 HydrophobicContact CD1-CG 4.17Å; I72-L76 HydrophobicContact CG1-CD1 3.99Å; I72-L76 HydrophobicContact CG1-CG 4.25Å; I72-L76 WeakPolarHBondContact O-CB 3.43Å; I72-L76 WeakPolarHBondContact O-CG 3.17Å; I72-L76 PolarHBondContact O-N 3.33Å; V74-L76 PolarHBondContact O-N 3.04Å; L76-L79 PolarHBondContact O-N 2.85Å; L76-G80 PolarHBondContact O-N 3.23Å; L76-M235 HydrophobicContact CD1-CG 4.32Å; L76-V238 HydrophobicContact CD2-CB 4.3Å; L76-V238 HydrophobicContact CD2-CG1 3.92Å; L76-P239 HydrophobicContact CD1-CG 3.94Å; L76-P239 HydrophobicContact CD2-CG 4.31Å
77	S	96.1	Very high	91.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68.5	-40.1	176.4	-59.3	0	0	0	0	112.3	G73 V74 L75 G80 C81 N234	G73-S77 VanDerWaalsContact O-CB 3.25Å; G73-S77 WeakPolarHBondContact O-CB 3.42Å; G73-S77 PolarHBondContact O-N 3.34Å; G73-S77 PolarHBondContact O-OG 2.88Å; V74-S77 PolarHBondContact O-N 3.03Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 2.92Å; S77-G80 PolarHBondContact O-N 3Å; S77-C81 PolarHBondContact O-N 2.96Å; S77-C81 VanDerWaalsContact O-N 3.14Å; S77-N234 WeakPolarHBondContact CA-ND2 3.18Å; S77-N234 WeakPolarHBondContact CB-ND2 3.34Å; S77-N234 PolarHBondContact OG-ND2 3.16Å
78	C	95.9	Very high	92.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-42.6	173	-71.4	0	0	0	0	112.1	V74 L75 C81 Y127 I317	V74-C78 WeakPolarHBondContact O-CB 3.46Å; V74-C78 PolarHBondContact O-N 3.01Å; V74-C78 PolarHBondContact O-SG 2.86Å; L75-C78 PolarHBondContact O-N 3.39Å; C78-C81 WeakPolarHBondContact O-CB 3.44Å; C78-C81 PolarHBondContact O-N 3.01Å; C78-Y127 VanDerWaalsContact CB-OH 3.29Å; C78-Y127 WeakPolarHBondContact CB-OH 3.44Å; C78-Y127 PolarHBondContact SG-OH 3.28Å; C78-I317 HydrophobicContact CB-CD1 3.66Å; C78-I317 HydrophobicContact CB-CG1 3.97Å
79	L	96	Very high	92.3	Very high	18 Å²	18	23.9 Å²	23.9	9%	0.094	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-45.1	176.2	-75.3	173.4	0	0	0	111.9	L75 L76 C81 V82 I83 V238 I317 C320	L75-L79 HydrophobicContact CD1-CD1 4.13Å; L75-L79 HydrophobicContact CD1-CG 4.3Å; L75-L79 HydrophobicContact CG-CD1 4.06Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 WeakPolarHBondContact O-CG 3.46Å; L75-L79 PolarHBondContact O-N 3.05Å; L76-L79 PolarHBondContact O-N 2.85Å; L79-C81 PolarHBondContact O-N 3.41Å; L79-V82 WeakPolarHBondContact O-CG2 3.49Å; L79-V82 PolarHBondContact O-N 3.32Å; L79-V82 VanDerWaalsContact O-N 3.09Å; L79-I83 HydrophobicContact CB-CD1 4.16Å; L79-I83 HydrophobicContact CD2-CD1 4Å; L79-I83 WeakPolarHBondContact O-CB 3.42Å; L79-I83 PolarHBondContact O-N 2.74Å; L79-V238 HydrophobicContact CB-CG1 4.23Å; L79-I317 HydrophobicContact CD2-CD1 3.65Å; L79-I317 HydrophobicContact CG-CD1 3.7Å; L79-C320 HydrophobicContact CD2-CB 3.91Å
80	G	94.9	Very high	92.6	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.4	-23.6	177.8	0	0	0	0	0	113.5	L76 S77 V238 T399 S400	L76-G80 PolarHBondContact O-N 3.23Å; S77-G80 PolarHBondContact O-N 3Å; G80-V238 VanDerWaalsContact CA-CG2 3.45Å; G80-T399 CarbonylContact O-C 2.95Å; G80-T399 VanDerWaalsContact O-CB 3.25Å; G80-T399 WeakPolarHBondContact O-CB 3.22Å; G80-T399 PolarHBondContact O-OG1 3.11Å; G80-S400 PolarHBondContact O-N 3.11Å; G80-S400 VanDerWaalsContact O-N 3.17Å
81	C	93.2	Very high	92.9	Very high	4 Å²	4	19.2 Å²	19.2	3%	0.027	11%	0.108	C	C	.	.	H	α-helix	trans	-70.3	-32.4	174.7	-169.5	0	0	0	0	113.3	S77 C78 L79 L296 F297 Y300	S77-C81 PolarHBondContact O-N 2.96Å; S77-C81 VanDerWaalsContact O-N 3.14Å; C78-C81 WeakPolarHBondContact O-CB 3.44Å; C78-C81 PolarHBondContact O-N 3.01Å; L79-C81 PolarHBondContact O-N 3.41Å; C81-L296 VanDerWaalsContact SG-CB 3.51Å; C81-F297 HydrophobicContact CB-CE1 4.49Å; C81-Y300 HydrophobicContact CB-CD2 4.32Å; C81-Y300 HydrophobicContact CB-CE2 3.71Å
82	V	94	Very high	93.1	Very high	8 Å²	8	14.4 Å²	14.4	5%	0.048	7%	0.074	C	C	.	.	H	α-helix	trans	-108.7	-32	-175.6	-69.2	0	0	0	0	114.4	L79 G84 N87 T290 F297 I317 N321	L79-V82 WeakPolarHBondContact O-CG2 3.49Å; L79-V82 PolarHBondContact O-N 3.32Å; L79-V82 VanDerWaalsContact O-N 3.09Å; V82-G84 PolarHBondContact O-N 3.45Å; V82-N87 PolarHBondContact O-OD1 3.46Å; V82-N87 VanDerWaalsContact O-OD1 3.05Å; V82-T290 VanDerWaalsContact CG1-O 3.22Å; V82-T290 WeakPolarHBondContact CG1-O 3.45Å; V82-F297 HydrophobicContact CG1-CE1 3.65Å; V82-F297 HydrophobicContact CG1-CE2 4.34Å; V82-F297 HydrophobicContact CG1-CZ 3.28Å; V82-I317 HydrophobicContact CG1-CG2 4.43Å; V82-I317 HydrophobicContact CG2-CG2 3.55Å; V82-N321 HydrophobicContact CB-CB 4.37Å; V82-N321 HydrophobicContact CG2-CB 3.95Å; V82-N321 PolarHBondContact O-OD1 3.24Å; V82-N321 VanDerWaalsContact O-OD1 3.06Å
83	I	94.5	Very high	93	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.01	5%	0.054	C	C	.	.	S	Bend	trans	-77.7	94.5	176.4	-59.7	170	0	0	0	107.9	L79 N87 L241 L242 V324	L79-I83 HydrophobicContact CB-CD1 4.16Å; L79-I83 HydrophobicContact CD2-CD1 4Å; L79-I83 WeakPolarHBondContact O-CB 3.42Å; L79-I83 PolarHBondContact O-N 2.74Å; I83-N87 WeakPolarHBondContact CA-OD1 3.38Å; I83-L241 HydrophobicContact CG2-CD1 3.55Å; I83-L242 HydrophobicContact CD1-CD2 4.04Å; I83-V324 HydrophobicContact CD1-CG2 3.88Å; I83-V324 HydrophobicContact CG1-CG2 4.35Å; I83-V324 HydrophobicContact CG2-CG1 3.78Å
84	G	92.4	Very high	92.9	Very high	3 Å²	3	11.9 Å²	11.9	3%	0.031	6%	0.06	C	C	.	.	S	Bend	trans	-128.1	-167.5	-171.2	0	0	0	0	0	113.4	V82 G86 N87 I88 S400	V82-G84 PolarHBondContact O-N 3.45Å; G84-G86 PolarHBondContact O-N 3.4Å; G84-N87 PolarHBondContact N-OD1 2.9Å; G84-N87 PolarHBondContact O-N 2.86Å; G84-N87 PolarHBondContact O-OD1 3.13Å; G84-I88 PolarHBondContact O-N 3.33Å; G84-S400 WeakPolarHBondContact CA-OG 3.29Å
85	T	90.6	Very high	92.9	Very high	7 Å²	7	11.7 Å²	11.7	4%	0.043	6%	0.059	C	C	.	.	H	α-helix	trans	-63.6	-21.3	171.6	60.2	0	0	0	0	112.2	W89 R90 F167 L393	T85-W89 PolarHBondContact O-N 3.25Å; T85-R90 PolarHBondContact O-N 3.34Å; T85-F167 WeakPolarHBondContact OG1-CE2 3.49Å; T85-L393 HydrophobicContact CG2-CD2 4.01Å
86	G	88.5	Confident	92.8	Very high	6 Å²	6	8.5 Å²	8.5	6%	0.062	4%	0.042	C	C	.	.	I	π-helix	trans	-54.7	-46.4	170.4	0	0	0	0	0	112.8	G84 R90 F91	G84-G86 PolarHBondContact O-N 3.4Å; G86-R90 CarbonylContact O-C 3.43Å; G86-R90 WeakPolarHBondContact O-CB 3.16Å; G86-R90 PolarHBondContact O-N 3.05Å; G86-F91 WeakPolarHBondContact O-CB 3.39Å; G86-F91 PolarHBondContact O-N 2.87Å
87	N	94	Very high	92.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-76.5	-44.2	-178	-45.8	75.9	0	0	0	111.2	V82 I83 G84 P92 D289 N321 V324 S325 C328	V82-N87 PolarHBondContact O-OD1 3.46Å; V82-N87 VanDerWaalsContact O-OD1 3.05Å; I83-N87 WeakPolarHBondContact CA-OD1 3.38Å; G84-N87 PolarHBondContact N-OD1 2.9Å; G84-N87 PolarHBondContact O-N 2.86Å; G84-N87 PolarHBondContact O-OD1 3.13Å; N87-P92 VanDerWaalsContact O-CD 3.28Å; N87-P92 WeakPolarHBondContact O-CD 3.32Å; N87-D289 WeakPolarHBondContact CA-OD1 3.38Å; N87-D289 PolarHBondContact N-OD1 2.86Å; N87-D289 PolarHBondContact ND2-OD1 2.75Å; N87-D289 PolarHBondContact ND2-OD2 2.85Å; N87-D289 VanDerWaalsContact ND2-OD2 3.16Å; N87-D289 PolarHBondContact OD1-OD1 3.05Å; N87-N321 VanDerWaalsContact ND2-CG 3.3Å; N87-N321 PolarHBondContact ND2-ND2 3.43Å; N87-N321 PolarHBondContact ND2-O 3.42Å; N87-N321 PolarHBondContact ND2-OD1 3.12Å; N87-V324 HydrophobicContact CB-CG1 4.32Å; N87-S325 PolarHBondContact ND2-OG 3.31Å; N87-C328 WeakPolarHBondContact O-CB 3.37Å
88	I	91.4	Very high	92.2	Very high	7 Å²	7	10.5 Å²	10.5	4%	0.036	6%	0.057	C	C	.	.	I	π-helix	trans	-77.4	-40	-168.1	-57.4	169.3	0	0	0	111.9	G84 L245 C328 F389 L393 A396	G84-I88 PolarHBondContact O-N 3.33Å; I88-L245 HydrophobicContact CG1-CD1 4.43Å; I88-C328 VanDerWaalsContact CA-SG 3.55Å; I88-F389 HydrophobicContact CG2-CD2 4.48Å; I88-F389 HydrophobicContact CG2-CE2 3.68Å; I88-F389 HydrophobicContact CG2-CZ 4Å; I88-L393 HydrophobicContact CB-CD2 3.66Å; I88-L393 HydrophobicContact CB-CG 4.44Å; I88-L393 HydrophobicContact CD1-CD2 4.31Å; I88-L393 HydrophobicContact CG2-CD2 3.63Å; I88-L393 HydrophobicContact CG2-CG 3.9Å; I88-A396 HydrophobicContact CD1-CB 3.61Å
89	W	85.1	Confident	92.1	Very high	20 Å²	20	10.9 Å²	10.9	8%	0.076	6%	0.059	C	C	.	.	I	π-helix	trans	-113.6	-53	-177.3	158.8	40.6	0	0	0	112.4	T85 F91 P92 R93 I170 S363 T364 T367 F368 L393	T85-W89 PolarHBondContact O-N 3.25Å; W89-F91 PolarHBondContact O-N 3.38Å; W89-P92 WeakPolarHBondContact O-CD 3.44Å; W89-R93 PolarHBondContact O-N 2.84Å; W89-I170 HydrophobicContact CZ3-CG2 3.92Å; W89-S363 WeakPolarHBondContact CZ2-O 3.37Å; W89-T364 HydrophobicContact CH2-CG2 3.57Å; W89-T364 HydrophobicContact CZ2-CG2 3.51Å; W89-T367 HydrophobicContact CB-CG2 4.19Å; W89-T367 WeakPolarHBondContact CB-OG1 3.31Å; W89-T367 HydrophobicContact CD2-CG2 4.46Å; W89-T367 HydrophobicContact CG-CG2 3.98Å; W89-F368 HydrophobicContact CD2-CE2 4.24Å; W89-F368 HydrophobicContact CE3-CE2 4.07Å; W89-F368 HydrophobicContact CH2-CE2 4.21Å; W89-F368 HydrophobicContact CZ2-CE2 4.38Å; W89-F368 HydrophobicContact CZ3-CE2 4.04Å; W89-L393 HydrophobicContact CB-CD2 4.18Å
90	R	89.5	Confident	91.9	Very high	40 Å²	40	13.5 Å²	13.5	15%	0.151	7%	0.068	C	C	.	.	I	π-helix	trans	-65	-44.8	-169.8	-157.6	-176.5	-165.2	-151.6	7.9	111.1	T85 G86 R93 I94 D448	T85-R90 PolarHBondContact O-N 3.34Å; G86-R90 CarbonylContact O-C 3.43Å; G86-R90 WeakPolarHBondContact O-CB 3.16Å; G86-R90 PolarHBondContact O-N 3.05Å; R90-R93 WeakPolarHBondContact O-CB 3.36Å; R90-R93 PolarHBondContact O-N 2.97Å; R90-I94 HydrophobicContact CG-CG1 4.27Å; R90-I94 WeakPolarHBondContact O-CG1 3.46Å; R90-I94 PolarHBondContact O-N 2.88Å; R90-D448 IonicContact CZ-OD2 3.84Å; R90-D448 IonicContact NH2-OD1 3.66Å; R90-D448 PolarHBondContact NH2-OD1 2.78Å; R90-D448 IonicContact NH2-OD2 2.75Å; R90-D448 PolarHBondContact NH2-OD2 3.39Å
91	F	94.1	Very high	91.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-52	-177.8	178	-100.1	0	0	0	113.4	G86 W89 R93 I94 I95 F107 L108 W111 Q285 S325 A329	G86-F91 WeakPolarHBondContact O-CB 3.39Å; G86-F91 PolarHBondContact O-N 2.87Å; W89-F91 PolarHBondContact O-N 3.38Å; F91-R93 PolarHBondContact O-N 2.92Å; F91-I94 PolarHBondContact O-N 3.08Å; F91-I94 VanDerWaalsContact O-N 3.09Å; F91-I95 WeakPolarHBondContact O-CG2 3.44Å; F91-I95 PolarHBondContact O-N 2.77Å; F91-F107 AromaticContact CE2-CE1 3.82Å; F91-F107 HydrophobicContact CE2-CE1 3.82Å; F91-F107 HydrophobicContact CE2-CZ 4.48Å; F91-F107 HydrophobicContact CZ-CE1 4.35Å; F91-L108 HydrophobicContact CZ-CD2 3.85Å; F91-W111 HydrophobicContact CD2-CZ2 4.4Å; F91-W111 AromaticContact CD2-NE1 3.88Å; F91-W111 AromaticContact CE2-CD1 3.72Å; F91-W111 AromaticContact CE2-CD2 3.74Å; F91-W111 HydrophobicContact CE2-CD2 3.74Å; F91-W111 AromaticContact CE2-CE2 3.34Å; F91-W111 HydrophobicContact CE2-CE3 4.46Å; F91-W111 AromaticContact CE2-CG 3.93Å; F91-W111 HydrophobicContact CE2-CG 3.93Å; F91-W111 HydrophobicContact CE2-CH2 4.39Å; F91-W111 AromaticContact CE2-CZ2 3.69Å; F91-W111 HydrophobicContact CE2-CZ2 3.69Å; F91-W111 AromaticContact CE2-NE1 3.39Å; F91-W111 HydrophobicContact CZ-CD2 4.06Å; F91-W111 AromaticContact CZ-CE2 3.8Å; F91-W111 HydrophobicContact CZ-CE3 4.33Å; F91-W111 HydrophobicContact CZ-CH2 4.04Å; F91-W111 AromaticContact CZ-CZ2 3.76Å; F91-W111 HydrophobicContact CZ-CZ2 3.76Å; F91-W111 HydrophobicContact CZ-CZ3 4.34Å; F91-Q285 HydrophobicContact CD2-CG 3.78Å; F91-S325 WeakPolarHBondContact CD1-O 3.32Å; F91-S325 VanDerWaalsContact CE1-O 3.26Å; F91-S325 WeakPolarHBondContact CE1-O 3.4Å; F91-A329 HydrophobicContact CD1-CB 3.9Å; F91-A329 HydrophobicContact CE1-CB 3.62Å
92	P	92.9	Very high	91.8	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-55.9	-34.7	174	-27.8	34.5	0	0	0	114	N87 W89 I95 A96 C328 I332 L366	N87-P92 VanDerWaalsContact O-CD 3.28Å; N87-P92 WeakPolarHBondContact O-CD 3.32Å; W89-P92 WeakPolarHBondContact O-CD 3.44Å; P92-I95 WeakPolarHBondContact O-CG2 3.45Å; P92-A96 WeakPolarHBondContact O-CB 3.24Å; P92-A96 PolarHBondContact O-N 3.27Å; P92-C328 HydrophobicContact CG-CB 4.11Å; P92-I332 HydrophobicContact CB-CB 3.91Å; P92-I332 HydrophobicContact CB-CG1 3.95Å; P92-I332 HydrophobicContact CB-CG2 3.93Å; P92-I332 HydrophobicContact CG-CB 4.27Å; P92-I332 HydrophobicContact CG-CG1 3.88Å; P92-L366 HydrophobicContact CB-CD2 4.46Å
93	R	90.4	Very high	91.8	Very high	19 Å²	19	19.6 Å²	19.6	7%	0.072	10%	0.102	C	C	.	.	H	α-helix	trans	-68.5	-49.4	173.6	-178.4	-170.4	64.8	82.3	-3.2	111.4	W89 R90 F91 I95 A96 T97 S363 L366	W89-R93 PolarHBondContact O-N 2.84Å; R90-R93 WeakPolarHBondContact O-CB 3.36Å; R90-R93 PolarHBondContact O-N 2.97Å; F91-R93 PolarHBondContact O-N 2.92Å; R93-I95 VanDerWaalsContact C-N 3.35Å; R93-I95 PolarHBondContact O-N 2.88Å; R93-A96 WeakPolarHBondContact O-CB 3.38Å; R93-A96 PolarHBondContact O-N 2.95Å; R93-A96 VanDerWaalsContact O-N 3.13Å; R93-T97 HydrophobicContact CG-CG2 4.48Å; R93-T97 PolarHBondContact O-N 2.86Å; R93-T97 PolarHBondContact O-OG1 3.32Å; R93-T97 VanDerWaalsContact O-OG1 3.05Å; R93-S363 WeakPolarHBondContact CD-O 3.4Å; R93-S363 PolarHBondContact NE-O 3.36Å; R93-L366 HydrophobicContact CB-CD2 4.08Å
94	I	91.8	Very high	91.9	Very high	22 Å²	22	19.5 Å²	19.5	11%	0.113	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-45.2	-177	-69.8	-65.1	0	0	0	110.9	R90 F91 A96 T97 A98 F107 A281 Q285	R90-I94 HydrophobicContact CG-CG1 4.27Å; R90-I94 WeakPolarHBondContact O-CG1 3.46Å; R90-I94 PolarHBondContact O-N 2.88Å; F91-I94 PolarHBondContact O-N 3.08Å; F91-I94 VanDerWaalsContact O-N 3.09Å; I94-A96 VanDerWaalsContact C-N 3.33Å; I94-A96 PolarHBondContact O-N 2.93Å; I94-T97 VanDerWaalsContact CA-OG1 3.27Å; I94-T97 WeakPolarHBondContact CA-OG1 3.45Å; I94-T97 PolarHBondContact O-N 2.91Å; I94-T97 PolarHBondContact O-OG1 3.2Å; I94-A98 WeakPolarHBondContact O-CB 3.42Å; I94-A98 PolarHBondContact O-N 3.02Å; I94-F107 HydrophobicContact CG2-CE2 3.74Å; I94-F107 HydrophobicContact CG2-CZ 3.59Å; I94-A281 HydrophobicContact CG2-CB 4.23Å; I94-Q285 HydrophobicContact CB-CG 4.3Å; I94-Q285 HydrophobicContact CG1-CG 4.42Å; I94-Q285 HydrophobicContact CG2-CB 4.05Å; I94-Q285 HydrophobicContact CG2-CG 4.23Å
95	I	94.1	Very high	92.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-43.3	175.4	-173.4	160.9	0	0	0	110.8	F91 P92 R93 T97 A98 S99 F107 L108 L265 F333	F91-I95 WeakPolarHBondContact O-CG2 3.44Å; F91-I95 PolarHBondContact O-N 2.77Å; P92-I95 WeakPolarHBondContact O-CG2 3.45Å; R93-I95 VanDerWaalsContact C-N 3.35Å; R93-I95 PolarHBondContact O-N 2.88Å; I95-T97 PolarHBondContact O-N 2.68Å; I95-A98 CarbonylContact O-C 3.54Å; I95-A98 PolarHBondContact O-N 2.9Å; I95-S99 VanDerWaalsContact O-CB 3.26Å; I95-S99 WeakPolarHBondContact O-CB 3.46Å; I95-S99 PolarHBondContact O-N 2.8Å; I95-S99 PolarHBondContact O-OG 3.04Å; I95-F107 HydrophobicContact CB-CD1 3.76Å; I95-F107 HydrophobicContact CB-CE1 3.76Å; I95-F107 HydrophobicContact CD1-CD1 3.71Å; I95-F107 HydrophobicContact CD1-CE1 4.28Å; I95-F107 HydrophobicContact CG1-CB 4.44Å; I95-F107 HydrophobicContact CG1-CD1 3.55Å; I95-F107 HydrophobicContact CG1-CE1 4.09Å; I95-F107 HydrophobicContact CG1-CG 4.17Å; I95-L108 HydrophobicContact CD1-CD1 4.27Å; I95-L108 HydrophobicContact CD1-CD2 3.47Å; I95-L108 VanDerWaalsContact CD1-CD2 3.47Å; I95-L108 HydrophobicContact CD1-CG 3.62Å; I95-L265 HydrophobicContact CD1-CD1 3.4Å; I95-L265 HydrophobicContact CG1-CD1 4.23Å; I95-F333 HydrophobicContact CG2-CE2 3.51Å; I95-F333 HydrophobicContact CG2-CZ 3.75Å
96	A	92.4	Very high	92.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-45.8	176.2	0	0	0	0	0	112.2	P92 R93 I94 A98 S99 F333 L353 M356 Q357	P92-A96 WeakPolarHBondContact O-CB 3.24Å; P92-A96 PolarHBondContact O-N 3.27Å; R93-A96 WeakPolarHBondContact O-CB 3.38Å; R93-A96 PolarHBondContact O-N 2.95Å; R93-A96 VanDerWaalsContact O-N 3.13Å; I94-A96 VanDerWaalsContact C-N 3.33Å; I94-A96 PolarHBondContact O-N 2.93Å; A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.25Å; A96-S99 PolarHBondContact O-N 3.34Å; A96-F333 HydrophobicContact CB-CZ 4.04Å; A96-L353 HydrophobicContact CB-CD1 4.5Å; A96-M356 HydrophobicContact CB-CB 3.76Å; A96-M356 HydrophobicContact CB-CE 4.21Å; A96-Q357 VanDerWaalsContact O-CG 3.31Å; A96-Q357 WeakPolarHBondContact O-CG 3.42Å; A96-Q357 PolarHBondContact O-NE2 3.07Å
97	T	89.8	Confident	92.9	Very high	49 Å²	49	20.8 Å²	20.8	30%	0.301	11%	0.106	S	C	.	.	H	α-helix	trans	-65.1	-32	177.3	47.9	0	0	0	0	113.8	R93 I94 I95	R93-T97 HydrophobicContact CG-CG2 4.48Å; R93-T97 PolarHBondContact O-N 2.86Å; R93-T97 PolarHBondContact O-OG1 3.32Å; R93-T97 VanDerWaalsContact O-OG1 3.05Å; I94-T97 VanDerWaalsContact CA-OG1 3.27Å; I94-T97 WeakPolarHBondContact CA-OG1 3.45Å; I94-T97 PolarHBondContact O-N 2.91Å; I94-T97 PolarHBondContact O-OG1 3.2Å; I95-T97 PolarHBondContact O-N 2.68Å
98	A	91.7	Very high	93.1	Very high	15 Å²	15	21.3 Å²	21.3	12%	0.124	11%	0.109	C	C	.	.	H	α-helix	trans	-89.9	-4.4	177.6	0	0	0	0	0	113.4	I94 I95 A96 F107 L278 A281	I94-A98 WeakPolarHBondContact O-CB 3.42Å; I94-A98 PolarHBondContact O-N 3.02Å; I95-A98 CarbonylContact O-C 3.54Å; I95-A98 PolarHBondContact O-N 2.9Å; A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.25Å; A98-F107 HydrophobicContact CB-CD2 3.42Å; A98-F107 VanDerWaalsContact CB-CD2 3.42Å; A98-F107 HydrophobicContact CB-CE2 3.85Å; A98-F107 HydrophobicContact CB-CG 4.22Å; A98-L278 HydrophobicContact CB-CD1 4.48Å; A98-L278 WeakPolarHBondContact O-CD1 3.3Å; A98-A281 HydrophobicContact CB-CB 4.35Å
99	S	93.2	Very high	93.4	Very high	7 Å²	7	23.7 Å²	23.7	5%	0.049	12%	0.121	C	C	.	.			trans	-83.8	155	-179.6	-68.1	0	0	0	0	112.4	I95 A96 S104 Q357	I95-S99 VanDerWaalsContact O-CB 3.26Å; I95-S99 WeakPolarHBondContact O-CB 3.46Å; I95-S99 PolarHBondContact O-N 2.8Å; I95-S99 PolarHBondContact O-OG 3.04Å; A96-S99 PolarHBondContact O-N 3.34Å; S99-S104 WeakPolarHBondContact CB-OG 3.35Å; S99-S104 WeakPolarHBondContact OG-CB 3.49Å; S99-S104 PolarHBondContact OG-OG 3.1Å; S99-Q357 PolarHBondContact O-NE2 3.46Å; S99-Q357 VanDerWaalsContact O-NE2 3.1Å
100	Y	92.5	Very high	93.9	Very high	73 Å²	73	22.7 Å²	22.7	29%	0.286	12%	0.117	S	C	.	.	B	Isolated β-bridge	trans	-109.4	165.4	176.5	-69.6	-102.6	0	0	0	110.1	Q102 G103 F264 Y269 T275	Y100-Q102 PolarHBondContact O-N 2.99Å; Y100-G103 PolarHBondContact N-O 2.89Å; Y100-G103 PolarHBondContact O-N 3.35Å; Y100-F264 VanDerWaalsContact O-CZ 3.23Å; Y100-F264 WeakPolarHBondContact O-CZ 3.3Å; Y100-Y269 AromaticContact CD1-CD1 3.87Å; Y100-Y269 HydrophobicContact CD1-CD1 3.87Å; Y100-Y269 AromaticContact CD1-CE1 3.68Å; Y100-Y269 HydrophobicContact CD1-CE1 3.68Å; Y100-Y269 AromaticContact CD2-CD1 3.92Å; Y100-Y269 HydrophobicContact CD2-CD1 3.92Å; Y100-Y269 HydrophobicContact CD2-CE1 4.44Å; Y100-Y269 HydrophobicContact CE1-CE1 4.13Å; Y100-Y269 AromaticContact CG-CD1 3.51Å; Y100-Y269 HydrophobicContact CG-CD1 3.51Å; Y100-Y269 AromaticContact CG-CE1 3.85Å; Y100-Y269 HydrophobicContact CG-CE1 3.85Å; Y100-T275 WeakPolarHBondContact OH-CG2 3.37Å; Y100-T275 PolarHBondContact OH-OG1 3.35Å
101	S	91.7	Very high	94.3	Very high	55 Å²	55	21.2 Å²	21.2	39%	0.385	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.7	-178.3	54.1	0	0	0	0	113.8	S350	S101-S350 WeakPolarHBondContact CB-OG 3.21Å
102	Q	92.8	Very high	94.4	Very high	86 Å²	86	22.9 Å²	22.9	40%	0.402	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-28.2	178	-58.5	84.3	-7.4	0	0	113.4	Y100 T267 Y269	Y100-Q102 PolarHBondContact O-N 2.99Å; Q102-T267 WeakPolarHBondContact O-CG2 3.47Å; Q102-Y269 HydrophobicContact CB-CD2 4.28Å; Q102-Y269 HydrophobicContact CB-CG 4.23Å; Q102-Y269 HydrophobicContact CG-CD2 4.16Å; Q102-Y269 HydrophobicContact CG-CG 4.47Å
103	G	94.7	Very high	94.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	155.6	-176.2	179.5	0	0	0	0	0	115.2	Y100 F264 T267	Y100-G103 PolarHBondContact N-O 2.89Å; Y100-G103 PolarHBondContact O-N 3.35Å; G103-F264 WeakPolarHBondContact CA-O 3.16Å; G103-T267 CarbonylContact C-O 3.57Å; G103-T267 WeakPolarHBondContact CA-O 3.16Å
104	S	96.1	Very high	94.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-121.1	-6.7	-169.9	-50.1	0	0	0	0	115.8	S99 T106 F107 L108 F264 L265 T267	S99-S104 WeakPolarHBondContact CB-OG 3.35Å; S99-S104 WeakPolarHBondContact OG-CB 3.49Å; S99-S104 PolarHBondContact OG-OG 3.1Å; S104-T106 VanDerWaalsContact C-N 3.27Å; S104-T106 PolarHBondContact O-N 3.49Å; S104-F107 WeakPolarHBondContact O-CB 3.31Å; S104-F107 PolarHBondContact O-N 3.35Å; S104-F107 VanDerWaalsContact O-N 3.12Å; S104-L108 PolarHBondContact O-N 3.5Å; S104-F264 PolarHBondContact N-O 2.9Å; S104-F264 WeakPolarHBondContact OG-CE1 3.23Å; S104-L265 CarbonylContact C-O 3.51Å; S104-T267 PolarHBondContact N-O 2.92Å; S104-T267 VanDerWaalsContact N-O 3.08Å
105	L	97.6	Very high	95.1	Very high	40 Å²	40	26.2 Å²	26.2	21%	0.209	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-33.8	-167.9	176.5	59	0	0	0	113.4	F107 L108 I109 L265 F266 T267 P268	L105-F107 VanDerWaalsContact C-N 3.29Å; L105-F107 PolarHBondContact O-N 3.01Å; L105-L108 HydrophobicContact CD1-CB 4.43Å; L105-L108 HydrophobicContact CD1-CD1 4.43Å; L105-L108 WeakPolarHBondContact O-CB 3.49Å; L105-L108 PolarHBondContact O-N 3.4Å; L105-L108 VanDerWaalsContact O-N 3.11Å; L105-I109 HydrophobicContact CD1-CD1 4.49Å; L105-I109 HydrophobicContact CD1-CG1 4.36Å; L105-I109 HydrophobicContact CG-CD1 4.07Å; L105-I109 HydrophobicContact CG-CG1 4.42Å; L105-I109 WeakPolarHBondContact O-CG1 3.35Å; L105-I109 PolarHBondContact O-N 2.91Å; L105-L265 PolarHBondContact N-O 3.18Å; L105-F266 HydrophobicContact CD1-CD1 4.11Å; L105-F266 WeakPolarHBondContact CD2-O 3.17Å; L105-T267 WeakPolarHBondContact CB-O 3.26Å; L105-T267 PolarHBondContact N-O 3.16Å; L105-P268 HydrophobicContact CB-CB 4.29Å; L105-P268 HydrophobicContact CD2-CB 4.09Å; L105-P268 HydrophobicContact CD2-CG 4.33Å
106	T	97.5	Very high	95.2	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-34.7	-179.8	43.2	0	0	0	0	112.6	S104 I109 A110 P268 Y269 W270 S272 M273	S104-T106 VanDerWaalsContact C-N 3.27Å; S104-T106 PolarHBondContact O-N 3.49Å; T106-I109 PolarHBondContact O-N 3.39Å; T106-A110 PolarHBondContact O-N 3.13Å; T106-A110 VanDerWaalsContact O-N 3.12Å; T106-P268 HydrophobicContact CG2-CB 4.47Å; T106-Y269 VanDerWaalsContact CG2-O 3.32Å; T106-Y269 WeakPolarHBondContact CG2-O 3.29Å; T106-W270 HydrophobicContact CG2-CE3 4.14Å; T106-S272 VanDerWaalsContact CB-OG 3.29Å; T106-S272 WeakPolarHBondContact CB-OG 3.36Å; T106-S272 PolarHBondContact OG1-OG 2.6Å; T106-M273 HydrophobicContact CG2-CE 3.97Å; T106-M273 HydrophobicContact CG2-CG 3.82Å; T106-M273 HydrophobicContact CG2-SD 4.19Å
107	F	97.2	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-45.9	170.7	174.2	-88.1	0	0	0	111.2	F91 I94 I95 A98 S104 L105 I109 A110 W111 L278 A281 A282	F91-F107 AromaticContact CE2-CE1 3.82Å; F91-F107 HydrophobicContact CE2-CE1 3.82Å; F91-F107 HydrophobicContact CE2-CZ 4.48Å; F91-F107 HydrophobicContact CZ-CE1 4.35Å; I94-F107 HydrophobicContact CG2-CE2 3.74Å; I94-F107 HydrophobicContact CG2-CZ 3.59Å; I95-F107 HydrophobicContact CB-CD1 3.76Å; I95-F107 HydrophobicContact CB-CE1 3.76Å; I95-F107 HydrophobicContact CD1-CD1 3.71Å; I95-F107 HydrophobicContact CD1-CE1 4.28Å; I95-F107 HydrophobicContact CG1-CB 4.44Å; I95-F107 HydrophobicContact CG1-CD1 3.55Å; I95-F107 HydrophobicContact CG1-CE1 4.09Å; I95-F107 HydrophobicContact CG1-CG 4.17Å; A98-F107 HydrophobicContact CB-CD2 3.42Å; A98-F107 VanDerWaalsContact CB-CD2 3.42Å; A98-F107 HydrophobicContact CB-CE2 3.85Å; A98-F107 HydrophobicContact CB-CG 4.22Å; S104-F107 WeakPolarHBondContact O-CB 3.31Å; S104-F107 PolarHBondContact O-N 3.35Å; S104-F107 VanDerWaalsContact O-N 3.12Å; L105-F107 VanDerWaalsContact C-N 3.29Å; L105-F107 PolarHBondContact O-N 3.01Å; F107-I109 VanDerWaalsContact C-N 3.28Å; F107-I109 PolarHBondContact O-N 3.29Å; F107-A110 PolarHBondContact O-N 3.06Å; F107-W111 HydrophobicContact CE1-CB 4.14Å; F107-W111 HydrophobicContact CE1-CG 4.47Å; F107-W111 HydrophobicContact CZ-CB 4.44Å; F107-W111 VanDerWaalsContact O-CB 3.32Å; F107-W111 WeakPolarHBondContact O-CB 3.22Å; F107-W111 PolarHBondContact O-N 2.88Å; F107-L278 HydrophobicContact CB-CD1 3.93Å; F107-L278 HydrophobicContact CD2-CD1 4.44Å; F107-A281 HydrophobicContact CE2-CB 4.16Å; F107-A282 HydrophobicContact CD2-CB 4.06Å; F107-A282 HydrophobicContact CE2-CB 3.81Å; F107-A282 HydrophobicContact CZ-CB 4.32Å
108	L	97.9	Very high	95.6	Very high	12 Å²	12	31.2 Å²	31.2	6%	0.063	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-39.1	179	-69.9	176.4	0	0	0	112	F91 I95 S104 L105 W111 A112 L265 F266 L326	F91-L108 HydrophobicContact CZ-CD2 3.85Å; I95-L108 HydrophobicContact CD1-CD1 4.27Å; I95-L108 HydrophobicContact CD1-CD2 3.47Å; I95-L108 VanDerWaalsContact CD1-CD2 3.47Å; I95-L108 HydrophobicContact CD1-CG 3.62Å; S104-L108 PolarHBondContact O-N 3.5Å; L105-L108 HydrophobicContact CD1-CB 4.43Å; L105-L108 HydrophobicContact CD1-CD1 4.43Å; L105-L108 WeakPolarHBondContact O-CB 3.49Å; L105-L108 PolarHBondContact O-N 3.4Å; L105-L108 VanDerWaalsContact O-N 3.11Å; L108-W111 HydrophobicContact CD2-CE3 4.36Å; L108-W111 HydrophobicContact CD2-CZ3 4.5Å; L108-W111 PolarHBondContact O-N 3.26Å; L108-A112 VanDerWaalsContact O-CB 3.23Å; L108-A112 WeakPolarHBondContact O-CB 3.31Å; L108-A112 PolarHBondContact O-N 3.44Å; L108-L265 HydrophobicContact CD1-CG 4.13Å; L108-F266 HydrophobicContact CD1-CD1 4.19Å; L108-F266 HydrophobicContact CD1-CE1 4.01Å; L108-L326 HydrophobicContact CD1-CD1 4.28Å; L108-L326 HydrophobicContact CD2-CD1 4.2Å
109	I	97.8	Very high	95.9	Very high	56 Å²	56	30.5 Å²	30.5	29%	0.287	16%	0.158	S	C	.	.	H	α-helix	trans	-64	-50.1	175.9	-65.7	167	0	0	0	110.4	L105 T106 F107 W111 A112 M113 W270 M273	L105-I109 HydrophobicContact CD1-CD1 4.49Å; L105-I109 HydrophobicContact CD1-CG1 4.36Å; L105-I109 HydrophobicContact CG-CD1 4.07Å; L105-I109 HydrophobicContact CG-CG1 4.42Å; L105-I109 WeakPolarHBondContact O-CG1 3.35Å; L105-I109 PolarHBondContact O-N 2.91Å; T106-I109 PolarHBondContact O-N 3.39Å; F107-I109 VanDerWaalsContact C-N 3.28Å; F107-I109 PolarHBondContact O-N 3.29Å; I109-W111 VanDerWaalsContact C-N 3.3Å; I109-W111 PolarHBondContact O-N 2.74Å; I109-A112 PolarHBondContact O-N 2.89Å; I109-M113 HydrophobicContact CG2-CG 4.5Å; I109-M113 HydrophobicContact CG2-SD 4.02Å; I109-M113 VanDerWaalsContact O-CG 3.31Å; I109-M113 WeakPolarHBondContact O-CG 3.39Å; I109-M113 PolarHBondContact O-N 2.85Å; I109-W270 HydrophobicContact CD1-CH2 4.32Å; I109-W270 HydrophobicContact CD1-CZ3 4.19Å; I109-M273 HydrophobicContact CB-CE 3.66Å; I109-M273 HydrophobicContact CD1-CE 3.91Å; I109-M273 HydrophobicContact CG1-CE 4.39Å; I109-M273 HydrophobicContact CG2-CE 3.58Å
110	A	96.3	Very high	96	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-40	178.5	0	0	0	0	0	112.2	T106 F107 M113 S114 L278 W279 A282	T106-A110 PolarHBondContact O-N 3.13Å; T106-A110 VanDerWaalsContact O-N 3.12Å; F107-A110 PolarHBondContact O-N 3.06Å; A110-M113 PolarHBondContact O-N 3.25Å; A110-S114 PolarHBondContact O-N 3.42Å; A110-S114 PolarHBondContact O-OG 2.9Å; A110-L278 HydrophobicContact CB-CD2 4.21Å; A110-W279 HydrophobicContact CB-CD2 3.97Å; A110-W279 HydrophobicContact CB-CE3 3.66Å; A110-W279 HydrophobicContact CB-CH2 4.11Å; A110-W279 HydrophobicContact CB-CZ2 4.38Å; A110-W279 HydrophobicContact CB-CZ3 3.74Å; A110-A282 HydrophobicContact CB-CB 3.75Å
111	W	96.9	Very high	96.3	Very high	9 Å²	9	27.4 Å²	27.4	3%	0.034	15%	0.146	C	C	.	.	H	α-helix	trans	-68.3	-41.3	177.6	165.6	87	0	0	0	111.8	F91 F107 L108 I109 S114 L115 A282 N286 N322	F91-W111 HydrophobicContact CD2-CZ2 4.4Å; F91-W111 AromaticContact CD2-NE1 3.88Å; F91-W111 AromaticContact CE2-CD1 3.72Å; F91-W111 AromaticContact CE2-CD2 3.74Å; F91-W111 HydrophobicContact CE2-CD2 3.74Å; F91-W111 AromaticContact CE2-CE2 3.34Å; F91-W111 HydrophobicContact CE2-CE3 4.46Å; F91-W111 AromaticContact CE2-CG 3.93Å; F91-W111 HydrophobicContact CE2-CG 3.93Å; F91-W111 HydrophobicContact CE2-CH2 4.39Å; F91-W111 AromaticContact CE2-CZ2 3.69Å; F91-W111 HydrophobicContact CE2-CZ2 3.69Å; F91-W111 AromaticContact CE2-NE1 3.39Å; F91-W111 HydrophobicContact CZ-CD2 4.06Å; F91-W111 AromaticContact CZ-CE2 3.8Å; F91-W111 HydrophobicContact CZ-CE3 4.33Å; F91-W111 HydrophobicContact CZ-CH2 4.04Å; F91-W111 AromaticContact CZ-CZ2 3.76Å; F91-W111 HydrophobicContact CZ-CZ2 3.76Å; F91-W111 HydrophobicContact CZ-CZ3 4.34Å; F107-W111 HydrophobicContact CE1-CB 4.14Å; F107-W111 HydrophobicContact CE1-CG 4.47Å; F107-W111 HydrophobicContact CZ-CB 4.44Å; F107-W111 VanDerWaalsContact O-CB 3.32Å; F107-W111 WeakPolarHBondContact O-CB 3.22Å; F107-W111 PolarHBondContact O-N 2.88Å; L108-W111 HydrophobicContact CD2-CE3 4.36Å; L108-W111 HydrophobicContact CD2-CZ3 4.5Å; L108-W111 PolarHBondContact O-N 3.26Å; I109-W111 VanDerWaalsContact C-N 3.3Å; I109-W111 PolarHBondContact O-N 2.74Å; W111-S114 WeakPolarHBondContact O-CB 3.32Å; W111-S114 PolarHBondContact O-N 2.96Å; W111-L115 PolarHBondContact O-N 3.3Å; W111-A282 HydrophobicContact CB-CB 3.97Å; W111-N286 HydrophobicContact CG-CB 4.43Å; W111-N286 PolarHBondContact NE1-ND2 3.49Å; W111-N322 HydrophobicContact CH2-CB 3.48Å; W111-N322 VanDerWaalsContact CH2-CB 3.48Å; W111-N322 WeakPolarHBondContact CH2-ND2 3.37Å; W111-N322 VanDerWaalsContact CH2-O 3.27Å; W111-N322 WeakPolarHBondContact CH2-O 3.44Å; W111-N322 HydrophobicContact CZ2-CB 3.63Å; W111-N322 WeakPolarHBondContact CZ2-ND2 3.45Å; W111-N322 HydrophobicContact CZ3-CB 4.34Å; W111-N322 WeakPolarHBondContact CZ3-ND2 3.22Å
112	A	97.6	Very high	96.6	Very high	34 Å²	34	24.8 Å²	24.8	28%	0.281	13%	0.128	S	C	.	.	H	α-helix	trans	-66.6	-38.5	174.9	0	0	0	0	0	111.7	L108 I109 S114 L115 F116	L108-A112 VanDerWaalsContact O-CB 3.23Å; L108-A112 WeakPolarHBondContact O-CB 3.31Å; L108-A112 PolarHBondContact O-N 3.44Å; I109-A112 PolarHBondContact O-N 2.89Å; A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 3.38Å; A112-L115 WeakPolarHBondContact O-CB 3.46Å; A112-L115 PolarHBondContact O-N 2.85Å; A112-F116 WeakPolarHBondContact O-CD2 3.46Å
113	M	96.8	Very high	96.8	Very high	91 Å²	91	20.7 Å²	20.7	45%	0.448	11%	0.109	S	C	.	.	H	α-helix	trans	-62.4	-40.1	173.2	-72.4	175.8	64.8	0	0	111.5	I109 A110 L115 F116 V117 W279	I109-M113 HydrophobicContact CG2-CG 4.5Å; I109-M113 HydrophobicContact CG2-SD 4.02Å; I109-M113 VanDerWaalsContact O-CG 3.31Å; I109-M113 WeakPolarHBondContact O-CG 3.39Å; I109-M113 PolarHBondContact O-N 2.85Å; A110-M113 PolarHBondContact O-N 3.25Å; M113-L115 VanDerWaalsContact C-N 3.27Å; M113-L115 PolarHBondContact O-N 3.4Å; M113-F116 PolarHBondContact O-N 3.02Å; M113-F116 VanDerWaalsContact O-N 3.14Å; M113-V117 VanDerWaalsContact O-CG2 3.3Å; M113-V117 WeakPolarHBondContact O-CG2 3.29Å; M113-V117 PolarHBondContact O-N 3.45Å; M113-W279 HydrophobicContact CB-CZ3 4.47Å; M113-W279 HydrophobicContact CE-CH2 3.91Å; M113-W279 HydrophobicContact CE-CZ3 4.2Å; M113-W279 HydrophobicContact SD-CH2 3.73Å; M113-W279 HydrophobicContact SD-CZ3 4.14Å
114	S	95.8	Very high	97	Very high	12 Å²	12	21.1 Å²	21.1	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-61	-34.7	178	-57.8	0	0	0	0	112.6	A110 W111 A112 F116 V117 W118 S119 A283	A110-S114 PolarHBondContact O-N 3.42Å; A110-S114 PolarHBondContact O-OG 2.9Å; W111-S114 WeakPolarHBondContact O-CB 3.32Å; W111-S114 PolarHBondContact O-N 2.96Å; A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 3.38Å; S114-F116 VanDerWaalsContact C-N 3.34Å; S114-F116 PolarHBondContact O-N 3.39Å; S114-V117 PolarHBondContact O-N 2.96Å; S114-W118 WeakPolarHBondContact O-CB 3.4Å; S114-W118 PolarHBondContact O-N 3Å; S114-S119 PolarHBondContact O-N 3.03Å; S114-A283 WeakPolarHBondContact OG-CA 3.26Å; S114-A283 WeakPolarHBondContact OG-CB 3.13Å
115	L	97.4	Very high	97.1	Very high	9 Å²	9	21.1 Å²	21.1	5%	0.047	11%	0.111	C	C	.	.	I	π-helix	trans	-55.2	-49.3	172.8	173.9	65.3	0	0	0	111.7	W111 A112 M113 S119 L120 N286 T290 P318 I319 N322	W111-L115 PolarHBondContact O-N 3.3Å; A112-L115 WeakPolarHBondContact O-CB 3.46Å; A112-L115 PolarHBondContact O-N 2.85Å; M113-L115 VanDerWaalsContact C-N 3.27Å; M113-L115 PolarHBondContact O-N 3.4Å; L115-S119 PolarHBondContact O-N 2.95Å; L115-L120 HydrophobicContact CD1-CD2 4.3Å; L115-L120 HydrophobicContact CD1-CG 3.92Å; L115-L120 HydrophobicContact CG-CD1 4.17Å; L115-L120 HydrophobicContact CG-CG 4.04Å; L115-L120 WeakPolarHBondContact O-CB 3.47Å; L115-L120 WeakPolarHBondContact O-CG 3.38Å; L115-L120 PolarHBondContact O-N 2.7Å; L115-N286 WeakPolarHBondContact CA-OD1 3.35Å; L115-N286 PolarHBondContact N-OD1 3.18Å; L115-T290 HydrophobicContact CD1-CG2 4.18Å; L115-P318 HydrophobicContact CD1-CB 3.62Å; L115-I319 HydrophobicContact CD2-CG1 4.15Å; L115-N322 HydrophobicContact CD2-CB 4.25Å
116	F	96	Very high	97.1	Very high	107 Å²	107	19.2 Å²	19.2	47%	0.469	10%	0.101	S	C	.	.	I	π-helix	trans	-72.4	-43.5	-178.3	-64.2	-78.3	0	0	0	111.8	A112 M113 S114 L120 P121 M496	A112-F116 WeakPolarHBondContact O-CD2 3.46Å; M113-F116 PolarHBondContact O-N 3.02Å; M113-F116 VanDerWaalsContact O-N 3.14Å; S114-F116 VanDerWaalsContact C-N 3.34Å; S114-F116 PolarHBondContact O-N 3.39Å; F116-L120 HydrophobicContact CD1-CD1 3.56Å; F116-L120 HydrophobicContact CE1-CD1 3.89Å; F116-L120 HydrophobicContact CG-CD1 4.33Å; F116-P121 VanDerWaalsContact O-CD 3.25Å; F116-P121 WeakPolarHBondContact O-CD 3.28Å; F116-M496 WeakPolarHBondContact O-CE 3.02Å
117	V	95.4	Very high	97.1	Very high	39 Å²	39	19.1 Å²	19.1	24%	0.236	10%	0.1	C	C	.	.	I	π-helix	trans	-75.1	-33.1	-172	175.5	0	0	0	0	112.4	M113 S114 L500 V501 S504	M113-V117 VanDerWaalsContact O-CG2 3.3Å; M113-V117 WeakPolarHBondContact O-CG2 3.29Å; M113-V117 PolarHBondContact O-N 3.45Å; S114-V117 PolarHBondContact O-N 2.96Å; V117-L500 HydrophobicContact CG1-CB 3.94Å; V117-L500 HydrophobicContact CG2-CD1 4.49Å; V117-V501 VanDerWaalsContact O-CG2 3.31Å; V117-V501 WeakPolarHBondContact O-CG2 3.36Å; V117-S504 WeakPolarHBondContact CG1-OG 3.3Å
118	W	95.3	Very high	97.2	Very high	8 Å²	8	19.1 Å²	19.1	3%	0.03	10%	0.1	C	C	.	.	I	π-helix	trans	-119.4	-60.5	-172.2	-179.4	-91.1	0	0	0	113.1	S114 P121 L122 M456 V501 G505	S114-W118 WeakPolarHBondContact O-CB 3.4Å; S114-W118 PolarHBondContact O-N 3Å; W118-P121 WeakPolarHBondContact O-CD 3.37Å; W118-P121 VanDerWaalsContact O-CG 3.31Å; W118-P121 WeakPolarHBondContact O-CG 3.34Å; W118-L122 HydrophobicContact CD2-CD1 3.68Å; W118-L122 HydrophobicContact CE3-CD1 4.22Å; W118-L122 HydrophobicContact CG-CD1 4.04Å; W118-L122 HydrophobicContact CH2-CD1 4.28Å; W118-L122 HydrophobicContact CZ2-CD1 3.75Å; W118-L122 HydrophobicContact CZ3-CD1 4.47Å; W118-L122 WeakPolarHBondContact O-CB 3.48Å; W118-L122 WeakPolarHBondContact O-CG 3.49Å; W118-L122 PolarHBondContact O-N 3.24Å; W118-M456 HydrophobicContact CH2-CB 4.44Å; W118-M456 HydrophobicContact CH2-CG 4.12Å; W118-M456 HydrophobicContact CZ2-CG 4.19Å; W118-V501 HydrophobicContact CE3-CG1 3.97Å; W118-V501 HydrophobicContact CZ3-CG1 3.85Å; W118-V501 WeakPolarHBondContact CZ3-O 3.41Å; W118-G505 VanDerWaalsContact CZ3-N 3.34Å
119	S	96.7	Very high	97.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-73.4	-43.3	-163.2	-56.2	0	0	0	0	113.4	S114 L115 S123 N286 T290	S114-S119 PolarHBondContact O-N 3.03Å; L115-S119 PolarHBondContact O-N 2.95Å; S119-S123 VanDerWaalsContact O-CB 3.22Å; S119-S123 WeakPolarHBondContact O-CB 3.33Å; S119-S123 PolarHBondContact O-N 2.59Å; S119-S123 PolarHBondContact O-OG 3.11Å; S119-N286 WeakPolarHBondContact CB-OD1 3.45Å; S119-N286 PolarHBondContact OG-OD1 3.18Å; S119-T290 VanDerWaalsContact CB-OG1 3.27Å; S119-T290 WeakPolarHBondContact CB-OG1 3.45Å; S119-T290 PolarHBondContact OG-OG1 2.83Å
120	L	97.2	Very high	97	Very high	14 Å²	14	15.9 Å²	15.9	7%	0.073	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-53.6	176.5	-75	178.4	0	0	0	113.3	L115 F116 L122 S123 I124 T315 P318 I319	L115-L120 HydrophobicContact CD1-CD2 4.3Å; L115-L120 HydrophobicContact CD1-CG 3.92Å; L115-L120 HydrophobicContact CG-CD1 4.17Å; L115-L120 HydrophobicContact CG-CG 4.04Å; L115-L120 WeakPolarHBondContact O-CB 3.47Å; L115-L120 WeakPolarHBondContact O-CG 3.38Å; L115-L120 PolarHBondContact O-N 2.7Å; F116-L120 HydrophobicContact CD1-CD1 3.56Å; F116-L120 HydrophobicContact CE1-CD1 3.89Å; F116-L120 HydrophobicContact CG-CD1 4.33Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.39Å; L120-S123 PolarHBondContact O-N 2.8Å; L120-I124 WeakPolarHBondContact O-CG1 3.49Å; L120-I124 PolarHBondContact O-N 3.43Å; L120-T315 HydrophobicContact CD2-CG2 4.37Å; L120-T315 WeakPolarHBondContact CD2-O 3.39Å; L120-P318 HydrophobicContact CD2-CB 3.84Å; L120-P318 HydrophobicContact CD2-CG 4.03Å; L120-I319 HydrophobicContact CD2-CG1 4.37Å
121	P	97.9	Very high	96.9	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-61.8	-38.7	-178.2	20.8	-31.3	0	0	0	112.4	F116 W118 V125 W493 M496 V501	F116-P121 VanDerWaalsContact O-CD 3.25Å; F116-P121 WeakPolarHBondContact O-CD 3.28Å; W118-P121 WeakPolarHBondContact O-CD 3.37Å; W118-P121 VanDerWaalsContact O-CG 3.31Å; W118-P121 WeakPolarHBondContact O-CG 3.34Å; P121-V125 WeakPolarHBondContact O-CG2 3.36Å; P121-V125 PolarHBondContact O-N 2.91Å; P121-W493 PolarHBondContact O-NE1 2.99Å; P121-M496 HydrophobicContact CB-CB 4.18Å; P121-M496 HydrophobicContact CG-CB 4.33Å; P121-V501 HydrophobicContact CB-CG2 4.1Å; P121-V501 HydrophobicContact CG-CG2 3.56Å
122	L	97.9	Very high	96.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-70.6	-41.3	176.9	-73.8	168.7	0	0	0	112.7	W118 L120 I124 V125 E126 A292 A293 M462 I497 V501	W118-L122 HydrophobicContact CD2-CD1 3.68Å; W118-L122 HydrophobicContact CE3-CD1 4.22Å; W118-L122 HydrophobicContact CG-CD1 4.04Å; W118-L122 HydrophobicContact CH2-CD1 4.28Å; W118-L122 HydrophobicContact CZ2-CD1 3.75Å; W118-L122 HydrophobicContact CZ3-CD1 4.47Å; W118-L122 WeakPolarHBondContact O-CB 3.48Å; W118-L122 WeakPolarHBondContact O-CG 3.49Å; W118-L122 PolarHBondContact O-N 3.24Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.39Å; L122-I124 VanDerWaalsContact C-N 3.27Å; L122-I124 PolarHBondContact O-N 3.37Å; L122-V125 WeakPolarHBondContact O-CA 3.44Å; L122-V125 WeakPolarHBondContact O-CB 3.31Å; L122-V125 PolarHBondContact O-N 3.43Å; L122-E126 PolarHBondContact O-N 3.07Å; L122-A292 HydrophobicContact CB-CB 4.46Å; L122-A293 HydrophobicContact CD1-CB 4.31Å; L122-M462 HydrophobicContact CD2-CB 4.18Å; L122-M462 HydrophobicContact CD2-CG 4.36Å; L122-M462 HydrophobicContact CD2-SD 4.36Å; L122-I497 HydrophobicContact CD2-CD1 4.17Å; L122-V501 HydrophobicContact CD1-CG1 4.09Å; L122-V501 HydrophobicContact CD2-CG1 4.14Å; L122-V501 HydrophobicContact CG-CG1 4.14Å; L122-V501 HydrophobicContact CG-CG2 4.49Å
123	S	97.7	Very high	96.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.9	-41.8	175.9	-62.3	0	0	0	0	111.2	S119 L120 V125 E126 Y127 P318	S119-S123 VanDerWaalsContact O-CB 3.22Å; S119-S123 WeakPolarHBondContact O-CB 3.33Å; S119-S123 PolarHBondContact O-N 2.59Å; S119-S123 PolarHBondContact O-OG 3.11Å; L120-S123 PolarHBondContact O-N 2.8Å; S123-V125 VanDerWaalsContact C-N 3.32Å; S123-V125 PolarHBondContact O-N 3.25Å; S123-E126 PolarHBondContact O-N 2.98Å; S123-Y127 VanDerWaalsContact O-CD2 3.26Å; S123-Y127 WeakPolarHBondContact O-CD2 3.37Å; S123-Y127 PolarHBondContact O-N 3.31Å; S123-P318 WeakPolarHBondContact OG-CG 3.4Å
124	I	98.2	Very high	96.4	Very high	9 Å²	9	11.1 Å²	11.1	5%	0.046	5%	0.053	C	C	.	.	H	α-helix	trans	-61.3	-40.7	175	-67.1	165.9	0	0	0	110.9	L120 L122 T128 L489	L120-I124 WeakPolarHBondContact O-CG1 3.49Å; L120-I124 PolarHBondContact O-N 3.43Å; L122-I124 VanDerWaalsContact C-N 3.27Å; L122-I124 PolarHBondContact O-N 3.37Å; I124-T128 HydrophobicContact CG2-CG2 4.2Å; I124-T128 WeakPolarHBondContact O-CB 3.4Å; I124-T128 VanDerWaalsContact O-CG2 3.27Å; I124-T128 WeakPolarHBondContact O-CG2 3.43Å; I124-T128 PolarHBondContact O-N 3.18Å; I124-T128 PolarHBondContact O-OG1 2.87Å; I124-L489 HydrophobicContact CD1-CD1 3.93Å; I124-L489 HydrophobicContact CG2-CD1 4.11Å; I124-L489 HydrophobicContact CG2-CD2 4Å
125	V	98.3	Very high	96.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.2	-49.6	173	177.8	0	0	0	0	110.2	P121 L122 S123 Y127 T128 L129 M462 I466 W493 I497	P121-V125 WeakPolarHBondContact O-CG2 3.36Å; P121-V125 PolarHBondContact O-N 2.91Å; L122-V125 WeakPolarHBondContact O-CA 3.44Å; L122-V125 WeakPolarHBondContact O-CB 3.31Å; L122-V125 PolarHBondContact O-N 3.43Å; S123-V125 VanDerWaalsContact C-N 3.32Å; S123-V125 PolarHBondContact O-N 3.25Å; V125-Y127 PolarHBondContact O-N 3.25Å; V125-T128 PolarHBondContact O-N 3.41Å; V125-T128 PolarHBondContact O-OG1 3.39Å; V125-L129 HydrophobicContact CG1-CB 4.45Å; V125-L129 WeakPolarHBondContact O-CB 3.37Å; V125-L129 PolarHBondContact O-N 2.99Å; V125-M462 HydrophobicContact CB-CG 4.18Å; V125-M462 HydrophobicContact CB-SD 3.97Å; V125-M462 HydrophobicContact CG1-CG 3.49Å; V125-M462 VanDerWaalsContact CG1-CG 3.49Å; V125-M462 HydrophobicContact CG1-SD 3.69Å; V125-I466 HydrophobicContact CG1-CD1 3.88Å; V125-I466 HydrophobicContact CG1-CG1 4.1Å; V125-I466 HydrophobicContact CG2-CD1 4.14Å; V125-I466 HydrophobicContact CG2-CG1 3.84Å; V125-W493 HydrophobicContact CG2-CH2 4.31Å; V125-W493 HydrophobicContact CG2-CZ2 3.62Å; V125-I497 HydrophobicContact CG2-CD1 4.04Å; V125-I497 HydrophobicContact CG2-CG1 4.43Å
126	E	98	Very high	96.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60.2	-47.6	-177.1	-67.4	-170.1	-153.8	0	0	112.9	L122 S123 T128 G130 A293 M294 A295 L296 F297 I298 S301 M462	L122-E126 PolarHBondContact O-N 3.07Å; S123-E126 PolarHBondContact O-N 2.98Å; E126-T128 PolarHBondContact O-N 2.85Å; E126-G130 PolarHBondContact O-N 3.31Å; E126-A293 WeakPolarHBondContact OE1-CA 3.07Å; E126-A293 PolarHBondContact OE1-N 3.16Å; E126-M294 PolarHBondContact OE1-N 3.44Å; E126-A295 VanDerWaalsContact CD-CA 3.5Å; E126-A295 PolarHBondContact OE1-N 2.93Å; E126-A295 VanDerWaalsContact OE2-C 3.28Å; E126-A295 WeakPolarHBondContact OE2-CA 3.44Å; E126-A295 PolarHBondContact OE2-N 3.38Å; E126-L296 PolarHBondContact OE2-N 2.96Å; E126-F297 HydrophobicContact CB-CB 3.76Å; E126-F297 HydrophobicContact CB-CD2 4.24Å; E126-F297 WeakPolarHBondContact OE2-CD2 3.3Å; E126-F297 PolarHBondContact OE2-N 3.48Å; E126-F297 VanDerWaalsContact OE2-N 3.13Å; E126-I298 HydrophobicContact CB-CG1 3.88Å; E126-I298 HydrophobicContact CG-CD1 4.37Å; E126-I298 HydrophobicContact CG-CG1 4.22Å; E126-I298 VanDerWaalsContact O-CG1 3.3Å; E126-I298 WeakPolarHBondContact O-CG1 3.37Å; E126-S301 PolarHBondContact O-OG 3.14Å; E126-M462 HydrophobicContact CG-CE 3.76Å; E126-M462 HydrophobicContact CG-SD 3.58Å; E126-M462 VanDerWaalsContact CG-SD 3.58Å
127	Y	97.5	Very high	96.1	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-64.7	-38.9	178.4	-82.7	-73.6	0	0	0	113	C78 S123 V125 R131 F297 S301 F304 L313	C78-Y127 VanDerWaalsContact CB-OH 3.29Å; C78-Y127 WeakPolarHBondContact CB-OH 3.44Å; C78-Y127 PolarHBondContact SG-OH 3.28Å; S123-Y127 VanDerWaalsContact O-CD2 3.26Å; S123-Y127 WeakPolarHBondContact O-CD2 3.37Å; S123-Y127 PolarHBondContact O-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.25Å; Y127-R131 WeakPolarHBondContact O-CB 3.35Å; Y127-R131 PolarHBondContact O-N 2.94Å; Y127-R131 VanDerWaalsContact O-N 3.15Å; Y127-F297 HydrophobicContact CD1-CB 4.27Å; Y127-F297 HydrophobicContact CD2-CB 4.01Å; Y127-F297 HydrophobicContact CD2-CD2 4.2Å; Y127-F297 HydrophobicContact CD2-CG 4.1Å; Y127-F297 HydrophobicContact CE1-CB 4.1Å; Y127-F297 HydrophobicContact CE1-CD1 4.26Å; Y127-F297 HydrophobicContact CE1-CG 4.34Å; Y127-F297 HydrophobicContact CE2-CB 3.8Å; Y127-F297 AromaticContact CE2-CD1 3.73Å; Y127-F297 HydrophobicContact CE2-CD1 3.73Å; Y127-F297 AromaticContact CE2-CD2 3.68Å; Y127-F297 HydrophobicContact CE2-CD2 3.68Å; Y127-F297 HydrophobicContact CE2-CE1 4.07Å; Y127-F297 HydrophobicContact CE2-CE2 4.02Å; Y127-F297 AromaticContact CE2-CG 3.47Å; Y127-F297 HydrophobicContact CE2-CG 3.47Å; Y127-F297 VanDerWaalsContact CE2-CG 3.47Å; Y127-F297 HydrophobicContact CE2-CZ 4.15Å; Y127-F297 HydrophobicContact CG-CB 4.23Å; Y127-F297 AromaticContact CZ-CD1 3.44Å; Y127-F297 VanDerWaalsContact CZ-CD1 3.44Å; Y127-F297 AromaticContact CZ-CE1 3.89Å; Y127-F297 AromaticContact CZ-CG 3.61Å; Y127-F297 WeakPolarHBondContact OH-CD1 3.46Å; Y127-F297 WeakPolarHBondContact OH-CE1 3.47Å; Y127-S301 WeakPolarHBondContact O-CB 3.38Å; Y127-S301 PolarHBondContact O-OG 3.47Å; Y127-F304 AromaticContact CD1-CE2 3.69Å; Y127-F304 HydrophobicContact CD1-CE2 3.69Å; Y127-F304 HydrophobicContact CD1-CZ 4.27Å; Y127-F304 AromaticContact CE1-CE2 3.96Å; Y127-F304 HydrophobicContact CE1-CE2 3.96Å; Y127-F304 HydrophobicContact CE1-CZ 4.09Å; Y127-L313 HydrophobicContact CD1-CB 4.14Å; Y127-L313 HydrophobicContact CE1-CB 3.95Å; Y127-L313 HydrophobicContact CE1-CD1 4.36Å; Y127-L313 HydrophobicContact CE2-CB 4.42Å; Y127-L313 HydrophobicContact CG-CB 4.44Å
128	T	97.7	Very high	96.1	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-77.3	-38.7	-178.2	52.9	0	0	0	0	111.6	I124 V125 E126 F132 A310 Y474 V479	I124-T128 HydrophobicContact CG2-CG2 4.2Å; I124-T128 WeakPolarHBondContact O-CB 3.4Å; I124-T128 VanDerWaalsContact O-CG2 3.27Å; I124-T128 WeakPolarHBondContact O-CG2 3.43Å; I124-T128 PolarHBondContact O-N 3.18Å; I124-T128 PolarHBondContact O-OG1 2.87Å; V125-T128 PolarHBondContact O-N 3.41Å; V125-T128 PolarHBondContact O-OG1 3.39Å; E126-T128 PolarHBondContact O-N 2.85Å; T128-F132 WeakPolarHBondContact O-CB 3.3Å; T128-F132 PolarHBondContact O-N 3.41Å; T128-A310 HydrophobicContact CG2-CB 3.75Å; T128-Y474 PolarHBondContact OG1-OH 3.5Å; T128-V479 HydrophobicContact CG2-CB 4.32Å; T128-V479 HydrophobicContact CG2-CG1 3.81Å; T128-V479 HydrophobicContact CG2-CG2 3.84Å
129	L	96.5	Very high	95.9	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-67	-45.7	177.9	-166.4	67.2	0	0	0	111.7	V125 T133 A140 F144 I298 L465 Y474	V125-L129 HydrophobicContact CG1-CB 4.45Å; V125-L129 WeakPolarHBondContact O-CB 3.37Å; V125-L129 PolarHBondContact O-N 2.99Å; L129-T133 HydrophobicContact CD1-CG2 4.2Å; L129-T133 WeakPolarHBondContact O-CB 3.4Å; L129-T133 WeakPolarHBondContact O-CG2 3.19Å; L129-T133 PolarHBondContact O-N 2.92Å; L129-T133 PolarHBondContact O-OG1 3.09Å; L129-A140 HydrophobicContact CD1-CB 4.03Å; L129-A140 HydrophobicContact CD2-CB 3.61Å; L129-A140 HydrophobicContact CG-CB 3.64Å; L129-F144 HydrophobicContact CD1-CD2 3.8Å; L129-F144 HydrophobicContact CD1-CE2 3.35Å; L129-F144 HydrophobicContact CD1-CZ 3.81Å; L129-I298 HydrophobicContact CD2-CD1 3.9Å; L129-L465 HydrophobicContact CD1-CD2 4.36Å; L129-L465 HydrophobicContact CD2-CD1 4.4Å; L129-Y474 HydrophobicContact CD1-CE2 4.5Å; L129-Y474 PolarHBondContact N-OH 2.99Å
130	G	95.6	Very high	95.9	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-66.4	-46.1	176.2	0	0	0	0	0	111.8	E126 F132 R134 S301 S302	E126-G130 PolarHBondContact O-N 3.31Å; G130-F132 VanDerWaalsContact C-N 3.3Å; G130-F132 PolarHBondContact O-N 2.95Å; G130-R134 WeakPolarHBondContact O-CA 3.31Å; G130-R134 PolarHBondContact O-N 2.95Å; G130-S301 CarbonylContact C-O 3.6Å; G130-S301 VanDerWaalsContact CA-OG 3.22Å; G130-S301 WeakPolarHBondContact CA-OG 3.47Å; G130-S302 WeakPolarHBondContact O-CA 3.49Å
131	R	94.5	Very high	95.8	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-58.1	-39.5	176.4	-176.3	177.3	67.2	105.8	2.2	113.3	Y127 S301 F304 S305 R306 N308 A310 F482 G483	Y127-R131 WeakPolarHBondContact O-CB 3.35Å; Y127-R131 PolarHBondContact O-N 2.94Å; Y127-R131 VanDerWaalsContact O-N 3.15Å; R131-S301 WeakPolarHBondContact CA-O 3.33Å; R131-S301 PolarHBondContact N-O 3.32Å; R131-S301 PolarHBondContact N-OG 2.89Å; R131-F304 HydrophobicContact CB-CB 4.16Å; R131-F304 HydrophobicContact CG-CB 3.84Å; R131-S305 WeakPolarHBondContact CD-O 3.25Å; R131-R306 PolarHBondContact NH1-O 3.32Å; R131-R306 VanDerWaalsContact NH1-O 3.07Å; R131-N308 VanDerWaalsContact CD-O 3.31Å; R131-N308 WeakPolarHBondContact CD-O 3.49Å; R131-A310 VanDerWaalsContact NE-CB 3.33Å; R131-F482 HydrophobicContact CG-CE1 4.27Å; R131-G483 VanDerWaalsContact NH1-CA 3.29Å
132	F	94.5	Very high	95.6	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-77.3	-49.5	-178.6	-174.9	-90.3	0	0	0	111.9	T128 G130 F144 I478 F482 Y568 P570 P573	T128-F132 WeakPolarHBondContact O-CB 3.3Å; T128-F132 PolarHBondContact O-N 3.41Å; G130-F132 VanDerWaalsContact C-N 3.3Å; G130-F132 PolarHBondContact O-N 2.95Å; F132-F144 HydrophobicContact CD1-CE2 4.3Å; F132-F144 HydrophobicContact CD1-CZ 4.31Å; F132-I478 HydrophobicContact CB-CG2 3.94Å; F132-I478 HydrophobicContact CD1-CD1 4.3Å; F132-I478 HydrophobicContact CD1-CG2 4.22Å; F132-I478 HydrophobicContact CD2-CD1 4.13Å; F132-I478 HydrophobicContact CD2-CG2 3.84Å; F132-I478 HydrophobicContact CE1-CD1 3.84Å; F132-I478 HydrophobicContact CE2-CD1 3.64Å; F132-I478 HydrophobicContact CE2-CG2 4.44Å; F132-I478 HydrophobicContact CG-CD1 4.44Å; F132-I478 HydrophobicContact CG-CG2 3.72Å; F132-I478 HydrophobicContact CZ-CD1 3.49Å; F132-I478 VanDerWaalsContact CZ-CD1 3.49Å; F132-F482 HydrophobicContact CB-CE1 4.3Å; F132-F482 HydrophobicContact CD2-CB 4.4Å; F132-F482 AromaticContact CD2-CD1 3.79Å; F132-F482 HydrophobicContact CD2-CD1 3.79Å; F132-F482 AromaticContact CD2-CD2 3.74Å; F132-F482 HydrophobicContact CD2-CD2 3.74Å; F132-F482 AromaticContact CD2-CE1 3.93Å; F132-F482 HydrophobicContact CD2-CE1 3.93Å; F132-F482 AromaticContact CD2-CE2 3.87Å; F132-F482 HydrophobicContact CD2-CE2 3.87Å; F132-F482 AromaticContact CD2-CG 3.71Å; F132-F482 HydrophobicContact CD2-CG 3.71Å; F132-F482 AromaticContact CD2-CZ 3.97Å; F132-F482 HydrophobicContact CD2-CZ 3.97Å; F132-F482 AromaticContact CE2-CD2 3.81Å; F132-F482 HydrophobicContact CE2-CD2 3.81Å; F132-F482 HydrophobicContact CE2-CE2 4.04Å; F132-F482 HydrophobicContact CE2-CG 4.14Å; F132-Y568 HydrophobicContact CE2-CG 4.42Å; F132-Y568 VanDerWaalsContact CZ-CB 3.49Å; F132-Y568 WeakPolarHBondContact O-CD2 3.33Å; F132-Y568 PolarHBondContact O-N 3.23Å; F132-P570 HydrophobicContact CE1-CB 3.94Å; F132-P570 HydrophobicContact CZ-CB 4.48Å; F132-P573 HydrophobicContact CZ-CB 4.36Å
133	T	93.1	Very high	95.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-84.1	-23.9	-172.7	62.7	0	0	0	0	113.8	L129 T135 A140 R143 F144	L129-T133 HydrophobicContact CD1-CG2 4.2Å; L129-T133 WeakPolarHBondContact O-CB 3.4Å; L129-T133 WeakPolarHBondContact O-CG2 3.19Å; L129-T133 PolarHBondContact O-N 2.92Å; L129-T133 PolarHBondContact O-OG1 3.09Å; T133-T135 WeakPolarHBondContact CB-OG1 3.31Å; T133-T135 WeakPolarHBondContact O-CG2 3.44Å; T133-T135 PolarHBondContact O-N 3.4Å; T133-T135 PolarHBondContact OG1-N 3.26Å; T133-T135 PolarHBondContact OG1-OG1 2.64Å; T133-T135 VanDerWaalsContact OG1-OG1 3.07Å; T133-A140 HydrophobicContact CG2-CB 4.15Å; T133-R143 VanDerWaalsContact O-CZ 3.27Å; T133-R143 PolarHBondContact O-NH1 3.28Å; T133-R143 VanDerWaalsContact O-NH1 3.13Å; T133-F144 HydrophobicContact CG2-CD2 4.2Å; T133-F144 HydrophobicContact CG2-CE2 3.64Å
134	R	93	Very high	95.2	Very high	34 Å²	34	8 Å²	8	13%	0.128	4%	0.035	C	C	.	.			trans	51.2	34.2	-170.4	-58.3	-167.8	168.5	137.6	5.5	113.9	G130 S302 F304 N566 D579 E580	G130-R134 WeakPolarHBondContact O-CA 3.31Å; G130-R134 PolarHBondContact O-N 2.95Å; R134-S302 WeakPolarHBondContact CB-O 3.35Å; R134-S302 WeakPolarHBondContact CG-O 3.47Å; R134-F304 PolarHBondContact NE-O 3.05Å; R134-F304 PolarHBondContact NH2-O 2.92Å; R134-N566 HydrophobicContact CB-CB 4.34Å; R134-D579 WeakPolarHBondContact CD-OD2 3.46Å; R134-D579 IonicContact CZ-OD2 3.64Å; R134-D579 IonicContact NE-OD2 3.63Å; R134-D579 IonicContact NH1-OD2 2.77Å; R134-D579 PolarHBondContact NH1-OD2 3.38Å; R134-E580 IonicContact CZ-OE1 3.29Å; R134-E580 IonicContact NH1-OE1 2.81Å; R134-E580 IonicContact NH2-OE1 3.63Å; R134-E580 PolarHBondContact NH2-OE1 3.36Å
135	T	92.3	Very high	95	Very high	8 Å²	8	9.2 Å²	9.2	5%	0.049	4%	0.041	C	C	.	.	S	Bend	trans	-134.5	170.5	-179.5	59.1	0	0	0	0	111.5	T133 G139 A140 I298	T133-T135 WeakPolarHBondContact CB-OG1 3.31Å; T133-T135 WeakPolarHBondContact O-CG2 3.44Å; T133-T135 PolarHBondContact O-N 3.4Å; T133-T135 PolarHBondContact OG1-N 3.26Å; T133-T135 PolarHBondContact OG1-OG1 2.64Å; T133-T135 VanDerWaalsContact OG1-OG1 3.07Å; T135-G139 VanDerWaalsContact OG1-C 3.27Å; T135-A140 PolarHBondContact OG1-N 3.36Å; T135-A140 VanDerWaalsContact OG1-N 3.16Å; T135-I298 WeakPolarHBondContact O-CG2 3.42Å
136	S	95	Very high	94.7	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.056	C	C	.	.			trans	-69	173	167	73.8	0	0	0	0	112.3	L138 G139 A140 T411 D414	S136-L138 PolarHBondContact O-N 3.31Å; S136-L138 PolarHBondContact OG-N 3.33Å; S136-G139 PolarHBondContact O-N 2.99Å; S136-G139 VanDerWaalsContact O-N 3.08Å; S136-A140 PolarHBondContact O-N 2.9Å; S136-T411 WeakPolarHBondContact CB-OG1 3.44Å; S136-T411 PolarHBondContact OG-OG1 3.03Å; S136-D414 WeakPolarHBondContact CA-OD2 3.32Å; S136-D414 WeakPolarHBondContact CB-OD2 3.13Å; S136-D414 PolarHBondContact N-OD2 2.79Å; S136-D414 PolarHBondContact OG-OD2 3.28Å
137	P	95.9	Very high	94.3	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-53.2	-36.2	174.5	-29.4	37.3	0	0	0	114.1	G139 A140 F141 I156 V157 A295 I298 L407	P137-G139 PolarHBondContact O-N 3.32Å; P137-A140 PolarHBondContact O-N 2.61Å; P137-F141 WeakPolarHBondContact O-CD2 3.47Å; P137-F141 PolarHBondContact O-N 3.3Å; P137-I156 HydrophobicContact CB-CB 4.37Å; P137-I156 HydrophobicContact CB-CG2 4.49Å; P137-I156 HydrophobicContact CG-CG2 4.26Å; P137-V157 HydrophobicContact CB-CG2 4.03Å; P137-V157 HydrophobicContact CG-CG2 3.83Å; P137-A295 HydrophobicContact CG-CB 3.28Å; P137-I298 HydrophobicContact CG-CD1 4.04Å; P137-L407 HydrophobicContact CG-CD1 4.23Å
138	L	94.4	Very high	94	Very high	23 Å²	23	21 Å²	21	12%	0.12	10%	0.104	C	C	.	.	H	α-helix	trans	-61.8	-48.1	177.8	-75.1	71.4	0	0	0	110.4	S136 A140 F141 H142 V150 V157 T411 F560	S136-L138 PolarHBondContact O-N 3.31Å; S136-L138 PolarHBondContact OG-N 3.33Å; L138-A140 VanDerWaalsContact C-N 3.34Å; L138-F141 PolarHBondContact O-N 3.04Å; L138-H142 WeakPolarHBondContact O-CB 3.26Å; L138-H142 PolarHBondContact O-N 2.96Å; L138-V150 HydrophobicContact CB-CG1 4.03Å; L138-V150 HydrophobicContact CG-CG1 4.26Å; L138-V157 HydrophobicContact CD1-CB 3.85Å; L138-V157 HydrophobicContact CD1-CG2 3.37Å; L138-T411 HydrophobicContact CD1-CG2 3.76Å; L138-T411 HydrophobicContact CD2-CG2 4.09Å; L138-T411 HydrophobicContact CG-CG2 4.49Å; L138-F560 VanDerWaalsContact C-CZ 3.43Å; L138-F560 HydrophobicContact CB-CE1 4.36Å; L138-F560 HydrophobicContact CB-CZ 3.82Å
139	G	92.9	Very high	93.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.6	-37.2	178.3	0	0	0	0	0	112.6	T135 S136 P137 H142 R143 F560	T135-G139 VanDerWaalsContact OG1-C 3.27Å; S136-G139 PolarHBondContact O-N 2.99Å; S136-G139 VanDerWaalsContact O-N 3.08Å; P137-G139 PolarHBondContact O-N 3.32Å; G139-H142 WeakPolarHBondContact O-CB 3.15Å; G139-H142 PolarHBondContact O-N 3.29Å; G139-R143 WeakPolarHBondContact O-CG 3.33Å; G139-R143 PolarHBondContact O-N 2.83Å; G139-F560 VanDerWaalsContact CA-CE1 3.46Å
140	A	94.8	Very high	93.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.6	-46	177.1	0	0	0	0	0	112.2	L129 T133 T135 S136 P137 L138 H142 R143 F144	L129-A140 HydrophobicContact CD1-CB 4.03Å; L129-A140 HydrophobicContact CD2-CB 3.61Å; L129-A140 HydrophobicContact CG-CB 3.64Å; T133-A140 HydrophobicContact CG2-CB 4.15Å; T135-A140 PolarHBondContact OG1-N 3.36Å; T135-A140 VanDerWaalsContact OG1-N 3.16Å; S136-A140 PolarHBondContact O-N 2.9Å; P137-A140 PolarHBondContact O-N 2.61Å; L138-A140 VanDerWaalsContact C-N 3.34Å; A140-H142 VanDerWaalsContact C-N 3.33Å; A140-H142 PolarHBondContact O-N 3.3Å; A140-R143 PolarHBondContact O-N 3.36Å; A140-F144 VanDerWaalsContact O-CD2 3.31Å; A140-F144 WeakPolarHBondContact O-CD2 3Å; A140-F144 PolarHBondContact O-N 3.03Å
141	F	95.6	Very high	93.8	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-38.1	176.1	-86.2	-104.5	0	0	0	111.9	P137 L138 L145 L152 I156 L465	P137-F141 WeakPolarHBondContact O-CD2 3.47Å; P137-F141 PolarHBondContact O-N 3.3Å; L138-F141 PolarHBondContact O-N 3.04Å; F141-L145 HydrophobicContact CD1-CD1 4.01Å; F141-L145 HydrophobicContact CE1-CD1 4.36Å; F141-L145 WeakPolarHBondContact O-CB 3.27Å; F141-L145 PolarHBondContact O-N 3.08Å; F141-L152 HydrophobicContact CD1-CB 3.53Å; F141-L152 HydrophobicContact CD1-CD1 4.21Å; F141-L152 HydrophobicContact CE1-CB 3.37Å; F141-L152 HydrophobicContact CE1-CD1 3.91Å; F141-L152 HydrophobicContact CE1-CG 4.28Å; F141-L152 HydrophobicContact CG-CB 4.41Å; F141-L152 HydrophobicContact CZ-CB 4.13Å; F141-I156 HydrophobicContact CE2-CD1 3.64Å; F141-I156 HydrophobicContact CZ-CD1 3.91Å; F141-L465 HydrophobicContact CB-CD1 4.49Å; F141-L465 HydrophobicContact CD1-CD1 3.89Å; F141-L465 HydrophobicContact CD2-CD1 3.57Å; F141-L465 HydrophobicContact CE1-CB 3.93Å; F141-L465 HydrophobicContact CE1-CD1 3.92Å; F141-L465 HydrophobicContact CE1-CG 4.48Å; F141-L465 HydrophobicContact CE2-CD1 3.63Å; F141-L465 HydrophobicContact CG-CD1 3.73Å; F141-L465 HydrophobicContact CZ-CB 3.92Å; F141-L465 HydrophobicContact CZ-CD1 3.81Å
142	H	93.8	Very high	93.9	Very high	40 Å²	40	27.6 Å²	27.6	19%	0.185	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-49.9	173.2	170.1	80.8	0	0	0	112.3	L138 G139 A140 G146 N147 V150 D558 F560	L138-H142 WeakPolarHBondContact O-CB 3.26Å; L138-H142 PolarHBondContact O-N 2.96Å; G139-H142 WeakPolarHBondContact O-CB 3.15Å; G139-H142 PolarHBondContact O-N 3.29Å; A140-H142 VanDerWaalsContact C-N 3.33Å; A140-H142 PolarHBondContact O-N 3.3Å; H142-G146 WeakPolarHBondContact O-CA 3.49Å; H142-G146 PolarHBondContact O-N 3.44Å; H142-N147 PolarHBondContact CE1-OD1 3.45Å; H142-N147 PolarHBondContact ND1-OD1 3.32Å; H142-V150 HydrophobicContact CB-CG2 3.82Å; H142-D558 IonicContact CE1-OD1 3.58Å; H142-F560 HydrophobicContact CB-CD2 3.77Å; H142-F560 HydrophobicContact CB-CE2 3.37Å; H142-F560 HydrophobicContact CB-CZ 4.1Å; H142-F560 AromaticContact CD2-CD2 3.58Å; H142-F560 AromaticContact CE1-CD2 3.91Å; H142-F560 AromaticContact CG-CD2 3.38Å; H142-F560 AromaticContact CG-CE2 3.54Å; H142-F560 AromaticContact ND1-CD2 3.61Å; H142-F560 AromaticContact ND1-CE2 3.91Å; H142-F560 AromaticContact NE2-CD2 3.93Å
143	R	92	Very high	94	Very high	49 Å²	49	27.6 Å²	27.6	19%	0.185	13%	0.134	C	C	.	.	H	α-helix	trans	-66.8	-41.3	-177.8	-71.1	178.5	-171.4	-142.6	0.8	113.1	T133 G139 A140 N566 G567 Y568 P570 H571	T133-R143 VanDerWaalsContact O-CZ 3.27Å; T133-R143 PolarHBondContact O-NH1 3.28Å; T133-R143 VanDerWaalsContact O-NH1 3.13Å; G139-R143 WeakPolarHBondContact O-CG 3.33Å; G139-R143 PolarHBondContact O-N 2.83Å; A140-R143 PolarHBondContact O-N 3.36Å; R143-N566 VanDerWaalsContact CZ-O 3.25Å; R143-N566 PolarHBondContact NH1-O 3.04Å; R143-N566 PolarHBondContact NH2-O 3.15Å; R143-G567 PolarHBondContact NH1-O 3.12Å; R143-Y568 PolarHBondContact NH1-O 2.89Å; R143-P570 HydrophobicContact CB-CG 4.25Å; R143-P570 WeakPolarHBondContact O-CG 3.41Å; R143-H571 PolarHBondContact O-CD2 3.07Å; R143-H571 PolarHBondContact O-NE2 3.28Å
144	F	94.7	Very high	94.2	Very high	5 Å²	5	28 Å²	28	2%	0.022	14%	0.138	C	C	.	.	H	α-helix	trans	-76.7	-41.8	-177.6	-84.1	-99.9	0	0	0	112.5	L129 F132 T133 A140 L465 Y469 Y474 I478 P570 H571	L129-F144 HydrophobicContact CD1-CD2 3.8Å; L129-F144 HydrophobicContact CD1-CE2 3.35Å; L129-F144 HydrophobicContact CD1-CZ 3.81Å; F132-F144 HydrophobicContact CD1-CE2 4.3Å; F132-F144 HydrophobicContact CD1-CZ 4.31Å; T133-F144 HydrophobicContact CG2-CD2 4.2Å; T133-F144 HydrophobicContact CG2-CE2 3.64Å; A140-F144 VanDerWaalsContact O-CD2 3.31Å; A140-F144 WeakPolarHBondContact O-CD2 3Å; A140-F144 PolarHBondContact O-N 3.03Å; F144-L465 HydrophobicContact CB-CD1 4.2Å; F144-L465 HydrophobicContact CB-CD2 4.2Å; F144-L465 HydrophobicContact CB-CG 4.16Å; F144-L465 HydrophobicContact CD1-CD2 3.91Å; F144-L465 HydrophobicContact CE1-CD2 4.48Å; F144-L465 HydrophobicContact CG-CD2 3.97Å; F144-L465 HydrophobicContact CG-CG 4.46Å; F144-Y469 HydrophobicContact CD1-CD1 4.17Å; F144-Y469 AromaticContact CD1-CD2 3.57Å; F144-Y469 HydrophobicContact CD1-CD2 3.57Å; F144-Y469 HydrophobicContact CD1-CE2 4.07Å; F144-Y469 AromaticContact CD1-CG 3.63Å; F144-Y469 HydrophobicContact CD1-CG 3.63Å; F144-Y469 AromaticContact CE1-CD1 3.96Å; F144-Y469 HydrophobicContact CE1-CD1 3.96Å; F144-Y469 AromaticContact CE1-CD2 3.99Å; F144-Y469 HydrophobicContact CE1-CD2 3.99Å; F144-Y469 HydrophobicContact CE1-CE1 4.08Å; F144-Y469 HydrophobicContact CE1-CE2 4.13Å; F144-Y469 AromaticContact CE1-CG 3.91Å; F144-Y469 HydrophobicContact CE1-CG 3.91Å; F144-Y474 AromaticContact CE1-CD2 3.81Å; F144-Y474 HydrophobicContact CE1-CD2 3.81Å; F144-Y474 AromaticContact CE1-CE2 3.74Å; F144-Y474 HydrophobicContact CE1-CE2 3.74Å; F144-Y474 HydrophobicContact CZ-CD2 4.32Å; F144-Y474 AromaticContact CZ-CE2 3.83Å; F144-Y474 HydrophobicContact CZ-CE2 3.83Å; F144-I478 HydrophobicContact CE1-CD1 4.47Å; F144-I478 HydrophobicContact CE1-CG1 4.25Å; F144-I478 HydrophobicContact CZ-CD1 4.25Å; F144-I478 HydrophobicContact CZ-CG1 4.23Å; F144-I478 HydrophobicContact CZ-CG2 4.19Å; F144-P570 HydrophobicContact CB-CG 4.43Å; F144-P570 HydrophobicContact CD1-CB 3.86Å; F144-P570 HydrophobicContact CD1-CG 4.01Å; F144-P570 HydrophobicContact CD2-CB 4.13Å; F144-P570 HydrophobicContact CD2-CG 3.7Å; F144-P570 HydrophobicContact CE1-CB 3.53Å; F144-P570 HydrophobicContact CE1-CG 4.12Å; F144-P570 HydrophobicContact CE2-CB 3.82Å; F144-P570 HydrophobicContact CE2-CG 3.82Å; F144-P570 HydrophobicContact CG-CB 4.16Å; F144-P570 HydrophobicContact CG-CG 3.81Å; F144-P570 HydrophobicContact CZ-CB 3.52Å; F144-P570 HydrophobicContact CZ-CG 4.04Å; F144-H571 PolarHBondContact O-NE2 3.29Å
145	L	94.5	Very high	94.4	Very high	33 Å²	33	26.4 Å²	26.4	17%	0.173	13%	0.132	C	C	.	.	H	α-helix	trans	-124.1	-3.5	-165.2	-51.1	-177.6	0	0	0	114.5	F141 L149 L465 I468	F141-L145 HydrophobicContact CD1-CD1 4.01Å; F141-L145 HydrophobicContact CE1-CD1 4.36Å; F141-L145 WeakPolarHBondContact O-CB 3.27Å; F141-L145 PolarHBondContact O-N 3.08Å; L145-L149 HydrophobicContact CB-CB 4.07Å; L145-L149 HydrophobicContact CB-CD1 3.98Å; L145-L149 HydrophobicContact CD1-CB 4.29Å; L145-L149 HydrophobicContact CD1-CD1 3.82Å; L145-L149 HydrophobicContact CG-CD1 4.49Å; L145-L465 HydrophobicContact CD1-CB 4.27Å; L145-L465 HydrophobicContact CD1-CG 4.19Å; L145-L465 HydrophobicContact CG-CG 4.35Å; L145-I468 HydrophobicContact CD1-CD1 4.19Å; L145-I468 HydrophobicContact CD2-CB 3.93Å; L145-I468 HydrophobicContact CD2-CG2 3.59Å
146	G	91.5	Very high	94.7	Very high	29 Å²	29	26 Å²	26	30%	0.299	13%	0.13	S	C	.	.			trans	80.7	179.8	179.2	0	0	0	0	0	115.1	H142 K148 L149	H142-G146 WeakPolarHBondContact O-CA 3.49Å; H142-G146 PolarHBondContact O-N 3.44Å; G146-K148 PolarHBondContact O-N 3.05Å; G146-K148 VanDerWaalsContact O-N 3.09Å; G146-L149 PolarHBondContact O-N 2.97Å
147	N	90.5	Very high	94.8	Very high	59 Å²	59	26.8 Å²	26.8	32%	0.316	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-59.5	-24.4	-172.8	-72.3	-23.4	0	0	0	115.1	H142 L149 N549 V553	H142-N147 PolarHBondContact CE1-OD1 3.45Å; H142-N147 PolarHBondContact ND1-OD1 3.32Å; N147-L149 VanDerWaalsContact C-N 3.28Å; N147-L149 PolarHBondContact O-N 3.48Å; N147-N549 PolarHBondContact O-ND2 2.97Å; N147-N549 PolarHBondContact O-OD1 3.09Å; N147-V553 HydrophobicContact CB-CG2 4.11Å
148	K	92.1	Very high	94.9	Very high	160 Å²	160	27.8 Å²	27.8	70%	0.696	14%	0.142	S	C	*	.	G	3₁₀ helix	trans	-71.5	-22.4	-175.7	-64.9	-176.8	-179	179.3	0	113.4	G146 N549	G146-K148 PolarHBondContact O-N 3.05Å; G146-K148 VanDerWaalsContact O-N 3.09Å; K148-N549 PolarHBondContact O-ND2 2.71Å; K148-N549 VanDerWaalsContact O-ND2 3.1Å
149	L	94.5	Very high	95	Very high	50 Å²	50	26.7 Å²	26.7	26%	0.262	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-117.8	12.2	-171.8	-66.6	-176.9	0	0	0	114	L145 G146 N147 W151 L152 I468	L145-L149 HydrophobicContact CB-CB 4.07Å; L145-L149 HydrophobicContact CB-CD1 3.98Å; L145-L149 HydrophobicContact CD1-CB 4.29Å; L145-L149 HydrophobicContact CD1-CD1 3.82Å; L145-L149 HydrophobicContact CG-CD1 4.49Å; G146-L149 PolarHBondContact O-N 2.97Å; N147-L149 VanDerWaalsContact C-N 3.28Å; N147-L149 PolarHBondContact O-N 3.48Å; L149-W151 PolarHBondContact O-N 3.26Å; L149-L152 HydrophobicContact CB-CD1 4.28Å; L149-L152 HydrophobicContact CD2-CD1 4.15Å; L149-L152 WeakPolarHBondContact O-CB 3.31Å; L149-L152 PolarHBondContact O-N 3.11Å; L149-L152 VanDerWaalsContact O-N 3.14Å; L149-I468 HydrophobicContact CD1-CD1 4.43Å
150	V	94.6	Very high	95.1	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.024	14%	0.137	C	C	.	.	H	α-helix	trans	-60.5	-31.3	177.3	-179.1	0	0	0	0	112.1	L138 H142 L152 G153 G154 F559 F560	L138-V150 HydrophobicContact CB-CG1 4.03Å; L138-V150 HydrophobicContact CG-CG1 4.26Å; H142-V150 HydrophobicContact CB-CG2 3.82Å; V150-L152 PolarHBondContact O-N 2.93Å; V150-L152 VanDerWaalsContact O-N 3.16Å; V150-G153 WeakPolarHBondContact O-CA 3.42Å; V150-G153 PolarHBondContact O-N 3.39Å; V150-G154 PolarHBondContact O-N 3.07Å; V150-F559 HydrophobicContact CG1-CD2 4.43Å; V150-F560 HydrophobicContact CG1-CE2 4.19Å; V150-F560 HydrophobicContact CG1-CZ 4.28Å; V150-F560 HydrophobicContact CG2-CE2 4.38Å
151	W	95.9	Very high	95.2	Very high	59 Å²	59	28 Å²	28	22%	0.223	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-25.7	177.4	71.5	-91.3	0	0	0	113.7	L149 G154 W155 F542 L545 I546 N549	L149-W151 PolarHBondContact O-N 3.26Å; W151-G154 CarbonylContact O-C 3.44Å; W151-G154 WeakPolarHBondContact O-CA 3.37Å; W151-G154 PolarHBondContact O-N 2.99Å; W151-W155 PolarHBondContact O-N 3.16Å; W151-F542 AromaticContact CZ3-CD1 3.87Å; W151-F542 HydrophobicContact CZ3-CD1 3.87Å; W151-F542 AromaticContact CZ3-CE1 3.95Å; W151-F542 HydrophobicContact CZ3-CE1 3.95Å; W151-L545 HydrophobicContact CB-CB 4.19Å; W151-I546 HydrophobicContact CD2-CG1 3.83Å; W151-I546 HydrophobicContact CE3-CD1 4.41Å; W151-I546 HydrophobicContact CE3-CG1 3.89Å; W151-I546 HydrophobicContact CG-CG1 4.22Å; W151-I546 HydrophobicContact CH2-CD1 4.43Å; W151-I546 HydrophobicContact CZ3-CD1 4.32Å; W151-I546 HydrophobicContact CZ3-CG1 4.31Å; W151-N549 HydrophobicContact CB-CB 3.9Å
152	L	97	Very high	95.1	Very high	26 Å²	26	29.4 Å²	29.4	14%	0.136	15%	0.149	C	C	.	.	H	α-helix	trans	-69.2	-40.8	173.7	-70.8	171.4	0	0	0	111.4	F141 L149 V150 G154 W155 I156	F141-L152 HydrophobicContact CD1-CB 3.53Å; F141-L152 HydrophobicContact CD1-CD1 4.21Å; F141-L152 HydrophobicContact CE1-CB 3.37Å; F141-L152 HydrophobicContact CE1-CD1 3.91Å; F141-L152 HydrophobicContact CE1-CG 4.28Å; F141-L152 HydrophobicContact CG-CB 4.41Å; F141-L152 HydrophobicContact CZ-CB 4.13Å; L149-L152 HydrophobicContact CB-CD1 4.28Å; L149-L152 HydrophobicContact CD2-CD1 4.15Å; L149-L152 WeakPolarHBondContact O-CB 3.31Å; L149-L152 PolarHBondContact O-N 3.11Å; L149-L152 VanDerWaalsContact O-N 3.14Å; V150-L152 PolarHBondContact O-N 2.93Å; V150-L152 VanDerWaalsContact O-N 3.16Å; L152-G154 VanDerWaalsContact C-N 3.28Å; L152-W155 WeakPolarHBondContact O-CB 3.42Å; L152-W155 PolarHBondContact O-N 3.41Å; L152-I156 WeakPolarHBondContact O-CG1 3.33Å; L152-I156 PolarHBondContact O-N 3.38Å
153	G	96.8	Very high	95.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-38.7	169	0	0	0	0	0	111.3	V150 W155 I156 V157	V150-G153 WeakPolarHBondContact O-CA 3.42Å; V150-G153 PolarHBondContact O-N 3.39Å; G153-W155 VanDerWaalsContact C-N 3.32Å; G153-W155 PolarHBondContact O-N 2.99Å; G153-I156 PolarHBondContact O-N 2.98Å; G153-V157 PolarHBondContact O-N 2.93Å; G153-V157 VanDerWaalsContact O-N 3.13Å
154	G	97	Very high	95.4	Very high	7 Å²	7	25.2 Å²	25.2	7%	0.072	13%	0.132	C	C	.	.	H	α-helix	trans	-58.1	-40.1	172.6	0	0	0	0	0	113.4	V150 W151 L152 V157 A158	V150-G154 PolarHBondContact O-N 3.07Å; W151-G154 CarbonylContact O-C 3.44Å; W151-G154 WeakPolarHBondContact O-CA 3.37Å; W151-G154 PolarHBondContact O-N 2.99Å; L152-G154 VanDerWaalsContact C-N 3.28Å; G154-V157 PolarHBondContact O-N 3.42Å; G154-A158 VanDerWaalsContact O-CB 3.28Å; G154-A158 WeakPolarHBondContact O-CB 3.46Å; G154-A158 PolarHBondContact O-N 3Å
155	W	97.8	Very high	95.5	Very high	1 Å²	1	25.1 Å²	25.1	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-61.5	-48.4	176.3	169.6	-91.9	0	0	0	111.2	W151 L152 G153 V157 A158 V159 A454 L457 S458 W538 V541 F542 L545	W151-W155 PolarHBondContact O-N 3.16Å; L152-W155 WeakPolarHBondContact O-CB 3.42Å; L152-W155 PolarHBondContact O-N 3.41Å; G153-W155 VanDerWaalsContact C-N 3.32Å; G153-W155 PolarHBondContact O-N 2.99Å; W155-V157 VanDerWaalsContact C-N 3.31Å; W155-V157 PolarHBondContact O-N 3Å; W155-A158 PolarHBondContact O-N 2.98Å; W155-V159 HydrophobicContact CD2-CG2 4.01Å; W155-V159 HydrophobicContact CG-CG2 4.45Å; W155-V159 HydrophobicContact CH2-CG2 4.28Å; W155-V159 HydrophobicContact CZ2-CG2 3.69Å; W155-V159 WeakPolarHBondContact O-CG2 3.43Å; W155-V159 PolarHBondContact O-N 3.09Å; W155-A454 HydrophobicContact CH2-CB 4.37Å; W155-A454 HydrophobicContact CZ2-CB 3.83Å; W155-L457 HydrophobicContact CH2-CD1 4.13Å; W155-L457 HydrophobicContact CZ2-CB 3.84Å; W155-L457 HydrophobicContact CZ2-CD1 3.61Å; W155-L457 HydrophobicContact CZ2-CG 4.35Å; W155-S458 PolarHBondContact NE1-OG 2.91Å; W155-W538 HydrophobicContact CH2-CB 3.98Å; W155-W538 HydrophobicContact CH2-CD2 4.45Å; W155-W538 AromaticContact CH2-CG 3.93Å; W155-W538 HydrophobicContact CH2-CG 3.93Å; W155-W538 HydrophobicContact CZ3-CB 4.47Å; W155-V541 HydrophobicContact CE3-CG1 4.06Å; W155-V541 HydrophobicContact CZ3-CB 4.27Å; W155-V541 HydrophobicContact CZ3-CG1 4.12Å; W155-F542 HydrophobicContact CD2-CD1 4.43Å; W155-F542 AromaticContact CD2-CE1 3.71Å; W155-F542 HydrophobicContact CD2-CE1 3.71Å; W155-F542 AromaticContact CD2-CZ 3.9Å; W155-F542 HydrophobicContact CD2-CZ 3.9Å; W155-F542 AromaticContact CE3-CD1 3.69Å; W155-F542 HydrophobicContact CE3-CD1 3.69Å; W155-F542 HydrophobicContact CE3-CD2 4.38Å; W155-F542 AromaticContact CE3-CE1 3.36Å; W155-F542 HydrophobicContact CE3-CE1 3.36Å; W155-F542 HydrophobicContact CE3-CE2 4.11Å; W155-F542 HydrophobicContact CE3-CG 4.18Å; W155-F542 AromaticContact CE3-CZ 3.59Å; W155-F542 HydrophobicContact CE3-CZ 3.59Å; W155-F542 HydrophobicContact CG-CE1 4.36Å; W155-F542 HydrophobicContact CH2-CD2 4.24Å; W155-F542 HydrophobicContact CH2-CE1 4.22Å; W155-F542 AromaticContact CH2-CE2 3.57Å; W155-F542 HydrophobicContact CH2-CE2 3.57Å; W155-F542 AromaticContact CH2-CZ 3.55Å; W155-F542 HydrophobicContact CH2-CZ 3.55Å; W155-F542 HydrophobicContact CZ2-CE2 4.27Å; W155-F542 AromaticContact CZ2-CZ 3.85Å; W155-F542 HydrophobicContact CZ2-CZ 3.85Å; W155-F542 AromaticContact CZ3-CD1 3.91Å; W155-F542 HydrophobicContact CZ3-CD1 3.91Å; W155-F542 AromaticContact CZ3-CD2 3.75Å; W155-F542 HydrophobicContact CZ3-CD2 3.75Å; W155-F542 AromaticContact CZ3-CE1 3.64Å; W155-F542 HydrophobicContact CZ3-CE1 3.64Å; W155-F542 AromaticContact CZ3-CE2 3.47Å; W155-F542 HydrophobicContact CZ3-CE2 3.47Å; W155-F542 VanDerWaalsContact CZ3-CE2 3.47Å; W155-F542 AromaticContact CZ3-CG 3.95Å; W155-F542 HydrophobicContact CZ3-CG 3.95Å; W155-F542 AromaticContact CZ3-CZ 3.41Å; W155-F542 HydrophobicContact CZ3-CZ 3.41Å; W155-F542 VanDerWaalsContact CZ3-CZ 3.41Å; W155-L545 HydrophobicContact CB-CD1 4.1Å
156	I	97.7	Very high	95.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.6	-46.3	179.5	-61.2	169.1	0	0	0	110.3	P137 F141 L152 G153 T160 A295 M462	P137-I156 HydrophobicContact CB-CB 4.37Å; P137-I156 HydrophobicContact CB-CG2 4.49Å; P137-I156 HydrophobicContact CG-CG2 4.26Å; F141-I156 HydrophobicContact CE2-CD1 3.64Å; F141-I156 HydrophobicContact CZ-CD1 3.91Å; L152-I156 WeakPolarHBondContact O-CG1 3.33Å; L152-I156 PolarHBondContact O-N 3.38Å; G153-I156 PolarHBondContact O-N 2.98Å; I156-T160 PolarHBondContact O-N 3.18Å; I156-T160 VanDerWaalsContact O-N 3.12Å; I156-T160 PolarHBondContact O-OG1 3.41Å; I156-T160 VanDerWaalsContact O-OG1 3.12Å; I156-A295 HydrophobicContact CG2-CB 3.53Å; I156-M462 HydrophobicContact CD1-CB 4.5Å; I156-M462 HydrophobicContact CD1-CE 4.09Å
157	V	97.4	Very high	95.7	Very high	16 Å²	16	23.1 Å²	23.1	10%	0.097	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-42.4	178.1	175.2	0	0	0	0	111.8	P137 L138 G153 G154 W155 T160 Y161 L407 T411	P137-V157 HydrophobicContact CB-CG2 4.03Å; P137-V157 HydrophobicContact CG-CG2 3.83Å; L138-V157 HydrophobicContact CD1-CB 3.85Å; L138-V157 HydrophobicContact CD1-CG2 3.37Å; G153-V157 PolarHBondContact O-N 2.93Å; G153-V157 VanDerWaalsContact O-N 3.13Å; G154-V157 PolarHBondContact O-N 3.42Å; W155-V157 VanDerWaalsContact C-N 3.31Å; W155-V157 PolarHBondContact O-N 3Å; V157-T160 PolarHBondContact O-N 2.85Å; V157-Y161 WeakPolarHBondContact O-CB 3.32Å; V157-Y161 PolarHBondContact O-N 3.42Å; V157-L407 HydrophobicContact CG2-CD1 4.45Å; V157-T411 HydrophobicContact CG1-CG2 4.13Å; V157-T411 WeakPolarHBondContact CG2-OG1 3.42Å
158	A	96.9	Very high	96	Very high	21 Å²	21	20.3 Å²	20.3	17%	0.174	10%	0.098	C	C	.	.	H	α-helix	trans	-61.5	-46.8	179.2	0	0	0	0	0	111.6	G154 W155 Y161 M162 V541 L545	G154-A158 VanDerWaalsContact O-CB 3.28Å; G154-A158 WeakPolarHBondContact O-CB 3.46Å; G154-A158 PolarHBondContact O-N 3Å; W155-A158 PolarHBondContact O-N 2.98Å; A158-Y161 PolarHBondContact O-N 2.91Å; A158-M162 VanDerWaalsContact O-CG 3.32Å; A158-M162 WeakPolarHBondContact O-CG 3.27Å; A158-M162 PolarHBondContact O-N 3.1Å; A158-V541 HydrophobicContact CB-CG1 3.9Å; A158-L545 HydrophobicContact CB-CD1 4.36Å
159	V	96.2	Very high	96.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.9	-50.4	177.3	171.4	0	0	0	0	110.9	W155 Y161 M162 I163 W451 A454 L455	W155-V159 HydrophobicContact CD2-CG2 4.01Å; W155-V159 HydrophobicContact CG-CG2 4.45Å; W155-V159 HydrophobicContact CH2-CG2 4.28Å; W155-V159 HydrophobicContact CZ2-CG2 3.69Å; W155-V159 WeakPolarHBondContact O-CG2 3.43Å; W155-V159 PolarHBondContact O-N 3.09Å; V159-Y161 VanDerWaalsContact C-N 3.28Å; V159-Y161 PolarHBondContact O-N 3.19Å; V159-M162 PolarHBondContact O-N 3.23Å; V159-I163 HydrophobicContact CG1-CD1 4.07Å; V159-I163 WeakPolarHBondContact O-CG1 3.46Å; V159-I163 PolarHBondContact O-N 2.9Å; V159-W451 HydrophobicContact CG2-CE3 4.22Å; V159-W451 HydrophobicContact CG2-CZ3 4.48Å; V159-A454 HydrophobicContact CB-CB 4.4Å; V159-A454 HydrophobicContact CG1-CB 3.79Å; V159-A454 HydrophobicContact CG2-CB 3.66Å; V159-L455 HydrophobicContact CG1-CD2 3.81Å; V159-L455 HydrophobicContact CG1-CG 4.25Å
160	T	96.1	Very high	96.3	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.006	6%	0.055	C	C	.	.	H	α-helix	trans	-64.1	-35.7	-179.9	-56.7	0	0	0	0	111.9	I156 V157 I163 T164 M294 L296 L407	I156-T160 PolarHBondContact O-N 3.18Å; I156-T160 VanDerWaalsContact O-N 3.12Å; I156-T160 PolarHBondContact O-OG1 3.41Å; I156-T160 VanDerWaalsContact O-OG1 3.12Å; V157-T160 PolarHBondContact O-N 2.85Å; T160-I163 PolarHBondContact O-N 3.39Å; T160-T164 WeakPolarHBondContact O-CB 3.31Å; T160-T164 PolarHBondContact O-N 3.17Å; T160-T164 PolarHBondContact O-OG1 2.84Å; T160-M294 WeakPolarHBondContact CB-O 3.14Å; T160-M294 HydrophobicContact CG2-CB 4.17Å; T160-M294 WeakPolarHBondContact CG2-O 3.3Å; T160-M294 WeakPolarHBondContact OG1-CA 3.28Å; T160-M294 PolarHBondContact OG1-O 3.47Å; T160-L296 HydrophobicContact CG2-CD2 3.65Å; T160-L296 HydrophobicContact CG2-CG 4.45Å; T160-L407 HydrophobicContact CG2-CD2 3.56Å
161	Y	95.8	Very high	96.4	Very high	26 Å²	26	10.6 Å²	10.6	10%	0.102	5%	0.054	C	C	.	.	H	α-helix	trans	-65	-44.5	175.1	170.4	-100.1	0	0	0	112.2	V157 A158 V159 I163 T164 A165 T408 L429 F433	V157-Y161 WeakPolarHBondContact O-CB 3.32Å; V157-Y161 PolarHBondContact O-N 3.42Å; A158-Y161 PolarHBondContact O-N 2.91Å; V159-Y161 VanDerWaalsContact C-N 3.28Å; V159-Y161 PolarHBondContact O-N 3.19Å; Y161-I163 VanDerWaalsContact C-N 3.27Å; Y161-I163 PolarHBondContact O-N 3.08Å; Y161-T164 WeakPolarHBondContact O-CA 3.38Å; Y161-T164 VanDerWaalsContact O-CB 3.24Å; Y161-T164 WeakPolarHBondContact O-CB 3.48Å; Y161-T164 PolarHBondContact O-N 3.45Å; Y161-T164 VanDerWaalsContact O-N 3.08Å; Y161-A165 PolarHBondContact O-N 3.29Å; Y161-T408 HydrophobicContact CD2-CG2 4.28Å; Y161-L429 HydrophobicContact CE2-CB 3.68Å; Y161-L429 WeakPolarHBondContact OH-CA 3.31Å; Y161-L429 VanDerWaalsContact OH-CB 3.26Å; Y161-L429 WeakPolarHBondContact OH-CB 3.38Å; Y161-L429 PolarHBondContact OH-O 2.92Å; Y161-F433 HydrophobicContact CE1-CB 4.25Å; Y161-F433 HydrophobicContact CE1-CD1 4.29Å; Y161-F433 HydrophobicContact CE1-CD2 4.15Å; Y161-F433 AromaticContact CE1-CG 3.98Å; Y161-F433 HydrophobicContact CE1-CG 3.98Å; Y161-F433 AromaticContact CZ-CD2 3.93Å; Y161-F433 VanDerWaalsContact OH-CB 3.29Å; Y161-F433 WeakPolarHBondContact OH-CB 3.14Å; Y161-F433 WeakPolarHBondContact OH-CD2 3.34Å; Y161-F433 WeakPolarHBondContact OH-CG 3.33Å
162	M	95.4	Very high	96.5	Very high	32 Å²	32	7.8 Å²	7.8	16%	0.158	4%	0.044	C	C	.	.	H	α-helix	trans	-64.2	-33.8	175.7	-65.9	-59.4	-73.1	0	0	111.9	A158 V159 A165 Y166 F433 Q447 W451	A158-M162 VanDerWaalsContact O-CG 3.32Å; A158-M162 WeakPolarHBondContact O-CG 3.27Å; A158-M162 PolarHBondContact O-N 3.1Å; V159-M162 PolarHBondContact O-N 3.23Å; M162-A165 WeakPolarHBondContact O-CB 3.37Å; M162-A165 PolarHBondContact O-N 3.34Å; M162-Y166 WeakPolarHBondContact O-CD1 3.28Å; M162-F433 HydrophobicContact SD-CD1 4.24Å; M162-Q447 VanDerWaalsContact CE-OE1 3.27Å; M162-W451 HydrophobicContact CB-CB 4.41Å; M162-W451 HydrophobicContact CB-CD2 3.49Å; M162-W451 VanDerWaalsContact CB-CD2 3.49Å; M162-W451 HydrophobicContact CB-CE3 4.14Å; M162-W451 HydrophobicContact CB-CG 3.56Å; M162-W451 HydrophobicContact CB-CZ2 4.23Å; M162-W451 HydrophobicContact CE-CZ2 3.67Å; M162-W451 HydrophobicContact CG-CD2 3.94Å; M162-W451 HydrophobicContact CG-CE3 4.31Å; M162-W451 HydrophobicContact CG-CH2 4.23Å; M162-W451 HydrophobicContact CG-CZ2 3.82Å; M162-W451 HydrophobicContact CG-CZ3 4.44Å
163	I	94.6	Very high	96.4	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-63.8	-45.8	170.1	-66	167.9	0	0	0	111.3	V159 T160 Y161 A165 Y166 F167 W451 L455	V159-I163 HydrophobicContact CG1-CD1 4.07Å; V159-I163 WeakPolarHBondContact O-CG1 3.46Å; V159-I163 PolarHBondContact O-N 2.9Å; T160-I163 PolarHBondContact O-N 3.39Å; Y161-I163 VanDerWaalsContact C-N 3.27Å; Y161-I163 PolarHBondContact O-N 3.08Å; I163-A165 PolarHBondContact O-N 3.09Å; I163-Y166 VanDerWaalsContact CA-CE1 3.45Å; I163-Y166 HydrophobicContact CB-CE1 4.08Å; I163-Y166 HydrophobicContact CG1-CE1 4.05Å; I163-Y166 HydrophobicContact CG2-CE1 4.16Å; I163-Y166 PolarHBondContact O-N 3.1Å; I163-F167 WeakPolarHBondContact O-CB 3.39Å; I163-F167 PolarHBondContact O-N 3.31Å; I163-W451 HydrophobicContact CD1-CB 4.41Å; I163-W451 HydrophobicContact CG1-CB 3.69Å; I163-L455 HydrophobicContact CD1-CD1 3.84Å; I163-L455 HydrophobicContact CD1-CD2 3.63Å; I163-L455 HydrophobicContact CD1-CG 3.79Å
164	T	96.3	Very high	96.4	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-55.7	-41	178.6	-54.2	0	0	0	0	111.8	T160 Y161 F167 S168 L401 H404 V405 T430	T160-T164 WeakPolarHBondContact O-CB 3.31Å; T160-T164 PolarHBondContact O-N 3.17Å; T160-T164 PolarHBondContact O-OG1 2.84Å; Y161-T164 WeakPolarHBondContact O-CA 3.38Å; Y161-T164 VanDerWaalsContact O-CB 3.24Å; Y161-T164 WeakPolarHBondContact O-CB 3.48Å; Y161-T164 PolarHBondContact O-N 3.45Å; Y161-T164 VanDerWaalsContact O-N 3.08Å; T164-F167 PolarHBondContact O-N 3.49Å; T164-S168 PolarHBondContact O-N 2.85Å; T164-S168 VanDerWaalsContact O-N 3.14Å; T164-S168 PolarHBondContact O-OG 2.85Å; T164-L401 HydrophobicContact CG2-CD1 3.79Å; T164-H404 HydrophobicContact CG2-CB 3.78Å; T164-H404 WeakPolarHBondContact OG1-CB 3.43Å; T164-H404 PolarHBondContact OG1-ND1 3.5Å; T164-H404 VanDerWaalsContact OG1-ND1 3.15Å; T164-V405 HydrophobicContact CG2-CG2 3.79Å; T164-T430 HydrophobicContact CG2-CG2 4.01Å
165	A	96.1	Very high	96.4	Very high	3 Å²	3	7.9 Å²	7.9	3%	0.025	4%	0.042	C	C	.	.	H	α-helix	trans	-57.8	-57.5	-179.3	0	0	0	0	0	112.3	Y161 M162 I163 S168 F433 G434	Y161-A165 PolarHBondContact O-N 3.29Å; M162-A165 WeakPolarHBondContact O-CB 3.37Å; M162-A165 PolarHBondContact O-N 3.34Å; I163-A165 PolarHBondContact O-N 3.09Å; A165-S168 PolarHBondContact O-OG 2.95Å; A165-F433 HydrophobicContact CB-CB 3.88Å; A165-G434 VanDerWaalsContact O-CA 3.27Å; A165-G434 WeakPolarHBondContact O-CA 3.36Å
166	Y	95.1	Very high	96.4	Very high	6 Å²	6	8.3 Å²	8.3	2%	0.024	4%	0.044	C	C	.	.	H	α-helix	trans	-75.6	-28	178.9	78.4	-100.8	0	0	0	112.7	M162 I163 S168 V169 I170 Q447 D448	M162-Y166 WeakPolarHBondContact O-CD1 3.28Å; I163-Y166 VanDerWaalsContact CA-CE1 3.45Å; I163-Y166 HydrophobicContact CB-CE1 4.08Å; I163-Y166 HydrophobicContact CG1-CE1 4.05Å; I163-Y166 HydrophobicContact CG2-CE1 4.16Å; I163-Y166 PolarHBondContact O-N 3.1Å; Y166-S168 VanDerWaalsContact C-N 3.31Å; Y166-S168 PolarHBondContact O-N 2.89Å; Y166-V169 VanDerWaalsContact O-CB 3.28Å; Y166-V169 WeakPolarHBondContact O-CB 3.33Å; Y166-V169 PolarHBondContact O-N 3.13Å; Y166-V169 VanDerWaalsContact O-N 3.12Å; Y166-I170 PolarHBondContact O-N 2.91Å; Y166-Q447 HydrophobicContact CD1-CB 3.93Å; Y166-Q447 HydrophobicContact CG-CB 4.34Å; Y166-D448 HydrophobicContact CD2-CB 4.43Å; Y166-D448 HydrophobicContact CE2-CB 3.83Å; Y166-D448 WeakPolarHBondContact CE2-OD1 3.27Å; Y166-D448 VanDerWaalsContact CZ-OD1 3.29Å; Y166-D448 PolarHBondContact OH-OD1 3.29Å
167	F	95.7	Very high	96.3	Very high	13 Å²	13	8.7 Å²	8.7	6%	0.057	5%	0.045	C	C	.	.	H	α-helix	trans	-63	-37.7	-179.8	-178.3	-110.7	0	0	0	112.2	T85 I163 T164 V169 I170 V171 L401	T85-F167 WeakPolarHBondContact OG1-CE2 3.49Å; I163-F167 WeakPolarHBondContact O-CB 3.39Å; I163-F167 PolarHBondContact O-N 3.31Å; T164-F167 PolarHBondContact O-N 3.49Å; F167-V169 PolarHBondContact O-N 3.36Å; F167-I170 WeakPolarHBondContact O-CA 3.49Å; F167-I170 WeakPolarHBondContact O-CB 3.42Å; F167-I170 PolarHBondContact O-N 3.42Å; F167-V171 HydrophobicContact CD1-CG2 4.06Å; F167-V171 HydrophobicContact CE1-CG2 3.71Å; F167-V171 HydrophobicContact CZ-CG2 4.04Å; F167-V171 WeakPolarHBondContact O-CG2 3.45Å; F167-V171 PolarHBondContact O-N 3.24Å; F167-L401 HydrophobicContact CD1-CB 4.21Å; F167-L401 HydrophobicContact CD1-CD1 4.04Å; F167-L401 HydrophobicContact CE1-CB 4.04Å
168	S	97.7	Very high	96.2	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-59.4	-28	175.6	58.4	0	0	0	0	114	T164 A165 Y166 G172 H212 S215	T164-S168 PolarHBondContact O-N 2.85Å; T164-S168 VanDerWaalsContact O-N 3.14Å; T164-S168 PolarHBondContact O-OG 2.85Å; A165-S168 PolarHBondContact O-OG 2.95Å; Y166-S168 VanDerWaalsContact C-N 3.31Å; Y166-S168 PolarHBondContact O-N 2.89Å; S168-G172 PolarHBondContact O-N 3.41Å; S168-G172 VanDerWaalsContact O-N 3.11Å; S168-H212 PolarHBondContact OG-CE1 3.27Å; S168-H212 PolarHBondContact OG-ND1 3.47Å; S168-S215 WeakPolarHBondContact O-CB 3.48Å; S168-S215 PolarHBondContact O-OG 2.92Å
169	V	97.1	Very high	96.2	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.2	-45	171.4	-174.2	0	0	0	0	110.9	Y166 F167 V171 G172 W173 P208 H212 A438 L444	Y166-V169 VanDerWaalsContact O-CB 3.28Å; Y166-V169 WeakPolarHBondContact O-CB 3.33Å; Y166-V169 PolarHBondContact O-N 3.13Å; Y166-V169 VanDerWaalsContact O-N 3.12Å; F167-V169 PolarHBondContact O-N 3.36Å; V169-V171 VanDerWaalsContact C-N 3.32Å; V169-V171 PolarHBondContact O-N 2.9Å; V169-G172 CarbonylContact O-C 3.37Å; V169-G172 WeakPolarHBondContact O-CA 3.44Å; V169-G172 PolarHBondContact O-N 3.21Å; V169-W173 PolarHBondContact O-N 3.3Å; V169-P208 HydrophobicContact CG1-CB 4.38Å; V169-H212 HydrophobicContact CG2-CB 4.21Å; V169-A438 HydrophobicContact CG1-CB 4.22Å; V169-A438 HydrophobicContact CG2-CB 3.87Å; V169-L444 HydrophobicContact CB-CD1 4.01Å; V169-L444 HydrophobicContact CG1-CD1 3.79Å
170	I	94.4	Very high	96.1	Very high	11 Å²	11	17.9 Å²	17.9	6%	0.056	8%	0.077	C	C	.	.	H	α-helix	trans	-61	-40.4	176.2	-63.3	-60.3	0	0	0	111.4	W89 Y166 F167 G172 W173 C174 L444	W89-I170 HydrophobicContact CZ3-CG2 3.92Å; Y166-I170 PolarHBondContact O-N 2.91Å; F167-I170 WeakPolarHBondContact O-CA 3.49Å; F167-I170 WeakPolarHBondContact O-CB 3.42Å; F167-I170 PolarHBondContact O-N 3.42Å; I170-G172 PolarHBondContact O-N 3.44Å; I170-W173 HydrophobicContact CD1-CD2 4.25Å; I170-W173 HydrophobicContact CD1-CE3 4.11Å; I170-W173 HydrophobicContact CD1-CZ3 4.28Å; I170-W173 WeakPolarHBondContact O-CB 3.38Å; I170-W173 PolarHBondContact O-N 3.46Å; I170-W173 VanDerWaalsContact O-N 3.13Å; I170-C174 PolarHBondContact O-N 2.78Å; I170-C174 VanDerWaalsContact O-N 3.16Å; I170-C174 PolarHBondContact O-SG 2.9Å; I170-C174 VanDerWaalsContact O-SG 3.41Å; I170-L444 HydrophobicContact CD1-CD1 3.92Å; I170-L444 HydrophobicContact CD1-CD2 4.05Å; I170-L444 HydrophobicContact CG1-CD1 4.39Å
171	V	97.2	Very high	96	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-39.2	172.7	-178	0	0	0	0	110.7	F167 V169 W173 C174 L175 G397 I398 L401	F167-V171 HydrophobicContact CD1-CG2 4.06Å; F167-V171 HydrophobicContact CE1-CG2 3.71Å; F167-V171 HydrophobicContact CZ-CG2 4.04Å; F167-V171 WeakPolarHBondContact O-CG2 3.45Å; F167-V171 PolarHBondContact O-N 3.24Å; V169-V171 VanDerWaalsContact C-N 3.32Å; V169-V171 PolarHBondContact O-N 2.9Å; V171-W173 VanDerWaalsContact C-N 3.3Å; V171-W173 PolarHBondContact O-N 2.99Å; V171-C174 WeakPolarHBondContact O-CB 3.48Å; V171-C174 PolarHBondContact O-N 2.98Å; V171-L175 WeakPolarHBondContact O-CG 3.32Å; V171-L175 PolarHBondContact O-N 3.02Å; V171-G397 WeakPolarHBondContact CG2-O 3.09Å; V171-I398 HydrophobicContact CG1-CD1 3.64Å; V171-I398 HydrophobicContact CG1-CG1 3.89Å; V171-L401 HydrophobicContact CG2-CB 4.35Å; V171-L401 HydrophobicContact CG2-CD2 4.32Å
172	G	97.8	Very high	95.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.5	-38.3	174.8	0	0	0	0	0	112.8	S168 V169 I170 C174 L175 Y176 T211 S215	S168-G172 PolarHBondContact O-N 3.41Å; S168-G172 VanDerWaalsContact O-N 3.11Å; V169-G172 CarbonylContact O-C 3.37Å; V169-G172 WeakPolarHBondContact O-CA 3.44Å; V169-G172 PolarHBondContact O-N 3.21Å; I170-G172 PolarHBondContact O-N 3.44Å; G172-C174 PolarHBondContact O-N 3.28Å; G172-L175 PolarHBondContact O-N 3.21Å; G172-Y176 PolarHBondContact O-N 3.38Å; G172-T211 WeakPolarHBondContact CA-O 3.41Å; G172-T211 WeakPolarHBondContact O-CB 3.27Å; G172-S215 VanDerWaalsContact CA-OG 3.27Å; G172-S215 WeakPolarHBondContact CA-OG 3.08Å; G172-S215 PolarHBondContact N-OG 3.39Å
173	W	95.5	Very high	95.8	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.015	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-40.9	176.1	-63	14.4	0	0	0	111.5	V169 I170 V171 Y176 Y177 F198 F201 A202 T364 F368 I441 L444	V169-W173 PolarHBondContact O-N 3.3Å; I170-W173 HydrophobicContact CD1-CD2 4.25Å; I170-W173 HydrophobicContact CD1-CE3 4.11Å; I170-W173 HydrophobicContact CD1-CZ3 4.28Å; I170-W173 WeakPolarHBondContact O-CB 3.38Å; I170-W173 PolarHBondContact O-N 3.46Å; I170-W173 VanDerWaalsContact O-N 3.13Å; V171-W173 VanDerWaalsContact C-N 3.3Å; V171-W173 PolarHBondContact O-N 2.99Å; W173-Y176 PolarHBondContact O-N 3.06Å; W173-Y177 WeakPolarHBondContact O-CD2 3.43Å; W173-Y177 PolarHBondContact O-N 3.48Å; W173-F198 AromaticContact CE3-CE2 3.98Å; W173-F198 HydrophobicContact CE3-CE2 3.98Å; W173-F198 HydrophobicContact CE3-CZ 4.42Å; W173-F198 HydrophobicContact CH2-CE2 4.33Å; W173-F198 AromaticContact CH2-CZ 3.97Å; W173-F198 HydrophobicContact CH2-CZ 3.97Å; W173-F198 AromaticContact CZ3-CE2 3.66Å; W173-F198 HydrophobicContact CZ3-CE2 3.66Å; W173-F198 AromaticContact CZ3-CZ 3.67Å; W173-F198 HydrophobicContact CZ3-CZ 3.67Å; W173-F201 HydrophobicContact CB-CE1 3.99Å; W173-F201 HydrophobicContact CB-CZ 4.21Å; W173-F201 AromaticContact CD1-CE1 3.43Å; W173-F201 VanDerWaalsContact CD1-CE1 3.43Å; W173-F201 AromaticContact CD1-CZ 3.37Å; W173-F201 AromaticContact CD2-CE1 3.9Å; W173-F201 HydrophobicContact CD2-CE1 3.9Å; W173-F201 AromaticContact CG-CE1 3.51Å; W173-F201 HydrophobicContact CG-CE1 3.51Å; W173-F201 AromaticContact CG-CZ 3.82Å; W173-F201 HydrophobicContact CG-CZ 3.82Å; W173-F201 AromaticContact NE1-CE1 3.74Å; W173-F201 AromaticContact NE1-CZ 3.9Å; W173-A202 HydrophobicContact CZ2-CB 4.34Å; W173-T364 HydrophobicContact CE3-CG2 4.26Å; W173-T364 HydrophobicContact CH2-CG2 4.38Å; W173-T364 HydrophobicContact CZ3-CG2 3.49Å; W173-T364 VanDerWaalsContact CZ3-CG2 3.49Å; W173-F368 HydrophobicContact CB-CE1 3.91Å; W173-F368 HydrophobicContact CB-CZ 3.86Å; W173-F368 HydrophobicContact CE3-CD2 4.49Å; W173-F368 HydrophobicContact CE3-CE2 4.22Å; W173-F368 HydrophobicContact CE3-CZ 4.4Å; W173-I441 HydrophobicContact CH2-CD1 3.68Å; W173-I441 HydrophobicContact CH2-CG1 3.98Å; W173-I441 HydrophobicContact CZ2-CD1 4.44Å; W173-I441 HydrophobicContact CZ2-CG1 4.48Å; W173-L444 HydrophobicContact CH2-CD1 4.46Å; W173-L444 HydrophobicContact CZ2-CD1 3.96Å
174	C	96.2	Very high	95.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-44.9	174.7	-60	0	0	0	0	111.7	I170 V171 G172 Y176 Y177 F178 L393 S394	I170-C174 PolarHBondContact O-N 2.78Å; I170-C174 VanDerWaalsContact O-N 3.16Å; I170-C174 PolarHBondContact O-SG 2.9Å; I170-C174 VanDerWaalsContact O-SG 3.41Å; V171-C174 WeakPolarHBondContact O-CB 3.48Å; V171-C174 PolarHBondContact O-N 2.98Å; G172-C174 PolarHBondContact O-N 3.28Å; C174-Y176 PolarHBondContact O-N 3.48Å; C174-Y177 PolarHBondContact O-N 3.02Å; C174-F178 PolarHBondContact O-N 3.3Å; C174-L393 HydrophobicContact CB-CB 4.08Å; C174-S394 VanDerWaalsContact C-OG 3.26Å; C174-S394 PolarHBondContact O-OG 3.27Å
175	L	97.7	Very high	95	Very high	30 Å²	30	27.9 Å²	27.9	16%	0.157	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-43.6	176.6	-68	171.9	0	0	0	111.8	V171 G172 F178 Y179 L214 I218 S394	V171-L175 WeakPolarHBondContact O-CG 3.32Å; V171-L175 PolarHBondContact O-N 3.02Å; G172-L175 PolarHBondContact O-N 3.21Å; L175-F178 PolarHBondContact O-N 2.9Å; L175-Y179 PolarHBondContact O-N 3.36Å; L175-L214 HydrophobicContact CD1-CD2 4.31Å; L175-L214 HydrophobicContact CD1-CG 4.31Å; L175-I218 HydrophobicContact CD1-CD1 3.93Å; L175-I218 HydrophobicContact CD2-CD1 4.42Å; L175-S394 PolarHBondContact N-OG 2.9Å
176	Y	96.9	Very high	94.7	Very high	11 Å²	11	31 Å²	31	4%	0.043	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-45.5	176.8	178	-102.7	0	0	0	112	G172 W173 C174 F178 Y179 K180 F201 W207	G172-Y176 PolarHBondContact O-N 3.38Å; W173-Y176 PolarHBondContact O-N 3.06Å; C174-Y176 PolarHBondContact O-N 3.48Å; Y176-F178 PolarHBondContact O-N 3.16Å; Y176-Y179 WeakPolarHBondContact O-CB 3.48Å; Y176-Y179 PolarHBondContact O-N 3.4Å; Y176-K180 HydrophobicContact CD1-CG 3.98Å; Y176-K180 HydrophobicContact CD2-CG 4.42Å; Y176-K180 HydrophobicContact CE1-CD 4.16Å; Y176-K180 HydrophobicContact CE1-CG 3.52Å; Y176-K180 HydrophobicContact CE2-CD 4.11Å; Y176-K180 HydrophobicContact CE2-CG 3.99Å; Y176-K180 HydrophobicContact CG-CG 4.41Å; Y176-K180 WeakPolarHBondContact O-CG 3.47Å; Y176-K180 PolarHBondContact O-N 2.9Å; Y176-F201 HydrophobicContact CD1-CB 4.13Å; Y176-F201 HydrophobicContact CD1-CD1 4.01Å; Y176-F201 AromaticContact CD1-CD2 3.35Å; Y176-F201 HydrophobicContact CD1-CD2 3.35Å; Y176-F201 HydrophobicContact CD1-CE1 4.28Å; Y176-F201 AromaticContact CD1-CE2 3.67Å; Y176-F201 HydrophobicContact CD1-CE2 3.67Å; Y176-F201 AromaticContact CD1-CG 3.54Å; Y176-F201 HydrophobicContact CD1-CG 3.54Å; Y176-F201 HydrophobicContact CD1-CZ 4.13Å; Y176-F201 AromaticContact CD2-CD2 3.67Å; Y176-F201 HydrophobicContact CD2-CD2 3.67Å; Y176-F201 AromaticContact CD2-CE2 3.8Å; Y176-F201 HydrophobicContact CD2-CE2 3.8Å; Y176-F201 HydrophobicContact CE1-CB 3.48Å; Y176-F201 VanDerWaalsContact CE1-CB 3.48Å; Y176-F201 HydrophobicContact CE1-CD1 4.21Å; Y176-F201 AromaticContact CE1-CD2 3.43Å; Y176-F201 HydrophobicContact CE1-CD2 3.43Å; Y176-F201 VanDerWaalsContact CE1-CD2 3.43Å; Y176-F201 HydrophobicContact CE1-CE2 4.23Å; Y176-F201 AromaticContact CE1-CG 3.43Å; Y176-F201 HydrophobicContact CE1-CG 3.43Å; Y176-F201 VanDerWaalsContact CE1-CG 3.43Å; Y176-F201 AromaticContact CE2-CD2 3.76Å; Y176-F201 HydrophobicContact CE2-CD2 3.76Å; Y176-F201 HydrophobicContact CE2-CE2 4.35Å; Y176-F201 AromaticContact CG-CD2 3.46Å; Y176-F201 HydrophobicContact CG-CD2 3.46Å; Y176-F201 VanDerWaalsContact CG-CD2 3.46Å; Y176-F201 AromaticContact CG-CE2 3.42Å; Y176-F201 HydrophobicContact CG-CE2 3.42Å; Y176-F201 VanDerWaalsContact CG-CE2 3.42Å; Y176-F201 HydrophobicContact CG-CG 4.15Å; Y176-F201 HydrophobicContact CG-CZ 4.06Å; Y176-F201 AromaticContact CZ-CD2 3.63Å; Y176-F201 AromaticContact CZ-CG 3.96Å; Y176-W207 HydrophobicContact CD2-CD2 4.32Å; Y176-W207 HydrophobicContact CD2-CE3 4.09Å; Y176-W207 AromaticContact CE2-CD2 3.96Å; Y176-W207 HydrophobicContact CE2-CD2 3.96Å; Y176-W207 HydrophobicContact CE2-CE3 4.14Å; Y176-W207 HydrophobicContact CE2-CG 4.17Å
177	Y	95.7	Very high	94.6	Very high	8 Å²	8	31.5 Å²	31.5	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-70.6	-31.3	-179.7	-90.8	-101.9	0	0	0	113.1	W173 C174 Y179 K180 S181 F198 F201 F368 P372 F390	W173-Y177 WeakPolarHBondContact O-CD2 3.43Å; W173-Y177 PolarHBondContact O-N 3.48Å; C174-Y177 PolarHBondContact O-N 3.02Å; Y177-Y179 VanDerWaalsContact C-N 3.35Å; Y177-K180 PolarHBondContact O-N 2.9Å; Y177-S181 WeakPolarHBondContact O-CB 3.27Å; Y177-S181 PolarHBondContact O-N 2.71Å; Y177-S181 PolarHBondContact O-OG 2.66Å; Y177-F198 HydrophobicContact CE2-CD2 4.39Å; Y177-F198 WeakPolarHBondContact OH-CA 3.22Å; Y177-F198 WeakPolarHBondContact OH-CB 3.4Å; Y177-F198 WeakPolarHBondContact OH-CD2 3.36Å; Y177-F201 HydrophobicContact CE2-CD1 4.33Å; Y177-F368 HydrophobicContact CD1-CD1 4Å; Y177-F368 AromaticContact CD2-CD1 3.37Å; Y177-F368 HydrophobicContact CD2-CD1 3.37Å; Y177-F368 AromaticContact CD2-CE1 3.76Å; Y177-F368 HydrophobicContact CD2-CE1 3.76Å; Y177-F368 HydrophobicContact CE1-CB 4.19Å; Y177-F368 HydrophobicContact CE1-CD1 4.07Å; Y177-F368 WeakPolarHBondContact CE1-O 3.26Å; Y177-F368 HydrophobicContact CE2-CB 4.2Å; Y177-F368 AromaticContact CE2-CD1 3.46Å; Y177-F368 HydrophobicContact CE2-CD1 3.46Å; Y177-F368 VanDerWaalsContact CE2-CD1 3.46Å; Y177-F368 HydrophobicContact CE2-CE1 4.23Å; Y177-F368 HydrophobicContact CE2-CG 4.23Å; Y177-F368 AromaticContact CG-CD1 3.65Å; Y177-F368 HydrophobicContact CG-CD1 3.65Å; Y177-F368 HydrophobicContact CG-CE1 4.06Å; Y177-F368 AromaticContact CZ-CD1 3.8Å; Y177-F368 PolarHBondContact OH-O 3.47Å; Y177-P372 HydrophobicContact CD1-CG 4.38Å; Y177-P372 HydrophobicContact CE1-CG 4.19Å; Y177-F390 VanDerWaalsContact CB-CE1 3.43Å; Y177-F390 AromaticContact CD1-CE1 3.87Å; Y177-F390 HydrophobicContact CD1-CE1 3.87Å; Y177-F390 AromaticContact CD1-CE2 3.86Å; Y177-F390 HydrophobicContact CD1-CE2 3.86Å; Y177-F390 AromaticContact CD1-CZ 3.45Å; Y177-F390 HydrophobicContact CD1-CZ 3.45Å; Y177-F390 VanDerWaalsContact CD1-CZ 3.45Å; Y177-F390 HydrophobicContact CE1-CZ 4.32Å; Y177-F390 HydrophobicContact CG-CD1 4.27Å; Y177-F390 AromaticContact CG-CE1 3.82Å; Y177-F390 HydrophobicContact CG-CE1 3.82Å; Y177-F390 HydrophobicContact CG-CE2 4.41Å; Y177-F390 AromaticContact CG-CZ 3.9Å; Y177-F390 HydrophobicContact CG-CZ 3.9Å
178	F	96.9	Very high	94.4	Very high	65 Å²	65	31.3 Å²	31.3	29%	0.285	18%	0.179	S	C	.	.	H	α-helix	trans	-63	-42.3	168.7	172.4	-116.9	0	0	0	111.6	C174 L175 Y176 S181 C182 S387 F390 L391	C174-F178 PolarHBondContact O-N 3.3Å; L175-F178 PolarHBondContact O-N 2.9Å; Y176-F178 PolarHBondContact O-N 3.16Å; F178-S181 PolarHBondContact O-OG 3.31Å; F178-C182 PolarHBondContact O-N 3.37Å; F178-C182 PolarHBondContact O-SG 2.92Å; F178-S387 WeakPolarHBondContact CD2-O 2.98Å; F178-F390 HydrophobicContact CB-CB 3.89Å; F178-L391 HydrophobicContact CD1-CD1 4.25Å; F178-L391 HydrophobicContact CD2-CB 3.75Å; F178-L391 HydrophobicContact CD2-CD1 4.26Å; F178-L391 HydrophobicContact CE1-CD1 3.94Å; F178-L391 HydrophobicContact CE2-CB 3.78Å; F178-L391 HydrophobicContact CE2-CD1 3.96Å; F178-L391 HydrophobicContact CE2-CD2 4.33Å; F178-L391 HydrophobicContact CE2-CG 4.24Å; F178-L391 HydrophobicContact CG-CB 4.42Å; F178-L391 HydrophobicContact CG-CD1 4.4Å; F178-L391 HydrophobicContact CZ-CB 4.47Å; F178-L391 HydrophobicContact CZ-CD1 3.79Å; F178-L391 HydrophobicContact CZ-CD2 4.49Å; F178-L391 HydrophobicContact CZ-CG 4.48Å
179	Y	96.4	Very high	94	Very high	126 Å²	126	39.5 Å²	39.5	49%	0.494	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-49	172.4	162.7	-106.5	0	0	0	111.3	L175 Y176 Y177 S181 C182 A183	L175-Y179 PolarHBondContact O-N 3.36Å; Y176-Y179 WeakPolarHBondContact O-CB 3.48Å; Y176-Y179 PolarHBondContact O-N 3.4Å; Y177-Y179 VanDerWaalsContact C-N 3.35Å; Y179-S181 PolarHBondContact O-N 3.33Å; Y179-C182 PolarHBondContact O-N 3Å; Y179-C182 VanDerWaalsContact O-N 3.15Å; Y179-A183 HydrophobicContact CD2-CB 4.09Å; Y179-A183 HydrophobicContact CE1-CB 4.32Å; Y179-A183 HydrophobicContact CE2-CB 3.62Å; Y179-A183 VanDerWaalsContact O-CB 3.27Å; Y179-A183 WeakPolarHBondContact O-CB 3.33Å; Y179-A183 PolarHBondContact O-N 3.47Å
180	K	94.4	Very high	93.6	Very high	38 Å²	38	42.7 Å²	42.7	17%	0.165	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-37.6	-178.9	-69.7	-68.8	-70.2	-162.5	0	112.9	Y176 Y177 C182 A183 L184	Y176-K180 HydrophobicContact CD1-CG 3.98Å; Y176-K180 HydrophobicContact CD2-CG 4.42Å; Y176-K180 HydrophobicContact CE1-CD 4.16Å; Y176-K180 HydrophobicContact CE1-CG 3.52Å; Y176-K180 HydrophobicContact CE2-CD 4.11Å; Y176-K180 HydrophobicContact CE2-CG 3.99Å; Y176-K180 HydrophobicContact CG-CG 4.41Å; Y176-K180 WeakPolarHBondContact O-CG 3.47Å; Y176-K180 PolarHBondContact O-N 2.9Å; Y177-K180 PolarHBondContact O-N 2.9Å; K180-C182 PolarHBondContact O-N 3.31Å; K180-A183 PolarHBondContact O-N 3.49Å; K180-L184 HydrophobicContact CB-CD1 4.25Å; K180-L184 VanDerWaalsContact O-CB 3.3Å; K180-L184 WeakPolarHBondContact O-CB 3.49Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.2Å
181	S	93.8	Very high	93.1	Very high	3 Å²	3	44 Å²	44	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-28.8	176.8	65.9	0	0	0	0	112.3	Y177 F178 Y179 R383 S387	Y177-S181 WeakPolarHBondContact O-CB 3.27Å; Y177-S181 PolarHBondContact O-N 2.71Å; Y177-S181 PolarHBondContact O-OG 2.66Å; F178-S181 PolarHBondContact O-OG 3.31Å; Y179-S181 PolarHBondContact O-N 3.33Å; S181-R383 VanDerWaalsContact O-CG 3.3Å; S181-R383 WeakPolarHBondContact O-CG 3.1Å; S181-S387 WeakPolarHBondContact CB-OG 3.49Å; S181-S387 PolarHBondContact O-OG 3.49Å; S181-S387 VanDerWaalsContact OG-CA 3.24Å; S181-S387 WeakPolarHBondContact OG-CA 3.33Å; S181-S387 WeakPolarHBondContact OG-CB 3.26Å; S181-S387 PolarHBondContact OG-OG 3.2Å; S181-S387 VanDerWaalsContact OG-OG 3.05Å
182	C	94	Very high	92.6	Very high	64 Å²	64	51.7 Å²	51.7	43%	0.432	27%	0.271	S	S	.	.	H	α-helix	trans	-84.7	-42.4	175.4	-61.9	0	0	0	0	112.7	F178 Y179 K180	F178-C182 PolarHBondContact O-N 3.37Å; F178-C182 PolarHBondContact O-SG 2.92Å; Y179-C182 PolarHBondContact O-N 3Å; Y179-C182 VanDerWaalsContact O-N 3.15Å; K180-C182 PolarHBondContact O-N 3.31Å
183	A	92.8	Very high	92.4	Very high	56 Å²	56	54.6 Å²	54.6	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-86.2	-26.2	-168.6	0	0	0	0	0	114.6	Y179 K180	Y179-A183 HydrophobicContact CD2-CB 4.09Å; Y179-A183 HydrophobicContact CE1-CB 4.32Å; Y179-A183 HydrophobicContact CE2-CB 3.62Å; Y179-A183 VanDerWaalsContact O-CB 3.27Å; Y179-A183 WeakPolarHBondContact O-CB 3.33Å; Y179-A183 PolarHBondContact O-N 3.47Å; K180-A183 PolarHBondContact O-N 3.49Å
184	L	88	Confident	92.1	Very high	41 Å²	41	54.4 Å²	54.4	22%	0.215	29%	0.288	C	S	.	.	S	Bend	trans	-66.6	139.2	179.3	-75.8	170.6	0	0	0	111.6	K180 S186 I197 R383	K180-L184 HydrophobicContact CB-CD1 4.25Å; K180-L184 VanDerWaalsContact O-CB 3.3Å; K180-L184 WeakPolarHBondContact O-CB 3.49Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.2Å; L184-S186 PolarHBondContact O-N 2.89Å; L184-I197 HydrophobicContact CD1-CD1 4.21Å; L184-R383 PolarHBondContact O-NH1 2.89Å
185	S	85.8	Confident	91.8	Very high	107 Å²	107	57.7 Å²	57.7	75%	0.748	31%	0.305	S	S	*	.	S	Bend	trans	-62.2	-31.6	175	56.5	0	0	0	0	112.4	R383	S185-R383 PolarHBondContact O-NH2 3.01Å
186	S	90.1	Very high	91.5	Very high	69 Å²	69	62.3 Å²	62.3	48%	0.483	32%	0.324	S	S	.	.	S	Bend	trans	-152.4	147.3	171.2	56.2	0	0	0	0	110.8	L184	L184-S186 PolarHBondContact O-N 2.89Å
187	L	92.7	Very high	91.3	Very high	16 Å²	16	62.8 Å²	62.8	8%	0.084	33%	0.327	C	S	.	.			trans	-65.8	149	170.7	-66.5	-179.5	0	0	0	110.7	F375 A376 R383 C386	L187-F375 HydrophobicContact CD1-CB 4.09Å; L187-A376 HydrophobicContact CB-CB 3.68Å; L187-A376 HydrophobicContact CD1-CB 4.45Å; L187-R383 HydrophobicContact CD1-CB 4.49Å; L187-C386 HydrophobicContact CD1-CB 3.8Å; L187-C386 HydrophobicContact CD2-CB 4.37Å
188	P	92.3	Very high	91.2	Very high	9 Å²	9	62.4 Å²	62.4	6%	0.058	33%	0.325	C	S	.	.			trans	-61.5	138.4	176.7	27.9	-35.4	0	0	0	110.1	T193 I197 P372 V373 A376	P188-T193 HydrophobicContact CB-CG2 3.98Å; P188-I197 HydrophobicContact CB-CD1 4.21Å; P188-I197 HydrophobicContact CG-CD1 4.21Å; P188-P372 HydrophobicContact CG-CB 3.71Å; P188-V373 HydrophobicContact CB-CG2 4.36Å; P188-V373 HydrophobicContact CG-CG2 4.24Å; P188-V373 WeakPolarHBondContact O-CA 3.4Å; P188-A376 WeakPolarHBondContact O-CB 3.3Å
189	R	88.6	Confident	90.9	Very high	172 Å²	172	61 Å²	61	65%	0.649	32%	0.321	S	S	*	.			trans	-102.7	-10.8	-179.4	-70.5	-176.1	176.9	172.6	0.1	113.6	A376 Y377	R189-A376 HydrophobicContact CG-CB 4.19Å; R189-Y377 VanDerWaalsContact O-CE2 3.31Å; R189-Y377 WeakPolarHBondContact O-CE2 3.35Å; R189-Y377 PolarHBondContact O-OH 2.91Å; R189-Y377 VanDerWaalsContact O-OH 3.06Å
190	D	88.1	Confident	90.8	Very high	66 Å²	66	58.9 Å²	58.9	35%	0.353	32%	0.315	S	S	.	.	S	Bend	trans	-132.9	158.1	179.2	64.3	91.4	0	0	0	109.9	E192 T193 S194 V373	D190-E192 VanDerWaalsContact C-N 3.33Å; D190-E192 WeakPolarHBondContact OD1-CB 3.15Å; D190-E192 PolarHBondContact OD1-N 3.14Å; D190-T193 VanDerWaalsContact CG-OG1 3.28Å; D190-T193 WeakPolarHBondContact OD1-CB 3.46Å; D190-T193 PolarHBondContact OD1-N 3.26Å; D190-T193 PolarHBondContact OD1-OG1 3.28Å; D190-T193 WeakPolarHBondContact OD2-CB 3.36Å; D190-T193 PolarHBondContact OD2-OG1 3.19Å; D190-S194 PolarHBondContact O-N 3.24Å; D190-V373 WeakPolarHBondContact O-CG2 3.39Å
191	V	83.5	Confident	90.8	Very high	39 Å²	39	57 Å²	57	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-69.5	-33.8	-174.5	-177	0	0	0	0	111.3	S194 I195 W370	V191-S194 PolarHBondContact O-N 3.03Å; V191-I195 HydrophobicContact CG1-CD1 3.73Å; V191-I195 HydrophobicContact CG1-CG1 4.18Å; V191-I195 WeakPolarHBondContact O-CB 3.37Å; V191-I195 VanDerWaalsContact O-CG1 3.32Å; V191-I195 WeakPolarHBondContact O-CG1 3.37Å; V191-I195 PolarHBondContact O-N 2.78Å; V191-W370 HydrophobicContact CB-CZ2 4.44Å; V191-W370 HydrophobicContact CG1-CZ2 4.18Å; V191-W370 HydrophobicContact CG2-CD2 4.13Å; V191-W370 HydrophobicContact CG2-CE3 3.91Å; V191-W370 HydrophobicContact CG2-CH2 3.2Å; V191-W370 HydrophobicContact CG2-CZ2 3.41Å; V191-W370 VanDerWaalsContact CG2-CZ2 3.41Å; V191-W370 HydrophobicContact CG2-CZ3 3.46Å; V191-W370 VanDerWaalsContact CG2-CZ3 3.46Å
192	E	88.4	Confident	90.6	Very high	161 Å²	161	57.3 Å²	57.3	75%	0.752	31%	0.31	S	S	*	.	H	α-helix	trans	-64.2	-49.6	-178.3	-175.6	-179.1	168.7	0	0	110.9	D190 S194 I195 K196	D190-E192 VanDerWaalsContact C-N 3.33Å; D190-E192 WeakPolarHBondContact OD1-CB 3.15Å; D190-E192 PolarHBondContact OD1-N 3.14Å; E192-S194 VanDerWaalsContact C-N 3.27Å; E192-S194 PolarHBondContact O-N 2.98Å; E192-I195 PolarHBondContact O-N 3.37Å; E192-K196 WeakPolarHBondContact O-CB 3.34Å; E192-K196 PolarHBondContact O-N 3.31Å
193	T	92	Very high	90.3	Very high	61 Å²	61	59.1 Å²	59.1	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-40.3	173.9	-58.9	0	0	0	0	111.3	P188 D190 K196 I197	P188-T193 HydrophobicContact CB-CG2 3.98Å; D190-T193 VanDerWaalsContact CG-OG1 3.28Å; D190-T193 WeakPolarHBondContact OD1-CB 3.46Å; D190-T193 PolarHBondContact OD1-N 3.26Å; D190-T193 PolarHBondContact OD1-OG1 3.28Å; D190-T193 WeakPolarHBondContact OD2-CB 3.36Å; D190-T193 PolarHBondContact OD2-OG1 3.19Å; T193-K196 PolarHBondContact O-N 2.97Å; T193-I197 HydrophobicContact CG2-CD1 4.35Å; T193-I197 WeakPolarHBondContact O-CG1 3.43Å; T193-I197 PolarHBondContact O-N 2.96Å
194	S	90.5	Very high	90.2	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-68.2	-40.7	179.2	-158.1	0	0	0	0	112.8	D190 V191 E192 K196 I197 F198 T369	D190-S194 PolarHBondContact O-N 3.24Å; V191-S194 PolarHBondContact O-N 3.03Å; E192-S194 VanDerWaalsContact C-N 3.27Å; E192-S194 PolarHBondContact O-N 2.98Å; S194-K196 VanDerWaalsContact C-N 3.33Å; S194-I197 PolarHBondContact O-N 2.98Å; S194-F198 PolarHBondContact O-N 3.37Å; S194-T369 VanDerWaalsContact CB-O 3.29Å; S194-T369 WeakPolarHBondContact CB-O 3.38Å; S194-T369 WeakPolarHBondContact OG-CA 3.39Å; S194-T369 PolarHBondContact OG-O 3.43Å
195	I	89.5	Confident	90.5	Very high	68 Å²	68	62.9 Å²	62.9	35%	0.349	32%	0.323	S	S	.	.	H	α-helix	trans	-63.6	-40.5	173.2	-72.3	170.3	0	0	0	110.5	V191 E192 I197 F198 N199 T369	V191-I195 HydrophobicContact CG1-CD1 3.73Å; V191-I195 HydrophobicContact CG1-CG1 4.18Å; V191-I195 WeakPolarHBondContact O-CB 3.37Å; V191-I195 VanDerWaalsContact O-CG1 3.32Å; V191-I195 WeakPolarHBondContact O-CG1 3.37Å; V191-I195 PolarHBondContact O-N 2.78Å; E192-I195 PolarHBondContact O-N 3.37Å; I195-I197 PolarHBondContact O-N 3.31Å; I195-F198 WeakPolarHBondContact O-CB 3.24Å; I195-F198 PolarHBondContact O-N 2.91Å; I195-F198 VanDerWaalsContact O-N 3.16Å; I195-N199 PolarHBondContact O-N 2.93Å; I195-T369 HydrophobicContact CG1-CG2 3.93Å
196	K	91.9	Very high	90.9	Very high	128 Å²	128	66.3 Å²	66.3	56%	0.557	32%	0.32	S	S	*	.	H	α-helix	trans	-59.4	-46.9	175.7	-175.9	177.1	174.8	178.8	0	111.5	E192 T193 S194 F198 N199 E200	E192-K196 WeakPolarHBondContact O-CB 3.34Å; E192-K196 PolarHBondContact O-N 3.31Å; T193-K196 PolarHBondContact O-N 2.97Å; S194-K196 VanDerWaalsContact C-N 3.33Å; K196-F198 VanDerWaalsContact C-N 3.27Å; K196-F198 PolarHBondContact O-N 3.23Å; K196-N199 PolarHBondContact O-N 3.49Å; K196-E200 WeakPolarHBondContact CE-OE1 3.47Å; K196-E200 HydrophobicContact CG-CG 4.39Å; K196-E200 WeakPolarHBondContact O-CB 3.46Å; K196-E200 WeakPolarHBondContact O-CG 3.27Å; K196-E200 PolarHBondContact O-N 3.43Å
197	I	93	Very high	91.2	Very high	21 Å²	21	68 Å²	68	11%	0.108	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-40.6	175.1	-67.6	165.3	0	0	0	111.3	L184 P188 T193 S194 I195 F201	L184-I197 HydrophobicContact CD1-CD1 4.21Å; P188-I197 HydrophobicContact CB-CD1 4.21Å; P188-I197 HydrophobicContact CG-CD1 4.21Å; T193-I197 HydrophobicContact CG2-CD1 4.35Å; T193-I197 WeakPolarHBondContact O-CG1 3.43Å; T193-I197 PolarHBondContact O-N 2.96Å; S194-I197 PolarHBondContact O-N 2.98Å; I195-I197 PolarHBondContact O-N 3.31Å; I197-F201 WeakPolarHBondContact O-CB 3.47Å; I197-F201 PolarHBondContact O-N 3.12Å
198	F	92.2	Very high	91.5	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-44.5	176.9	179.8	-95.7	0	0	0	112.1	W173 Y177 S194 I195 K196 F201 A202 P361 T364 F368 T369 I441	W173-F198 AromaticContact CE3-CE2 3.98Å; W173-F198 HydrophobicContact CE3-CE2 3.98Å; W173-F198 HydrophobicContact CE3-CZ 4.42Å; W173-F198 HydrophobicContact CH2-CE2 4.33Å; W173-F198 AromaticContact CH2-CZ 3.97Å; W173-F198 HydrophobicContact CH2-CZ 3.97Å; W173-F198 AromaticContact CZ3-CE2 3.66Å; W173-F198 HydrophobicContact CZ3-CE2 3.66Å; W173-F198 AromaticContact CZ3-CZ 3.67Å; W173-F198 HydrophobicContact CZ3-CZ 3.67Å; Y177-F198 HydrophobicContact CE2-CD2 4.39Å; Y177-F198 WeakPolarHBondContact OH-CA 3.22Å; Y177-F198 WeakPolarHBondContact OH-CB 3.4Å; Y177-F198 WeakPolarHBondContact OH-CD2 3.36Å; S194-F198 PolarHBondContact O-N 3.37Å; I195-F198 WeakPolarHBondContact O-CB 3.24Å; I195-F198 PolarHBondContact O-N 2.91Å; I195-F198 VanDerWaalsContact O-N 3.16Å; K196-F198 VanDerWaalsContact C-N 3.27Å; K196-F198 PolarHBondContact O-N 3.23Å; F198-F201 WeakPolarHBondContact O-CB 3.48Å; F198-F201 PolarHBondContact O-N 3.39Å; F198-A202 HydrophobicContact CD1-CB 4.36Å; F198-A202 HydrophobicContact CE1-CB 3.85Å; F198-A202 HydrophobicContact CE2-CB 4.06Å; F198-A202 HydrophobicContact CZ-CB 3.69Å; F198-A202 WeakPolarHBondContact O-CB 3.37Å; F198-A202 PolarHBondContact O-N 3.46Å; F198-P361 HydrophobicContact CE1-CB 4.04Å; F198-P361 HydrophobicContact CE1-CG 4.2Å; F198-T364 VanDerWaalsContact CZ-OG1 3.29Å; F198-T364 WeakPolarHBondContact CZ-OG1 3.36Å; F198-F368 HydrophobicContact CD2-CB 3.83Å; F198-F368 HydrophobicContact CE2-CB 4.11Å; F198-T369 HydrophobicContact CB-CG2 4.41Å; F198-I441 HydrophobicContact CE1-CD1 4.09Å; F198-I441 HydrophobicContact CZ-CD1 3.92Å
199	N	91.9	Very high	91.7	Very high	36 Å²	36	68.5 Å²	68.5	19%	0.193	32%	0.32	C	S	.	.	H	α-helix	trans	-67.7	-44.3	-179.1	-71.4	-15.2	0	0	0	112.2	I195 K196 F201 A202 Q203 E204	I195-N199 PolarHBondContact O-N 2.93Å; K196-N199 PolarHBondContact O-N 3.49Å; N199-F201 PolarHBondContact O-N 3.25Å; N199-F201 VanDerWaalsContact O-N 3.14Å; N199-A202 PolarHBondContact O-N 2.96Å; N199-Q203 PolarHBondContact O-N 2.76Å; N199-Q203 PolarHBondContact OD1-NE2 3.1Å; N199-E204 PolarHBondContact O-N 2.91Å
200	E	93.3	Very high	92.2	Very high	80 Å²	80	65.1 Å²	65.1	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-54.9	-30.9	173.2	-76.3	177.3	179.3	0	0	111.7	K196 S205	K196-E200 WeakPolarHBondContact CE-OE1 3.47Å; K196-E200 HydrophobicContact CG-CG 4.39Å; K196-E200 WeakPolarHBondContact O-CB 3.46Å; K196-E200 WeakPolarHBondContact O-CG 3.27Å; K196-E200 PolarHBondContact O-N 3.43Å; E200-S205 WeakPolarHBondContact O-CB 3.26Å; E200-S205 PolarHBondContact O-OG 2.86Å
201	F	93.5	Very high	92.7	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-82.2	-65	173.6	168.1	-110	0	0	0	112.4	W173 Y176 Y177 I197 F198 N199 S205 W207 P208 T211	W173-F201 HydrophobicContact CB-CE1 3.99Å; W173-F201 HydrophobicContact CB-CZ 4.21Å; W173-F201 AromaticContact CD1-CE1 3.43Å; W173-F201 VanDerWaalsContact CD1-CE1 3.43Å; W173-F201 AromaticContact CD1-CZ 3.37Å; W173-F201 AromaticContact CD2-CE1 3.9Å; W173-F201 HydrophobicContact CD2-CE1 3.9Å; W173-F201 AromaticContact CG-CE1 3.51Å; W173-F201 HydrophobicContact CG-CE1 3.51Å; W173-F201 AromaticContact CG-CZ 3.82Å; W173-F201 HydrophobicContact CG-CZ 3.82Å; W173-F201 AromaticContact NE1-CE1 3.74Å; W173-F201 AromaticContact NE1-CZ 3.9Å; Y176-F201 HydrophobicContact CD1-CB 4.13Å; Y176-F201 HydrophobicContact CD1-CD1 4.01Å; Y176-F201 AromaticContact CD1-CD2 3.35Å; Y176-F201 HydrophobicContact CD1-CD2 3.35Å; Y176-F201 HydrophobicContact CD1-CE1 4.28Å; Y176-F201 AromaticContact CD1-CE2 3.67Å; Y176-F201 HydrophobicContact CD1-CE2 3.67Å; Y176-F201 AromaticContact CD1-CG 3.54Å; Y176-F201 HydrophobicContact CD1-CG 3.54Å; Y176-F201 HydrophobicContact CD1-CZ 4.13Å; Y176-F201 AromaticContact CD2-CD2 3.67Å; Y176-F201 HydrophobicContact CD2-CD2 3.67Å; Y176-F201 AromaticContact CD2-CE2 3.8Å; Y176-F201 HydrophobicContact CD2-CE2 3.8Å; Y176-F201 HydrophobicContact CE1-CB 3.48Å; Y176-F201 VanDerWaalsContact CE1-CB 3.48Å; Y176-F201 HydrophobicContact CE1-CD1 4.21Å; Y176-F201 AromaticContact CE1-CD2 3.43Å; Y176-F201 HydrophobicContact CE1-CD2 3.43Å; Y176-F201 VanDerWaalsContact CE1-CD2 3.43Å; Y176-F201 HydrophobicContact CE1-CE2 4.23Å; Y176-F201 AromaticContact CE1-CG 3.43Å; Y176-F201 HydrophobicContact CE1-CG 3.43Å; Y176-F201 VanDerWaalsContact CE1-CG 3.43Å; Y176-F201 AromaticContact CE2-CD2 3.76Å; Y176-F201 HydrophobicContact CE2-CD2 3.76Å; Y176-F201 HydrophobicContact CE2-CE2 4.35Å; Y176-F201 AromaticContact CG-CD2 3.46Å; Y176-F201 HydrophobicContact CG-CD2 3.46Å; Y176-F201 VanDerWaalsContact CG-CD2 3.46Å; Y176-F201 AromaticContact CG-CE2 3.42Å; Y176-F201 HydrophobicContact CG-CE2 3.42Å; Y176-F201 VanDerWaalsContact CG-CE2 3.42Å; Y176-F201 HydrophobicContact CG-CG 4.15Å; Y176-F201 HydrophobicContact CG-CZ 4.06Å; Y176-F201 AromaticContact CZ-CD2 3.63Å; Y176-F201 AromaticContact CZ-CG 3.96Å; Y177-F201 HydrophobicContact CE2-CD1 4.33Å; I197-F201 WeakPolarHBondContact O-CB 3.47Å; I197-F201 PolarHBondContact O-N 3.12Å; F198-F201 WeakPolarHBondContact O-CB 3.48Å; F198-F201 PolarHBondContact O-N 3.39Å; N199-F201 PolarHBondContact O-N 3.25Å; N199-F201 VanDerWaalsContact O-N 3.14Å; F201-S205 PolarHBondContact O-OG 3.43Å; F201-W207 HydrophobicContact CD2-CB 3.36Å; F201-W207 HydrophobicContact CD2-CG 4.17Å; F201-W207 HydrophobicContact CE2-CB 3.58Å; F201-P208 HydrophobicContact CD2-CG 4.48Å; F201-P208 HydrophobicContact CE1-CG 4.27Å; F201-P208 HydrophobicContact CE2-CG 4.06Å; F201-P208 HydrophobicContact CZ-CB 4.36Å; F201-P208 HydrophobicContact CZ-CG 3.94Å; F201-P208 WeakPolarHBondContact O-CD 3.19Å; F201-T211 HydrophobicContact CE2-CG2 4.37Å
202	A	91.1	Very high	93.4	Very high	8 Å²	8	60.4 Å²	60.4	7%	0.066	29%	0.288	C	S	.	.	H	α-helix	trans	-84.6	-21.6	-162.3	0	0	0	0	0	114.9	W173 F198 N199	W173-A202 HydrophobicContact CZ2-CB 4.34Å; F198-A202 HydrophobicContact CD1-CB 4.36Å; F198-A202 HydrophobicContact CE1-CB 3.85Å; F198-A202 HydrophobicContact CE2-CB 4.06Å; F198-A202 HydrophobicContact CZ-CB 3.69Å; F198-A202 WeakPolarHBondContact O-CB 3.37Å; F198-A202 PolarHBondContact O-N 3.46Å; N199-A202 PolarHBondContact O-N 2.96Å
203	Q	87.9	Confident	93.8	Very high	103 Å²	103	55 Å²	55	48%	0.481	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-33.1	-172.2	-64	-170.2	72.5	0	0	113.3	N199 I441	N199-Q203 PolarHBondContact O-N 2.76Å; N199-Q203 PolarHBondContact OD1-NE2 3.1Å; Q203-I441 HydrophobicContact CG-CG2 4.23Å
204	E	90.5	Very high	94.2	Very high	139 Å²	139	56 Å²	56	65%	0.65	27%	0.269	S	S	*	.	S	Bend	trans	-105.6	8.4	-171.8	-59.5	171.1	-167	0	0	112.9	N199	N199-E204 PolarHBondContact O-N 2.91Å
205	S	93.9	Very high	94.5	Very high	36 Å²	36	56 Å²	56	25%	0.252	27%	0.268	S	S	.	.	S	Bend	trans	-148.7	173.9	-179.6	83.6	0	0	0	0	113.3	E200 F201 W207	E200-S205 WeakPolarHBondContact O-CB 3.26Å; E200-S205 PolarHBondContact O-OG 2.86Å; F201-S205 PolarHBondContact O-OG 3.43Å; S205-W207 WeakPolarHBondContact OG-CB 3.4Å; S205-W207 PolarHBondContact OG-N 3.2Å; S205-W207 VanDerWaalsContact OG-N 3.15Å
206	Y	94.8	Very high	95	Very high	179 Å²	179	53.3 Å²	53.3	70%	0.702	26%	0.255	S	S	*	.	S	Bend	trans	-98.6	15.8	171.7	-64.7	-73.6	0	0	0	113.4	P208 V209 L210	Y206-P208 VanDerWaalsContact C-CD 3.43Å; Y206-P208 VanDerWaalsContact C-N 3.31Å; Y206-V209 HydrophobicContact CD1-CG2 4.27Å; Y206-V209 WeakPolarHBondContact O-CB 3.48Å; Y206-V209 PolarHBondContact O-N 3.42Å; Y206-V209 VanDerWaalsContact O-N 3.08Å; Y206-L210 PolarHBondContact O-N 3.5Å
207	W	96.7	Very high	95.3	Very high	106 Å²	106	51.7 Å²	51.7	40%	0.402	26%	0.255	S	S	.	.	H	α-helix	trans	-55	-37.9	174.3	-83	109.7	0	0	0	114	Y176 F201 S205 V209 L210 T211	Y176-W207 HydrophobicContact CD2-CD2 4.32Å; Y176-W207 HydrophobicContact CD2-CE3 4.09Å; Y176-W207 AromaticContact CE2-CD2 3.96Å; Y176-W207 HydrophobicContact CE2-CD2 3.96Å; Y176-W207 HydrophobicContact CE2-CE3 4.14Å; Y176-W207 HydrophobicContact CE2-CG 4.17Å; F201-W207 HydrophobicContact CD2-CB 3.36Å; F201-W207 HydrophobicContact CD2-CG 4.17Å; F201-W207 HydrophobicContact CE2-CB 3.58Å; S205-W207 WeakPolarHBondContact OG-CB 3.4Å; S205-W207 PolarHBondContact OG-N 3.2Å; S205-W207 VanDerWaalsContact OG-N 3.15Å; W207-V209 VanDerWaalsContact C-N 3.26Å; W207-V209 PolarHBondContact O-N 3.14Å; W207-L210 HydrophobicContact CE3-CD2 3.89Å; W207-L210 HydrophobicContact CZ3-CD2 3.67Å; W207-L210 PolarHBondContact O-N 3.44Å; W207-T211 HydrophobicContact CE3-CG2 4.44Å; W207-T211 VanDerWaalsContact O-CG2 3.3Å; W207-T211 WeakPolarHBondContact O-CG2 3.42Å; W207-T211 PolarHBondContact O-N 3.25Å; W207-T211 PolarHBondContact O-OG1 2.84Å
208	P	97.2	Very high	95.5	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.019	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-31.7	176	-24.2	34.4	0	0	0	113	V169 F201 Y206 T211 H212 A438	V169-P208 HydrophobicContact CG1-CB 4.38Å; F201-P208 HydrophobicContact CD2-CG 4.48Å; F201-P208 HydrophobicContact CE1-CG 4.27Å; F201-P208 HydrophobicContact CE2-CG 4.06Å; F201-P208 HydrophobicContact CZ-CB 4.36Å; F201-P208 HydrophobicContact CZ-CG 3.94Å; F201-P208 WeakPolarHBondContact O-CD 3.19Å; Y206-P208 VanDerWaalsContact C-CD 3.43Å; Y206-P208 VanDerWaalsContact C-N 3.31Å; P208-T211 WeakPolarHBondContact CA-OG1 2.9Å; P208-T211 PolarHBondContact O-OG1 2.86Å; P208-H212 WeakPolarHBondContact O-CB 3.41Å; P208-H212 PolarHBondContact O-N 3.41Å; P208-A438 WeakPolarHBondContact CB-O 3.28Å
209	V	98.1	Very high	95.8	Very high	31 Å²	31	53.7 Å²	53.7	19%	0.188	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-46	174.3	174.3	0	0	0	0	111.3	Y206 W207 T213 M435 A438 I439	Y206-V209 HydrophobicContact CD1-CG2 4.27Å; Y206-V209 WeakPolarHBondContact O-CB 3.48Å; Y206-V209 PolarHBondContact O-N 3.42Å; Y206-V209 VanDerWaalsContact O-N 3.08Å; W207-V209 VanDerWaalsContact C-N 3.26Å; W207-V209 PolarHBondContact O-N 3.14Å; V209-T213 WeakPolarHBondContact O-CB 3.22Å; V209-T213 PolarHBondContact O-N 2.91Å; V209-T213 PolarHBondContact O-OG1 3.43Å; V209-M435 HydrophobicContact CG1-SD 3.71Å; V209-M435 HydrophobicContact CG2-SD 4.35Å; V209-A438 HydrophobicContact CG2-CB 3.96Å; V209-I439 HydrophobicContact CG2-CG1 3.92Å
210	L	98	Very high	96.1	Very high	101 Å²	101	52.2 Å²	52.2	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-46.5	177.6	175.7	61.2	0	0	0	111.3	Y206 W207 T213 L214	Y206-L210 PolarHBondContact O-N 3.5Å; W207-L210 HydrophobicContact CE3-CD2 3.89Å; W207-L210 HydrophobicContact CZ3-CD2 3.67Å; W207-L210 PolarHBondContact O-N 3.44Å; L210-T213 WeakPolarHBondContact O-CB 3.31Å; L210-T213 PolarHBondContact O-N 3.23Å; L210-L214 WeakPolarHBondContact O-CB 3.41Å; L210-L214 PolarHBondContact O-N 3.22Å
211	T	98.2	Very high	96.2	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-73.9	-33.4	-175.8	58.2	0	0	0	0	112.4	G172 F201 W207 P208 L214 S215	G172-T211 WeakPolarHBondContact CA-O 3.41Å; G172-T211 WeakPolarHBondContact O-CB 3.27Å; F201-T211 HydrophobicContact CE2-CG2 4.37Å; W207-T211 HydrophobicContact CE3-CG2 4.44Å; W207-T211 VanDerWaalsContact O-CG2 3.3Å; W207-T211 WeakPolarHBondContact O-CG2 3.42Å; W207-T211 PolarHBondContact O-N 3.25Å; W207-T211 PolarHBondContact O-OG1 2.84Å; P208-T211 WeakPolarHBondContact CA-OG1 2.9Å; P208-T211 PolarHBondContact O-OG1 2.86Å; T211-L214 PolarHBondContact O-N 3.05Å; T211-S215 PolarHBondContact O-N 3.23Å; T211-S215 PolarHBondContact O-OG 3.29Å
212	H	98.3	Very high	96.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.2	-51.9	165.6	166.8	54.5	0	0	0	111.3	S168 V169 P208 L214 S215 V216 T430 L431 A438	S168-H212 PolarHBondContact OG-CE1 3.27Å; S168-H212 PolarHBondContact OG-ND1 3.47Å; V169-H212 HydrophobicContact CG2-CB 4.21Å; P208-H212 WeakPolarHBondContact O-CB 3.41Å; P208-H212 PolarHBondContact O-N 3.41Å; H212-L214 VanDerWaalsContact C-N 3.28Å; H212-L214 PolarHBondContact O-N 3.44Å; H212-S215 WeakPolarHBondContact O-CB 3.39Å; H212-S215 PolarHBondContact O-N 3.2Å; H212-S215 VanDerWaalsContact O-N 3.16Å; H212-V216 WeakPolarHBondContact O-CG2 3.45Å; H212-V216 PolarHBondContact O-N 3.35Å; H212-T430 PolarHBondContact CE1-O 3.4Å; H212-L431 PolarHBondContact NE2-O 3.42Å; H212-A438 HydrophobicContact CB-CB 4.1Å
213	T	98.5	Very high	96.6	Very high	47 Å²	47	51 Å²	51	29%	0.288	27%	0.266	S	S	.	.	H	α-helix	trans	-58.6	-43.1	177.6	-55.7	0	0	0	0	110.8	V209 L210 V216 V217 L431	V209-T213 WeakPolarHBondContact O-CB 3.22Å; V209-T213 PolarHBondContact O-N 2.91Å; V209-T213 PolarHBondContact O-OG1 3.43Å; L210-T213 WeakPolarHBondContact O-CB 3.31Å; L210-T213 PolarHBondContact O-N 3.23Å; T213-V216 PolarHBondContact O-N 3.24Å; T213-V217 HydrophobicContact CG2-CG2 4.44Å; T213-V217 VanDerWaalsContact O-CG2 3.28Å; T213-V217 WeakPolarHBondContact O-CG2 3.35Å; T213-V217 PolarHBondContact O-N 3.13Å; T213-L431 HydrophobicContact CG2-CD1 3.97Å
214	L	98.4	Very high	96.9	Very high	84 Å²	84	49.9 Å²	49.9	44%	0.44	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-43.9	176.7	-176.8	62	0	0	0	112.2	L175 L210 T211 H212 V216 V217 I218	L175-L214 HydrophobicContact CD1-CD2 4.31Å; L175-L214 HydrophobicContact CD1-CG 4.31Å; L210-L214 WeakPolarHBondContact O-CB 3.41Å; L210-L214 PolarHBondContact O-N 3.22Å; T211-L214 PolarHBondContact O-N 3.05Å; H212-L214 VanDerWaalsContact C-N 3.28Å; H212-L214 PolarHBondContact O-N 3.44Å; L214-V216 VanDerWaalsContact C-N 3.34Å; L214-V216 PolarHBondContact O-N 2.8Å; L214-V217 PolarHBondContact O-N 3.25Å; L214-I218 HydrophobicContact CD1-CD1 4.16Å; L214-I218 HydrophobicContact CD1-CG1 4.3Å; L214-I218 HydrophobicContact CG-CD1 3.92Å; L214-I218 HydrophobicContact CG-CG1 4.48Å; L214-I218 VanDerWaalsContact O-CG1 3.3Å; L214-I218 WeakPolarHBondContact O-CG1 3.43Å; L214-I218 PolarHBondContact O-N 2.93Å
215	S	98.5	Very high	97	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-47.5	175.1	-60.6	0	0	0	0	111.7	S168 G172 T211 H212 I218 V219	S168-S215 WeakPolarHBondContact O-CB 3.48Å; S168-S215 PolarHBondContact O-OG 2.92Å; G172-S215 VanDerWaalsContact CA-OG 3.27Å; G172-S215 WeakPolarHBondContact CA-OG 3.08Å; G172-S215 PolarHBondContact N-OG 3.39Å; T211-S215 PolarHBondContact O-N 3.23Å; T211-S215 PolarHBondContact O-OG 3.29Å; H212-S215 WeakPolarHBondContact O-CB 3.39Å; H212-S215 PolarHBondContact O-N 3.2Å; H212-S215 VanDerWaalsContact O-N 3.16Å; S215-I218 PolarHBondContact O-N 3.22Å; S215-V219 WeakPolarHBondContact O-CG2 3.47Å; S215-V219 PolarHBondContact O-N 3.34Å; S215-V219 VanDerWaalsContact O-N 3.08Å
216	V	98.4	Very high	97	Very high	11 Å²	11	43.2 Å²	43.2	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-41.7	178.4	176.5	0	0	0	0	111.1	H212 T213 L214 V219 G220 L427 T430 L431	H212-V216 WeakPolarHBondContact O-CG2 3.45Å; H212-V216 PolarHBondContact O-N 3.35Å; T213-V216 PolarHBondContact O-N 3.24Å; L214-V216 VanDerWaalsContact C-N 3.34Å; L214-V216 PolarHBondContact O-N 2.8Å; V216-V219 PolarHBondContact O-N 3.02Å; V216-G220 PolarHBondContact O-N 3.21Å; V216-L427 HydrophobicContact CG1-CB 4.06Å; V216-L427 HydrophobicContact CG1-CD2 3.93Å; V216-T430 HydrophobicContact CG2-CG2 3.89Å; V216-L431 HydrophobicContact CB-CD1 4.5Å
217	V	98.2	Very high	96.9	Very high	94 Å²	94	34.8 Å²	34.8	57%	0.57	20%	0.201	S	C	*	.	H	α-helix	trans	-63.8	-45.2	178.1	168.4	0	0	0	0	111.7	T213 L214 V219 G220 G221	T213-V217 HydrophobicContact CG2-CG2 4.44Å; T213-V217 VanDerWaalsContact O-CG2 3.28Å; T213-V217 WeakPolarHBondContact O-CG2 3.35Å; T213-V217 PolarHBondContact O-N 3.13Å; L214-V217 PolarHBondContact O-N 3.25Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 2.93Å; V217-G220 PolarHBondContact O-N 3.45Å; V217-G221 PolarHBondContact O-N 3.45Å; V217-G221 VanDerWaalsContact O-N 3.1Å
218	I	98.2	Very high	96.6	Very high	63 Å²	63	33.7 Å²	33.7	32%	0.323	20%	0.199	S	C	.	.	H	α-helix	trans	-59.6	-47.6	177.4	-68.8	166.6	0	0	0	110.1	L175 L214 S215 G220 G221 I398	L175-I218 HydrophobicContact CD1-CD1 3.93Å; L175-I218 HydrophobicContact CD2-CD1 4.42Å; L214-I218 HydrophobicContact CD1-CD1 4.16Å; L214-I218 HydrophobicContact CD1-CG1 4.3Å; L214-I218 HydrophobicContact CG-CD1 3.92Å; L214-I218 HydrophobicContact CG-CG1 4.48Å; L214-I218 VanDerWaalsContact O-CG1 3.3Å; L214-I218 WeakPolarHBondContact O-CG1 3.43Å; L214-I218 PolarHBondContact O-N 2.93Å; S215-I218 PolarHBondContact O-N 3.22Å; I218-G220 VanDerWaalsContact C-N 3.29Å; I218-G220 PolarHBondContact O-N 3.16Å; I218-G221 WeakPolarHBondContact O-CA 3.32Å; I218-G221 PolarHBondContact O-N 3.21Å; I218-G221 VanDerWaalsContact O-N 3.09Å; I218-I398 HydrophobicContact CB-CD1 4.05Å; I218-I398 HydrophobicContact CG2-CD1 3.77Å; I218-I398 HydrophobicContact CG2-CG1 4.33Å; I218-I398 HydrophobicContact CG2-CG2 4.13Å
219	V	98.1	Very high	96.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-35.5	177.5	168.7	0	0	0	0	111.9	S215 V216 V217 G221 C222 I223 I398 L401 I402 V405 L427	S215-V219 WeakPolarHBondContact O-CG2 3.47Å; S215-V219 PolarHBondContact O-N 3.34Å; S215-V219 VanDerWaalsContact O-N 3.08Å; V216-V219 PolarHBondContact O-N 3.02Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 2.93Å; V219-G221 VanDerWaalsContact C-N 3.26Å; V219-G221 PolarHBondContact O-N 2.93Å; V219-C222 WeakPolarHBondContact O-CB 3.46Å; V219-C222 PolarHBondContact O-N 2.87Å; V219-I223 HydrophobicContact CG1-CD1 3.47Å; V219-I223 VanDerWaalsContact CG1-CD1 3.47Å; V219-I223 HydrophobicContact CG1-CG1 4.09Å; V219-I223 WeakPolarHBondContact O-CG1 3.4Å; V219-I223 PolarHBondContact O-N 3.45Å; V219-I223 VanDerWaalsContact O-N 3.07Å; V219-I398 HydrophobicContact CG2-CD1 3.99Å; V219-I398 HydrophobicContact CG2-CG2 4.23Å; V219-L401 HydrophobicContact CB-CD2 4.46Å; V219-L401 HydrophobicContact CG1-CG 4.48Å; V219-L401 HydrophobicContact CG2-CB 3.98Å; V219-L401 HydrophobicContact CG2-CD2 3.7Å; V219-L401 HydrophobicContact CG2-CG 3.79Å; V219-I402 HydrophobicContact CB-CG1 4.46Å; V219-I402 HydrophobicContact CG1-CG1 4.03Å; V219-I402 HydrophobicContact CG2-CG1 4.05Å; V219-V405 HydrophobicContact CG1-CB 4.34Å; V219-V405 HydrophobicContact CG1-CG2 4.21Å; V219-L427 HydrophobicContact CG1-CD2 4.25Å
220	G	97.5	Very high	96.4	Very high	4 Å²	4	38 Å²	38	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-55.8	-42.6	172.1	0	0	0	0	0	112.2	V216 V217 I218 C222 I223 F224 L427	V216-G220 PolarHBondContact O-N 3.21Å; V217-G220 PolarHBondContact O-N 3.45Å; I218-G220 VanDerWaalsContact C-N 3.29Å; I218-G220 PolarHBondContact O-N 3.16Å; G220-C222 PolarHBondContact O-N 3.16Å; G220-C222 VanDerWaalsContact O-N 3.1Å; G220-I223 PolarHBondContact O-N 3.46Å; G220-I223 VanDerWaalsContact O-N 3.16Å; G220-F224 WeakPolarHBondContact O-CD2 3.13Å; G220-F224 PolarHBondContact O-N 3.17Å; G220-L427 VanDerWaalsContact CA-CD1 3.5Å
221	G	95.9	Very high	96.3	Very high	45 Å²	45	33.2 Å²	33.2	46%	0.464	19%	0.187	S	C	.	.	H	α-helix	trans	-57.8	-20.3	173.7	0	0	0	0	0	114.7	V217 I218 V219	V217-G221 PolarHBondContact O-N 3.45Å; V217-G221 VanDerWaalsContact O-N 3.1Å; I218-G221 WeakPolarHBondContact O-CA 3.32Å; I218-G221 PolarHBondContact O-N 3.21Å; I218-G221 VanDerWaalsContact O-N 3.09Å; V219-G221 VanDerWaalsContact C-N 3.26Å; V219-G221 PolarHBondContact O-N 2.93Å
222	C	96.8	Very high	96.2	Very high	18 Å²	18	38.9 Å²	38.9	12%	0.122	21%	0.211	C	C	.	.	H	α-helix	trans	-96.8	-30.7	176.4	-56.9	0	0	0	0	113.2	V219 G220 W229 I230 A233 I402	V219-C222 WeakPolarHBondContact O-CB 3.46Å; V219-C222 PolarHBondContact O-N 2.87Å; G220-C222 PolarHBondContact O-N 3.16Å; G220-C222 VanDerWaalsContact O-N 3.1Å; C222-W229 CarbonylContact O-C 3.59Å; C222-W229 WeakPolarHBondContact O-CB 3.42Å; C222-I230 PolarHBondContact O-N 3.07Å; C222-A233 HydrophobicContact CB-CB 4.21Å; C222-I402 HydrophobicContact CB-CD1 3.72Å; C222-I402 HydrophobicContact CB-CG1 4.03Å
223	I	96.1	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-89.4	-31.4	-169.6	-69.9	-177.4	0	0	0	113.1	V219 G220 G225 G226 I230 I402 V405 V409 H419 A423	V219-I223 HydrophobicContact CG1-CD1 3.47Å; V219-I223 VanDerWaalsContact CG1-CD1 3.47Å; V219-I223 HydrophobicContact CG1-CG1 4.09Å; V219-I223 WeakPolarHBondContact O-CG1 3.4Å; V219-I223 PolarHBondContact O-N 3.45Å; V219-I223 VanDerWaalsContact O-N 3.07Å; G220-I223 PolarHBondContact O-N 3.46Å; G220-I223 VanDerWaalsContact O-N 3.16Å; I223-G225 PolarHBondContact O-N 2.98Å; I223-G225 VanDerWaalsContact O-N 3.16Å; I223-G226 PolarHBondContact O-N 3.42Å; I223-I230 HydrophobicContact CG1-CD1 4.37Å; I223-I230 HydrophobicContact CG1-CG1 4.47Å; I223-I402 HydrophobicContact CG1-CG2 4.31Å; I223-V405 HydrophobicContact CD1-CB 3.44Å; I223-V405 VanDerWaalsContact CD1-CB 3.44Å; I223-V405 HydrophobicContact CD1-CG1 3.37Å; I223-V409 HydrophobicContact CG2-CG2 3.83Å; I223-H419 PolarHBondContact O-NE2 3.16Å; I223-A423 HydrophobicContact CG2-CB 3.81Å
224	F	95.5	Very high	96	Very high	79 Å²	79	37.4 Å²	37.4	35%	0.346	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.9	-174.2	-85.7	-66	0	0	0	114.4	G220 G226 H419 A423 F424 L427	G220-F224 WeakPolarHBondContact O-CD2 3.13Å; G220-F224 PolarHBondContact O-N 3.17Å; F224-G226 VanDerWaalsContact C-N 3.34Å; F224-H419 PolarHBondContact O-CD2 3.17Å; F224-A423 HydrophobicContact CD1-CB 3.84Å; F224-A423 HydrophobicContact CE1-CB 3.92Å; F224-F424 HydrophobicContact CE1-CB 4.26Å; F224-F424 HydrophobicContact CZ-CB 4.38Å; F224-L427 HydrophobicContact CD2-CD1 4.32Å; F224-L427 HydrophobicContact CE2-CD1 3.59Å; F224-L427 HydrophobicContact CZ-CD1 3.8Å
225	G	92.4	Very high	95.9	Very high	29 Å²	29	36.8 Å²	36.8	30%	0.299	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	13.2	174.6	0	0	0	0	0	115.4	I223 W229	I223-G225 PolarHBondContact O-N 2.98Å; I223-G225 VanDerWaalsContact O-N 3.16Å; G225-W229 VanDerWaalsContact CA-CD2 3.43Å; G225-W229 VanDerWaalsContact CA-CG 3.47Å
226	G	93	Very high	95.9	Very high	7 Å²	7	40.5 Å²	40.5	7%	0.072	22%	0.221	C	C	.	.			trans	70.9	-159	173.7	0	0	0	0	0	113.8	I223 F224 K228 W229 I230 H419	I223-G226 PolarHBondContact O-N 3.42Å; F224-G226 VanDerWaalsContact C-N 3.34Å; G226-K228 PolarHBondContact O-N 3.09Å; G226-K228 VanDerWaalsContact O-N 3.09Å; G226-W229 PolarHBondContact O-N 3.45Å; G226-I230 PolarHBondContact O-N 3.24Å; G226-H419 VanDerWaalsContact CA-CE1 3.47Å; G226-H419 WeakPolarHBondContact CA-CE1 3.22Å; G226-H419 VanDerWaalsContact CA-NE2 3.3Å; G226-H419 WeakPolarHBondContact CA-NE2 3.19Å; G226-H419 PolarHBondContact N-NE2 2.88Å
227	I	92.2	Very high	95.8	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-30.4	-170.4	-158.3	63	0	0	0	112.7	S66 F68 W229 I230 E231 Y300 Y303	S66-I227 WeakPolarHBondContact O-CG2 3.23Å; S66-I227 WeakPolarHBondContact OG-CG2 3.28Å; F68-I227 HydrophobicContact CD1-CG1 4.21Å; F68-I227 HydrophobicContact CD2-CG1 4.12Å; F68-I227 HydrophobicContact CE1-CD1 4.02Å; F68-I227 HydrophobicContact CE1-CG1 3.88Å; F68-I227 HydrophobicContact CE2-CD1 3.95Å; F68-I227 HydrophobicContact CE2-CG1 3.79Å; F68-I227 HydrophobicContact CG-CG1 4.35Å; F68-I227 HydrophobicContact CZ-CD1 3.57Å; F68-I227 HydrophobicContact CZ-CG1 3.7Å; I227-W229 PolarHBondContact O-N 2.81Å; I227-I230 HydrophobicContact CD1-CD1 4.5Å; I227-I230 PolarHBondContact O-N 2.9Å; I227-E231 WeakPolarHBondContact O-CB 3.39Å; I227-E231 PolarHBondContact O-N 3.47Å; I227-Y300 HydrophobicContact CD1-CD1 4.01Å; I227-Y300 HydrophobicContact CD1-CE1 4.28Å; I227-Y303 HydrophobicContact CB-CD1 4.35Å; I227-Y303 HydrophobicContact CB-CG 4.38Å; I227-Y303 HydrophobicContact CD1-CD2 4.01Å; I227-Y303 HydrophobicContact CD1-CE2 4.41Å; I227-Y303 HydrophobicContact CD1-CG 4.38Å; I227-Y303 HydrophobicContact CG1-CD2 4.26Å; I227-Y303 HydrophobicContact CG1-CG 4.12Å; I227-Y303 HydrophobicContact CG2-CD1 4.33Å
228	K	91.9	Very high	95.8	Very high	83 Å²	83	36.8 Å²	36.8	36%	0.361	20%	0.198	S	C	.	.	H	α-helix	trans	-65.9	-37	177.9	-66.9	-177.5	177.1	177	0	112.7	G226 K232	G226-K228 PolarHBondContact O-N 3.09Å; G226-K228 VanDerWaalsContact O-N 3.09Å; K228-K232 VanDerWaalsContact O-CG 3.27Å; K228-K232 WeakPolarHBondContact O-CG 3.47Å; K228-K232 PolarHBondContact O-N 3.33Å; K228-K232 VanDerWaalsContact O-N 3.11Å
229	W	95.3	Very high	95.7	Very high	125 Å²	125	36.5 Å²	36.5	47%	0.473	20%	0.2	S	C	.	.	H	α-helix	trans	-78.2	-36.5	178.5	-76.3	33.9	0	0	0	111	C222 G225 G226 I227 K232 A233	C222-W229 CarbonylContact O-C 3.59Å; C222-W229 WeakPolarHBondContact O-CB 3.42Å; G225-W229 VanDerWaalsContact CA-CD2 3.43Å; G225-W229 VanDerWaalsContact CA-CG 3.47Å; G226-W229 PolarHBondContact O-N 3.45Å; I227-W229 PolarHBondContact O-N 2.81Å; W229-K232 PolarHBondContact O-N 2.96Å; W229-A233 WeakPolarHBondContact O-CB 3.16Å; W229-A233 PolarHBondContact O-N 3.11Å
230	I	95.1	Very high	95.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-47.8	171.3	-63.3	172.4	0	0	0	110.5	C222 I223 G226 I227 K232 A233 N234 Y300 I402 Q406	C222-I230 PolarHBondContact O-N 3.07Å; I223-I230 HydrophobicContact CG1-CD1 4.37Å; I223-I230 HydrophobicContact CG1-CG1 4.47Å; G226-I230 PolarHBondContact O-N 3.24Å; I227-I230 HydrophobicContact CD1-CD1 4.5Å; I227-I230 PolarHBondContact O-N 2.9Å; I230-K232 PolarHBondContact O-N 3.26Å; I230-A233 PolarHBondContact O-N 3.39Å; I230-N234 WeakPolarHBondContact CG2-ND2 3.34Å; I230-N234 WeakPolarHBondContact O-CB 3.43Å; I230-N234 PolarHBondContact O-N 3.45Å; I230-N234 PolarHBondContact O-ND2 3.32Å; I230-Y300 HydrophobicContact CG2-CE1 3.77Å; I230-I402 HydrophobicContact CB-CG2 4.2Å; I230-I402 HydrophobicContact CD1-CG2 4.08Å; I230-I402 HydrophobicContact CG1-CG2 3.75Å; I230-I402 HydrophobicContact CG2-CG2 3.6Å; I230-Q406 HydrophobicContact CD1-CB 4.25Å; I230-Q406 HydrophobicContact CD1-CG 4Å
231	E	95.3	Very high	95.6	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-57.1	-49.7	175.4	-173.4	-173.1	-179.2	0	0	110.8	F68 N69 S70 I227 A233 N234 M235	F68-E231 HydrophobicContact CD1-CB 4.11Å; F68-E231 HydrophobicContact CD1-CG 4.04Å; F68-E231 HydrophobicContact CE1-CB 4.4Å; N69-E231 WeakPolarHBondContact CB-OE2 3.21Å; N69-E231 PolarHBondContact N-OE1 3.44Å; N69-E231 PolarHBondContact N-OE2 2.99Å; N69-E231 PolarHBondContact ND2-OE2 3.45Å; S70-E231 PolarHBondContact N-OE1 2.88Å; S70-E231 PolarHBondContact OG-OE1 3.18Å; I227-E231 WeakPolarHBondContact O-CB 3.39Å; I227-E231 PolarHBondContact O-N 3.47Å; E231-A233 PolarHBondContact O-N 3.4Å; E231-N234 PolarHBondContact O-N 3.26Å; E231-M235 HydrophobicContact CG-CE 4.11Å; E231-M235 HydrophobicContact CG-CG 4.42Å; E231-M235 HydrophobicContact CG-SD 4.4Å; E231-M235 WeakPolarHBondContact O-CB 3.44Å; E231-M235 VanDerWaalsContact O-CG 3.26Å; E231-M235 WeakPolarHBondContact O-CG 3.28Å; E231-M235 PolarHBondContact O-N 2.88Å
232	K	95.9	Very high	95.6	Very high	124 Å²	124	40.8 Å²	40.8	54%	0.539	21%	0.21	S	C	.	.	H	α-helix	trans	-59.3	-42.7	178.2	-76.5	175.9	-179.1	-174.3	0	112.9	K228 W229 I230 M235	K228-K232 VanDerWaalsContact O-CG 3.27Å; K228-K232 WeakPolarHBondContact O-CG 3.47Å; K228-K232 PolarHBondContact O-N 3.33Å; K228-K232 VanDerWaalsContact O-N 3.11Å; W229-K232 PolarHBondContact O-N 2.96Å; I230-K232 PolarHBondContact O-N 3.26Å; K232-M235 HydrophobicContact CB-CE 4.48Å; K232-M235 HydrophobicContact CG-CE 4.05Å
233	A	96.8	Very high	95.6	Very high	17 Å²	17	41.8 Å²	41.8	14%	0.14	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-49.5	177	0	0	0	0	0	110.9	C222 W229 I230 E231 M235 V236 L237 I402	C222-A233 HydrophobicContact CB-CB 4.21Å; W229-A233 WeakPolarHBondContact O-CB 3.16Å; W229-A233 PolarHBondContact O-N 3.11Å; I230-A233 PolarHBondContact O-N 3.39Å; E231-A233 PolarHBondContact O-N 3.4Å; A233-M235 VanDerWaalsContact C-N 3.31Å; A233-M235 PolarHBondContact O-N 2.62Å; A233-V236 PolarHBondContact O-N 2.94Å; A233-L237 HydrophobicContact CB-CD1 4.42Å; A233-L237 WeakPolarHBondContact O-CG 3.46Å; A233-L237 PolarHBondContact O-N 3.49Å; A233-I402 HydrophobicContact CB-CD1 4.37Å
234	N	97	Very high	95.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-30.3	-179.5	-72.3	-32.4	0	0	0	113	S77 I230 E231 V236 V238 P239 T399	S77-N234 WeakPolarHBondContact CA-ND2 3.18Å; S77-N234 WeakPolarHBondContact CB-ND2 3.34Å; S77-N234 PolarHBondContact OG-ND2 3.16Å; I230-N234 WeakPolarHBondContact CG2-ND2 3.34Å; I230-N234 WeakPolarHBondContact O-CB 3.43Å; I230-N234 PolarHBondContact O-N 3.45Å; I230-N234 PolarHBondContact O-ND2 3.32Å; E231-N234 PolarHBondContact O-N 3.26Å; N234-V236 PolarHBondContact O-N 3.01Å; N234-V238 HydrophobicContact CB-CG2 4.19Å; N234-V238 WeakPolarHBondContact O-CB 3.29Å; N234-V238 PolarHBondContact O-N 3.41Å; N234-V238 VanDerWaalsContact O-N 3.16Å; N234-P239 WeakPolarHBondContact O-CD 3.36Å; N234-T399 WeakPolarHBondContact OD1-CG2 3.11Å
235	M	96.8	Very high	95.4	Very high	70 Å²	70	39.4 Å²	39.4	35%	0.345	21%	0.213	S	C	.	.	H	α-helix	trans	-62.6	-18.2	172.5	-79	-166.9	-63.1	0	0	113.6	L76 E231 K232 A233 P239	L76-M235 HydrophobicContact CD1-CG 4.32Å; E231-M235 HydrophobicContact CG-CE 4.11Å; E231-M235 HydrophobicContact CG-CG 4.42Å; E231-M235 HydrophobicContact CG-SD 4.4Å; E231-M235 WeakPolarHBondContact O-CB 3.44Å; E231-M235 VanDerWaalsContact O-CG 3.26Å; E231-M235 WeakPolarHBondContact O-CG 3.28Å; E231-M235 PolarHBondContact O-N 2.88Å; K232-M235 HydrophobicContact CB-CE 4.48Å; K232-M235 HydrophobicContact CG-CE 4.05Å; A233-M235 VanDerWaalsContact C-N 3.31Å; A233-M235 PolarHBondContact O-N 2.62Å; M235-P239 WeakPolarHBondContact O-CG 3.5Å
236	V	97.2	Very high	95.6	Very high	78 Å²	78	43.1 Å²	43.1	47%	0.473	23%	0.225	S	C	.	.	H	α-helix	trans	-104.8	-52.4	175.9	179.1	0	0	0	0	110.9	A233 N234 V238 P239 M240	A233-V236 PolarHBondContact O-N 2.94Å; N234-V236 PolarHBondContact O-N 3.01Å; V236-V238 PolarHBondContact O-N 2.84Å; V236-P239 WeakPolarHBondContact O-CD 3.13Å; V236-M240 HydrophobicContact CG1-CE 3.83Å; V236-M240 HydrophobicContact CG1-SD 3.95Å; V236-M240 WeakPolarHBondContact O-CB 3.44Å; V236-M240 VanDerWaalsContact O-CG 3.3Å; V236-M240 WeakPolarHBondContact O-CG 3.26Å; V236-M240 PolarHBondContact O-N 3.47Å
237	L	97	Very high	95.6	Very high	27 Å²	27	48.2 Å²	48.2	14%	0.141	25%	0.246	C	C	.	.	H	α-helix	trans	-66.5	-41	-171.7	-64.3	175.6	0	0	0	112.8	A233 M240 L241 F395 I398 T399	A233-L237 HydrophobicContact CB-CD1 4.42Å; A233-L237 WeakPolarHBondContact O-CG 3.46Å; A233-L237 PolarHBondContact O-N 3.49Å; L237-M240 PolarHBondContact O-N 3.3Å; L237-L241 PolarHBondContact O-N 2.89Å; L237-F395 HydrophobicContact CD2-CD1 3.72Å; L237-F395 HydrophobicContact CD2-CE1 3.91Å; L237-F395 HydrophobicContact CD2-CG 4.04Å; L237-F395 HydrophobicContact CD2-CZ 4.39Å; L237-I398 HydrophobicContact CD1-CG2 4.01Å; L237-T399 HydrophobicContact CB-CG2 3.51Å; L237-T399 HydrophobicContact CD1-CG2 3.81Å; L237-T399 HydrophobicContact CG-CG2 4.32Å
238	V	97.4	Very high	95.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.4	-45.9	-176.3	-179.7	0	0	0	0	112	L76 L79 G80 N234 V236 M240 L241 L242 T399	L76-V238 HydrophobicContact CD2-CB 4.3Å; L76-V238 HydrophobicContact CD2-CG1 3.92Å; L79-V238 HydrophobicContact CB-CG1 4.23Å; G80-V238 VanDerWaalsContact CA-CG2 3.45Å; N234-V238 HydrophobicContact CB-CG2 4.19Å; N234-V238 WeakPolarHBondContact O-CB 3.29Å; N234-V238 PolarHBondContact O-N 3.41Å; N234-V238 VanDerWaalsContact O-N 3.16Å; V236-V238 PolarHBondContact O-N 2.84Å; V238-M240 VanDerWaalsContact C-N 3.29Å; V238-M240 PolarHBondContact O-N 3.33Å; V238-L241 HydrophobicContact CB-CD2 4.4Å; V238-L241 HydrophobicContact CG1-CD2 4.44Å; V238-L241 HydrophobicContact CG2-CD2 4.32Å; V238-L241 WeakPolarHBondContact O-CG 3.31Å; V238-L241 PolarHBondContact O-N 3.18Å; V238-L242 HydrophobicContact CG1-CD1 4.04Å; V238-L242 HydrophobicContact CG1-CG 4.39Å; V238-L242 WeakPolarHBondContact O-CB 3.25Å; V238-L242 WeakPolarHBondContact O-CG 3.41Å; V238-L242 PolarHBondContact O-N 2.96Å; V238-T399 HydrophobicContact CG2-CG2 3.98Å
239	P	97.3	Very high	95.5	Very high	58 Å²	58	47 Å²	47	38%	0.377	24%	0.241	S	C	.	.	H	α-helix	trans	-59.4	-39.1	171.5	-28.4	38.2	0	0	0	113.2	L76 N234 M235 V236 G243	L76-P239 HydrophobicContact CD1-CG 3.94Å; L76-P239 HydrophobicContact CD2-CG 4.31Å; N234-P239 WeakPolarHBondContact O-CD 3.36Å; M235-P239 WeakPolarHBondContact O-CG 3.5Å; V236-P239 WeakPolarHBondContact O-CD 3.13Å; P239-G243 PolarHBondContact O-N 3.07Å
240	M	96.4	Very high	95.4	Very high	99 Å²	99	42.7 Å²	42.7	49%	0.488	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-46.9	176.7	-75.3	-175.5	174.1	0	0	112.2	V236 L237 V238 L242 G243 I244 F395	V236-M240 HydrophobicContact CG1-CE 3.83Å; V236-M240 HydrophobicContact CG1-SD 3.95Å; V236-M240 WeakPolarHBondContact O-CB 3.44Å; V236-M240 VanDerWaalsContact O-CG 3.3Å; V236-M240 WeakPolarHBondContact O-CG 3.26Å; V236-M240 PolarHBondContact O-N 3.47Å; L237-M240 PolarHBondContact O-N 3.3Å; V238-M240 VanDerWaalsContact C-N 3.29Å; V238-M240 PolarHBondContact O-N 3.33Å; M240-L242 PolarHBondContact O-N 2.98Å; M240-G243 PolarHBondContact O-N 2.94Å; M240-I244 VanDerWaalsContact O-CG1 3.31Å; M240-I244 WeakPolarHBondContact O-CG1 3.46Å; M240-I244 PolarHBondContact O-N 3.43Å; M240-F395 HydrophobicContact CB-CD2 3.96Å; M240-F395 HydrophobicContact CB-CE2 3.83Å; M240-F395 HydrophobicContact SD-CE2 3.91Å; M240-F395 HydrophobicContact SD-CZ 4.31Å
241	L	96.2	Very high	95.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-44.5	179	88.7	84.2	0	0	0	110.9	I83 L237 V238 G243 I244 L245 C392 F395 A396	I83-L241 HydrophobicContact CG2-CD1 3.55Å; L237-L241 PolarHBondContact O-N 2.89Å; V238-L241 HydrophobicContact CB-CD2 4.4Å; V238-L241 HydrophobicContact CG1-CD2 4.44Å; V238-L241 HydrophobicContact CG2-CD2 4.32Å; V238-L241 WeakPolarHBondContact O-CG 3.31Å; V238-L241 PolarHBondContact O-N 3.18Å; L241-G243 VanDerWaalsContact C-N 3.34Å; L241-G243 PolarHBondContact O-N 3.33Å; L241-I244 PolarHBondContact O-N 3.3Å; L241-L245 WeakPolarHBondContact O-CB 3.11Å; L241-L245 PolarHBondContact O-N 3.16Å; L241-C392 PolarHBondContact O-SG 2.92Å; L241-F395 HydrophobicContact CB-CB 4.11Å; L241-A396 HydrophobicContact CD2-CB 4.47Å
242	L	96.2	Very high	95.1	Very high	41 Å²	41	44.2 Å²	44.2	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-39.4	179.1	-71.5	177.6	0	0	0	111.5	I83 V238 M240 L245 I246 V324	I83-L242 HydrophobicContact CD1-CD2 4.04Å; V238-L242 HydrophobicContact CG1-CD1 4.04Å; V238-L242 HydrophobicContact CG1-CG 4.39Å; V238-L242 WeakPolarHBondContact O-CB 3.25Å; V238-L242 WeakPolarHBondContact O-CG 3.41Å; V238-L242 PolarHBondContact O-N 2.96Å; M240-L242 PolarHBondContact O-N 2.98Å; L242-L245 PolarHBondContact O-N 3.09Å; L242-I246 WeakPolarHBondContact O-CB 3.44Å; L242-I246 VanDerWaalsContact O-CG1 3.27Å; L242-I246 WeakPolarHBondContact O-CG1 3.43Å; L242-I246 PolarHBondContact O-N 3.34Å; L242-V324 HydrophobicContact CD2-CG2 4.22Å
243	G	96.4	Very high	95	Very high	39 Å²	39	42 Å²	42	40%	0.402	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-46.3	174.5	0	0	0	0	0	112.2	P239 M240 L241 L245 F247	P239-G243 PolarHBondContact O-N 3.07Å; M240-G243 PolarHBondContact O-N 2.94Å; L241-G243 VanDerWaalsContact C-N 3.34Å; L241-G243 PolarHBondContact O-N 3.33Å; G243-L245 VanDerWaalsContact C-N 3.34Å; G243-L245 PolarHBondContact O-N 2.91Å; G243-F247 VanDerWaalsContact O-CB 3.28Å; G243-F247 WeakPolarHBondContact O-CB 3.47Å; G243-F247 PolarHBondContact O-N 2.78Å
244	I	94.5	Very high	94.8	Very high	21 Å²	21	46.3 Å²	46.3	11%	0.108	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.6	-63.8	164.6	0	0	0	110.9	M240 L241 F247 T248 L388 L391 C392	M240-I244 VanDerWaalsContact O-CG1 3.31Å; M240-I244 WeakPolarHBondContact O-CG1 3.46Å; M240-I244 PolarHBondContact O-N 3.43Å; L241-I244 PolarHBondContact O-N 3.3Å; I244-F247 PolarHBondContact O-N 3.26Å; I244-T248 HydrophobicContact CG2-CG2 4.19Å; I244-T248 WeakPolarHBondContact O-CB 3.37Å; I244-T248 WeakPolarHBondContact O-CG2 3.35Å; I244-T248 PolarHBondContact O-N 3.43Å; I244-T248 PolarHBondContact O-OG1 3.34Å; I244-L388 HydrophobicContact CD1-CD2 4.48Å; I244-L388 HydrophobicContact CG1-CD2 4.38Å; I244-L388 HydrophobicContact CG2-CB 3.96Å; I244-L388 WeakPolarHBondContact CG2-O 3.23Å; I244-L391 HydrophobicContact CD1-CD2 4.25Å; I244-L391 HydrophobicContact CD1-CG 4.37Å; I244-C392 HydrophobicContact CB-CB 4.09Å; I244-C392 HydrophobicContact CD1-CB 4.21Å; I244-C392 HydrophobicContact CG2-CB 3.7Å
245	L	93.7	Very high	94.5	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-47.7	179.5	-177	131.4	0	0	0	112	I88 L241 L242 G243 F247 T248 F249 V324 L327 C328	I88-L245 HydrophobicContact CG1-CD1 4.43Å; L241-L245 WeakPolarHBondContact O-CB 3.11Å; L241-L245 PolarHBondContact O-N 3.16Å; L242-L245 PolarHBondContact O-N 3.09Å; G243-L245 VanDerWaalsContact C-N 3.34Å; G243-L245 PolarHBondContact O-N 2.91Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 3.11Å; L245-T248 PolarHBondContact O-N 2.85Å; L245-T248 PolarHBondContact O-OG1 3.25Å; L245-T248 VanDerWaalsContact O-OG1 3.11Å; L245-F249 VanDerWaalsContact O-CB 3.24Å; L245-F249 WeakPolarHBondContact O-CB 3.38Å; L245-F249 PolarHBondContact O-N 2.85Å; L245-V324 HydrophobicContact CD1-CG1 3.71Å; L245-V324 HydrophobicContact CD2-CG1 4.26Å; L245-L327 HydrophobicContact CD2-CB 4.07Å; L245-L327 HydrophobicContact CD2-CD1 3.92Å; L245-C328 WeakPolarHBondContact CD1-SG 3.39Å
246	I	95.5	Very high	94.4	Very high	107 Å²	107	52.2 Å²	52.2	55%	0.549	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-42.1	177.6	-67.9	165.9	0	0	0	110.6	L242 G250	L242-I246 WeakPolarHBondContact O-CB 3.44Å; L242-I246 VanDerWaalsContact O-CG1 3.27Å; L242-I246 WeakPolarHBondContact O-CG1 3.43Å; L242-I246 PolarHBondContact O-N 3.34Å; I246-G250 PolarHBondContact O-N 3.47Å
247	F	93.3	Very high	94.2	Very high	115 Å²	115	52.2 Å²	52.2	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-50.4	177	171.9	-102	0	0	0	112.3	G243 I244 L245 F249 G250 W251 L385 L388	G243-F247 VanDerWaalsContact O-CB 3.28Å; G243-F247 WeakPolarHBondContact O-CB 3.47Å; G243-F247 PolarHBondContact O-N 2.78Å; I244-F247 PolarHBondContact O-N 3.26Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 3.11Å; F247-F249 PolarHBondContact O-N 3.14Å; F247-G250 PolarHBondContact O-N 3.14Å; F247-W251 WeakPolarHBondContact O-CB 3.48Å; F247-W251 PolarHBondContact O-N 2.83Å; F247-L385 HydrophobicContact CE1-CD2 3.87Å; F247-L388 HydrophobicContact CD1-CD1 4.23Å; F247-L388 HydrophobicContact CE1-CD1 3.94Å
248	T	89.8	Confident	94.1	Very high	13 Å²	13	51.3 Å²	51.3	8%	0.08	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-36.7	-179.1	50.1	0	0	0	0	112	I244 L245 S252	I244-T248 HydrophobicContact CG2-CG2 4.19Å; I244-T248 WeakPolarHBondContact O-CB 3.37Å; I244-T248 WeakPolarHBondContact O-CG2 3.35Å; I244-T248 PolarHBondContact O-N 3.43Å; I244-T248 PolarHBondContact O-OG1 3.34Å; L245-T248 PolarHBondContact O-N 2.85Å; L245-T248 PolarHBondContact O-OG1 3.25Å; L245-T248 VanDerWaalsContact O-OG1 3.11Å; T248-S252 WeakPolarHBondContact O-CB 3.4Å; T248-S252 PolarHBondContact O-N 2.87Å
249	F	92.4	Very high	94.1	Very high	44 Å²	44	56 Å²	56	19%	0.193	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-53.6	170.4	172.8	-114.7	0	0	0	111.5	L245 F247 W251 S252 L253 L327 L330 T331	L245-F249 VanDerWaalsContact O-CB 3.24Å; L245-F249 WeakPolarHBondContact O-CB 3.38Å; L245-F249 PolarHBondContact O-N 2.85Å; F247-F249 PolarHBondContact O-N 3.14Å; F249-W251 VanDerWaalsContact C-N 3.29Å; F249-W251 PolarHBondContact O-N 3.13Å; F249-S252 WeakPolarHBondContact O-CB 3.4Å; F249-S252 PolarHBondContact O-N 3.25Å; F249-S252 PolarHBondContact O-OG 3.47Å; F249-L253 HydrophobicContact CE1-CD1 3.92Å; F249-L253 HydrophobicContact CE2-CD1 4.16Å; F249-L253 HydrophobicContact CE2-CD2 3.94Å; F249-L253 HydrophobicContact CE2-CG 4.14Å; F249-L253 HydrophobicContact CZ-CD1 3.71Å; F249-L253 HydrophobicContact CZ-CD2 4.22Å; F249-L253 HydrophobicContact CZ-CG 4.21Å; F249-L253 PolarHBondContact O-N 2.88Å; F249-L327 HydrophobicContact CD1-CD2 3.71Å; F249-L327 HydrophobicContact CD2-CD2 4.09Å; F249-L327 HydrophobicContact CE1-CD2 3.57Å; F249-L327 HydrophobicContact CE2-CD2 3.98Å; F249-L327 HydrophobicContact CG-CD2 3.96Å; F249-L327 HydrophobicContact CZ-CD2 3.7Å; F249-L330 HydrophobicContact CD2-CB 4.19Å; F249-L330 HydrophobicContact CE2-CB 3.7Å; F249-L330 HydrophobicContact CE2-CD1 3.93Å; F249-L330 HydrophobicContact CE2-CG 4.43Å; F249-L330 HydrophobicContact CZ-CD1 4.27Å; F249-T331 WeakPolarHBondContact CA-OG1 3.32Å; F249-T331 WeakPolarHBondContact CB-OG1 3.19Å; F249-T331 WeakPolarHBondContact CD2-OG1 3.37Å
250	G	93.6	Very high	94.1	Very high	35 Å²	35	54.9 Å²	54.9	36%	0.361	28%	0.284	S	S	.	.	H	α-helix	trans	-56.2	-43.6	179.1	0	0	0	0	0	112.4	I246 F247 L253	I246-G250 PolarHBondContact O-N 3.47Å; F247-G250 PolarHBondContact O-N 3.14Å; G250-L253 PolarHBondContact O-N 2.93Å
251	W	91.3	Very high	94.1	Very high	34 Å²	34	50.1 Å²	50.1	13%	0.129	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-40.4	173.5	169.8	82.1	0	0	0	113.1	F247 F249 L253 T254 R255 T335 F375 V378 L385	F247-W251 WeakPolarHBondContact O-CB 3.48Å; F247-W251 PolarHBondContact O-N 2.83Å; F249-W251 VanDerWaalsContact C-N 3.29Å; F249-W251 PolarHBondContact O-N 3.13Å; W251-L253 PolarHBondContact O-N 3.31Å; W251-T254 PolarHBondContact O-N 3.42Å; W251-T254 VanDerWaalsContact O-N 3.07Å; W251-T254 PolarHBondContact O-OG1 3.49Å; W251-R255 HydrophobicContact CH2-CG 4.34Å; W251-R255 HydrophobicContact CZ2-CG 4.22Å; W251-T335 HydrophobicContact CH2-CG2 4.15Å; W251-T335 HydrophobicContact CZ3-CG2 4.04Å; W251-F375 HydrophobicContact CH2-CD1 4.44Å; W251-F375 HydrophobicContact CH2-CE1 4.05Å; W251-F375 AromaticContact CZ3-CE1 3.92Å; W251-F375 HydrophobicContact CZ3-CE1 3.92Å; W251-V378 HydrophobicContact CH2-CG1 4.38Å; W251-V378 HydrophobicContact CH2-CG2 3.78Å; W251-V378 HydrophobicContact CZ2-CB 4.46Å; W251-V378 HydrophobicContact CZ2-CG1 3.67Å; W251-V378 HydrophobicContact CZ2-CG2 3.87Å; W251-L385 HydrophobicContact CD2-CD1 3.81Å; W251-L385 HydrophobicContact CD2-CD2 4.25Å; W251-L385 HydrophobicContact CE3-CD1 4.14Å; W251-L385 HydrophobicContact CE3-CD2 4.46Å; W251-L385 HydrophobicContact CG-CD2 4.46Å; W251-L385 HydrophobicContact CH2-CD1 3.74Å; W251-L385 HydrophobicContact CZ2-CD1 3.35Å; W251-L385 HydrophobicContact CZ3-CD1 4.11Å
252	S	91.3	Very high	94.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-30.8	-178.9	76	0	0	0	0	112.8	T248 F249 T254 R255 S258	T248-S252 WeakPolarHBondContact O-CB 3.4Å; T248-S252 PolarHBondContact O-N 2.87Å; F249-S252 WeakPolarHBondContact O-CB 3.4Å; F249-S252 PolarHBondContact O-N 3.25Å; F249-S252 PolarHBondContact O-OG 3.47Å; S252-T254 VanDerWaalsContact C-N 3.33Å; S252-R255 WeakPolarHBondContact O-CB 3.45Å; S252-R255 WeakPolarHBondContact O-CG 3.35Å; S252-R255 PolarHBondContact O-N 2.93Å; S252-S258 WeakPolarHBondContact O-CB 3.3Å
253	L	94.7	Very high	94.2	Very high	76 Å²	76	54.1 Å²	54.1	40%	0.398	29%	0.285	S	S	.	.	H	α-helix	trans	-71.7	-25.2	177	-60.2	-177.8	0	0	0	112.8	F249 G250 W251 R255 S258 I262	F249-L253 HydrophobicContact CE1-CD1 3.92Å; F249-L253 HydrophobicContact CE2-CD1 4.16Å; F249-L253 HydrophobicContact CE2-CD2 3.94Å; F249-L253 HydrophobicContact CE2-CG 4.14Å; F249-L253 HydrophobicContact CZ-CD1 3.71Å; F249-L253 HydrophobicContact CZ-CD2 4.22Å; F249-L253 HydrophobicContact CZ-CG 4.21Å; F249-L253 PolarHBondContact O-N 2.88Å; G250-L253 PolarHBondContact O-N 2.93Å; W251-L253 PolarHBondContact O-N 3.31Å; L253-R255 PolarHBondContact O-N 2.7Å; L253-S258 PolarHBondContact O-OG 2.62Å; L253-I262 HydrophobicContact CD2-CD1 3.72Å
254	T	92.8	Very high	94.2	Very high	108 Å²	108	52.3 Å²	52.3	66%	0.663	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-1.7	178.7	77.1	0	0	0	0	112.7	W251 S252	W251-T254 PolarHBondContact O-N 3.42Å; W251-T254 VanDerWaalsContact O-N 3.07Å; W251-T254 PolarHBondContact O-OG1 3.49Å; S252-T254 VanDerWaalsContact C-N 3.33Å
255	R	90.8	Very high	94.3	Very high	63 Å²	63	51.3 Å²	51.3	24%	0.238	26%	0.261	C	S	.	.	S	Bend	trans	-82.2	138.1	-177.3	-56.9	-59	-62.1	171.6	-0.3	110.8	W251 S252 L253 S258 S338	W251-R255 HydrophobicContact CH2-CG 4.34Å; W251-R255 HydrophobicContact CZ2-CG 4.22Å; S252-R255 WeakPolarHBondContact O-CB 3.45Å; S252-R255 WeakPolarHBondContact O-CG 3.35Å; S252-R255 PolarHBondContact O-N 2.93Å; L253-R255 PolarHBondContact O-N 2.7Å; R255-S258 WeakPolarHBondContact O-CB 3.4Å; R255-S258 PolarHBondContact O-N 3.26Å; R255-S258 VanDerWaalsContact O-N 3.14Å; R255-S258 PolarHBondContact O-OG 3.29Å; R255-S338 WeakPolarHBondContact CB-OG 3.32Å
256	K	93.6	Very high	94.5	Very high	131 Å²	131	55.2 Å²	55.2	57%	0.57	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	135	173.5	-167.4	-174.5	-176.1	-169.3	0	110	S258 S338	K256-S258 PolarHBondContact O-N 3.44Å; K256-S338 VanDerWaalsContact O-CB 3.27Å; K256-S338 WeakPolarHBondContact O-CB 3.4Å; K256-S338 PolarHBondContact O-OG 2.92Å
257	Y	94.8	Very high	94.7	Very high	79 Å²	79	52 Å²	52	31%	0.31	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	11.5	-175.3	-45.4	-69	0	0	0	114.9	E259 V260 I341 Q342	Y257-E259 WeakPolarHBondContact CA-OE1 3.27Å; Y257-E259 WeakPolarHBondContact CA-OE2 3.26Å; Y257-E259 PolarHBondContact N-OE2 3.48Å; Y257-E259 PolarHBondContact O-N 3.45Å; Y257-V260 PolarHBondContact O-N 3Å; Y257-I341 HydrophobicContact CD1-CG2 4.26Å; Y257-I341 HydrophobicContact CD2-CB 4.31Å; Y257-I341 HydrophobicContact CD2-CG2 3.67Å; Y257-I341 HydrophobicContact CE1-CG2 4.49Å; Y257-I341 HydrophobicContact CE2-CG2 3.95Å; Y257-I341 HydrophobicContact CG-CB 4.44Å; Y257-I341 HydrophobicContact CG-CG2 3.83Å; Y257-Q342 HydrophobicContact CD2-CG 3.91Å; Y257-Q342 HydrophobicContact CE2-CG 4.05Å
258	S	94.8	Very high	94.8	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-33.3	172.6	61.9	0	0	0	0	111.6	S252 L253 R255 K256 V260 G261 I262 S334	S252-S258 WeakPolarHBondContact O-CB 3.3Å; L253-S258 PolarHBondContact O-OG 2.62Å; R255-S258 WeakPolarHBondContact O-CB 3.4Å; R255-S258 PolarHBondContact O-N 3.26Å; R255-S258 VanDerWaalsContact O-N 3.14Å; R255-S258 PolarHBondContact O-OG 3.29Å; K256-S258 PolarHBondContact O-N 3.44Å; S258-V260 PolarHBondContact O-N 3.38Å; S258-G261 PolarHBondContact O-N 3.08Å; S258-I262 WeakPolarHBondContact O-CG1 3.35Å; S258-I262 PolarHBondContact O-N 3.07Å; S258-S334 PolarHBondContact O-OG 2.91Å
259	E	96.8	Very high	95.1	Very high	98 Å²	98	52 Å²	52	46%	0.458	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-31.7	177.6	71.3	-74	175.7	0	0	112.2	Y257 G261 I262 T263	Y257-E259 WeakPolarHBondContact CA-OE1 3.27Å; Y257-E259 WeakPolarHBondContact CA-OE2 3.26Å; Y257-E259 PolarHBondContact N-OE2 3.48Å; Y257-E259 PolarHBondContact O-N 3.45Å; E259-G261 VanDerWaalsContact C-N 3.34Å; E259-G261 PolarHBondContact O-N 3Å; E259-I262 PolarHBondContact O-N 2.89Å; E259-T263 WeakPolarHBondContact O-CB 3.45Å; E259-T263 PolarHBondContact O-N 3.47Å; E259-T263 PolarHBondContact O-OG1 3.39Å
260	V	96.6	Very high	95.3	Very high	35 Å²	35	57.3 Å²	57.3	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-41.1	179.2	-174.6	0	0	0	0	110.8	Y257 S258 F264 F337 I341 R349	Y257-V260 PolarHBondContact O-N 3Å; S258-V260 PolarHBondContact O-N 3.38Å; V260-F264 WeakPolarHBondContact O-CB 2.82Å; V260-F264 PolarHBondContact O-N 3.5Å; V260-F337 HydrophobicContact CB-CD1 4.42Å; V260-F337 HydrophobicContact CG1-CD1 3.91Å; V260-F337 HydrophobicContact CG1-CE1 4.44Å; V260-I341 HydrophobicContact CB-CD1 4.05Å; V260-I341 HydrophobicContact CG1-CD1 4Å; V260-I341 HydrophobicContact CG2-CD1 4.15Å; V260-R349 HydrophobicContact CG1-CG 4.11Å
261	G	95.9	Very high	95.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-40.9	175.2	0	0	0	0	0	112.3	S258 E259 F264 L265	S258-G261 PolarHBondContact O-N 3.08Å; E259-G261 VanDerWaalsContact C-N 3.34Å; E259-G261 PolarHBondContact O-N 3Å; G261-F264 PolarHBondContact O-N 3.01Å; G261-L265 WeakPolarHBondContact O-CB 3.49Å; G261-L265 PolarHBondContact O-N 2.87Å
262	I	97.4	Very high	95.5	Very high	44 Å²	44	55.5 Å²	55.5	23%	0.226	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-48.3	176.6	-62.1	169	0	0	0	110.7	L253 S258 E259 F264 L265 F266 L330 S334	L253-I262 HydrophobicContact CD2-CD1 3.72Å; S258-I262 WeakPolarHBondContact O-CG1 3.35Å; S258-I262 PolarHBondContact O-N 3.07Å; E259-I262 PolarHBondContact O-N 2.89Å; I262-F264 VanDerWaalsContact C-N 3.29Å; I262-F264 PolarHBondContact O-N 3.37Å; I262-L265 WeakPolarHBondContact O-CB 3.27Å; I262-L265 PolarHBondContact O-N 2.85Å; I262-F266 HydrophobicContact CG2-CD2 3.96Å; I262-F266 HydrophobicContact CG2-CE2 4.14Å; I262-F266 WeakPolarHBondContact O-CD2 3.44Å; I262-F266 PolarHBondContact O-N 2.87Å; I262-F266 VanDerWaalsContact O-N 3.11Å; I262-L330 HydrophobicContact CG1-CD2 4.15Å; I262-L330 HydrophobicContact CG2-CD2 4.16Å; I262-S334 VanDerWaalsContact CG1-OG 3.22Å; I262-S334 WeakPolarHBondContact CG1-OG 3.18Å
263	T	97.7	Very high	95.6	Very high	81 Å²	81	57.4 Å²	57.4	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-43.8	177.1	-61.7	0	0	0	0	110.4	E259 L265 F266 T267	E259-T263 WeakPolarHBondContact O-CB 3.45Å; E259-T263 PolarHBondContact O-N 3.47Å; E259-T263 PolarHBondContact O-OG1 3.39Å; T263-L265 VanDerWaalsContact C-N 3.34Å; T263-L265 PolarHBondContact O-N 2.54Å; T263-F266 CarbonylContact O-C 3.6Å; T263-F266 PolarHBondContact O-N 2.68Å; T263-T267 WeakPolarHBondContact O-CB 3.44Å; T263-T267 PolarHBondContact O-N 3.15Å; T263-T267 PolarHBondContact O-OG1 2.88Å
264	F	97.2	Very high	95.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-44.9	176.6	-176.5	-88.5	0	0	0	112.1	Y100 G103 S104 V260 G261 I262 F266 T267 F333 F337 L353	Y100-F264 VanDerWaalsContact O-CZ 3.23Å; Y100-F264 WeakPolarHBondContact O-CZ 3.3Å; G103-F264 WeakPolarHBondContact CA-O 3.16Å; S104-F264 PolarHBondContact N-O 2.9Å; S104-F264 WeakPolarHBondContact OG-CE1 3.23Å; V260-F264 WeakPolarHBondContact O-CB 2.82Å; V260-F264 PolarHBondContact O-N 3.5Å; G261-F264 PolarHBondContact O-N 3.01Å; I262-F264 VanDerWaalsContact C-N 3.29Å; I262-F264 PolarHBondContact O-N 3.37Å; F264-F266 VanDerWaalsContact C-N 3.26Å; F264-F266 PolarHBondContact O-N 3.09Å; F264-T267 PolarHBondContact O-N 3.29Å; F264-F333 HydrophobicContact CD1-CD1 4.1Å; F264-F333 AromaticContact CD1-CE1 3.82Å; F264-F333 HydrophobicContact CD1-CE1 3.82Å; F264-F333 HydrophobicContact CE1-CE1 4.04Å; F264-F337 HydrophobicContact CB-CE1 4.15Å; F264-F337 HydrophobicContact CB-CZ 4.01Å; F264-F337 HydrophobicContact CD1-CE2 4.42Å; F264-F337 AromaticContact CD1-CZ 3.88Å; F264-F337 HydrophobicContact CD1-CZ 3.88Å; F264-F337 HydrophobicContact CD2-CE1 4.45Å; F264-F337 HydrophobicContact CD2-CZ 4.19Å; F264-F337 HydrophobicContact CE1-CZ 4.44Å; F264-F337 HydrophobicContact CG-CE1 4.2Å; F264-F337 AromaticContact CG-CZ 3.75Å; F264-F337 HydrophobicContact CG-CZ 3.75Å; F264-L353 HydrophobicContact CE1-CD1 4Å; F264-L353 HydrophobicContact CZ-CB 4.39Å; F264-L353 HydrophobicContact CZ-CD1 3.99Å; F264-L353 HydrophobicContact CZ-CD2 3.91Å; F264-L353 HydrophobicContact CZ-CG 4.3Å
265	L	97.1	Very high	95.2	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.5	-38.7	178.4	-167.9	69.4	0	0	0	112.4	I95 S104 L105 L108 G261 I262 T263 L326 A329 L330 F333	I95-L265 HydrophobicContact CD1-CD1 3.4Å; I95-L265 HydrophobicContact CG1-CD1 4.23Å; S104-L265 CarbonylContact C-O 3.51Å; L105-L265 PolarHBondContact N-O 3.18Å; L108-L265 HydrophobicContact CD1-CG 4.13Å; G261-L265 WeakPolarHBondContact O-CB 3.49Å; G261-L265 PolarHBondContact O-N 2.87Å; I262-L265 WeakPolarHBondContact O-CB 3.27Å; I262-L265 PolarHBondContact O-N 2.85Å; T263-L265 VanDerWaalsContact C-N 3.34Å; T263-L265 PolarHBondContact O-N 2.54Å; L265-L326 HydrophobicContact CD2-CD1 4.41Å; L265-A329 HydrophobicContact CD1-CB 4.43Å; L265-A329 HydrophobicContact CD2-CB 4.31Å; L265-L330 HydrophobicContact CD2-CD2 3.58Å; L265-L330 HydrophobicContact CD2-CG 3.97Å; L265-F333 HydrophobicContact CB-CD1 4.41Å; L265-F333 HydrophobicContact CD1-CD1 4.04Å; L265-F333 HydrophobicContact CD1-CD2 4.17Å; L265-F333 HydrophobicContact CD1-CE1 4.06Å; L265-F333 HydrophobicContact CD1-CE2 4.2Å; L265-F333 HydrophobicContact CD1-CG 4.11Å; L265-F333 HydrophobicContact CD1-CZ 4.14Å
266	F	98	Very high	94.9	Very high	90 Å²	90	58.3 Å²	58.3	40%	0.395	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	13.7	-179.7	-65.9	-71.4	0	0	0	114.5	L105 L108 I262 T263 F264 L326 L330	L105-F266 HydrophobicContact CD1-CD1 4.11Å; L105-F266 WeakPolarHBondContact CD2-O 3.17Å; L108-F266 HydrophobicContact CD1-CD1 4.19Å; L108-F266 HydrophobicContact CD1-CE1 4.01Å; I262-F266 HydrophobicContact CG2-CD2 3.96Å; I262-F266 HydrophobicContact CG2-CE2 4.14Å; I262-F266 WeakPolarHBondContact O-CD2 3.44Å; I262-F266 PolarHBondContact O-N 2.87Å; I262-F266 VanDerWaalsContact O-N 3.11Å; T263-F266 CarbonylContact O-C 3.6Å; T263-F266 PolarHBondContact O-N 2.68Å; F264-F266 VanDerWaalsContact C-N 3.26Å; F264-F266 PolarHBondContact O-N 3.09Å; F266-L326 HydrophobicContact CZ-CD1 4.22Å; F266-L330 HydrophobicContact CE2-CD2 3.71Å; F266-L330 HydrophobicContact CZ-CD2 4.3Å
267	T	98	Very high	94.4	Very high	39 Å²	39	54.7 Å²	54.7	24%	0.239	28%	0.278	C	S	.	.			trans	-89.5	127.5	172.8	-61.3	0	0	0	0	110	Q102 G103 S104 L105 T263 F264	Q102-T267 WeakPolarHBondContact O-CG2 3.47Å; G103-T267 CarbonylContact C-O 3.57Å; G103-T267 WeakPolarHBondContact CA-O 3.16Å; S104-T267 PolarHBondContact N-O 2.92Å; S104-T267 VanDerWaalsContact N-O 3.08Å; L105-T267 WeakPolarHBondContact CB-O 3.26Å; L105-T267 PolarHBondContact N-O 3.16Å; T263-T267 WeakPolarHBondContact O-CB 3.44Å; T263-T267 PolarHBondContact O-N 3.15Å; T263-T267 PolarHBondContact O-OG1 2.88Å; F264-T267 PolarHBondContact O-N 3.29Å
268	P	96.8	Very high	94.2	Very high	46 Å²	46	51.1 Å²	51.1	30%	0.299	26%	0.264	S	S	.	.			trans	-81.9	144.8	178.5	30.3	-32	0	0	0	113	L105 T106 W270	L105-P268 HydrophobicContact CB-CB 4.29Å; L105-P268 HydrophobicContact CD2-CB 4.09Å; L105-P268 HydrophobicContact CD2-CG 4.33Å; T106-P268 HydrophobicContact CG2-CB 4.47Å; P268-W270 HydrophobicContact CB-CD2 4.19Å; P268-W270 HydrophobicContact CB-CH2 4.38Å; P268-W270 HydrophobicContact CB-CZ2 3.82Å; P268-W270 HydrophobicContact CG-CZ2 4.07Å
269	Y	96.2	Very high	94	Very high	81 Å²	81	54.8 Å²	54.8	32%	0.318	28%	0.277	S	S	.	.			trans	-123.4	89	159.3	177.6	-130	0	0	0	109.7	Y100 Q102 T106 G271 S272	Y100-Y269 AromaticContact CD1-CD1 3.87Å; Y100-Y269 HydrophobicContact CD1-CD1 3.87Å; Y100-Y269 AromaticContact CD1-CE1 3.68Å; Y100-Y269 HydrophobicContact CD1-CE1 3.68Å; Y100-Y269 AromaticContact CD2-CD1 3.92Å; Y100-Y269 HydrophobicContact CD2-CD1 3.92Å; Y100-Y269 HydrophobicContact CD2-CE1 4.44Å; Y100-Y269 HydrophobicContact CE1-CE1 4.13Å; Y100-Y269 AromaticContact CG-CD1 3.51Å; Y100-Y269 HydrophobicContact CG-CD1 3.51Å; Y100-Y269 AromaticContact CG-CE1 3.85Å; Y100-Y269 HydrophobicContact CG-CE1 3.85Å; Q102-Y269 HydrophobicContact CB-CD2 4.28Å; Q102-Y269 HydrophobicContact CB-CG 4.23Å; Q102-Y269 HydrophobicContact CG-CD2 4.16Å; Q102-Y269 HydrophobicContact CG-CG 4.47Å; T106-Y269 VanDerWaalsContact CG2-O 3.32Å; T106-Y269 WeakPolarHBondContact CG2-O 3.29Å; Y269-G271 PolarHBondContact O-N 2.9Å; Y269-S272 PolarHBondContact O-N 2.95Å; Y269-S272 PolarHBondContact O-OG 3Å
270	W	96.6	Very high	93.4	Very high	157 Å²	157	51.1 Å²	51.1	60%	0.595	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-57.2	-28.3	-172.1	-59.4	113.3	0	0	0	114.4	T106 I109 P268 S272 M273	T106-W270 HydrophobicContact CG2-CE3 4.14Å; I109-W270 HydrophobicContact CD1-CH2 4.32Å; I109-W270 HydrophobicContact CD1-CZ3 4.19Å; P268-W270 HydrophobicContact CB-CD2 4.19Å; P268-W270 HydrophobicContact CB-CH2 4.38Å; P268-W270 HydrophobicContact CB-CZ2 3.82Å; P268-W270 HydrophobicContact CG-CZ2 4.07Å; W270-S272 PolarHBondContact O-N 3.27Å; W270-M273 HydrophobicContact CE3-CG 4.44Å; W270-M273 HydrophobicContact CZ3-CE 4.46Å; W270-M273 WeakPolarHBondContact O-CB 3.49Å; W270-M273 PolarHBondContact O-N 3Å; W270-M273 VanDerWaalsContact O-N 3.07Å
271	G	95.7	Very high	93	Very high	31 Å²	31	50.4 Å²	50.4	32%	0.32	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-57.8	-30.7	174.8	0	0	0	0	0	113.4	Y269 M273 F274	Y269-G271 PolarHBondContact O-N 2.9Å; G271-M273 VanDerWaalsContact C-N 3.25Å; G271-M273 PolarHBondContact O-N 2.97Å; G271-F274 PolarHBondContact O-N 2.81Å
272	S	92.8	Very high	92.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-71.8	-17.1	178.7	78.1	0	0	0	0	113.7	T106 Y269 W270 F274 T275	T106-S272 VanDerWaalsContact CB-OG 3.29Å; T106-S272 WeakPolarHBondContact CB-OG 3.36Å; T106-S272 PolarHBondContact OG1-OG 2.6Å; Y269-S272 PolarHBondContact O-N 2.95Å; Y269-S272 PolarHBondContact O-OG 3Å; W270-S272 PolarHBondContact O-N 3.27Å; S272-F274 PolarHBondContact O-N 3.26Å; S272-T275 WeakPolarHBondContact O-CA 3.24Å; S272-T275 VanDerWaalsContact O-CB 3.23Å; S272-T275 WeakPolarHBondContact O-CB 3.49Å; S272-T275 PolarHBondContact O-N 2.92Å
273	M	92.8	Very high	92.6	Very high	39 Å²	39	49 Å²	49	19%	0.192	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-64.3	-26.3	175.2	-71.7	-63.3	-154.4	0	0	112.3	T106 I109 W270 G271 T275 L278 W279	T106-M273 HydrophobicContact CG2-CE 3.97Å; T106-M273 HydrophobicContact CG2-CG 3.82Å; T106-M273 HydrophobicContact CG2-SD 4.19Å; I109-M273 HydrophobicContact CB-CE 3.66Å; I109-M273 HydrophobicContact CD1-CE 3.91Å; I109-M273 HydrophobicContact CG1-CE 4.39Å; I109-M273 HydrophobicContact CG2-CE 3.58Å; W270-M273 HydrophobicContact CE3-CG 4.44Å; W270-M273 HydrophobicContact CZ3-CE 4.46Å; W270-M273 WeakPolarHBondContact O-CB 3.49Å; W270-M273 PolarHBondContact O-N 3Å; W270-M273 VanDerWaalsContact O-N 3.07Å; G271-M273 VanDerWaalsContact C-N 3.25Å; G271-M273 PolarHBondContact O-N 2.97Å; M273-T275 PolarHBondContact O-N 3.44Å; M273-L278 HydrophobicContact SD-CD2 4.18Å; M273-W279 PolarHBondContact O-NE1 3.29Å; M273-W279 HydrophobicContact SD-CZ2 4.09Å
274	F	91	Very high	92.1	Very high	181 Å²	181	46.8 Å²	46.8	79%	0.794	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-85.2	5.8	171.9	-57.9	-78.9	0	0	0	112.4	G271 S272 P276	G271-F274 PolarHBondContact O-N 2.81Å; S272-F274 PolarHBondContact O-N 3.26Å; F274-P276 WeakPolarHBondContact O-CD 3.28Å
275	T	88.1	Confident	91.9	Very high	37 Å²	37	46.9 Å²	46.9	23%	0.227	24%	0.242	C	C	.	.			trans	-94.5	103.6	176.2	-55.9	0	0	0	0	110.5	Y100 S272 M273 S277 L278	Y100-T275 WeakPolarHBondContact OH-CG2 3.37Å; Y100-T275 PolarHBondContact OH-OG1 3.35Å; S272-T275 WeakPolarHBondContact O-CA 3.24Å; S272-T275 VanDerWaalsContact O-CB 3.23Å; S272-T275 WeakPolarHBondContact O-CB 3.49Å; S272-T275 PolarHBondContact O-N 2.92Å; M273-T275 PolarHBondContact O-N 3.44Å; T275-S277 WeakPolarHBondContact CG2-OG 3.49Å; T275-S277 PolarHBondContact O-N 3.48Å; T275-L278 WeakPolarHBondContact O-CB 3.46Å; T275-L278 PolarHBondContact O-N 3.39Å; T275-L278 VanDerWaalsContact O-N 3.11Å
276	P	84.2	Confident	91.7	Very high	48 Å²	48	46.9 Å²	46.9	31%	0.312	24%	0.242	S	C	.	.	H	α-helix	trans	-20.3	-64.2	160.8	-48.8	46.7	0	0	0	119.4	F274 L278 W279 V280 W511	F274-P276 WeakPolarHBondContact O-CD 3.28Å; P276-L278 PolarHBondContact O-N 2.97Å; P276-W279 PolarHBondContact O-N 3.02Å; P276-W279 VanDerWaalsContact O-N 3.11Å; P276-V280 PolarHBondContact O-N 3.17Å; P276-W511 HydrophobicContact CB-CH2 3.93Å; P276-W511 HydrophobicContact CB-CZ2 3.06Å; P276-W511 HydrophobicContact CG-CH2 3.5Å; P276-W511 HydrophobicContact CG-CZ2 2.99Å
277	S	83.7	Confident	91.4	Very high	56 Å²	56	42.8 Å²	42.8	39%	0.392	22%	0.224	S	C	.	.	H	α-helix	trans	-65.7	-24.5	-172.2	53.1	0	0	0	0	113.1	T275 W279 A281	T275-S277 WeakPolarHBondContact CG2-OG 3.49Å; T275-S277 PolarHBondContact O-N 3.48Å; S277-W279 VanDerWaalsContact C-N 3.35Å; S277-A281 VanDerWaalsContact O-CB 3.29Å; S277-A281 WeakPolarHBondContact O-CB 3.33Å; S277-A281 PolarHBondContact O-N 2.9Å
278	L	91.2	Very high	90.9	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-47.2	172.8	-173.9	99.2	0	0	0	110.5	A98 F107 A110 M273 T275 P276 A282	A98-L278 HydrophobicContact CB-CD1 4.48Å; A98-L278 WeakPolarHBondContact O-CD1 3.3Å; F107-L278 HydrophobicContact CB-CD1 3.93Å; F107-L278 HydrophobicContact CD2-CD1 4.44Å; A110-L278 HydrophobicContact CB-CD2 4.21Å; M273-L278 HydrophobicContact SD-CD2 4.18Å; T275-L278 WeakPolarHBondContact O-CB 3.46Å; T275-L278 PolarHBondContact O-N 3.39Å; T275-L278 VanDerWaalsContact O-N 3.11Å; P276-L278 PolarHBondContact O-N 2.97Å; L278-A282 WeakPolarHBondContact O-CB 3.27Å; L278-A282 PolarHBondContact O-N 3Å
279	W	89.3	Confident	90.6	Very high	85 Å²	85	40.3 Å²	40.3	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-69.5	-40.8	-177.9	-71.1	94	0	0	0	112	A110 M113 M273 P276 S277 A282 A283	A110-W279 HydrophobicContact CB-CD2 3.97Å; A110-W279 HydrophobicContact CB-CE3 3.66Å; A110-W279 HydrophobicContact CB-CH2 4.11Å; A110-W279 HydrophobicContact CB-CZ2 4.38Å; A110-W279 HydrophobicContact CB-CZ3 3.74Å; M113-W279 HydrophobicContact CB-CZ3 4.47Å; M113-W279 HydrophobicContact CE-CH2 3.91Å; M113-W279 HydrophobicContact CE-CZ3 4.2Å; M113-W279 HydrophobicContact SD-CH2 3.73Å; M113-W279 HydrophobicContact SD-CZ3 4.14Å; M273-W279 PolarHBondContact O-NE1 3.29Å; M273-W279 HydrophobicContact SD-CZ2 4.09Å; P276-W279 PolarHBondContact O-N 3.02Å; P276-W279 VanDerWaalsContact O-N 3.11Å; S277-W279 VanDerWaalsContact C-N 3.35Å; W279-A282 PolarHBondContact O-N 3.49Å; W279-A283 VanDerWaalsContact O-CB 3.23Å; W279-A283 WeakPolarHBondContact O-CB 3.4Å; W279-A283 PolarHBondContact O-N 3.39Å
280	V	85.5	Confident	90.4	Very high	20 Å²	20	36.5 Å²	36.5	12%	0.121	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-48.1	175.5	177.7	0	0	0	0	110.6	P276 A282 A283 S284 F453 L508 W511	P276-V280 PolarHBondContact O-N 3.17Å; V280-A282 VanDerWaalsContact C-N 3.34Å; V280-A282 PolarHBondContact O-N 2.97Å; V280-A283 PolarHBondContact O-N 3.37Å; V280-S284 VanDerWaalsContact O-CB 3.22Å; V280-S284 WeakPolarHBondContact O-CB 3.5Å; V280-S284 PolarHBondContact O-N 3.05Å; V280-S284 PolarHBondContact O-OG 2.99Å; V280-F453 HydrophobicContact CG1-CE1 4.33Å; V280-L508 HydrophobicContact CG2-CD2 4.24Å; V280-W511 HydrophobicContact CG2-CB 3.99Å; V280-W511 HydrophobicContact CG2-CD2 4.42Å; V280-W511 HydrophobicContact CG2-CG 3.57Å
281	A	88.8	Confident	90.1	Very high	21 Å²	21	29.2 Å²	29.2	17%	0.174	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-43.1	178.1	0	0	0	0	0	111.6	I94 A98 F107 S277 S284 Q285	I94-A281 HydrophobicContact CG2-CB 4.23Å; A98-A281 HydrophobicContact CB-CB 4.35Å; F107-A281 HydrophobicContact CE2-CB 4.16Å; S277-A281 VanDerWaalsContact O-CB 3.29Å; S277-A281 WeakPolarHBondContact O-CB 3.33Å; S277-A281 PolarHBondContact O-N 2.9Å; A281-S284 PolarHBondContact O-OG 3.23Å; A281-Q285 WeakPolarHBondContact O-CB 3.33Å; A281-Q285 PolarHBondContact O-N 3.31Å
282	A	93.6	Very high	89.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.6	-47.1	179.3	0	0	0	0	0	112.7	F107 A110 W111 L278 W279 V280 N286	F107-A282 HydrophobicContact CD2-CB 4.06Å; F107-A282 HydrophobicContact CE2-CB 3.81Å; F107-A282 HydrophobicContact CZ-CB 4.32Å; A110-A282 HydrophobicContact CB-CB 3.75Å; W111-A282 HydrophobicContact CB-CB 3.97Å; L278-A282 WeakPolarHBondContact O-CB 3.27Å; L278-A282 PolarHBondContact O-N 3Å; W279-A282 PolarHBondContact O-N 3.49Å; V280-A282 VanDerWaalsContact C-N 3.34Å; V280-A282 PolarHBondContact O-N 2.97Å; A282-N286 WeakPolarHBondContact O-CB 3.23Å; A282-N286 PolarHBondContact O-N 3.22Å
283	A	91.1	Very high	89.8	Confident	13 Å²	13	27.7 Å²	27.7	11%	0.107	15%	0.149	C	C	.	.	H	α-helix	trans	-71.7	-45.6	-177.6	0	0	0	0	0	112.3	S114 W279 V280 Q285 N286 A287 L508	S114-A283 WeakPolarHBondContact OG-CA 3.26Å; S114-A283 WeakPolarHBondContact OG-CB 3.13Å; W279-A283 VanDerWaalsContact O-CB 3.23Å; W279-A283 WeakPolarHBondContact O-CB 3.4Å; W279-A283 PolarHBondContact O-N 3.39Å; V280-A283 PolarHBondContact O-N 3.37Å; A283-Q285 VanDerWaalsContact C-N 3.34Å; A283-Q285 PolarHBondContact O-N 3.21Å; A283-N286 PolarHBondContact O-N 3.05Å; A283-A287 WeakPolarHBondContact O-CB 3.43Å; A283-A287 PolarHBondContact O-N 3.3Å; A283-L508 HydrophobicContact CB-CD1 3.72Å; A283-L508 HydrophobicContact CB-CD2 3.76Å; A283-L508 HydrophobicContact CB-CG 4.37Å
284	S	87.2	Confident	89.9	Confident	35 Å²	35	26 Å²	26	25%	0.245	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-42.7	176.3	59	0	0	0	0	111.5	V280 A281 A287 F288	V280-S284 VanDerWaalsContact O-CB 3.22Å; V280-S284 WeakPolarHBondContact O-CB 3.5Å; V280-S284 PolarHBondContact O-N 3.05Å; V280-S284 PolarHBondContact O-OG 2.99Å; A281-S284 PolarHBondContact O-OG 3.23Å; S284-A287 PolarHBondContact O-N 3.46Å; S284-F288 VanDerWaalsContact O-CB 3.28Å; S284-F288 WeakPolarHBondContact O-CB 3.46Å; S284-F288 PolarHBondContact O-N 3.19Å
285	Q	91.8	Very high	90.2	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.009	10%	0.103	C	C	.	.	H	α-helix	trans	-65.1	-41.8	175.5	-178.8	58.4	42.5	0	0	111.5	F91 I94 A281 A283 F288 D289	F91-Q285 HydrophobicContact CD2-CG 3.78Å; I94-Q285 HydrophobicContact CB-CG 4.3Å; I94-Q285 HydrophobicContact CG1-CG 4.42Å; I94-Q285 HydrophobicContact CG2-CB 4.05Å; I94-Q285 HydrophobicContact CG2-CG 4.23Å; A281-Q285 WeakPolarHBondContact O-CB 3.33Å; A281-Q285 PolarHBondContact O-N 3.31Å; A283-Q285 VanDerWaalsContact C-N 3.34Å; A283-Q285 PolarHBondContact O-N 3.21Å; Q285-F288 PolarHBondContact O-N 3.21Å; Q285-D289 WeakPolarHBondContact O-CB 3.49Å; Q285-D289 PolarHBondContact O-N 3.14Å
286	N	94.4	Very high	90.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.3	-42.8	178.3	-167.9	-94.8	0	0	0	112.5	W111 L115 S119 A282 A283 D289 T290 N322	W111-N286 HydrophobicContact CG-CB 4.43Å; W111-N286 PolarHBondContact NE1-ND2 3.49Å; L115-N286 WeakPolarHBondContact CA-OD1 3.35Å; L115-N286 PolarHBondContact N-OD1 3.18Å; S119-N286 WeakPolarHBondContact CB-OD1 3.45Å; S119-N286 PolarHBondContact OG-OD1 3.18Å; A282-N286 WeakPolarHBondContact O-CB 3.23Å; A282-N286 PolarHBondContact O-N 3.22Å; A283-N286 PolarHBondContact O-N 3.05Å; N286-D289 PolarHBondContact O-N 3.06Å; N286-T290 WeakPolarHBondContact O-CB 3.45Å; N286-T290 WeakPolarHBondContact O-CG2 3.3Å; N286-T290 PolarHBondContact O-N 3.12Å; N286-T290 VanDerWaalsContact O-N 3.1Å; N286-T290 PolarHBondContact O-OG1 3.17Å; N286-N322 PolarHBondContact ND2-ND2 3.08Å; N286-N322 PolarHBondContact ND2-OD1 2.99Å
287	A	90.9	Very high	91.1	Very high	4 Å²	4	13.5 Å²	13.5	3%	0.033	8%	0.078	C	C	.	.	H	α-helix	trans	-61.8	-45.2	177	0	0	0	0	0	111.5	A283 S284 T290 G291 A292	A283-A287 WeakPolarHBondContact O-CB 3.43Å; A283-A287 PolarHBondContact O-N 3.3Å; S284-A287 PolarHBondContact O-N 3.46Å; A287-T290 PolarHBondContact O-OG1 3.28Å; A287-G291 PolarHBondContact O-N 2.95Å; A287-A292 PolarHBondContact O-N 3.09Å
288	F	87	Confident	91.6	Very high	30 Å²	30	10.9 Å²	10.9	13%	0.132	6%	0.06	C	C	.	.	H	α-helix	trans	-63.8	-46.8	178.5	-172.7	-91.1	0	0	0	112.3	S284 Q285 T290 G291 M294 L455	S284-F288 VanDerWaalsContact O-CB 3.28Å; S284-F288 WeakPolarHBondContact O-CB 3.46Å; S284-F288 PolarHBondContact O-N 3.19Å; Q285-F288 PolarHBondContact O-N 3.21Å; F288-T290 PolarHBondContact O-N 3.4Å; F288-G291 PolarHBondContact O-N 2.98Å; F288-M294 HydrophobicContact CD2-CE 3.85Å; F288-M294 HydrophobicContact CE2-CE 4.25Å; F288-M294 HydrophobicContact CG-CE 4.28Å; F288-L455 HydrophobicContact CD2-CD1 4.23Å
289	D	90.3	Very high	91.7	Very high	4 Å²	4	10.7 Å²	10.7	2%	0.021	6%	0.059	C	C	.	.	H	α-helix	trans	-70.4	-31.6	-174.1	-155.6	44.1	0	0	0	112.7	N87 Q285 N286 G291 N321 S325	N87-D289 WeakPolarHBondContact CA-OD1 3.38Å; N87-D289 PolarHBondContact N-OD1 2.86Å; N87-D289 PolarHBondContact ND2-OD1 2.75Å; N87-D289 PolarHBondContact ND2-OD2 2.85Å; N87-D289 VanDerWaalsContact ND2-OD2 3.16Å; N87-D289 PolarHBondContact OD1-OD1 3.05Å; Q285-D289 WeakPolarHBondContact O-CB 3.49Å; Q285-D289 PolarHBondContact O-N 3.14Å; N286-D289 PolarHBondContact O-N 3.06Å; D289-G291 VanDerWaalsContact C-N 3.34Å; D289-N321 VanDerWaalsContact C-ND2 3.35Å; D289-N321 PolarHBondContact O-ND2 3.14Å; D289-N321 PolarHBondContact O-OD1 3.07Å; D289-N321 PolarHBondContact OD2-ND2 2.5Å; D289-S325 WeakPolarHBondContact OD2-CB 3.15Å; D289-S325 PolarHBondContact OD2-OG 2.91Å
290	T	93.3	Very high	91.9	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-4.9	176.5	56.6	0	0	0	0	113.3	V82 L115 S119 N286 A287 F288 A292 F297 P318	V82-T290 VanDerWaalsContact CG1-O 3.22Å; V82-T290 WeakPolarHBondContact CG1-O 3.45Å; L115-T290 HydrophobicContact CD1-CG2 4.18Å; S119-T290 VanDerWaalsContact CB-OG1 3.27Å; S119-T290 WeakPolarHBondContact CB-OG1 3.45Å; S119-T290 PolarHBondContact OG-OG1 2.83Å; N286-T290 WeakPolarHBondContact O-CB 3.45Å; N286-T290 WeakPolarHBondContact O-CG2 3.3Å; N286-T290 PolarHBondContact O-N 3.12Å; N286-T290 VanDerWaalsContact O-N 3.1Å; N286-T290 PolarHBondContact O-OG1 3.17Å; A287-T290 PolarHBondContact O-OG1 3.28Å; F288-T290 PolarHBondContact O-N 3.4Å; T290-A292 PolarHBondContact O-N 3.22Å; T290-F297 WeakPolarHBondContact O-CE2 3.38Å; T290-P318 HydrophobicContact CG2-CB 3.93Å
291	G	89.9	Confident	92.4	Very high	4 Å²	4	5.7 Å²	5.7	4%	0.041	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	17.4	-173.1	0	0	0	0	0	114	A287 F288 D289 A293 M294	A287-G291 PolarHBondContact O-N 2.95Å; F288-G291 PolarHBondContact O-N 2.98Å; D289-G291 VanDerWaalsContact C-N 3.34Å; G291-A293 PolarHBondContact O-N 3.3Å; G291-M294 WeakPolarHBondContact O-CB 3.33Å; G291-M294 PolarHBondContact O-N 3.28Å; G291-M294 VanDerWaalsContact O-N 3.09Å
292	A	91.2	Very high	92.6	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	129.7	-175.5	0	0	0	0	0	111.1	L122 A287 T290 M294	L122-A292 HydrophobicContact CB-CB 4.46Å; A287-A292 PolarHBondContact O-N 3.09Å; T290-A292 PolarHBondContact O-N 3.22Å; A292-M294 PolarHBondContact O-N 3.34Å
293	A	91.1	Very high	92.5	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	9.8	-175.5	0	0	0	0	0	116	L122 E126 G291 A295 S458 G459	L122-A293 HydrophobicContact CD1-CB 4.31Å; E126-A293 WeakPolarHBondContact OE1-CA 3.07Å; E126-A293 PolarHBondContact OE1-N 3.16Å; G291-A293 PolarHBondContact O-N 3.3Å; A293-A295 VanDerWaalsContact C-N 3.3Å; A293-S458 VanDerWaalsContact O-CB 3.24Å; A293-S458 WeakPolarHBondContact O-CB 3.45Å; A293-G459 VanDerWaalsContact CB-N 3.31Å
294	M	94.4	Very high	92.5	Very high	4 Å²	4	5.6 Å²	5.6	2%	0.02	3%	0.032	C	C	.	.	S	Bend	trans	-82.9	-9.2	170.5	-64.8	-176.9	-172.4	0	0	112.5	E126 T160 F288 G291 A292 L296 L407 L455	E126-M294 PolarHBondContact OE1-N 3.44Å; T160-M294 WeakPolarHBondContact CB-O 3.14Å; T160-M294 HydrophobicContact CG2-CB 4.17Å; T160-M294 WeakPolarHBondContact CG2-O 3.3Å; T160-M294 WeakPolarHBondContact OG1-CA 3.28Å; T160-M294 PolarHBondContact OG1-O 3.47Å; F288-M294 HydrophobicContact CD2-CE 3.85Å; F288-M294 HydrophobicContact CE2-CE 4.25Å; F288-M294 HydrophobicContact CG-CE 4.28Å; G291-M294 WeakPolarHBondContact O-CB 3.33Å; G291-M294 PolarHBondContact O-N 3.28Å; G291-M294 VanDerWaalsContact O-N 3.09Å; A292-M294 PolarHBondContact O-N 3.34Å; M294-L296 HydrophobicContact CB-CD1 4.08Å; M294-L296 HydrophobicContact CB-CD2 4.47Å; M294-L296 HydrophobicContact CB-CG 3.72Å; M294-L296 PolarHBondContact O-N 3.22Å; M294-L296 VanDerWaalsContact O-N 3.15Å; M294-L296 HydrophobicContact SD-CD1 3.93Å; M294-L407 WeakPolarHBondContact O-CD2 3.49Å; M294-L455 HydrophobicContact CB-CD2 4.49Å; M294-L455 HydrophobicContact CE-CD1 3.5Å; M294-L455 VanDerWaalsContact CE-CD1 3.5Å; M294-L455 HydrophobicContact CE-CD2 4.3Å; M294-L455 HydrophobicContact CG-CD1 4.4Å; M294-L455 HydrophobicContact CG-CD2 3.5Å; M294-L455 VanDerWaalsContact CG-CD2 3.5Å
295	A	96.5	Very high	92.5	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.032	C	C	.	.			trans	60.8	14.8	-174.4	0	0	0	0	0	115.3	E126 P137 I156 A293 F297 I298 S299 L407 M462	E126-A295 VanDerWaalsContact CD-CA 3.5Å; E126-A295 PolarHBondContact OE1-N 2.93Å; E126-A295 VanDerWaalsContact OE2-C 3.28Å; E126-A295 WeakPolarHBondContact OE2-CA 3.44Å; E126-A295 PolarHBondContact OE2-N 3.38Å; P137-A295 HydrophobicContact CG-CB 3.28Å; I156-A295 HydrophobicContact CG2-CB 3.53Å; A293-A295 VanDerWaalsContact C-N 3.3Å; A295-F297 PolarHBondContact O-N 3.39Å; A295-I298 HydrophobicContact CB-CB 4.36Å; A295-I298 HydrophobicContact CB-CD1 3.83Å; A295-I298 HydrophobicContact CB-CG1 4.35Å; A295-I298 WeakPolarHBondContact O-CB 3.17Å; A295-I298 PolarHBondContact O-N 2.93Å; A295-I298 VanDerWaalsContact O-N 3.14Å; A295-S299 PolarHBondContact O-N 3.36Å; A295-L407 HydrophobicContact CB-CD1 4.3Å; A295-L407 HydrophobicContact CB-CD2 4.23Å; A295-M462 HydrophobicContact CB-CE 4.48Å
296	L	95.1	Very high	92.4	Very high	2 Å²	2	9 Å²	9	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-61.4	-37.6	177.1	-58.2	176.2	0	0	0	110.5	C81 E126 T160 M294 I298 S299 Y300 H404 L407	C81-L296 VanDerWaalsContact SG-CB 3.51Å; E126-L296 PolarHBondContact OE2-N 2.96Å; T160-L296 HydrophobicContact CG2-CD2 3.65Å; T160-L296 HydrophobicContact CG2-CG 4.45Å; M294-L296 HydrophobicContact CB-CD1 4.08Å; M294-L296 HydrophobicContact CB-CD2 4.47Å; M294-L296 HydrophobicContact CB-CG 3.72Å; M294-L296 PolarHBondContact O-N 3.22Å; M294-L296 VanDerWaalsContact O-N 3.15Å; M294-L296 HydrophobicContact SD-CD1 3.93Å; L296-I298 VanDerWaalsContact C-N 3.32Å; L296-I298 PolarHBondContact O-N 3.04Å; L296-S299 WeakPolarHBondContact O-CB 3.43Å; L296-S299 PolarHBondContact O-N 2.72Å; L296-S299 PolarHBondContact O-OG 3.5Å; L296-Y300 WeakPolarHBondContact O-CD2 3.35Å; L296-Y300 PolarHBondContact O-N 2.82Å; L296-H404 WeakPolarHBondContact CD1-NE2 3.42Å; L296-H404 HydrophobicContact CD2-CB 4.37Å; L296-L407 HydrophobicContact CD2-CB 4.49Å; L296-L407 HydrophobicContact CD2-CD2 4.48Å
297	F	96	Very high	92.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-74.7	-22.6	179.4	-54.2	-52.2	0	0	0	113	C81 V82 E126 Y127 T290 A295 S299 Y300 S301 I317	C81-F297 HydrophobicContact CB-CE1 4.49Å; V82-F297 HydrophobicContact CG1-CE1 3.65Å; V82-F297 HydrophobicContact CG1-CE2 4.34Å; V82-F297 HydrophobicContact CG1-CZ 3.28Å; E126-F297 HydrophobicContact CB-CB 3.76Å; E126-F297 HydrophobicContact CB-CD2 4.24Å; E126-F297 WeakPolarHBondContact OE2-CD2 3.3Å; E126-F297 PolarHBondContact OE2-N 3.48Å; E126-F297 VanDerWaalsContact OE2-N 3.13Å; Y127-F297 HydrophobicContact CD1-CB 4.27Å; Y127-F297 HydrophobicContact CD2-CB 4.01Å; Y127-F297 HydrophobicContact CD2-CD2 4.2Å; Y127-F297 HydrophobicContact CD2-CG 4.1Å; Y127-F297 HydrophobicContact CE1-CB 4.1Å; Y127-F297 HydrophobicContact CE1-CD1 4.26Å; Y127-F297 HydrophobicContact CE1-CG 4.34Å; Y127-F297 HydrophobicContact CE2-CB 3.8Å; Y127-F297 AromaticContact CE2-CD1 3.73Å; Y127-F297 HydrophobicContact CE2-CD1 3.73Å; Y127-F297 AromaticContact CE2-CD2 3.68Å; Y127-F297 HydrophobicContact CE2-CD2 3.68Å; Y127-F297 HydrophobicContact CE2-CE1 4.07Å; Y127-F297 HydrophobicContact CE2-CE2 4.02Å; Y127-F297 AromaticContact CE2-CG 3.47Å; Y127-F297 HydrophobicContact CE2-CG 3.47Å; Y127-F297 VanDerWaalsContact CE2-CG 3.47Å; Y127-F297 HydrophobicContact CE2-CZ 4.15Å; Y127-F297 HydrophobicContact CG-CB 4.23Å; Y127-F297 AromaticContact CZ-CD1 3.44Å; Y127-F297 VanDerWaalsContact CZ-CD1 3.44Å; Y127-F297 AromaticContact CZ-CE1 3.89Å; Y127-F297 AromaticContact CZ-CG 3.61Å; Y127-F297 WeakPolarHBondContact OH-CD1 3.46Å; Y127-F297 WeakPolarHBondContact OH-CE1 3.47Å; T290-F297 WeakPolarHBondContact O-CE2 3.38Å; A295-F297 PolarHBondContact O-N 3.39Å; F297-S299 VanDerWaalsContact C-N 3.29Å; F297-Y300 PolarHBondContact O-N 3.41Å; F297-S301 WeakPolarHBondContact O-CB 3.24Å; F297-S301 PolarHBondContact O-N 3.41Å; F297-S301 PolarHBondContact O-OG 3.2Å; F297-I317 HydrophobicContact CE1-CG2 4.13Å; F297-I317 HydrophobicContact CZ-CG2 4.01Å
298	I	96	Very high	92.2	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-61.9	-42.8	169.7	-66.9	172.8	0	0	0	109.3	E126 L129 T135 P137 A295 L296 Y300 S301 S302 M462	E126-I298 HydrophobicContact CB-CG1 3.88Å; E126-I298 HydrophobicContact CG-CD1 4.37Å; E126-I298 HydrophobicContact CG-CG1 4.22Å; E126-I298 VanDerWaalsContact O-CG1 3.3Å; E126-I298 WeakPolarHBondContact O-CG1 3.37Å; L129-I298 HydrophobicContact CD2-CD1 3.9Å; T135-I298 WeakPolarHBondContact O-CG2 3.42Å; P137-I298 HydrophobicContact CG-CD1 4.04Å; A295-I298 HydrophobicContact CB-CB 4.36Å; A295-I298 HydrophobicContact CB-CD1 3.83Å; A295-I298 HydrophobicContact CB-CG1 4.35Å; A295-I298 WeakPolarHBondContact O-CB 3.17Å; A295-I298 PolarHBondContact O-N 2.93Å; A295-I298 VanDerWaalsContact O-N 3.14Å; L296-I298 VanDerWaalsContact C-N 3.32Å; L296-I298 PolarHBondContact O-N 3.04Å; I298-Y300 VanDerWaalsContact C-N 3.3Å; I298-Y300 PolarHBondContact O-N 2.9Å; I298-S301 PolarHBondContact O-N 3.09Å; I298-S302 WeakPolarHBondContact O-CB 3.4Å; I298-S302 PolarHBondContact O-N 3.32Å; I298-S302 PolarHBondContact O-OG 2.94Å; I298-M462 HydrophobicContact CD1-CE 4.06Å
299	S	93.2	Very high	92.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.2	-29.8	-179.2	81.3	0	0	0	0	114.2	A295 L296 F297 S302 Y303	A295-S299 PolarHBondContact O-N 3.36Å; L296-S299 WeakPolarHBondContact O-CB 3.43Å; L296-S299 PolarHBondContact O-N 2.72Å; L296-S299 PolarHBondContact O-OG 3.5Å; F297-S299 VanDerWaalsContact C-N 3.29Å; S299-S302 PolarHBondContact O-OG 2.74Å; S299-S302 VanDerWaalsContact O-OG 3.07Å; S299-Y303 VanDerWaalsContact O-CD2 3.27Å; S299-Y303 WeakPolarHBondContact O-CD2 3.42Å; S299-Y303 VanDerWaalsContact O-CE2 3.28Å; S299-Y303 WeakPolarHBondContact O-CE2 3.45Å
300	Y	93.5	Very high	92.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-85.6	-46.5	175.1	-77.6	-67.3	0	0	0	111.6	F68 C81 I227 I230 L296 F297 I298 S302 Y303 G403	F68-Y300 AromaticContact CZ-CD1 3.83Å; F68-Y300 HydrophobicContact CZ-CD1 3.83Å; C81-Y300 HydrophobicContact CB-CD2 4.32Å; C81-Y300 HydrophobicContact CB-CE2 3.71Å; I227-Y300 HydrophobicContact CD1-CD1 4.01Å; I227-Y300 HydrophobicContact CD1-CE1 4.28Å; I230-Y300 HydrophobicContact CG2-CE1 3.77Å; L296-Y300 WeakPolarHBondContact O-CD2 3.35Å; L296-Y300 PolarHBondContact O-N 2.82Å; F297-Y300 PolarHBondContact O-N 3.41Å; I298-Y300 VanDerWaalsContact C-N 3.3Å; I298-Y300 PolarHBondContact O-N 2.9Å; Y300-S302 PolarHBondContact O-N 3.08Å; Y300-Y303 PolarHBondContact O-N 2.98Å; Y300-Y303 VanDerWaalsContact O-N 3.13Å; Y300-G403 WeakPolarHBondContact OH-CA 3.36Å
301	S	94.9	Very high	93	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-71.4	-16	-177.8	64.7	0	0	0	0	113.3	E126 Y127 G130 R131 F297 I298 Y303 F304	E126-S301 PolarHBondContact O-OG 3.14Å; Y127-S301 WeakPolarHBondContact O-CB 3.38Å; Y127-S301 PolarHBondContact O-OG 3.47Å; G130-S301 CarbonylContact C-O 3.6Å; G130-S301 VanDerWaalsContact CA-OG 3.22Å; G130-S301 WeakPolarHBondContact CA-OG 3.47Å; R131-S301 WeakPolarHBondContact CA-O 3.33Å; R131-S301 PolarHBondContact N-O 3.32Å; R131-S301 PolarHBondContact N-OG 2.89Å; F297-S301 WeakPolarHBondContact O-CB 3.24Å; F297-S301 PolarHBondContact O-N 3.41Å; F297-S301 PolarHBondContact O-OG 3.2Å; I298-S301 PolarHBondContact O-N 3.09Å; S301-Y303 PolarHBondContact O-N 2.99Å; S301-Y303 VanDerWaalsContact O-N 3.1Å; S301-F304 WeakPolarHBondContact O-CB 3.37Å; S301-F304 PolarHBondContact O-N 3.41Å
302	S	93.4	Very high	93.4	Very high	9 Å²	9	21.6 Å²	21.6	6%	0.063	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.3	168.8	66.3	0	0	0	0	113.6	G130 R134 I298 S299 Y300	G130-S302 WeakPolarHBondContact O-CA 3.49Å; R134-S302 WeakPolarHBondContact CB-O 3.35Å; R134-S302 WeakPolarHBondContact CG-O 3.47Å; I298-S302 WeakPolarHBondContact O-CB 3.4Å; I298-S302 PolarHBondContact O-N 3.32Å; I298-S302 PolarHBondContact O-OG 2.94Å; S299-S302 PolarHBondContact O-OG 2.74Å; S299-S302 VanDerWaalsContact O-OG 3.07Å; Y300-S302 PolarHBondContact O-N 3.08Å
303	Y	91.3	Very high	93.7	Very high	22 Å²	22	22.3 Å²	22.3	9%	0.086	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.3	175.3	-60.9	-84.7	0	0	0	113.1	S66 I227 S299 Y300 S301 V410 K413	S66-Y303 WeakPolarHBondContact O-CD1 3.39Å; I227-Y303 HydrophobicContact CB-CD1 4.35Å; I227-Y303 HydrophobicContact CB-CG 4.38Å; I227-Y303 HydrophobicContact CD1-CD2 4.01Å; I227-Y303 HydrophobicContact CD1-CE2 4.41Å; I227-Y303 HydrophobicContact CD1-CG 4.38Å; I227-Y303 HydrophobicContact CG1-CD2 4.26Å; I227-Y303 HydrophobicContact CG1-CG 4.12Å; I227-Y303 HydrophobicContact CG2-CD1 4.33Å; S299-Y303 VanDerWaalsContact O-CD2 3.27Å; S299-Y303 WeakPolarHBondContact O-CD2 3.42Å; S299-Y303 VanDerWaalsContact O-CE2 3.28Å; S299-Y303 WeakPolarHBondContact O-CE2 3.45Å; Y300-Y303 PolarHBondContact O-N 2.98Å; Y300-Y303 VanDerWaalsContact O-N 3.13Å; S301-Y303 PolarHBondContact O-N 2.99Å; S301-Y303 VanDerWaalsContact O-N 3.1Å; Y303-V410 HydrophobicContact CE2-CG2 3.9Å; Y303-K413 PolarHBondContact OH-NZ 3.41Å; Y303-K413 VanDerWaalsContact OH-NZ 3.08Å
304	F	91.3	Very high	93.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.1	C	C	.	.			trans	-84.4	148.9	178.9	-73.3	6	0	0	0	112.1	F68 V74 Y127 R131 R134 S301 N308 L313	F68-F304 HydrophobicContact CD2-CD1 4.11Å; F68-F304 HydrophobicContact CD2-CE1 4.03Å; F68-F304 AromaticContact CE2-CD1 3.98Å; F68-F304 HydrophobicContact CE2-CD1 3.98Å; F68-F304 AromaticContact CE2-CE1 3.61Å; F68-F304 HydrophobicContact CE2-CE1 3.61Å; F68-F304 HydrophobicContact CZ-CE1 4.4Å; V74-F304 HydrophobicContact CG1-CD1 4.48Å; V74-F304 HydrophobicContact CG1-CE1 3.5Å; V74-F304 HydrophobicContact CG1-CE2 4.34Å; V74-F304 HydrophobicContact CG1-CZ 3.41Å; V74-F304 VanDerWaalsContact CG1-CZ 3.41Å; V74-F304 HydrophobicContact CG2-CE1 4.28Å; Y127-F304 AromaticContact CD1-CE2 3.69Å; Y127-F304 HydrophobicContact CD1-CE2 3.69Å; Y127-F304 HydrophobicContact CD1-CZ 4.27Å; Y127-F304 AromaticContact CE1-CE2 3.96Å; Y127-F304 HydrophobicContact CE1-CE2 3.96Å; Y127-F304 HydrophobicContact CE1-CZ 4.09Å; R131-F304 HydrophobicContact CB-CB 4.16Å; R131-F304 HydrophobicContact CG-CB 3.84Å; R134-F304 PolarHBondContact NE-O 3.05Å; R134-F304 PolarHBondContact NH2-O 2.92Å; S301-F304 WeakPolarHBondContact O-CB 3.37Å; S301-F304 PolarHBondContact O-N 3.41Å; F304-N308 HydrophobicContact CB-CB 3.77Å; F304-N308 HydrophobicContact CD1-CB 4.34Å; F304-N308 HydrophobicContact CD2-CB 3.58Å; F304-N308 HydrophobicContact CE2-CB 4.25Å; F304-N308 HydrophobicContact CG-CB 3.63Å; F304-L313 HydrophobicContact CD2-CD1 4.48Å; F304-L313 HydrophobicContact CE2-CD1 3.45Å; F304-L313 VanDerWaalsContact CE2-CD1 3.45Å; F304-L313 HydrophobicContact CZ-CD1 3.74Å
305	S	87.8	Confident	94.1	Very high	37 Å²	37	23.5 Å²	23.5	26%	0.259	11%	0.108	S	C	.	.			trans	-86.7	171.3	163.7	73.4	0	0	0	0	110.8	R131 K307 N308	R131-S305 WeakPolarHBondContact CD-O 3.25Å; S305-K307 PolarHBondContact O-N 2.85Å; S305-K307 VanDerWaalsContact O-N 3.13Å; S305-K307 PolarHBondContact OG-N 3.37Å; S305-N308 PolarHBondContact N-OD1 3.13Å; S305-N308 PolarHBondContact O-N 2.77Å; S305-N308 VanDerWaalsContact O-N 3.16Å; S305-N308 PolarHBondContact O-OD1 3.44Å; S305-N308 PolarHBondContact OG-OD1 3.48Å
306	R	89.8	Confident	94.1	Very high	71 Å²	71	26.9 Å²	26.9	27%	0.268	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22	173.2	-65.2	-176.4	65.6	-177.1	1.7	114	R131 D481 F482 I484	R131-R306 PolarHBondContact NH1-O 3.32Å; R131-R306 VanDerWaalsContact NH1-O 3.07Å; R306-D481 PolarHBondContact NH2-O 2.94Å; R306-F482 HydrophobicContact CG-CD1 4.48Å; R306-F482 HydrophobicContact CG-CE1 3.89Å; R306-F482 HydrophobicContact CG-CE2 4.01Å; R306-F482 HydrophobicContact CG-CZ 3.62Å; R306-F482 PolarHBondContact NE-O 2.83Å; R306-F482 PolarHBondContact NH2-O 2.66Å; R306-I484 HydrophobicContact CB-CD1 3.86Å; R306-I484 HydrophobicContact CB-CG1 4.06Å; R306-I484 PolarHBondContact O-N 3.07Å
307	K	88.7	Confident	94.3	Very high	151 Å²	151	26.9 Å²	26.9	66%	0.657	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.7	-180	-62.2	-179.8	178.7	178.7	0	113.9	S305 G309 I484	S305-K307 PolarHBondContact O-N 2.85Å; S305-K307 VanDerWaalsContact O-N 3.13Å; S305-K307 PolarHBondContact OG-N 3.37Å; K307-G309 PolarHBondContact O-N 2.86Å; K307-I484 HydrophobicContact CG-CB 4.35Å; K307-I484 HydrophobicContact CG-CG2 4.37Å
308	N	91.9	Very high	94.3	Very high	32 Å²	32	26.9 Å²	26.9	17%	0.171	12%	0.124	C	C	.	.	S	Bend	trans	-75	112.9	175.1	-63.6	94.5	0	0	0	108.4	R131 F304 S305 A310	R131-N308 VanDerWaalsContact CD-O 3.31Å; R131-N308 WeakPolarHBondContact CD-O 3.49Å; F304-N308 HydrophobicContact CB-CB 3.77Å; F304-N308 HydrophobicContact CD1-CB 4.34Å; F304-N308 HydrophobicContact CD2-CB 3.58Å; F304-N308 HydrophobicContact CE2-CB 4.25Å; F304-N308 HydrophobicContact CG-CB 3.63Å; S305-N308 PolarHBondContact N-OD1 3.13Å; S305-N308 PolarHBondContact O-N 2.77Å; S305-N308 VanDerWaalsContact O-N 3.16Å; S305-N308 PolarHBondContact O-OD1 3.44Å; S305-N308 PolarHBondContact OG-OD1 3.48Å; N308-A310 PolarHBondContact O-N 2.79Å
309	G	93.7	Very high	94.4	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.01	14%	0.136	C	C	.	.			trans	-67.3	92.7	-176.5	0	0	0	0	0	113	K307 R312 L313 D486	K307-G309 PolarHBondContact O-N 2.86Å; G309-R312 PolarHBondContact O-N 2.94Å; G309-L313 WeakPolarHBondContact O-CB 3.31Å; G309-L313 VanDerWaalsContact O-CG 3.31Å; G309-L313 WeakPolarHBondContact O-CG 3.33Å; G309-L313 PolarHBondContact O-N 3.25Å; G309-D486 VanDerWaalsContact C-OD2 3.29Å; G309-D486 WeakPolarHBondContact CA-OD1 3.46Å; G309-D486 WeakPolarHBondContact CA-OD2 3.35Å
310	A	96.1	Very high	94.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-37.9	-178.4	0	0	0	0	0	112.3	T128 R131 N308 G314 D486	T128-A310 HydrophobicContact CG2-CB 3.75Å; R131-A310 VanDerWaalsContact NE-CB 3.33Å; N308-A310 PolarHBondContact O-N 2.79Å; A310-G314 PolarHBondContact O-N 3.48Å; A310-D486 PolarHBondContact N-OD2 3.45Å
311	V	98	Very high	94.8	Very high	6 Å²	6	31.8 Å²	31.8	4%	0.036	15%	0.154	C	C	.	.	H	α-helix	trans	-68.8	-45	175.5	-179.3	0	0	0	0	109.6	G314 T315 V479 D486 W487 L489	V311-G314 PolarHBondContact O-N 3.09Å; V311-T315 WeakPolarHBondContact O-CB 3.29Å; V311-T315 PolarHBondContact O-N 3.24Å; V311-T315 PolarHBondContact O-OG1 3.43Å; V311-V479 HydrophobicContact CG2-CG1 3.31Å; V311-D486 PolarHBondContact N-OD2 2.72Å; V311-W487 HydrophobicContact CB-CB 4.31Å; V311-W487 WeakPolarHBondContact CB-O 3.44Å; V311-W487 HydrophobicContact CG1-CB 4.05Å; V311-W487 WeakPolarHBondContact CG2-O 3.47Å; V311-L489 HydrophobicContact CG1-CB 4.49Å; V311-L489 HydrophobicContact CG1-CD1 4.13Å; V311-L489 HydrophobicContact CG2-CB 4.22Å
312	R	97.4	Very high	94.9	Very high	118 Å²	118	31.9 Å²	31.9	45%	0.445	15%	0.154	S	C	.	.	H	α-helix	trans	-60.3	-48	177	-174.6	176.9	65.9	-175.2	-2.2	111.8	G309 T315 M316 D486 W487	G309-R312 PolarHBondContact O-N 2.94Å; R312-T315 PolarHBondContact O-N 3.49Å; R312-M316 HydrophobicContact CG-CG 4.26Å; R312-M316 WeakPolarHBondContact O-CB 3.29Å; R312-M316 WeakPolarHBondContact O-CG 3.22Å; R312-M316 PolarHBondContact O-N 2.86Å; R312-D486 PolarHBondContact N-OD1 2.95Å; R312-D486 VanDerWaalsContact N-OD1 3.15Å; R312-W487 HydrophobicContact CB-CD2 4.01Å; R312-W487 HydrophobicContact CB-CE3 4.16Å; R312-W487 HydrophobicContact CB-CG 4.32Å; R312-W487 HydrophobicContact CG-CD2 4.1Å; R312-W487 HydrophobicContact CG-CE3 4.23Å; R312-W487 HydrophobicContact CG-CH2 4.13Å; R312-W487 HydrophobicContact CG-CZ2 3.97Å; R312-W487 HydrophobicContact CG-CZ3 4.25Å
313	L	97	Very high	95.1	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.079	17%	0.174	C	C	.	.	H	α-helix	trans	-66.4	-46.3	178.3	-72.9	169.3	0	0	0	111.8	V74 L75 Y127 F304 G309 T315 M316 I317	V74-L313 HydrophobicContact CG1-CD1 3.89Å; L75-L313 HydrophobicContact CD1-CD2 4.26Å; Y127-L313 HydrophobicContact CD1-CB 4.14Å; Y127-L313 HydrophobicContact CE1-CB 3.95Å; Y127-L313 HydrophobicContact CE1-CD1 4.36Å; Y127-L313 HydrophobicContact CE2-CB 4.42Å; Y127-L313 HydrophobicContact CG-CB 4.44Å; F304-L313 HydrophobicContact CD2-CD1 4.48Å; F304-L313 HydrophobicContact CE2-CD1 3.45Å; F304-L313 VanDerWaalsContact CE2-CD1 3.45Å; F304-L313 HydrophobicContact CZ-CD1 3.74Å; G309-L313 WeakPolarHBondContact O-CB 3.31Å; G309-L313 VanDerWaalsContact O-CG 3.31Å; G309-L313 WeakPolarHBondContact O-CG 3.33Å; G309-L313 PolarHBondContact O-N 3.25Å; L313-T315 PolarHBondContact O-N 3.02Å; L313-T315 VanDerWaalsContact O-N 3.09Å; L313-M316 PolarHBondContact O-N 3.39Å; L313-I317 HydrophobicContact CB-CG1 4.4Å; L313-I317 HydrophobicContact CD2-CD1 4.28Å; L313-I317 HydrophobicContact CD2-CG1 4.12Å; L313-I317 VanDerWaalsContact O-CB 3.27Å; L313-I317 WeakPolarHBondContact O-CB 3.48Å; L313-I317 WeakPolarHBondContact O-CG1 3.42Å; L313-I317 PolarHBondContact O-N 3.06Å
314	G	96.8	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-17.9	175.9	0	0	0	0	0	114.2	A310 V311 P318	A310-G314 PolarHBondContact O-N 3.48Å; V311-G314 PolarHBondContact O-N 3.09Å; G314-P318 WeakPolarHBondContact O-CD 3.39Å; G314-P318 WeakPolarHBondContact O-CG 3.34Å
315	T	97.6	Very high	95.7	Very high	29 Å²	29	35.6 Å²	35.6	18%	0.178	17%	0.174	C	C	.	.	H	α-helix	trans	-94.7	-50.5	174.4	-51.6	0	0	0	0	112.5	L120 V311 R312 L313 I319 W487	L120-T315 HydrophobicContact CD2-CG2 4.37Å; L120-T315 WeakPolarHBondContact CD2-O 3.39Å; V311-T315 WeakPolarHBondContact O-CB 3.29Å; V311-T315 PolarHBondContact O-N 3.24Å; V311-T315 PolarHBondContact O-OG1 3.43Å; R312-T315 PolarHBondContact O-N 3.49Å; L313-T315 PolarHBondContact O-N 3.02Å; L313-T315 VanDerWaalsContact O-N 3.09Å; T315-I319 HydrophobicContact CG2-CD1 4.03Å; T315-I319 WeakPolarHBondContact O-CD1 3.24Å; T315-I319 WeakPolarHBondContact O-CG1 3.45Å; T315-W487 HydrophobicContact CG2-CZ3 4.34Å
316	M	97.3	Very high	96.1	Very high	71 Å²	71	35.5 Å²	35.5	35%	0.35	17%	0.17	S	C	.	.	H	α-helix	trans	-73.9	-38.6	-173.2	-69.1	-67.9	100.5	0	0	112.7	R312 L313 I319 C320 W487	R312-M316 HydrophobicContact CG-CG 4.26Å; R312-M316 WeakPolarHBondContact O-CB 3.29Å; R312-M316 WeakPolarHBondContact O-CG 3.22Å; R312-M316 PolarHBondContact O-N 2.86Å; L313-M316 PolarHBondContact O-N 3.39Å; M316-I319 HydrophobicContact CE-CD1 3.93Å; M316-I319 PolarHBondContact O-N 3.17Å; M316-C320 WeakPolarHBondContact O-CB 3.01Å; M316-C320 PolarHBondContact O-N 3.37Å; M316-C320 PolarHBondContact O-SG 2.78Å; M316-W487 HydrophobicContact CE-CH2 3.82Å; M316-W487 HydrophobicContact CE-CZ3 3.9Å; M316-W487 HydrophobicContact CG-CH2 4.14Å; M316-W487 HydrophobicContact CG-CZ3 4.38Å; M316-W487 HydrophobicContact SD-CH2 4.12Å
317	I	97.5	Very high	96.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-62	-49.7	-176.5	-62.3	-68.3	0	0	0	111.4	L75 C78 L79 V82 F297 L313 I319 C320 N321	L75-I317 HydrophobicContact CD1-CD1 3.76Å; C78-I317 HydrophobicContact CB-CD1 3.66Å; C78-I317 HydrophobicContact CB-CG1 3.97Å; L79-I317 HydrophobicContact CD2-CD1 3.65Å; L79-I317 HydrophobicContact CG-CD1 3.7Å; V82-I317 HydrophobicContact CG1-CG2 4.43Å; V82-I317 HydrophobicContact CG2-CG2 3.55Å; F297-I317 HydrophobicContact CE1-CG2 4.13Å; F297-I317 HydrophobicContact CZ-CG2 4.01Å; L313-I317 HydrophobicContact CB-CG1 4.4Å; L313-I317 HydrophobicContact CD2-CD1 4.28Å; L313-I317 HydrophobicContact CD2-CG1 4.12Å; L313-I317 VanDerWaalsContact O-CB 3.27Å; L313-I317 WeakPolarHBondContact O-CB 3.48Å; L313-I317 WeakPolarHBondContact O-CG1 3.42Å; L313-I317 PolarHBondContact O-N 3.06Å; I317-I319 VanDerWaalsContact C-N 3.33Å; I317-I319 PolarHBondContact O-N 3.43Å; I317-C320 PolarHBondContact O-N 2.92Å; I317-N321 VanDerWaalsContact O-CB 3.31Å; I317-N321 WeakPolarHBondContact O-CB 3.45Å; I317-N321 PolarHBondContact O-N 2.61Å
318	P	97.3	Very high	96.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-34.2	175.9	-25.4	37.8	0	0	0	113.8	L115 L120 S123 T290 G314 N321 N322	L115-P318 HydrophobicContact CD1-CB 3.62Å; L120-P318 HydrophobicContact CD2-CB 3.84Å; L120-P318 HydrophobicContact CD2-CG 4.03Å; S123-P318 WeakPolarHBondContact OG-CG 3.4Å; T290-P318 HydrophobicContact CG2-CB 3.93Å; G314-P318 WeakPolarHBondContact O-CD 3.39Å; G314-P318 WeakPolarHBondContact O-CG 3.34Å; P318-N321 WeakPolarHBondContact O-CB 3.41Å; P318-N321 PolarHBondContact O-N 3.19Å; P318-N322 PolarHBondContact O-N 3.03Å; P318-N322 PolarHBondContact O-OD1 3.01Å
319	I	97.9	Very high	97	Very high	50 Å²	50	25.9 Å²	25.9	26%	0.256	13%	0.131	S	C	.	.	H	α-helix	trans	-66.4	-48.9	176	-70.9	170.5	0	0	0	110.7	L115 L120 T315 M316 I317 N321 N322 M323	L115-I319 HydrophobicContact CD2-CG1 4.15Å; L120-I319 HydrophobicContact CD2-CG1 4.37Å; T315-I319 HydrophobicContact CG2-CD1 4.03Å; T315-I319 WeakPolarHBondContact O-CD1 3.24Å; T315-I319 WeakPolarHBondContact O-CG1 3.45Å; M316-I319 HydrophobicContact CE-CD1 3.93Å; M316-I319 PolarHBondContact O-N 3.17Å; I317-I319 VanDerWaalsContact C-N 3.33Å; I317-I319 PolarHBondContact O-N 3.43Å; I319-N321 VanDerWaalsContact C-N 3.28Å; I319-N321 PolarHBondContact O-N 3.47Å; I319-N322 PolarHBondContact O-N 2.94Å; I319-M323 WeakPolarHBondContact O-CG 3.46Å; I319-M323 PolarHBondContact O-N 3.43Å
320	C	97.4	Very high	97.1	Very high	54 Å²	54	26.8 Å²	26.8	37%	0.365	14%	0.135	S	C	.	.	H	α-helix	trans	-58.8	-42.4	175.9	-71.6	0	0	0	0	111.2	L79 M316 I317 M323 V324	L79-C320 HydrophobicContact CD2-CB 3.91Å; M316-C320 WeakPolarHBondContact O-CB 3.01Å; M316-C320 PolarHBondContact O-N 3.37Å; M316-C320 PolarHBondContact O-SG 2.78Å; I317-C320 PolarHBondContact O-N 2.92Å; C320-M323 PolarHBondContact O-N 3.13Å; C320-V324 WeakPolarHBondContact O-CG2 3.3Å; C320-V324 PolarHBondContact O-N 3.01Å
321	N	97.3	Very high	97	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-54.4	-54.3	174.4	-178.8	75.2	0	0	0	111.8	V82 N87 D289 I317 P318 I319 M323 V324 S325	V82-N321 HydrophobicContact CB-CB 4.37Å; V82-N321 HydrophobicContact CG2-CB 3.95Å; V82-N321 PolarHBondContact O-OD1 3.24Å; V82-N321 VanDerWaalsContact O-OD1 3.06Å; N87-N321 VanDerWaalsContact ND2-CG 3.3Å; N87-N321 PolarHBondContact ND2-ND2 3.43Å; N87-N321 PolarHBondContact ND2-O 3.42Å; N87-N321 PolarHBondContact ND2-OD1 3.12Å; D289-N321 VanDerWaalsContact C-ND2 3.35Å; D289-N321 PolarHBondContact O-ND2 3.14Å; D289-N321 PolarHBondContact O-OD1 3.07Å; D289-N321 PolarHBondContact OD2-ND2 2.5Å; I317-N321 VanDerWaalsContact O-CB 3.31Å; I317-N321 WeakPolarHBondContact O-CB 3.45Å; I317-N321 PolarHBondContact O-N 2.61Å; P318-N321 WeakPolarHBondContact O-CB 3.41Å; P318-N321 PolarHBondContact O-N 3.19Å; I319-N321 VanDerWaalsContact C-N 3.28Å; I319-N321 PolarHBondContact O-N 3.47Å; N321-M323 VanDerWaalsContact C-N 3.3Å; N321-M323 PolarHBondContact O-N 2.6Å; N321-V324 WeakPolarHBondContact O-CB 3.49Å; N321-V324 PolarHBondContact O-N 3.41Å; N321-V324 VanDerWaalsContact O-N 3.08Å; N321-S325 PolarHBondContact O-N 3.39Å; N321-S325 PolarHBondContact O-OG 3.32Å
322	N	97.6	Very high	96.7	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.011	14%	0.139	C	C	.	.	H	α-helix	trans	-57.6	-41.2	176.9	-88.3	59.6	0	0	0	112.1	W111 L115 N286 P318 I319 V324 S325 L326	W111-N322 HydrophobicContact CH2-CB 3.48Å; W111-N322 VanDerWaalsContact CH2-CB 3.48Å; W111-N322 WeakPolarHBondContact CH2-ND2 3.37Å; W111-N322 VanDerWaalsContact CH2-O 3.27Å; W111-N322 WeakPolarHBondContact CH2-O 3.44Å; W111-N322 HydrophobicContact CZ2-CB 3.63Å; W111-N322 WeakPolarHBondContact CZ2-ND2 3.45Å; W111-N322 HydrophobicContact CZ3-CB 4.34Å; W111-N322 WeakPolarHBondContact CZ3-ND2 3.22Å; L115-N322 HydrophobicContact CD2-CB 4.25Å; N286-N322 PolarHBondContact ND2-ND2 3.08Å; N286-N322 PolarHBondContact ND2-OD1 2.99Å; P318-N322 PolarHBondContact O-N 3.03Å; P318-N322 PolarHBondContact O-OD1 3.01Å; I319-N322 PolarHBondContact O-N 2.94Å; N322-V324 VanDerWaalsContact C-N 3.3Å; N322-V324 PolarHBondContact O-N 3.31Å; N322-S325 PolarHBondContact O-N 2.7Å; N322-L326 PolarHBondContact O-N 2.99Å
323	M	97.3	Very high	96.5	Very high	98 Å²	98	21.9 Å²	21.9	48%	0.483	12%	0.118	S	C	.	.	H	α-helix	trans	-61.3	-39.7	176.6	-68.2	-60.7	99	0	0	112	I319 C320 N321 L326 L327	I319-M323 WeakPolarHBondContact O-CG 3.46Å; I319-M323 PolarHBondContact O-N 3.43Å; C320-M323 PolarHBondContact O-N 3.13Å; N321-M323 VanDerWaalsContact C-N 3.3Å; N321-M323 PolarHBondContact O-N 2.6Å; M323-L326 PolarHBondContact O-N 3.35Å; M323-L327 WeakPolarHBondContact O-CG 3.37Å; M323-L327 PolarHBondContact O-N 2.92Å
324	V	97.3	Very high	96.4	Very high	12 Å²	12	21.1 Å²	21.1	7%	0.073	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-42.6	174.6	174.2	0	0	0	0	111.2	I83 N87 L242 L245 C320 N321 N322 L326 L327 C328	I83-V324 HydrophobicContact CD1-CG2 3.88Å; I83-V324 HydrophobicContact CG1-CG2 4.35Å; I83-V324 HydrophobicContact CG2-CG1 3.78Å; N87-V324 HydrophobicContact CB-CG1 4.32Å; L242-V324 HydrophobicContact CD2-CG2 4.22Å; L245-V324 HydrophobicContact CD1-CG1 3.71Å; L245-V324 HydrophobicContact CD2-CG1 4.26Å; C320-V324 WeakPolarHBondContact O-CG2 3.3Å; C320-V324 PolarHBondContact O-N 3.01Å; N321-V324 WeakPolarHBondContact O-CB 3.49Å; N321-V324 PolarHBondContact O-N 3.41Å; N321-V324 VanDerWaalsContact O-N 3.08Å; N322-V324 VanDerWaalsContact C-N 3.3Å; N322-V324 PolarHBondContact O-N 3.31Å; V324-L326 VanDerWaalsContact C-N 3.29Å; V324-L326 PolarHBondContact O-N 3.24Å; V324-L327 WeakPolarHBondContact O-CB 3.35Å; V324-L327 PolarHBondContact O-N 3.35Å; V324-L327 VanDerWaalsContact O-N 3.16Å; V324-C328 PolarHBondContact O-N 3.3Å; V324-C328 PolarHBondContact O-SG 3Å
325	S	97.5	Very high	96.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.4	-40.2	175.4	-38.4	0	0	0	0	111.8	N87 F91 D289 N321 N322 C328 A329	N87-S325 PolarHBondContact ND2-OG 3.31Å; F91-S325 WeakPolarHBondContact CD1-O 3.32Å; F91-S325 VanDerWaalsContact CE1-O 3.26Å; F91-S325 WeakPolarHBondContact CE1-O 3.4Å; D289-S325 WeakPolarHBondContact OD2-CB 3.15Å; D289-S325 PolarHBondContact OD2-OG 2.91Å; N321-S325 PolarHBondContact O-N 3.39Å; N321-S325 PolarHBondContact O-OG 3.32Å; N322-S325 PolarHBondContact O-N 2.7Å; S325-C328 WeakPolarHBondContact O-CB 3.29Å; S325-C328 PolarHBondContact O-N 3.42Å; S325-A329 PolarHBondContact O-N 2.97Å
326	L	97.4	Very high	95.8	Very high	35 Å²	35	20.1 Å²	20.1	18%	0.183	11%	0.108	C	C	.	.	H	α-helix	trans	-64.4	-42.9	174.8	-176.2	61.7	0	0	0	111.7	L108 L265 F266 N322 M323 V324 C328 A329 L330	L108-L326 HydrophobicContact CD1-CD1 4.28Å; L108-L326 HydrophobicContact CD2-CD1 4.2Å; L265-L326 HydrophobicContact CD2-CD1 4.41Å; F266-L326 HydrophobicContact CZ-CD1 4.22Å; N322-L326 PolarHBondContact O-N 2.99Å; M323-L326 PolarHBondContact O-N 3.35Å; V324-L326 VanDerWaalsContact C-N 3.29Å; V324-L326 PolarHBondContact O-N 3.24Å; L326-C328 VanDerWaalsContact C-N 3.33Å; L326-C328 PolarHBondContact O-N 3.26Å; L326-A329 PolarHBondContact O-N 3.3Å; L326-L330 HydrophobicContact CG-CD1 4.25Å; L326-L330 VanDerWaalsContact O-CG 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.43Å; L326-L330 PolarHBondContact O-N 2.86Å
327	L	96.8	Very high	95.6	Very high	47 Å²	47	16.7 Å²	16.7	25%	0.246	9%	0.091	C	C	.	.	H	α-helix	trans	-60.3	-41.6	173.8	-73.3	171.1	0	0	0	111.9	L245 F249 M323 V324 L330 T331	L245-L327 HydrophobicContact CD2-CB 4.07Å; L245-L327 HydrophobicContact CD2-CD1 3.92Å; F249-L327 HydrophobicContact CD1-CD2 3.71Å; F249-L327 HydrophobicContact CD2-CD2 4.09Å; F249-L327 HydrophobicContact CE1-CD2 3.57Å; F249-L327 HydrophobicContact CE2-CD2 3.98Å; F249-L327 HydrophobicContact CG-CD2 3.96Å; F249-L327 HydrophobicContact CZ-CD2 3.7Å; M323-L327 WeakPolarHBondContact O-CG 3.37Å; M323-L327 PolarHBondContact O-N 2.92Å; V324-L327 WeakPolarHBondContact O-CB 3.35Å; V324-L327 PolarHBondContact O-N 3.35Å; V324-L327 VanDerWaalsContact O-N 3.16Å; L327-L330 PolarHBondContact O-N 3.12Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 PolarHBondContact O-N 3.43Å; L327-T331 PolarHBondContact O-OG1 3.47Å
328	C	95.6	Very high	95.4	Very high	4 Å²	4	16.7 Å²	16.7	3%	0.027	9%	0.091	C	C	.	.	H	α-helix	trans	-61.3	-47.9	173.7	-66.2	0	0	0	0	111.4	N87 I88 P92 L245 V324 S325 L326 L330 T331 I332	N87-C328 WeakPolarHBondContact O-CB 3.37Å; I88-C328 VanDerWaalsContact CA-SG 3.55Å; P92-C328 HydrophobicContact CG-CB 4.11Å; L245-C328 WeakPolarHBondContact CD1-SG 3.39Å; V324-C328 PolarHBondContact O-N 3.3Å; V324-C328 PolarHBondContact O-SG 3Å; S325-C328 WeakPolarHBondContact O-CB 3.29Å; S325-C328 PolarHBondContact O-N 3.42Å; L326-C328 VanDerWaalsContact C-N 3.33Å; L326-C328 PolarHBondContact O-N 3.26Å; C328-L330 VanDerWaalsContact C-N 3.35Å; C328-L330 PolarHBondContact O-N 3.47Å; C328-T331 PolarHBondContact O-N 3.12Å; C328-I332 WeakPolarHBondContact O-CB 3.44Å; C328-I332 VanDerWaalsContact O-CG1 3.27Å; C328-I332 WeakPolarHBondContact O-CG1 3.48Å; C328-I332 PolarHBondContact O-N 3.05Å
329	A	95.8	Very high	95	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61	-43.8	178.1	0	0	0	0	0	111.8	F91 L265 S325 L326 I332 F333	F91-A329 HydrophobicContact CD1-CB 3.9Å; F91-A329 HydrophobicContact CE1-CB 3.62Å; L265-A329 HydrophobicContact CD1-CB 4.43Å; L265-A329 HydrophobicContact CD2-CB 4.31Å; S325-A329 PolarHBondContact O-N 2.97Å; L326-A329 PolarHBondContact O-N 3.3Å; A329-I332 PolarHBondContact O-N 2.65Å; A329-F333 VanDerWaalsContact O-CB 3.31Å; A329-F333 WeakPolarHBondContact O-CB 3.28Å; A329-F333 WeakPolarHBondContact O-CD2 3.22Å; A329-F333 PolarHBondContact O-N 3.45Å
330	L	96.5	Very high	94.6	Very high	20 Å²	20	15 Å²	15	11%	0.105	8%	0.083	C	C	.	.	H	α-helix	trans	-58.1	-50.8	173.9	-71.3	165.7	0	0	0	111.2	F249 I262 L265 F266 L326 L327 C328 I332 F333 S334	F249-L330 HydrophobicContact CD2-CB 4.19Å; F249-L330 HydrophobicContact CE2-CB 3.7Å; F249-L330 HydrophobicContact CE2-CD1 3.93Å; F249-L330 HydrophobicContact CE2-CG 4.43Å; F249-L330 HydrophobicContact CZ-CD1 4.27Å; I262-L330 HydrophobicContact CG1-CD2 4.15Å; I262-L330 HydrophobicContact CG2-CD2 4.16Å; L265-L330 HydrophobicContact CD2-CD2 3.58Å; L265-L330 HydrophobicContact CD2-CG 3.97Å; F266-L330 HydrophobicContact CE2-CD2 3.71Å; F266-L330 HydrophobicContact CZ-CD2 4.3Å; L326-L330 HydrophobicContact CG-CD1 4.25Å; L326-L330 VanDerWaalsContact O-CG 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.43Å; L326-L330 PolarHBondContact O-N 2.86Å; L327-L330 PolarHBondContact O-N 3.12Å; C328-L330 VanDerWaalsContact C-N 3.35Å; C328-L330 PolarHBondContact O-N 3.47Å; L330-I332 VanDerWaalsContact C-N 3.34Å; L330-I332 PolarHBondContact O-N 3.27Å; L330-F333 PolarHBondContact O-N 3.4Å; L330-S334 WeakPolarHBondContact O-CB 3.09Å; L330-S334 PolarHBondContact O-N 2.92Å; L330-S334 PolarHBondContact O-OG 2.66Å
331	T	94	Very high	94.3	Very high	13 Å²	13	14.1 Å²	14.1	8%	0.08	7%	0.074	C	C	.	.	H	α-helix	trans	-56.1	-48.2	179.9	-55	0	0	0	0	111.6	F249 L327 C328 T335	F249-T331 WeakPolarHBondContact CA-OG1 3.32Å; F249-T331 WeakPolarHBondContact CB-OG1 3.19Å; F249-T331 WeakPolarHBondContact CD2-OG1 3.37Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 PolarHBondContact O-N 3.43Å; L327-T331 PolarHBondContact O-OG1 3.47Å; C328-T331 PolarHBondContact O-N 3.12Å; T331-T335 VanDerWaalsContact O-CB 3.26Å; T331-T335 WeakPolarHBondContact O-CB 3.29Å; T331-T335 PolarHBondContact O-N 2.66Å; T331-T335 PolarHBondContact O-OG1 3.14Å
332	I	91.8	Very high	93.9	Very high	8 Å²	8	18 Å²	18	4%	0.041	9%	0.092	C	C	.	.	H	α-helix	trans	-69.8	-48.2	-178.1	-63.1	-61.4	0	0	0	111.2	P92 C328 A329 L330 S334 T335 V336 M356 L366 I371 F389	P92-I332 HydrophobicContact CB-CB 3.91Å; P92-I332 HydrophobicContact CB-CG1 3.95Å; P92-I332 HydrophobicContact CB-CG2 3.93Å; P92-I332 HydrophobicContact CG-CB 4.27Å; P92-I332 HydrophobicContact CG-CG1 3.88Å; C328-I332 WeakPolarHBondContact O-CB 3.44Å; C328-I332 VanDerWaalsContact O-CG1 3.27Å; C328-I332 WeakPolarHBondContact O-CG1 3.48Å; C328-I332 PolarHBondContact O-N 3.05Å; A329-I332 PolarHBondContact O-N 2.65Å; L330-I332 VanDerWaalsContact C-N 3.34Å; L330-I332 PolarHBondContact O-N 3.27Å; I332-S334 PolarHBondContact O-N 3.48Å; I332-T335 PolarHBondContact O-N 2.96Å; I332-V336 HydrophobicContact CG2-CG2 3.91Å; I332-V336 WeakPolarHBondContact O-CB 3.44Å; I332-V336 WeakPolarHBondContact O-CG2 3.4Å; I332-V336 PolarHBondContact O-N 3.42Å; I332-M356 HydrophobicContact CG2-CE 4.38Å; I332-L366 HydrophobicContact CG2-CD2 4.2Å; I332-I371 HydrophobicContact CD1-CD1 3.69Å; I332-F389 HydrophobicContact CD1-CE2 3.97Å; I332-F389 HydrophobicContact CD1-CZ 4.33Å
333	F	94.1	Very high	93.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-44.6	179.9	-84.5	-115.1	0	0	0	111.3	I95 A96 F264 L265 A329 L330 T335 F337 M356	I95-F333 HydrophobicContact CG2-CE2 3.51Å; I95-F333 HydrophobicContact CG2-CZ 3.75Å; A96-F333 HydrophobicContact CB-CZ 4.04Å; F264-F333 HydrophobicContact CD1-CD1 4.1Å; F264-F333 AromaticContact CD1-CE1 3.82Å; F264-F333 HydrophobicContact CD1-CE1 3.82Å; F264-F333 HydrophobicContact CE1-CE1 4.04Å; L265-F333 HydrophobicContact CB-CD1 4.41Å; L265-F333 HydrophobicContact CD1-CD1 4.04Å; L265-F333 HydrophobicContact CD1-CD2 4.17Å; L265-F333 HydrophobicContact CD1-CE1 4.06Å; L265-F333 HydrophobicContact CD1-CE2 4.2Å; L265-F333 HydrophobicContact CD1-CG 4.11Å; L265-F333 HydrophobicContact CD1-CZ 4.14Å; A329-F333 VanDerWaalsContact O-CB 3.31Å; A329-F333 WeakPolarHBondContact O-CB 3.28Å; A329-F333 WeakPolarHBondContact O-CD2 3.22Å; A329-F333 PolarHBondContact O-N 3.45Å; L330-F333 PolarHBondContact O-N 3.4Å; F333-T335 PolarHBondContact O-N 3Å; F333-F337 HydrophobicContact CD1-CD2 4.49Å; F333-F337 AromaticContact CD1-CE2 3.91Å; F333-F337 HydrophobicContact CD1-CE2 3.91Å; F333-F337 HydrophobicContact CE1-CE2 4.42Å; F333-F337 WeakPolarHBondContact O-CB 3.37Å; F333-F337 VanDerWaalsContact O-CD2 3.26Å; F333-F337 WeakPolarHBondContact O-CD2 3.34Å; F333-F337 PolarHBondContact O-N 3.23Å; F333-M356 HydrophobicContact CD1-CE 4.09Å; F333-M356 HydrophobicContact CD2-CE 3.61Å; F333-M356 HydrophobicContact CE1-CE 3.95Å; F333-M356 HydrophobicContact CE1-SD 4.43Å; F333-M356 HydrophobicContact CE2-CE 3.44Å; F333-M356 VanDerWaalsContact CE2-CE 3.44Å; F333-M356 HydrophobicContact CG-CE 3.93Å; F333-M356 HydrophobicContact CZ-CE 3.62Å
334	S	94.3	Very high	92.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.8	-48.3	174	-71.1	0	0	0	0	111.7	S258 I262 L330 I332 S338	S258-S334 PolarHBondContact O-OG 2.91Å; I262-S334 VanDerWaalsContact CG1-OG 3.22Å; I262-S334 WeakPolarHBondContact CG1-OG 3.18Å; L330-S334 WeakPolarHBondContact O-CB 3.09Å; L330-S334 PolarHBondContact O-N 2.92Å; L330-S334 PolarHBondContact O-OG 2.66Å; I332-S334 PolarHBondContact O-N 3.48Å; S334-S338 WeakPolarHBondContact O-CB 3.48Å; S334-S338 PolarHBondContact O-N 3.32Å
335	T	90.9	Very high	92.3	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.025	13%	0.128	C	C	.	.	H	α-helix	trans	-70	-44.5	-176.1	-56.1	0	0	0	0	112.3	W251 T331 I332 F333 T339	W251-T335 HydrophobicContact CH2-CG2 4.15Å; W251-T335 HydrophobicContact CZ3-CG2 4.04Å; T331-T335 VanDerWaalsContact O-CB 3.26Å; T331-T335 WeakPolarHBondContact O-CB 3.29Å; T331-T335 PolarHBondContact O-N 2.66Å; T331-T335 PolarHBondContact O-OG1 3.14Å; I332-T335 PolarHBondContact O-N 2.96Å; F333-T335 PolarHBondContact O-N 3Å; T335-T339 VanDerWaalsContact O-CB 3.3Å; T335-T339 WeakPolarHBondContact O-CB 3.32Å; T335-T339 PolarHBondContact O-N 3.48Å; T335-T339 PolarHBondContact O-OG1 3.43Å
336	V	91	Very high	91.9	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-65.5	-50.6	-178.8	175.3	0	0	0	0	110.7	I332 T339 L340 I352 M356 L366 L374	I332-V336 HydrophobicContact CG2-CG2 3.91Å; I332-V336 WeakPolarHBondContact O-CB 3.44Å; I332-V336 WeakPolarHBondContact O-CG2 3.4Å; I332-V336 PolarHBondContact O-N 3.42Å; V336-T339 PolarHBondContact O-N 3.3Å; V336-L340 HydrophobicContact CG1-CD1 3.72Å; V336-L340 HydrophobicContact CG1-CG 4.42Å; V336-L340 WeakPolarHBondContact O-CB 3.27Å; V336-L340 WeakPolarHBondContact O-CG 3.28Å; V336-L340 PolarHBondContact O-N 3.19Å; V336-I352 HydrophobicContact CG1-CG2 4.12Å; V336-M356 HydrophobicContact CB-CE 4.47Å; V336-M356 HydrophobicContact CB-SD 4.25Å; V336-M356 HydrophobicContact CG1-CG 3.71Å; V336-M356 HydrophobicContact CG1-SD 3.79Å; V336-M356 HydrophobicContact CG2-CE 4.42Å; V336-L366 HydrophobicContact CG2-CD1 4.5Å; V336-L374 HydrophobicContact CB-CD1 4.3Å; V336-L374 HydrophobicContact CG1-CD1 4.5Å; V336-L374 HydrophobicContact CG2-CD1 3.53Å
337	F	93.3	Very high	91.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-46.1	179.2	-83.7	-110.4	0	0	0	111	V260 F264 F333 T339 I341 R349 I352 M356	V260-F337 HydrophobicContact CB-CD1 4.42Å; V260-F337 HydrophobicContact CG1-CD1 3.91Å; V260-F337 HydrophobicContact CG1-CE1 4.44Å; F264-F337 HydrophobicContact CB-CE1 4.15Å; F264-F337 HydrophobicContact CB-CZ 4.01Å; F264-F337 HydrophobicContact CD1-CE2 4.42Å; F264-F337 AromaticContact CD1-CZ 3.88Å; F264-F337 HydrophobicContact CD1-CZ 3.88Å; F264-F337 HydrophobicContact CD2-CE1 4.45Å; F264-F337 HydrophobicContact CD2-CZ 4.19Å; F264-F337 HydrophobicContact CE1-CZ 4.44Å; F264-F337 HydrophobicContact CG-CE1 4.2Å; F264-F337 AromaticContact CG-CZ 3.75Å; F264-F337 HydrophobicContact CG-CZ 3.75Å; F333-F337 HydrophobicContact CD1-CD2 4.49Å; F333-F337 AromaticContact CD1-CE2 3.91Å; F333-F337 HydrophobicContact CD1-CE2 3.91Å; F333-F337 HydrophobicContact CE1-CE2 4.42Å; F333-F337 WeakPolarHBondContact O-CB 3.37Å; F333-F337 VanDerWaalsContact O-CD2 3.26Å; F333-F337 WeakPolarHBondContact O-CD2 3.34Å; F333-F337 PolarHBondContact O-N 3.23Å; F337-T339 VanDerWaalsContact C-N 3.32Å; F337-T339 PolarHBondContact O-N 2.9Å; F337-I341 HydrophobicContact CB-CD1 4.42Å; F337-I341 VanDerWaalsContact O-CB 3.31Å; F337-I341 WeakPolarHBondContact O-CB 3.33Å; F337-I341 WeakPolarHBondContact O-CD1 3.33Å; F337-I341 WeakPolarHBondContact O-CG1 3.38Å; F337-I341 PolarHBondContact O-N 2.9Å; F337-R349 HydrophobicContact CE1-CB 4.2Å; F337-R349 HydrophobicContact CE1-CG 4.11Å; F337-I352 HydrophobicContact CD1-CD1 4.01Å; F337-I352 HydrophobicContact CD1-CG2 4.1Å; F337-I352 HydrophobicContact CD2-CG2 3.71Å; F337-I352 HydrophobicContact CE1-CB 4.38Å; F337-I352 HydrophobicContact CE1-CD1 4.43Å; F337-I352 HydrophobicContact CE1-CG2 4.07Å; F337-I352 HydrophobicContact CE2-CG2 3.67Å; F337-I352 HydrophobicContact CG-CD1 4.45Å; F337-I352 HydrophobicContact CG-CG2 3.94Å; F337-I352 HydrophobicContact CZ-CB 4.43Å; F337-I352 HydrophobicContact CZ-CG2 3.86Å; F337-M356 HydrophobicContact CD2-SD 4.16Å; F337-M356 HydrophobicContact CE2-SD 3.66Å
338	S	92.1	Very high	91.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55	-49.1	177.1	175.7	0	0	0	0	111.9	R255 K256 S334 Q342	R255-S338 WeakPolarHBondContact CB-OG 3.32Å; K256-S338 VanDerWaalsContact O-CB 3.27Å; K256-S338 WeakPolarHBondContact O-CB 3.4Å; K256-S338 PolarHBondContact O-OG 2.92Å; S334-S338 WeakPolarHBondContact O-CB 3.48Å; S334-S338 PolarHBondContact O-N 3.32Å; S338-Q342 VanDerWaalsContact O-CG 3.31Å; S338-Q342 WeakPolarHBondContact O-CG 3.41Å; S338-Q342 PolarHBondContact O-N 2.95Å; S338-Q342 PolarHBondContact O-NE2 3.24Å; S338-Q342 PolarHBondContact OG-NE2 3.26Å
339	T	88.9	Confident	91.1	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-69.5	-49.1	-175.4	-54.5	0	0	0	0	111	T335 V336 F337 I341 Q342 T343 L374 Y377	T335-T339 VanDerWaalsContact O-CB 3.3Å; T335-T339 WeakPolarHBondContact O-CB 3.32Å; T335-T339 PolarHBondContact O-N 3.48Å; T335-T339 PolarHBondContact O-OG1 3.43Å; V336-T339 PolarHBondContact O-N 3.3Å; F337-T339 VanDerWaalsContact C-N 3.32Å; F337-T339 PolarHBondContact O-N 2.9Å; T339-I341 PolarHBondContact O-N 3.42Å; T339-Q342 PolarHBondContact O-N 3.21Å; T339-Q342 VanDerWaalsContact O-N 3.13Å; T339-T343 HydrophobicContact CG2-CG2 4.21Å; T339-T343 WeakPolarHBondContact O-CG2 3.46Å; T339-T343 PolarHBondContact O-N 3.45Å; T339-T343 PolarHBondContact O-OG1 3.5Å; T339-L374 HydrophobicContact CG2-CB 4.49Å; T339-L374 HydrophobicContact CG2-CD2 3.72Å; T339-Y377 HydrophobicContact CG2-CD2 4.41Å; T339-Y377 HydrophobicContact CG2-CG 4.4Å
340	L	89.9	Confident	90.8	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-69.4	-32.2	-175.8	-69.4	177.3	0	0	0	113.5	V336 Q342 S344 L347 I352 I355 W370 L374	V336-L340 HydrophobicContact CG1-CD1 3.72Å; V336-L340 HydrophobicContact CG1-CG 4.42Å; V336-L340 WeakPolarHBondContact O-CB 3.27Å; V336-L340 WeakPolarHBondContact O-CG 3.28Å; V336-L340 PolarHBondContact O-N 3.19Å; L340-Q342 VanDerWaalsContact C-N 3.29Å; L340-S344 CarbonylContact O-C 3.48Å; L340-S344 WeakPolarHBondContact O-CA 3.45Å; L340-S344 WeakPolarHBondContact O-CB 3.15Å; L340-S344 PolarHBondContact O-N 2.95Å; L340-L347 HydrophobicContact CB-CD1 4.18Å; L340-L347 HydrophobicContact CD2-CD1 4.44Å; L340-I352 HydrophobicContact CB-CD1 4.25Å; L340-I352 HydrophobicContact CB-CG1 4.05Å; L340-I352 HydrophobicContact CD1-CB 4.49Å; L340-I352 HydrophobicContact CD1-CG1 4.26Å; L340-I352 HydrophobicContact CD1-CG2 4.04Å; L340-I355 HydrophobicContact CD1-CB 4.37Å; L340-I355 HydrophobicContact CD1-CD1 3.94Å; L340-I355 HydrophobicContact CD1-CG2 3.93Å; L340-W370 HydrophobicContact CD2-CZ3 4.18Å; L340-L374 HydrophobicContact CD2-CD2 4.31Å; L340-L374 HydrophobicContact CG-CD2 4.16Å
341	I	92.3	Very high	90.5	Very high	37 Å²	37	39.3 Å²	39.3	19%	0.19	23%	0.225	C	C	.	.	H	α-helix	trans	-65.4	-36.8	172.3	-69.4	167.2	0	0	0	110.7	Y257 V260 F337 T339 P345 I352	Y257-I341 HydrophobicContact CD1-CG2 4.26Å; Y257-I341 HydrophobicContact CD2-CB 4.31Å; Y257-I341 HydrophobicContact CD2-CG2 3.67Å; Y257-I341 HydrophobicContact CE1-CG2 4.49Å; Y257-I341 HydrophobicContact CE2-CG2 3.95Å; Y257-I341 HydrophobicContact CG-CB 4.44Å; Y257-I341 HydrophobicContact CG-CG2 3.83Å; V260-I341 HydrophobicContact CB-CD1 4.05Å; V260-I341 HydrophobicContact CG1-CD1 4Å; V260-I341 HydrophobicContact CG2-CD1 4.15Å; F337-I341 HydrophobicContact CB-CD1 4.42Å; F337-I341 VanDerWaalsContact O-CB 3.31Å; F337-I341 WeakPolarHBondContact O-CB 3.33Å; F337-I341 WeakPolarHBondContact O-CD1 3.33Å; F337-I341 WeakPolarHBondContact O-CG1 3.38Å; F337-I341 PolarHBondContact O-N 2.9Å; T339-I341 PolarHBondContact O-N 3.42Å; I341-P345 WeakPolarHBondContact O-CA 3.27Å; I341-I352 HydrophobicContact CD1-CD1 4.23Å; I341-I352 HydrophobicContact CG1-CD1 3.64Å
342	Q	88.9	Confident	90.4	Very high	82 Å²	82	38.7 Å²	38.7	38%	0.383	22%	0.222	S	C	.	.	H	α-helix	trans	-76	-39.7	179.7	-74.1	174.2	91.1	0	0	112.8	Y257 S338 T339 L340	Y257-Q342 HydrophobicContact CD2-CG 3.91Å; Y257-Q342 HydrophobicContact CE2-CG 4.05Å; S338-Q342 VanDerWaalsContact O-CG 3.31Å; S338-Q342 WeakPolarHBondContact O-CG 3.41Å; S338-Q342 PolarHBondContact O-N 2.95Å; S338-Q342 PolarHBondContact O-NE2 3.24Å; S338-Q342 PolarHBondContact OG-NE2 3.26Å; T339-Q342 PolarHBondContact O-N 3.21Å; T339-Q342 VanDerWaalsContact O-N 3.13Å; L340-Q342 VanDerWaalsContact C-N 3.29Å
343	T	85.8	Confident	90.3	Very high	50 Å²	50	38.6 Å²	38.6	31%	0.307	22%	0.221	S	C	.	.	H	α-helix	trans	-89.9	-25.9	-174.6	59.5	0	0	0	0	113.2	T339 Y377	T339-T343 HydrophobicContact CG2-CG2 4.21Å; T339-T343 WeakPolarHBondContact O-CG2 3.46Å; T339-T343 PolarHBondContact O-N 3.45Å; T339-T343 PolarHBondContact O-OG1 3.5Å; T343-Y377 HydrophobicContact CG2-CD1 3.45Å; T343-Y377 VanDerWaalsContact CG2-CD1 3.45Å; T343-Y377 HydrophobicContact CG2-CD2 4.14Å; T343-Y377 HydrophobicContact CG2-CE1 3.9Å; T343-Y377 HydrophobicContact CG2-CG 3.58Å
344	S	87.8	Confident	90	Very high	45 Å²	45	46 Å²	46	32%	0.315	25%	0.253	S	S	.	.			trans	-135.5	71.5	-179.2	-63.6	0	0	0	0	110.7	L340 T346 L347	L340-S344 CarbonylContact O-C 3.48Å; L340-S344 WeakPolarHBondContact O-CA 3.45Å; L340-S344 WeakPolarHBondContact O-CB 3.15Å; L340-S344 PolarHBondContact O-N 2.95Å; S344-T346 PolarHBondContact O-N 3.47Å; S344-L347 VanDerWaalsContact CB-CD1 3.44Å; S344-L347 WeakPolarHBondContact O-CB 3.05Å; S344-L347 PolarHBondContact O-N 3.48Å
345	P	84.1	Confident	89.6	Confident	106 Å²	106	47.5 Å²	47.5	69%	0.688	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.2	-170.4	-24.2	34.9	0	0	0	115.5	I341 L347	I341-P345 WeakPolarHBondContact O-CA 3.27Å; P345-L347 VanDerWaalsContact C-N 3.29Å
346	T	89.9	Confident	89.4	Confident	135 Å²	135	47.3 Å²	47.3	83%	0.828	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.2	176	54.5	0	0	0	0	113.1	S344 T348	S344-T346 PolarHBondContact O-N 3.47Å; T346-T348 PolarHBondContact O-N 3.07Å
347	L	88.7	Confident	89.2	Confident	52 Å²	52	49.9 Å²	49.9	27%	0.272	27%	0.272	S	S	.	.			trans	-72.3	124.8	177.2	-74.1	176.1	0	0	0	111.2	L340 S344 P345 I352 I355	L340-L347 HydrophobicContact CB-CD1 4.18Å; L340-L347 HydrophobicContact CD2-CD1 4.44Å; S344-L347 VanDerWaalsContact CB-CD1 3.44Å; S344-L347 WeakPolarHBondContact O-CB 3.05Å; S344-L347 PolarHBondContact O-N 3.48Å; P345-L347 VanDerWaalsContact C-N 3.29Å; L347-I352 HydrophobicContact CB-CG1 4.16Å; L347-I352 HydrophobicContact CD1-CG1 4.42Å; L347-I355 HydrophobicContact CD1-CD1 3.71Å; L347-I355 HydrophobicContact CD2-CD1 4.28Å
348	T	93	Very high	88.4	Confident	90 Å²	90	52.2 Å²	52.2	55%	0.552	29%	0.288	S	S	*	.			trans	-74.6	162.6	168	65.9	0	0	0	0	110.7	T346 S350 G351 I352	T346-T348 PolarHBondContact O-N 3.07Å; T348-S350 PolarHBondContact O-N 3.39Å; T348-G351 WeakPolarHBondContact O-CA 3.22Å; T348-G351 PolarHBondContact O-N 3.1Å; T348-G351 PolarHBondContact OG1-N 3.25Å; T348-G351 VanDerWaalsContact OG1-N 3.09Å; T348-I352 PolarHBondContact O-N 2.95Å
349	R	90.2	Very high	87.1	Confident	124 Å²	124	56 Å²	56	47%	0.468	31%	0.308	S	S	.	.	H	α-helix	trans	-52.8	-38.2	171.2	-68.4	-174.7	-72.9	165.9	-2.5	112.1	V260 F337 I352 L353	V260-R349 HydrophobicContact CG1-CG 4.11Å; F337-R349 HydrophobicContact CE1-CB 4.2Å; F337-R349 HydrophobicContact CE1-CG 4.11Å; R349-I352 PolarHBondContact O-N 3.11Å; R349-L353 PolarHBondContact O-N 2.86Å
350	S	89.2	Confident	86	Confident	46 Å²	46	56.9 Å²	56.9	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-69.2	-33.7	175.5	-47	0	0	0	0	112.7	S101 T348 L353 K354	S101-S350 WeakPolarHBondContact CB-OG 3.21Å; T348-S350 PolarHBondContact O-N 3.39Å; S350-L353 PolarHBondContact O-N 2.75Å; S350-K354 WeakPolarHBondContact O-CG 3.5Å; S350-K354 PolarHBondContact O-N 3.22Å
351	G	90.6	Very high	84.4	Confident	16 Å²	16	58.9 Å²	58.9	17%	0.165	33%	0.332	C	S	.	.	H	α-helix	trans	-64.7	-43.4	171.4	0	0	0	0	0	112.3	T348 K354 I355	T348-G351 WeakPolarHBondContact O-CA 3.22Å; T348-G351 PolarHBondContact O-N 3.1Å; T348-G351 PolarHBondContact OG1-N 3.25Å; T348-G351 VanDerWaalsContact OG1-N 3.09Å; G351-K354 PolarHBondContact O-N 3.35Å; G351-I355 PolarHBondContact O-N 3.12Å; G351-I355 VanDerWaalsContact O-N 3.07Å
352	I	91	Very high	82.6	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-61.8	-44.9	173.9	-65.7	169.9	0	0	0	110.7	V336 F337 L340 I341 L347 T348 R349 K354 I355 M356	V336-I352 HydrophobicContact CG1-CG2 4.12Å; F337-I352 HydrophobicContact CD1-CD1 4.01Å; F337-I352 HydrophobicContact CD1-CG2 4.1Å; F337-I352 HydrophobicContact CD2-CG2 3.71Å; F337-I352 HydrophobicContact CE1-CB 4.38Å; F337-I352 HydrophobicContact CE1-CD1 4.43Å; F337-I352 HydrophobicContact CE1-CG2 4.07Å; F337-I352 HydrophobicContact CE2-CG2 3.67Å; F337-I352 HydrophobicContact CG-CD1 4.45Å; F337-I352 HydrophobicContact CG-CG2 3.94Å; F337-I352 HydrophobicContact CZ-CB 4.43Å; F337-I352 HydrophobicContact CZ-CG2 3.86Å; L340-I352 HydrophobicContact CB-CD1 4.25Å; L340-I352 HydrophobicContact CB-CG1 4.05Å; L340-I352 HydrophobicContact CD1-CB 4.49Å; L340-I352 HydrophobicContact CD1-CG1 4.26Å; L340-I352 HydrophobicContact CD1-CG2 4.04Å; I341-I352 HydrophobicContact CD1-CD1 4.23Å; I341-I352 HydrophobicContact CG1-CD1 3.64Å; L347-I352 HydrophobicContact CB-CG1 4.16Å; L347-I352 HydrophobicContact CD1-CG1 4.42Å; T348-I352 PolarHBondContact O-N 2.95Å; R349-I352 PolarHBondContact O-N 3.11Å; I352-K354 PolarHBondContact O-N 3.38Å; I352-I355 WeakPolarHBondContact O-CB 3.43Å; I352-I355 PolarHBondContact O-N 3.45Å; I352-I355 VanDerWaalsContact O-N 3.15Å; I352-M356 HydrophobicContact CG2-SD 4.24Å; I352-M356 WeakPolarHBondContact O-CG 3.27Å; I352-M356 PolarHBondContact O-N 3.08Å
353	L	91.3	Very high	81.5	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-47	175.2	179.8	67.5	0	0	0	111.3	A96 F264 R349 S350 I355 M356 Q357	A96-L353 HydrophobicContact CB-CD1 4.5Å; F264-L353 HydrophobicContact CE1-CD1 4Å; F264-L353 HydrophobicContact CZ-CB 4.39Å; F264-L353 HydrophobicContact CZ-CD1 3.99Å; F264-L353 HydrophobicContact CZ-CD2 3.91Å; F264-L353 HydrophobicContact CZ-CG 4.3Å; R349-L353 PolarHBondContact O-N 2.86Å; S350-L353 PolarHBondContact O-N 2.75Å; L353-I355 PolarHBondContact O-N 2.81Å; L353-M356 CarbonylContact O-C 3.59Å; L353-M356 WeakPolarHBondContact O-CA 2.9Å; L353-M356 WeakPolarHBondContact O-CB 3.07Å; L353-M356 PolarHBondContact O-N 3.34Å; L353-Q357 HydrophobicContact CD1-CG 4.22Å; L353-Q357 HydrophobicContact CG-CG 4.17Å; L353-Q357 WeakPolarHBondContact O-CB 3.23Å; L353-Q357 VanDerWaalsContact O-CG 3.22Å; L353-Q357 WeakPolarHBondContact O-CG 3.45Å; L353-Q357 PolarHBondContact O-N 3.42Å
354	K	87.9	Confident	80.8	Confident	155 Å²	155	54.1 Å²	54.1	67%	0.674	32%	0.317	S	S	*	.	H	α-helix	trans	-57.8	-37	177	-79.1	-176.5	178.9	-175.5	0	112.5	S350 G351 I352 Q357 S358	S350-K354 WeakPolarHBondContact O-CG 3.5Å; S350-K354 PolarHBondContact O-N 3.22Å; G351-K354 PolarHBondContact O-N 3.35Å; I352-K354 PolarHBondContact O-N 3.38Å; K354-Q357 CarbonylContact O-C 3.35Å; K354-Q357 PolarHBondContact O-N 3.43Å; K354-S358 PolarHBondContact O-N 3.2Å; K354-S358 VanDerWaalsContact O-N 3.08Å
355	I	85.2	Confident	80.1	Confident	32 Å²	32	52 Å²	52	16%	0.164	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-47.4	172.5	-74.1	165.9	0	0	0	110.6	L340 L347 G351 I352 L353 Q357 S358 W370	L340-I355 HydrophobicContact CD1-CB 4.37Å; L340-I355 HydrophobicContact CD1-CD1 3.94Å; L340-I355 HydrophobicContact CD1-CG2 3.93Å; L347-I355 HydrophobicContact CD1-CD1 3.71Å; L347-I355 HydrophobicContact CD2-CD1 4.28Å; G351-I355 PolarHBondContact O-N 3.12Å; G351-I355 VanDerWaalsContact O-N 3.07Å; I352-I355 WeakPolarHBondContact O-CB 3.43Å; I352-I355 PolarHBondContact O-N 3.45Å; I352-I355 VanDerWaalsContact O-N 3.15Å; L353-I355 PolarHBondContact O-N 2.81Å; I355-Q357 PolarHBondContact O-N 2.66Å; I355-S358 VanDerWaalsContact O-CB 3.31Å; I355-S358 WeakPolarHBondContact O-CB 3.46Å; I355-S358 PolarHBondContact O-N 3.17Å; I355-S358 PolarHBondContact O-OG 3.05Å; I355-W370 HydrophobicContact CB-CH2 4.49Å; I355-W370 HydrophobicContact CB-CZ2 4.25Å; I355-W370 HydrophobicContact CD1-CH2 4.19Å; I355-W370 HydrophobicContact CG1-CH2 4.19Å; I355-W370 HydrophobicContact CG1-CZ2 4.15Å; I355-W370 HydrophobicContact CG2-CD2 3.8Å; I355-W370 VanDerWaalsContact CG2-CE2 3.44Å; I355-W370 HydrophobicContact CG2-CE3 4.03Å; I355-W370 HydrophobicContact CG2-CH2 3.55Å; I355-W370 HydrophobicContact CG2-CZ2 3.32Å; I355-W370 HydrophobicContact CG2-CZ3 3.91Å
356	M	86.5	Confident	79.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-27.2	177.5	-63.6	176.9	73.1	0	0	113.1	A96 I332 F333 V336 F337 I352 L353 S358 L366	A96-M356 HydrophobicContact CB-CB 3.76Å; A96-M356 HydrophobicContact CB-CE 4.21Å; I332-M356 HydrophobicContact CG2-CE 4.38Å; F333-M356 HydrophobicContact CD1-CE 4.09Å; F333-M356 HydrophobicContact CD2-CE 3.61Å; F333-M356 HydrophobicContact CE1-CE 3.95Å; F333-M356 HydrophobicContact CE1-SD 4.43Å; F333-M356 HydrophobicContact CE2-CE 3.44Å; F333-M356 VanDerWaalsContact CE2-CE 3.44Å; F333-M356 HydrophobicContact CG-CE 3.93Å; F333-M356 HydrophobicContact CZ-CE 3.62Å; V336-M356 HydrophobicContact CB-CE 4.47Å; V336-M356 HydrophobicContact CB-SD 4.25Å; V336-M356 HydrophobicContact CG1-CG 3.71Å; V336-M356 HydrophobicContact CG1-SD 3.79Å; V336-M356 HydrophobicContact CG2-CE 4.42Å; F337-M356 HydrophobicContact CD2-SD 4.16Å; F337-M356 HydrophobicContact CE2-SD 3.66Å; I352-M356 HydrophobicContact CG2-SD 4.24Å; I352-M356 WeakPolarHBondContact O-CG 3.27Å; I352-M356 PolarHBondContact O-N 3.08Å; L353-M356 CarbonylContact O-C 3.59Å; L353-M356 WeakPolarHBondContact O-CA 2.9Å; L353-M356 WeakPolarHBondContact O-CB 3.07Å; L353-M356 PolarHBondContact O-N 3.34Å; M356-S358 VanDerWaalsContact C-N 3.33Å; M356-L366 HydrophobicContact CG-CD1 4.45Å
357	Q	86.2	Confident	79.7	Confident	58 Å²	58	40.9 Å²	40.9	27%	0.271	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.9	174.9	-68.3	178.1	-23.9	0	0	113.1	A96 S99 L353 K354 I355 N359	A96-Q357 VanDerWaalsContact O-CG 3.31Å; A96-Q357 WeakPolarHBondContact O-CG 3.42Å; A96-Q357 PolarHBondContact O-NE2 3.07Å; S99-Q357 PolarHBondContact O-NE2 3.46Å; S99-Q357 VanDerWaalsContact O-NE2 3.1Å; L353-Q357 HydrophobicContact CD1-CG 4.22Å; L353-Q357 HydrophobicContact CG-CG 4.17Å; L353-Q357 WeakPolarHBondContact O-CB 3.23Å; L353-Q357 VanDerWaalsContact O-CG 3.22Å; L353-Q357 WeakPolarHBondContact O-CG 3.45Å; L353-Q357 PolarHBondContact O-N 3.42Å; K354-Q357 CarbonylContact O-C 3.35Å; K354-Q357 PolarHBondContact O-N 3.43Å; I355-Q357 PolarHBondContact O-N 2.66Å; Q357-N359 PolarHBondContact O-N 2.98Å; Q357-N359 PolarHBondContact O-ND2 3.27Å
358	S	78.1	Confident	79.6	Confident	49 Å²	49	38.4 Å²	38.4	34%	0.343	22%	0.219	S	C	.	.			trans	-67.8	98.2	177.4	69.5	0	0	0	0	109.8	K354 I355 M356 G360 W370	K354-S358 PolarHBondContact O-N 3.2Å; K354-S358 VanDerWaalsContact O-N 3.08Å; I355-S358 VanDerWaalsContact O-CB 3.31Å; I355-S358 WeakPolarHBondContact O-CB 3.46Å; I355-S358 PolarHBondContact O-N 3.17Å; I355-S358 PolarHBondContact O-OG 3.05Å; M356-S358 VanDerWaalsContact C-N 3.33Å; S358-G360 PolarHBondContact O-N 2.96Å; S358-W370 PolarHBondContact OG-NE1 3.26Å; S358-W370 VanDerWaalsContact OG-NE1 3.1Å
359	N	64.4	Low	79.3	Confident	79 Å²	79	34.3 Å²	34.3	42%	0.422	19%	0.194	S	C	.	.			trans	-82.5	104.7	176.9	-66.9	-45.8	0	0	0	107.7	Q357	Q357-N359 PolarHBondContact O-N 2.98Å; Q357-N359 PolarHBondContact O-ND2 3.27Å
360	G	64.3	Low	79	Confident	23 Å²	23	30 Å²	30	24%	0.237	18%	0.178	C	C	.	.			trans	-62.2	178.2	161.5	0	0	0	0	0	111.4	S358 G362 S363	S358-G360 PolarHBondContact O-N 2.96Å; G360-G362 PolarHBondContact O-N 3.33Å; G360-S363 PolarHBondContact O-N 3.21Å
361	P	56.6	Low	78.9	Confident	51 Å²	51	27.9 Å²	27.9	33%	0.331	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-49.5	135.9	179.9	-24.8	32.8	0	0	0	112.4	F198 S363 T364 I441	F198-P361 HydrophobicContact CE1-CB 4.04Å; F198-P361 HydrophobicContact CE1-CG 4.2Å; P361-S363 PolarHBondContact O-N 3.02Å; P361-T364 PolarHBondContact O-N 2.85Å; P361-T364 PolarHBondContact O-OG1 2.88Å; P361-I441 HydrophobicContact CB-CD1 3.75Å
362	G	56.1	Low	78.9	Confident	27 Å²	27	27.5 Å²	27.5	28%	0.278	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	65.5	20.5	-178.6	0	0	0	0	0	115.1	G360 T364	G360-G362 PolarHBondContact O-N 3.33Å; G362-T364 VanDerWaalsContact C-N 3.27Å; G362-T364 VanDerWaalsContact O-CG2 3.27Å; G362-T364 WeakPolarHBondContact O-CG2 3.19Å; G362-T364 PolarHBondContact O-N 3.18Å
363	S	65.8	Low	78.7	Confident	42 Å²	42	27.6 Å²	27.6	29%	0.294	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	61.2	30.9	-174.8	-58	0	0	0	0	114.2	W89 R93 G360 P361	W89-S363 WeakPolarHBondContact CZ2-O 3.37Å; R93-S363 WeakPolarHBondContact CD-O 3.4Å; R93-S363 PolarHBondContact NE-O 3.36Å; G360-S363 PolarHBondContact O-N 3.21Å; P361-S363 PolarHBondContact O-N 3.02Å
364	T	71.1	Confident	78.5	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	16%	0.158	C	C	.	.			trans	-103.3	-3.8	-170.4	64.8	0	0	0	0	115.2	W89 W173 F198 P361 G362 L366 T367 F368	W89-T364 HydrophobicContact CH2-CG2 3.57Å; W89-T364 HydrophobicContact CZ2-CG2 3.51Å; W173-T364 HydrophobicContact CE3-CG2 4.26Å; W173-T364 HydrophobicContact CH2-CG2 4.38Å; W173-T364 HydrophobicContact CZ3-CG2 3.49Å; W173-T364 VanDerWaalsContact CZ3-CG2 3.49Å; F198-T364 VanDerWaalsContact CZ-OG1 3.29Å; F198-T364 WeakPolarHBondContact CZ-OG1 3.36Å; P361-T364 PolarHBondContact O-N 2.85Å; P361-T364 PolarHBondContact O-OG1 2.88Å; G362-T364 VanDerWaalsContact C-N 3.27Å; G362-T364 VanDerWaalsContact O-CG2 3.27Å; G362-T364 WeakPolarHBondContact O-CG2 3.19Å; G362-T364 PolarHBondContact O-N 3.18Å; T364-L366 PolarHBondContact O-N 3.09Å; T364-T367 PolarHBondContact O-N 2.91Å; T364-F368 HydrophobicContact CG2-CD2 4.34Å; T364-F368 PolarHBondContact O-N 3.15Å
365	G	72.1	Confident	78.5	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-48.8	-54.5	-175.1	0	0	0	0	0	114	T367 T369 W370	G365-T367 VanDerWaalsContact C-N 3.35Å; G365-T367 PolarHBondContact O-N 3.13Å; G365-T369 VanDerWaalsContact C-OG1 3.29Å; G365-T369 WeakPolarHBondContact CA-OG1 3.41Å; G365-T369 WeakPolarHBondContact O-CA 3.41Å; G365-T369 WeakPolarHBondContact O-CB 3.27Å; G365-T369 PolarHBondContact O-N 3.3Å; G365-T369 PolarHBondContact O-OG1 3.29Å; G365-W370 PolarHBondContact O-N 3.29Å
366	L	78.8	Confident	78.8	Confident	4 Å²	4	20.1 Å²	20.1	2%	0.021	13%	0.128	C	C	.	.	I	π-helix	trans	-52.6	-50.3	-174.8	-174.7	60.5	0	0	0	112.8	P92 R93 I332 V336 M356 T364 W370 I371	P92-L366 HydrophobicContact CB-CD2 4.46Å; R93-L366 HydrophobicContact CB-CD2 4.08Å; I332-L366 HydrophobicContact CG2-CD2 4.2Å; V336-L366 HydrophobicContact CG2-CD1 4.5Å; M356-L366 HydrophobicContact CG-CD1 4.45Å; T364-L366 PolarHBondContact O-N 3.09Å; L366-W370 HydrophobicContact CD1-CB 4.48Å; L366-W370 WeakPolarHBondContact O-CB 3.18Å; L366-W370 PolarHBondContact O-N 3.38Å; L366-I371 WeakPolarHBondContact O-CG1 3.22Å; L366-I371 PolarHBondContact O-N 3.02Å
367	T	86.7	Confident	78.7	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	15%	0.15	C	C	.	.	I	π-helix	trans	-84.6	-43.1	-175.5	-79.2	0	0	0	0	113.8	W89 T364 G365 I371 P372 F389 F390 L393	W89-T367 HydrophobicContact CB-CG2 4.19Å; W89-T367 WeakPolarHBondContact CB-OG1 3.31Å; W89-T367 HydrophobicContact CD2-CG2 4.46Å; W89-T367 HydrophobicContact CG-CG2 3.98Å; T364-T367 PolarHBondContact O-N 2.91Å; G365-T367 VanDerWaalsContact C-N 3.35Å; G365-T367 PolarHBondContact O-N 3.13Å; T367-I371 WeakPolarHBondContact O-CB 3.29Å; T367-P372 WeakPolarHBondContact O-CD 3.5Å; T367-F389 HydrophobicContact CG2-CE1 4.01Å; T367-F389 HydrophobicContact CG2-CZ 4.48Å; T367-F390 HydrophobicContact CG2-CE1 3.97Å; T367-F390 HydrophobicContact CG2-CZ 4.46Å; T367-F390 WeakPolarHBondContact O-CZ 3.45Å; T367-L393 HydrophobicContact CG2-CD1 3.75Å
368	F	87.7	Confident	78.5	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-94.9	-12.1	-171	-65.5	-78.1	0	0	0	113.4	W89 W173 Y177 F198 T364 F390	W89-F368 HydrophobicContact CD2-CE2 4.24Å; W89-F368 HydrophobicContact CE3-CE2 4.07Å; W89-F368 HydrophobicContact CH2-CE2 4.21Å; W89-F368 HydrophobicContact CZ2-CE2 4.38Å; W89-F368 HydrophobicContact CZ3-CE2 4.04Å; W173-F368 HydrophobicContact CB-CE1 3.91Å; W173-F368 HydrophobicContact CB-CZ 3.86Å; W173-F368 HydrophobicContact CE3-CD2 4.49Å; W173-F368 HydrophobicContact CE3-CE2 4.22Å; W173-F368 HydrophobicContact CE3-CZ 4.4Å; Y177-F368 HydrophobicContact CD1-CD1 4Å; Y177-F368 AromaticContact CD2-CD1 3.37Å; Y177-F368 HydrophobicContact CD2-CD1 3.37Å; Y177-F368 AromaticContact CD2-CE1 3.76Å; Y177-F368 HydrophobicContact CD2-CE1 3.76Å; Y177-F368 HydrophobicContact CE1-CB 4.19Å; Y177-F368 HydrophobicContact CE1-CD1 4.07Å; Y177-F368 WeakPolarHBondContact CE1-O 3.26Å; Y177-F368 HydrophobicContact CE2-CB 4.2Å; Y177-F368 AromaticContact CE2-CD1 3.46Å; Y177-F368 HydrophobicContact CE2-CD1 3.46Å; Y177-F368 VanDerWaalsContact CE2-CD1 3.46Å; Y177-F368 HydrophobicContact CE2-CE1 4.23Å; Y177-F368 HydrophobicContact CE2-CG 4.23Å; Y177-F368 AromaticContact CG-CD1 3.65Å; Y177-F368 HydrophobicContact CG-CD1 3.65Å; Y177-F368 HydrophobicContact CG-CE1 4.06Å; Y177-F368 AromaticContact CZ-CD1 3.8Å; Y177-F368 PolarHBondContact OH-O 3.47Å; F198-F368 HydrophobicContact CD2-CB 3.83Å; F198-F368 HydrophobicContact CE2-CB 4.11Å; T364-F368 HydrophobicContact CG2-CD2 4.34Å; T364-F368 PolarHBondContact O-N 3.15Å; F368-F390 AromaticContact CD1-CE1 3.92Å; F368-F390 HydrophobicContact CD1-CE1 3.92Å; F368-F390 HydrophobicContact CD1-CZ 4.47Å; F368-F390 AromaticContact CE1-CE1 3.92Å; F368-F390 HydrophobicContact CE1-CE1 3.92Å
369	T	84.9	Confident	78.6	Confident	5 Å²	5	23.8 Å²	23.8	3%	0.031	15%	0.149	C	C	.	.	I	π-helix	trans	-112.9	-48.7	173.9	76.5	0	0	0	0	111.9	S194 I195 F198 G365 V373	S194-T369 VanDerWaalsContact CB-O 3.29Å; S194-T369 WeakPolarHBondContact CB-O 3.38Å; S194-T369 WeakPolarHBondContact OG-CA 3.39Å; S194-T369 PolarHBondContact OG-O 3.43Å; I195-T369 HydrophobicContact CG1-CG2 3.93Å; F198-T369 HydrophobicContact CB-CG2 4.41Å; G365-T369 VanDerWaalsContact C-OG1 3.29Å; G365-T369 WeakPolarHBondContact CA-OG1 3.41Å; G365-T369 WeakPolarHBondContact O-CA 3.41Å; G365-T369 WeakPolarHBondContact O-CB 3.27Å; G365-T369 PolarHBondContact O-N 3.3Å; G365-T369 PolarHBondContact O-OG1 3.29Å; T369-V373 WeakPolarHBondContact O-CG2 3.35Å
370	W	83.8	Confident	79.2	Confident	33 Å²	33	23.9 Å²	23.9	13%	0.125	17%	0.168	C	C	.	.	I	π-helix	trans	-83.7	-41.9	-173.1	-78	100.9	0	0	0	114.8	V191 L340 I355 S358 G365 L366 V373 L374	V191-W370 HydrophobicContact CB-CZ2 4.44Å; V191-W370 HydrophobicContact CG1-CZ2 4.18Å; V191-W370 HydrophobicContact CG2-CD2 4.13Å; V191-W370 HydrophobicContact CG2-CE3 3.91Å; V191-W370 HydrophobicContact CG2-CH2 3.2Å; V191-W370 HydrophobicContact CG2-CZ2 3.41Å; V191-W370 VanDerWaalsContact CG2-CZ2 3.41Å; V191-W370 HydrophobicContact CG2-CZ3 3.46Å; V191-W370 VanDerWaalsContact CG2-CZ3 3.46Å; L340-W370 HydrophobicContact CD2-CZ3 4.18Å; I355-W370 HydrophobicContact CB-CH2 4.49Å; I355-W370 HydrophobicContact CB-CZ2 4.25Å; I355-W370 HydrophobicContact CD1-CH2 4.19Å; I355-W370 HydrophobicContact CG1-CH2 4.19Å; I355-W370 HydrophobicContact CG1-CZ2 4.15Å; I355-W370 HydrophobicContact CG2-CD2 3.8Å; I355-W370 VanDerWaalsContact CG2-CE2 3.44Å; I355-W370 HydrophobicContact CG2-CE3 4.03Å; I355-W370 HydrophobicContact CG2-CH2 3.55Å; I355-W370 HydrophobicContact CG2-CZ2 3.32Å; I355-W370 HydrophobicContact CG2-CZ3 3.91Å; S358-W370 PolarHBondContact OG-NE1 3.26Å; S358-W370 VanDerWaalsContact OG-NE1 3.1Å; G365-W370 PolarHBondContact O-N 3.29Å; L366-W370 HydrophobicContact CD1-CB 4.48Å; L366-W370 WeakPolarHBondContact O-CB 3.18Å; L366-W370 PolarHBondContact O-N 3.38Å; W370-V373 WeakPolarHBondContact O-CB 3.35Å; W370-V373 PolarHBondContact O-N 3.26Å; W370-L374 HydrophobicContact CB-CD1 4.37Å; W370-L374 VanDerWaalsContact O-CG 3.31Å; W370-L374 WeakPolarHBondContact O-CG 3.06Å; W370-L374 PolarHBondContact O-N 3.4Å
371	I	87.6	Confident	80.2	Confident	2 Å²	2	28 Å²	28	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-57.1	-43.7	-177.8	-68.5	-68.2	0	0	0	113.6	I332 L366 T367 V373 L374 F375 F389	I332-I371 HydrophobicContact CD1-CD1 3.69Å; L366-I371 WeakPolarHBondContact O-CG1 3.22Å; L366-I371 PolarHBondContact O-N 3.02Å; T367-I371 WeakPolarHBondContact O-CB 3.29Å; I371-V373 VanDerWaalsContact C-N 3.28Å; I371-V373 PolarHBondContact O-N 3.35Å; I371-L374 HydrophobicContact CD1-CD1 4.16Å; I371-L374 PolarHBondContact O-N 2.84Å; I371-F375 HydrophobicContact CG2-CD2 3.46Å; I371-F375 VanDerWaalsContact CG2-CD2 3.46Å; I371-F375 HydrophobicContact CG2-CE2 3.34Å; I371-F375 HydrophobicContact CG2-CZ 4.5Å; I371-F375 WeakPolarHBondContact O-CD2 3.28Å; I371-F375 PolarHBondContact O-N 2.72Å; I371-F389 HydrophobicContact CB-CE1 4.41Å; I371-F389 HydrophobicContact CG1-CE1 4.34Å; I371-F389 HydrophobicContact CG1-CZ 4.39Å; I371-F389 HydrophobicContact CG2-CD1 3.74Å; I371-F389 HydrophobicContact CG2-CE1 3.78Å; I371-F389 HydrophobicContact CG2-CG 4.31Å; I371-F389 HydrophobicContact CG2-CZ 4.41Å
372	P	90.2	Very high	81.8	Confident	7 Å²	7	25.6 Å²	25.6	5%	0.045	17%	0.169	C	C	.	.	H	α-helix	trans	-56.7	-41.2	173.6	-26.4	34.6	0	0	0	113.2	Y177 P188 T367 A376 F390	Y177-P372 HydrophobicContact CD1-CG 4.38Å; Y177-P372 HydrophobicContact CE1-CG 4.19Å; P188-P372 HydrophobicContact CG-CB 3.71Å; T367-P372 WeakPolarHBondContact O-CD 3.5Å; P372-A376 PolarHBondContact O-N 3.3Å; P372-F390 HydrophobicContact CG-CE2 4.11Å; P372-F390 HydrophobicContact CG-CZ 4.21Å
373	V	88.3	Confident	83.5	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-45.8	179.1	176.4	0	0	0	0	111.1	P188 D190 T369 W370 I371 F375 A376 Y377	P188-V373 HydrophobicContact CB-CG2 4.36Å; P188-V373 HydrophobicContact CG-CG2 4.24Å; P188-V373 WeakPolarHBondContact O-CA 3.4Å; D190-V373 WeakPolarHBondContact O-CG2 3.39Å; T369-V373 WeakPolarHBondContact O-CG2 3.35Å; W370-V373 WeakPolarHBondContact O-CB 3.35Å; W370-V373 PolarHBondContact O-N 3.26Å; I371-V373 VanDerWaalsContact C-N 3.28Å; I371-V373 PolarHBondContact O-N 3.35Å; V373-F375 VanDerWaalsContact C-N 3.33Å; V373-F375 PolarHBondContact O-N 3.4Å; V373-A376 WeakPolarHBondContact O-CB 3.27Å; V373-A376 PolarHBondContact O-N 2.75Å; V373-A376 VanDerWaalsContact O-N 3.11Å; V373-Y377 HydrophobicContact CG1-CD2 4.1Å; V373-Y377 HydrophobicContact CG1-CE2 3.76Å; V373-Y377 VanDerWaalsContact O-CD2 3.25Å; V373-Y377 WeakPolarHBondContact O-CD2 3.21Å; V373-Y377 PolarHBondContact O-N 2.94Å
374	L	85.5	Confident	84.7	Confident	3 Å²	3	31 Å²	31	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-44.2	179.3	-67.4	166.3	0	0	0	111.2	V336 T339 L340 W370 I371 A376 Y377	V336-L374 HydrophobicContact CB-CD1 4.3Å; V336-L374 HydrophobicContact CG1-CD1 4.5Å; V336-L374 HydrophobicContact CG2-CD1 3.53Å; T339-L374 HydrophobicContact CG2-CB 4.49Å; T339-L374 HydrophobicContact CG2-CD2 3.72Å; L340-L374 HydrophobicContact CD2-CD2 4.31Å; L340-L374 HydrophobicContact CG-CD2 4.16Å; W370-L374 HydrophobicContact CB-CD1 4.37Å; W370-L374 VanDerWaalsContact O-CG 3.31Å; W370-L374 WeakPolarHBondContact O-CG 3.06Å; W370-L374 PolarHBondContact O-N 3.4Å; I371-L374 HydrophobicContact CD1-CD1 4.16Å; I371-L374 PolarHBondContact O-N 2.84Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 3.13Å; L374-Y377 PolarHBondContact O-N 3.38Å
375	F	89.5	Confident	85.6	Confident	12 Å²	12	31.2 Å²	31.2	5%	0.053	18%	0.184	C	C	.	.	H	α-helix	trans	-68.7	-29.9	175.9	-77.1	-50.9	0	0	0	113	L187 W251 I371 V373 Y377 V378 G382 L385 C386 F389	L187-F375 HydrophobicContact CD1-CB 4.09Å; W251-F375 HydrophobicContact CH2-CD1 4.44Å; W251-F375 HydrophobicContact CH2-CE1 4.05Å; W251-F375 AromaticContact CZ3-CE1 3.92Å; W251-F375 HydrophobicContact CZ3-CE1 3.92Å; I371-F375 HydrophobicContact CG2-CD2 3.46Å; I371-F375 VanDerWaalsContact CG2-CD2 3.46Å; I371-F375 HydrophobicContact CG2-CE2 3.34Å; I371-F375 HydrophobicContact CG2-CZ 4.5Å; I371-F375 WeakPolarHBondContact O-CD2 3.28Å; I371-F375 PolarHBondContact O-N 2.72Å; V373-F375 VanDerWaalsContact C-N 3.33Å; V373-F375 PolarHBondContact O-N 3.4Å; F375-Y377 VanDerWaalsContact C-N 3.26Å; F375-Y377 PolarHBondContact O-N 3.18Å; F375-V378 HydrophobicContact CD1-CG2 4.32Å; F375-V378 WeakPolarHBondContact O-CB 3.12Å; F375-V378 PolarHBondContact O-N 2.96Å; F375-G382 WeakPolarHBondContact CB-O 3.22Å; F375-G382 WeakPolarHBondContact O-CA 3.24Å; F375-L385 HydrophobicContact CD1-CB 3.65Å; F375-L385 HydrophobicContact CD1-CD1 4.35Å; F375-L385 HydrophobicContact CE1-CB 3.52Å; F375-L385 HydrophobicContact CE1-CD1 4.26Å; F375-L385 HydrophobicContact CE1-CG 4.48Å; F375-L385 HydrophobicContact CG-CB 4.4Å; F375-L385 HydrophobicContact CZ-CB 4.13Å; F375-C386 HydrophobicContact CB-CB 3.79Å; F375-C386 VanDerWaalsContact CD2-CA 3.45Å; F375-C386 HydrophobicContact CD2-CB 3.64Å; F375-C386 HydrophobicContact CE2-CB 4.48Å; F375-C386 HydrophobicContact CG-CB 3.94Å; F375-F389 HydrophobicContact CE2-CB 3.85Å; F375-F389 HydrophobicContact CE2-CG 4.09Å; F375-F389 HydrophobicContact CZ-CB 4.3Å
376	A	89.9	Confident	86.5	Confident	19 Å²	19	31.2 Å²	31.2	16%	0.157	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-37.1	173.6	0	0	0	0	0	112.3	L187 P188 R189 P372 V373 L374 V378 G379	L187-A376 HydrophobicContact CB-CB 3.68Å; L187-A376 HydrophobicContact CD1-CB 4.45Å; P188-A376 WeakPolarHBondContact O-CB 3.3Å; R189-A376 HydrophobicContact CG-CB 4.19Å; P372-A376 PolarHBondContact O-N 3.3Å; V373-A376 WeakPolarHBondContact O-CB 3.27Å; V373-A376 PolarHBondContact O-N 2.75Å; V373-A376 VanDerWaalsContact O-N 3.11Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 3.13Å; A376-V378 VanDerWaalsContact C-N 3.31Å; A376-V378 PolarHBondContact O-N 3.04Å; A376-G379 PolarHBondContact O-N 2.87Å
377	Y	85.8	Confident	87.3	Confident	117 Å²	117	31.8 Å²	31.8	46%	0.459	19%	0.188	S	C	.	.	H	α-helix	trans	-74.1	-16.1	177.8	-77	-68.8	0	0	0	114.6	R189 T339 T343 V373 L374 F375 G379	R189-Y377 VanDerWaalsContact O-CE2 3.31Å; R189-Y377 WeakPolarHBondContact O-CE2 3.35Å; R189-Y377 PolarHBondContact O-OH 2.91Å; R189-Y377 VanDerWaalsContact O-OH 3.06Å; T339-Y377 HydrophobicContact CG2-CD2 4.41Å; T339-Y377 HydrophobicContact CG2-CG 4.4Å; T343-Y377 HydrophobicContact CG2-CD1 3.45Å; T343-Y377 VanDerWaalsContact CG2-CD1 3.45Å; T343-Y377 HydrophobicContact CG2-CD2 4.14Å; T343-Y377 HydrophobicContact CG2-CE1 3.9Å; T343-Y377 HydrophobicContact CG2-CG 3.58Å; V373-Y377 HydrophobicContact CG1-CD2 4.1Å; V373-Y377 HydrophobicContact CG1-CE2 3.76Å; V373-Y377 VanDerWaalsContact O-CD2 3.25Å; V373-Y377 WeakPolarHBondContact O-CD2 3.21Å; V373-Y377 PolarHBondContact O-N 2.94Å; L374-Y377 PolarHBondContact O-N 3.38Å; F375-Y377 VanDerWaalsContact C-N 3.26Å; F375-Y377 PolarHBondContact O-N 3.18Å; Y377-G379 PolarHBondContact O-N 3.33Å
378	V	82.2	Confident	87.6	Confident	24 Å²	24	33.9 Å²	33.9	15%	0.145	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.5	173	174.7	0	0	0	0	111.6	W251 F375 A376 L385	W251-V378 HydrophobicContact CH2-CG1 4.38Å; W251-V378 HydrophobicContact CH2-CG2 3.78Å; W251-V378 HydrophobicContact CZ2-CB 4.46Å; W251-V378 HydrophobicContact CZ2-CG1 3.67Å; W251-V378 HydrophobicContact CZ2-CG2 3.87Å; F375-V378 HydrophobicContact CD1-CG2 4.32Å; F375-V378 WeakPolarHBondContact O-CB 3.12Å; F375-V378 PolarHBondContact O-N 2.96Å; A376-V378 VanDerWaalsContact C-N 3.31Å; A376-V378 PolarHBondContact O-N 3.04Å; V378-L385 HydrophobicContact CG1-CD1 4.11Å
379	G	79	Confident	87.8	Confident	43 Å²	43	34.5 Å²	34.5	44%	0.443	20%	0.202	S	C	.	.			trans	83.5	-141.6	-178.5	0	0	0	0	0	112.3	A376 Y377 L381 G382	A376-G379 PolarHBondContact O-N 2.87Å; Y377-G379 PolarHBondContact O-N 3.33Å; G379-L381 VanDerWaalsContact C-N 3.35Å; G379-L381 PolarHBondContact O-N 3.23Å; G379-L381 VanDerWaalsContact O-N 3.12Å; G379-G382 WeakPolarHBondContact O-CA 3.25Å; G379-G382 PolarHBondContact O-N 3.42Å
380	G	78	Confident	88.3	Confident	81 Å²	81	34.3 Å²	34.3	84%	0.835	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47	-46.1	-166.2	0	0	0	0	0	116	G382	G380-G382 VanDerWaalsContact C-N 3.32Å; G380-G382 PolarHBondContact O-N 3.4Å
381	L	85.5	Confident	88.8	Confident	110 Å²	110	34.5 Å²	34.5	58%	0.576	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.1	178.4	-68.3	177.2	0	0	0	114.2	G379 R383 V384 L385	G379-L381 VanDerWaalsContact C-N 3.35Å; G379-L381 PolarHBondContact O-N 3.23Å; G379-L381 VanDerWaalsContact O-N 3.12Å; L381-R383 VanDerWaalsContact C-N 3.35Å; L381-R383 PolarHBondContact O-N 3.19Å; L381-V384 WeakPolarHBondContact O-CB 3.37Å; L381-V384 PolarHBondContact O-N 3.35Å; L381-V384 VanDerWaalsContact O-N 3.09Å; L381-L385 HydrophobicContact CB-CD1 4.38Å; L381-L385 WeakPolarHBondContact O-CG 3.26Å; L381-L385 PolarHBondContact O-N 2.85Å
382	G	88.3	Confident	89.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-44.5	-175.4	0	0	0	0	0	113.8	F375 G379 G380 V384 L385 C386	F375-G382 WeakPolarHBondContact CB-O 3.22Å; F375-G382 WeakPolarHBondContact O-CA 3.24Å; G379-G382 WeakPolarHBondContact O-CA 3.25Å; G379-G382 PolarHBondContact O-N 3.42Å; G380-G382 VanDerWaalsContact C-N 3.32Å; G380-G382 PolarHBondContact O-N 3.4Å; G382-V384 PolarHBondContact O-N 2.91Å; G382-L385 PolarHBondContact O-N 3.4Å; G382-C386 VanDerWaalsContact O-CB 3.3Å; G382-C386 WeakPolarHBondContact O-CB 3.46Å; G382-C386 PolarHBondContact O-N 3.23Å
383	R	91.9	Very high	89.5	Confident	103 Å²	103	34.2 Å²	34.2	39%	0.389	20%	0.202	S	C	.	.	H	α-helix	trans	-62.2	-43	176.3	-171.9	-177.2	-55.5	-170.5	3	112.6	S181 L184 S185 L187 L381 C386 S387	S181-R383 VanDerWaalsContact O-CG 3.3Å; S181-R383 WeakPolarHBondContact O-CG 3.1Å; L184-R383 PolarHBondContact O-NH1 2.89Å; S185-R383 PolarHBondContact O-NH2 3.01Å; L187-R383 HydrophobicContact CD1-CB 4.49Å; L381-R383 VanDerWaalsContact C-N 3.35Å; L381-R383 PolarHBondContact O-N 3.19Å; R383-C386 PolarHBondContact O-N 3.3Å; R383-S387 WeakPolarHBondContact O-CB 3.5Å; R383-S387 PolarHBondContact O-N 2.93Å; R383-S387 PolarHBondContact O-OG 3.42Å
384	V	91.6	Very high	89.9	Confident	81 Å²	81	34.2 Å²	34.2	49%	0.491	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-47.8	179	175.8	0	0	0	0	109.6	L381 G382 S387 L388	L381-V384 WeakPolarHBondContact O-CB 3.37Å; L381-V384 PolarHBondContact O-N 3.35Å; L381-V384 VanDerWaalsContact O-N 3.09Å; G382-V384 PolarHBondContact O-N 2.91Å; V384-S387 PolarHBondContact O-N 2.91Å; V384-L388 HydrophobicContact CG1-CD1 4.05Å; V384-L388 HydrophobicContact CG1-CG 4.43Å; V384-L388 WeakPolarHBondContact O-CB 3.28Å; V384-L388 WeakPolarHBondContact O-CG 3.36Å; V384-L388 PolarHBondContact O-N 2.92Å
385	L	90	Very high	90.5	Very high	5 Å²	5	36 Å²	36	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-41.5	178.9	-66.8	168.5	0	0	0	112.7	F247 W251 F375 V378 L381 G382 S387 L388 F389	F247-L385 HydrophobicContact CE1-CD2 3.87Å; W251-L385 HydrophobicContact CD2-CD1 3.81Å; W251-L385 HydrophobicContact CD2-CD2 4.25Å; W251-L385 HydrophobicContact CE3-CD1 4.14Å; W251-L385 HydrophobicContact CE3-CD2 4.46Å; W251-L385 HydrophobicContact CG-CD2 4.46Å; W251-L385 HydrophobicContact CH2-CD1 3.74Å; W251-L385 HydrophobicContact CZ2-CD1 3.35Å; W251-L385 HydrophobicContact CZ3-CD1 4.11Å; F375-L385 HydrophobicContact CD1-CB 3.65Å; F375-L385 HydrophobicContact CD1-CD1 4.35Å; F375-L385 HydrophobicContact CE1-CB 3.52Å; F375-L385 HydrophobicContact CE1-CD1 4.26Å; F375-L385 HydrophobicContact CE1-CG 4.48Å; F375-L385 HydrophobicContact CG-CB 4.4Å; F375-L385 HydrophobicContact CZ-CB 4.13Å; V378-L385 HydrophobicContact CG1-CD1 4.11Å; L381-L385 HydrophobicContact CB-CD1 4.38Å; L381-L385 WeakPolarHBondContact O-CG 3.26Å; L381-L385 PolarHBondContact O-N 2.85Å; G382-L385 PolarHBondContact O-N 3.4Å; L385-S387 VanDerWaalsContact C-N 3.32Å; L385-S387 PolarHBondContact O-N 3.46Å; L385-L388 PolarHBondContact O-N 3.25Å; L385-F389 VanDerWaalsContact O-CB 3.31Å; L385-F389 WeakPolarHBondContact O-CB 3.36Å; L385-F389 PolarHBondContact O-N 3.45Å
386	C	92.2	Very high	90.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-43.5	174.4	-174	0	0	0	0	111.5	L187 F375 G382 R383 F389 F390	L187-C386 HydrophobicContact CD1-CB 3.8Å; L187-C386 HydrophobicContact CD2-CB 4.37Å; F375-C386 HydrophobicContact CB-CB 3.79Å; F375-C386 VanDerWaalsContact CD2-CA 3.45Å; F375-C386 HydrophobicContact CD2-CB 3.64Å; F375-C386 HydrophobicContact CE2-CB 4.48Å; F375-C386 HydrophobicContact CG-CB 3.94Å; G382-C386 VanDerWaalsContact O-CB 3.3Å; G382-C386 WeakPolarHBondContact O-CB 3.46Å; G382-C386 PolarHBondContact O-N 3.23Å; R383-C386 PolarHBondContact O-N 3.3Å; C386-F389 PolarHBondContact O-N 3.48Å; C386-F390 WeakPolarHBondContact O-CD2 3.5Å; C386-F390 PolarHBondContact O-N 3.43Å
387	S	94.2	Very high	91.1	Very high	15 Å²	15	34.6 Å²	34.6	11%	0.105	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-43.6	178.4	-54.1	0	0	0	0	112	F178 S181 R383 V384 L385 F389 F390 L391	F178-S387 WeakPolarHBondContact CD2-O 2.98Å; S181-S387 WeakPolarHBondContact CB-OG 3.49Å; S181-S387 PolarHBondContact O-OG 3.49Å; S181-S387 VanDerWaalsContact OG-CA 3.24Å; S181-S387 WeakPolarHBondContact OG-CA 3.33Å; S181-S387 WeakPolarHBondContact OG-CB 3.26Å; S181-S387 PolarHBondContact OG-OG 3.2Å; S181-S387 VanDerWaalsContact OG-OG 3.05Å; R383-S387 WeakPolarHBondContact O-CB 3.5Å; R383-S387 PolarHBondContact O-N 2.93Å; R383-S387 PolarHBondContact O-OG 3.42Å; V384-S387 PolarHBondContact O-N 2.91Å; L385-S387 VanDerWaalsContact C-N 3.32Å; L385-S387 PolarHBondContact O-N 3.46Å; S387-F389 VanDerWaalsContact C-N 3.31Å; S387-F389 PolarHBondContact O-N 3.21Å; S387-F390 PolarHBondContact O-N 2.88Å; S387-L391 WeakPolarHBondContact O-CB 3.22Å; S387-L391 PolarHBondContact O-N 3.06Å
388	L	92.8	Very high	91.7	Very high	47 Å²	47	29.4 Å²	29.4	25%	0.246	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-40.6	174	-72.6	175.4	0	0	0	111.6	I244 F247 V384 L385 L391 C392	I244-L388 HydrophobicContact CD1-CD2 4.48Å; I244-L388 HydrophobicContact CG1-CD2 4.38Å; I244-L388 HydrophobicContact CG2-CB 3.96Å; I244-L388 WeakPolarHBondContact CG2-O 3.23Å; F247-L388 HydrophobicContact CD1-CD1 4.23Å; F247-L388 HydrophobicContact CE1-CD1 3.94Å; V384-L388 HydrophobicContact CG1-CD1 4.05Å; V384-L388 HydrophobicContact CG1-CG 4.43Å; V384-L388 WeakPolarHBondContact O-CB 3.28Å; V384-L388 WeakPolarHBondContact O-CG 3.36Å; V384-L388 PolarHBondContact O-N 2.92Å; L385-L388 PolarHBondContact O-N 3.25Å; L388-L391 PolarHBondContact O-N 3.47Å; L388-C392 VanDerWaalsContact O-CB 3.31Å; L388-C392 WeakPolarHBondContact O-CB 3.42Å; L388-C392 PolarHBondContact O-N 3.49Å
389	F	92.2	Very high	92.4	Very high	13 Å²	13	28.3 Å²	28.3	6%	0.057	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-49.4	177.7	178.3	-94.9	0	0	0	112.2	I88 I332 T367 I371 F375 L385 C386 S387 C392 L393	I88-F389 HydrophobicContact CG2-CD2 4.48Å; I88-F389 HydrophobicContact CG2-CE2 3.68Å; I88-F389 HydrophobicContact CG2-CZ 4Å; I332-F389 HydrophobicContact CD1-CE2 3.97Å; I332-F389 HydrophobicContact CD1-CZ 4.33Å; T367-F389 HydrophobicContact CG2-CE1 4.01Å; T367-F389 HydrophobicContact CG2-CZ 4.48Å; I371-F389 HydrophobicContact CB-CE1 4.41Å; I371-F389 HydrophobicContact CG1-CE1 4.34Å; I371-F389 HydrophobicContact CG1-CZ 4.39Å; I371-F389 HydrophobicContact CG2-CD1 3.74Å; I371-F389 HydrophobicContact CG2-CE1 3.78Å; I371-F389 HydrophobicContact CG2-CG 4.31Å; I371-F389 HydrophobicContact CG2-CZ 4.41Å; F375-F389 HydrophobicContact CE2-CB 3.85Å; F375-F389 HydrophobicContact CE2-CG 4.09Å; F375-F389 HydrophobicContact CZ-CB 4.3Å; L385-F389 VanDerWaalsContact O-CB 3.31Å; L385-F389 WeakPolarHBondContact O-CB 3.36Å; L385-F389 PolarHBondContact O-N 3.45Å; C386-F389 PolarHBondContact O-N 3.48Å; S387-F389 VanDerWaalsContact C-N 3.31Å; S387-F389 PolarHBondContact O-N 3.21Å; F389-C392 WeakPolarHBondContact O-CB 3.44Å; F389-C392 PolarHBondContact O-N 3.46Å; F389-L393 HydrophobicContact CD1-CD1 3.9Å; F389-L393 HydrophobicContact CE1-CD1 3.3Å; F389-L393 HydrophobicContact CE1-CG 4.21Å; F389-L393 HydrophobicContact CZ-CD1 3.78Å; F389-L393 HydrophobicContact CZ-CG 4.36Å; F389-L393 PolarHBondContact O-N 3.39Å
390	F	95.1	Very high	93.2	Very high	1 Å²	1	26.6 Å²	26.6	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-72.2	-28.2	177.9	-75.5	-67.5	0	0	0	113.4	Y177 F178 T367 F368 P372 C386 S387 L393 S394	Y177-F390 VanDerWaalsContact CB-CE1 3.43Å; Y177-F390 AromaticContact CD1-CE1 3.87Å; Y177-F390 HydrophobicContact CD1-CE1 3.87Å; Y177-F390 AromaticContact CD1-CE2 3.86Å; Y177-F390 HydrophobicContact CD1-CE2 3.86Å; Y177-F390 AromaticContact CD1-CZ 3.45Å; Y177-F390 HydrophobicContact CD1-CZ 3.45Å; Y177-F390 VanDerWaalsContact CD1-CZ 3.45Å; Y177-F390 HydrophobicContact CE1-CZ 4.32Å; Y177-F390 HydrophobicContact CG-CD1 4.27Å; Y177-F390 AromaticContact CG-CE1 3.82Å; Y177-F390 HydrophobicContact CG-CE1 3.82Å; Y177-F390 HydrophobicContact CG-CE2 4.41Å; Y177-F390 AromaticContact CG-CZ 3.9Å; Y177-F390 HydrophobicContact CG-CZ 3.9Å; F178-F390 HydrophobicContact CB-CB 3.89Å; T367-F390 HydrophobicContact CG2-CE1 3.97Å; T367-F390 HydrophobicContact CG2-CZ 4.46Å; T367-F390 WeakPolarHBondContact O-CZ 3.45Å; F368-F390 AromaticContact CD1-CE1 3.92Å; F368-F390 HydrophobicContact CD1-CE1 3.92Å; F368-F390 HydrophobicContact CD1-CZ 4.47Å; F368-F390 AromaticContact CE1-CE1 3.92Å; F368-F390 HydrophobicContact CE1-CE1 3.92Å; P372-F390 HydrophobicContact CG-CE2 4.11Å; P372-F390 HydrophobicContact CG-CZ 4.21Å; C386-F390 WeakPolarHBondContact O-CD2 3.5Å; C386-F390 PolarHBondContact O-N 3.43Å; S387-F390 PolarHBondContact O-N 2.88Å; F390-L393 HydrophobicContact CD1-CD1 3.83Å; F390-L393 HydrophobicContact CE1-CD1 4.07Å; F390-S394 WeakPolarHBondContact O-CB 3.48Å; F390-S394 PolarHBondContact O-N 2.98Å; F390-S394 PolarHBondContact O-OG 3.43Å
391	L	95.9	Very high	94.2	Very high	36 Å²	36	22.8 Å²	22.8	19%	0.188	12%	0.115	C	C	.	.	H	α-helix	trans	-64.1	-44.9	169.5	-175.1	61.6	0	0	0	111	F178 I244 S387 L388 S394 F395	F178-L391 HydrophobicContact CD1-CD1 4.25Å; F178-L391 HydrophobicContact CD2-CB 3.75Å; F178-L391 HydrophobicContact CD2-CD1 4.26Å; F178-L391 HydrophobicContact CE1-CD1 3.94Å; F178-L391 HydrophobicContact CE2-CB 3.78Å; F178-L391 HydrophobicContact CE2-CD1 3.96Å; F178-L391 HydrophobicContact CE2-CD2 4.33Å; F178-L391 HydrophobicContact CE2-CG 4.24Å; F178-L391 HydrophobicContact CG-CB 4.42Å; F178-L391 HydrophobicContact CG-CD1 4.4Å; F178-L391 HydrophobicContact CZ-CB 4.47Å; F178-L391 HydrophobicContact CZ-CD1 3.79Å; F178-L391 HydrophobicContact CZ-CD2 4.49Å; F178-L391 HydrophobicContact CZ-CG 4.48Å; I244-L391 HydrophobicContact CD1-CD2 4.25Å; I244-L391 HydrophobicContact CD1-CG 4.37Å; S387-L391 WeakPolarHBondContact O-CB 3.22Å; S387-L391 PolarHBondContact O-N 3.06Å; L388-L391 PolarHBondContact O-N 3.47Å; L391-S394 WeakPolarHBondContact O-CB 3.37Å; L391-S394 PolarHBondContact O-N 3.26Å; L391-S394 VanDerWaalsContact O-N 3.17Å; L391-F395 HydrophobicContact CD1-CD1 4.27Å; L391-F395 HydrophobicContact CD1-CE1 3.61Å; L391-F395 HydrophobicContact CD1-CE2 4.11Å; L391-F395 HydrophobicContact CD1-CZ 3.52Å; L391-F395 HydrophobicContact CD2-CE2 4.24Å; L391-F395 HydrophobicContact CD2-CZ 4.23Å; L391-F395 HydrophobicContact CG-CD2 4.39Å; L391-F395 HydrophobicContact CG-CE1 4.27Å; L391-F395 HydrophobicContact CG-CE2 3.88Å; L391-F395 HydrophobicContact CG-CZ 3.82Å; L391-F395 WeakPolarHBondContact O-CG 3.39Å; L391-F395 PolarHBondContact O-N 3.01Å
392	C	95.8	Very high	94.7	Very high	4 Å²	4	17.5 Å²	17.5	3%	0.027	9%	0.088	C	C	.	.	H	α-helix	trans	-60.5	-46.5	175.4	-173.9	0	0	0	0	111.4	L241 I244 L388 F389 S394 F395 A396	L241-C392 PolarHBondContact O-SG 2.92Å; I244-C392 HydrophobicContact CB-CB 4.09Å; I244-C392 HydrophobicContact CD1-CB 4.21Å; I244-C392 HydrophobicContact CG2-CB 3.7Å; L388-C392 VanDerWaalsContact O-CB 3.31Å; L388-C392 WeakPolarHBondContact O-CB 3.42Å; L388-C392 PolarHBondContact O-N 3.49Å; F389-C392 WeakPolarHBondContact O-CB 3.44Å; F389-C392 PolarHBondContact O-N 3.46Å; C392-S394 VanDerWaalsContact C-N 3.29Å; C392-S394 PolarHBondContact O-N 3.22Å; C392-F395 PolarHBondContact O-N 2.85Å; C392-A396 VanDerWaalsContact O-CB 3.3Å; C392-A396 WeakPolarHBondContact O-CB 3.23Å; C392-A396 PolarHBondContact O-N 3.21Å
393	L	95	Very high	95.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.8	-39.9	173.2	-83.9	172.1	0	0	0	112.6	T85 I88 W89 C174 T367 F389 F390 G397	T85-L393 HydrophobicContact CG2-CD2 4.01Å; I88-L393 HydrophobicContact CB-CD2 3.66Å; I88-L393 HydrophobicContact CB-CG 4.44Å; I88-L393 HydrophobicContact CD1-CD2 4.31Å; I88-L393 HydrophobicContact CG2-CD2 3.63Å; I88-L393 HydrophobicContact CG2-CG 3.9Å; W89-L393 HydrophobicContact CB-CD2 4.18Å; C174-L393 HydrophobicContact CB-CB 4.08Å; T367-L393 HydrophobicContact CG2-CD1 3.75Å; F389-L393 HydrophobicContact CD1-CD1 3.9Å; F389-L393 HydrophobicContact CE1-CD1 3.3Å; F389-L393 HydrophobicContact CE1-CG 4.21Å; F389-L393 HydrophobicContact CZ-CD1 3.78Å; F389-L393 HydrophobicContact CZ-CG 4.36Å; F389-L393 PolarHBondContact O-N 3.39Å; F390-L393 HydrophobicContact CD1-CD1 3.83Å; F390-L393 HydrophobicContact CE1-CD1 4.07Å; L393-G397 PolarHBondContact O-N 2.85Å
394	S	97.4	Very high	95.3	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.021	7%	0.072	C	C	.	.	H	α-helix	trans	-65.8	-45.6	178.1	-60.5	0	0	0	0	111.3	C174 L175 F390 L391 C392 G397 I398	C174-S394 VanDerWaalsContact C-OG 3.26Å; C174-S394 PolarHBondContact O-OG 3.27Å; L175-S394 PolarHBondContact N-OG 2.9Å; F390-S394 WeakPolarHBondContact O-CB 3.48Å; F390-S394 PolarHBondContact O-N 2.98Å; F390-S394 PolarHBondContact O-OG 3.43Å; L391-S394 WeakPolarHBondContact O-CB 3.37Å; L391-S394 PolarHBondContact O-N 3.26Å; L391-S394 VanDerWaalsContact O-N 3.17Å; C392-S394 VanDerWaalsContact C-N 3.29Å; C392-S394 PolarHBondContact O-N 3.22Å; S394-G397 PolarHBondContact O-N 3.12Å; S394-I398 WeakPolarHBondContact O-CB 3.43Å; S394-I398 VanDerWaalsContact O-CG1 3.26Å; S394-I398 WeakPolarHBondContact O-CG1 3.48Å; S394-I398 PolarHBondContact O-N 3.32Å
395	F	97.5	Very high	95.5	Very high	42 Å²	42	9.4 Å²	9.4	18%	0.184	5%	0.049	C	C	.	.	H	α-helix	trans	-62.6	-47.9	176	-68.1	-12.2	0	0	0	111.6	L237 M240 L241 L391 C392 G397 I398 T399	L237-F395 HydrophobicContact CD2-CD1 3.72Å; L237-F395 HydrophobicContact CD2-CE1 3.91Å; L237-F395 HydrophobicContact CD2-CG 4.04Å; L237-F395 HydrophobicContact CD2-CZ 4.39Å; M240-F395 HydrophobicContact CB-CD2 3.96Å; M240-F395 HydrophobicContact CB-CE2 3.83Å; M240-F395 HydrophobicContact SD-CE2 3.91Å; M240-F395 HydrophobicContact SD-CZ 4.31Å; L241-F395 HydrophobicContact CB-CB 4.11Å; L391-F395 HydrophobicContact CD1-CD1 4.27Å; L391-F395 HydrophobicContact CD1-CE1 3.61Å; L391-F395 HydrophobicContact CD1-CE2 4.11Å; L391-F395 HydrophobicContact CD1-CZ 3.52Å; L391-F395 HydrophobicContact CD2-CE2 4.24Å; L391-F395 HydrophobicContact CD2-CZ 4.23Å; L391-F395 HydrophobicContact CG-CD2 4.39Å; L391-F395 HydrophobicContact CG-CE1 4.27Å; L391-F395 HydrophobicContact CG-CE2 3.88Å; L391-F395 HydrophobicContact CG-CZ 3.82Å; L391-F395 WeakPolarHBondContact O-CG 3.39Å; L391-F395 PolarHBondContact O-N 3.01Å; C392-F395 PolarHBondContact O-N 2.85Å; F395-G397 VanDerWaalsContact C-N 3.3Å; F395-G397 PolarHBondContact O-N 3.04Å; F395-I398 PolarHBondContact O-N 3.18Å; F395-T399 WeakPolarHBondContact O-CG2 3.5Å; F395-T399 PolarHBondContact O-N 3.41Å; F395-T399 PolarHBondContact O-OG1 2.91Å; F395-T399 VanDerWaalsContact O-OG1 3.13Å
396	A	96.7	Very high	95.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.1	-41.5	176.5	0	0	0	0	0	111.8	I88 L241 C392 T399 S400	I88-A396 HydrophobicContact CD1-CB 3.61Å; L241-A396 HydrophobicContact CD2-CB 4.47Å; C392-A396 VanDerWaalsContact O-CB 3.3Å; C392-A396 WeakPolarHBondContact O-CB 3.23Å; C392-A396 PolarHBondContact O-N 3.21Å; A396-T399 PolarHBondContact O-OG1 3.24Å; A396-S400 WeakPolarHBondContact O-CB 3.09Å; A396-S400 PolarHBondContact O-N 3.32Å; A396-S400 VanDerWaalsContact O-N 3.16Å; A396-S400 PolarHBondContact O-OG 3.38Å; A396-S400 VanDerWaalsContact O-OG 3.09Å
397	G	97	Very high	96	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-63.6	-45.5	175.2	0	0	0	0	0	113.2	V171 L393 S394 F395 L401	V171-G397 WeakPolarHBondContact CG2-O 3.09Å; L393-G397 PolarHBondContact O-N 2.85Å; S394-G397 PolarHBondContact O-N 3.12Å; F395-G397 VanDerWaalsContact C-N 3.3Å; F395-G397 PolarHBondContact O-N 3.04Å; G397-L401 VanDerWaalsContact O-CB 3.28Å; G397-L401 WeakPolarHBondContact O-CB 3.21Å; G397-L401 PolarHBondContact O-N 3.13Å
398	I	98.1	Very high	96.1	Very high	9 Å²	9	9.2 Å²	9.2	5%	0.046	5%	0.047	C	C	.	.	H	α-helix	trans	-66.2	-46.1	179.5	-69.5	-69.3	0	0	0	111.3	V171 I218 V219 L237 S394 F395 S400 L401 I402	V171-I398 HydrophobicContact CG1-CD1 3.64Å; V171-I398 HydrophobicContact CG1-CG1 3.89Å; I218-I398 HydrophobicContact CB-CD1 4.05Å; I218-I398 HydrophobicContact CG2-CD1 3.77Å; I218-I398 HydrophobicContact CG2-CG1 4.33Å; I218-I398 HydrophobicContact CG2-CG2 4.13Å; V219-I398 HydrophobicContact CG2-CD1 3.99Å; V219-I398 HydrophobicContact CG2-CG2 4.23Å; L237-I398 HydrophobicContact CD1-CG2 4.01Å; S394-I398 WeakPolarHBondContact O-CB 3.43Å; S394-I398 VanDerWaalsContact O-CG1 3.26Å; S394-I398 WeakPolarHBondContact O-CG1 3.48Å; S394-I398 PolarHBondContact O-N 3.32Å; F395-I398 PolarHBondContact O-N 3.18Å; I398-S400 VanDerWaalsContact C-N 3.33Å; I398-S400 PolarHBondContact O-N 3.15Å; I398-L401 PolarHBondContact O-N 2.9Å; I398-I402 HydrophobicContact CG2-CD1 4.12Å; I398-I402 VanDerWaalsContact O-CG1 3.29Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.2Å
399	T	97	Very high	96.2	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62.9	-39.8	179.8	55.3	0	0	0	0	112	G80 N234 L237 V238 F395 A396 G403	G80-T399 CarbonylContact O-C 2.95Å; G80-T399 VanDerWaalsContact O-CB 3.25Å; G80-T399 WeakPolarHBondContact O-CB 3.22Å; G80-T399 PolarHBondContact O-OG1 3.11Å; N234-T399 WeakPolarHBondContact OD1-CG2 3.11Å; L237-T399 HydrophobicContact CB-CG2 3.51Å; L237-T399 HydrophobicContact CD1-CG2 3.81Å; L237-T399 HydrophobicContact CG-CG2 4.32Å; V238-T399 HydrophobicContact CG2-CG2 3.98Å; F395-T399 WeakPolarHBondContact O-CG2 3.5Å; F395-T399 PolarHBondContact O-N 3.41Å; F395-T399 PolarHBondContact O-OG1 2.91Å; F395-T399 VanDerWaalsContact O-OG1 3.13Å; A396-T399 PolarHBondContact O-OG1 3.24Å; T399-G403 PolarHBondContact O-N 3.23Å
400	S	96	Very high	96.3	Very high	7 Å²	7	6.6 Å²	6.6	5%	0.049	3%	0.034	C	C	.	.	H	α-helix	trans	-65	-47	172.7	-63.3	0	0	0	0	111.3	G80 G84 A396 I398 I402 G403 H404	G80-S400 PolarHBondContact O-N 3.11Å; G80-S400 VanDerWaalsContact O-N 3.17Å; G84-S400 WeakPolarHBondContact CA-OG 3.29Å; A396-S400 WeakPolarHBondContact O-CB 3.09Å; A396-S400 PolarHBondContact O-N 3.32Å; A396-S400 VanDerWaalsContact O-N 3.16Å; A396-S400 PolarHBondContact O-OG 3.38Å; A396-S400 VanDerWaalsContact O-OG 3.09Å; I398-S400 VanDerWaalsContact C-N 3.33Å; I398-S400 PolarHBondContact O-N 3.15Å; S400-I402 PolarHBondContact O-N 2.91Å; S400-G403 PolarHBondContact O-N 3.49Å; S400-H404 PolarHBondContact O-CD2 2.86Å; S400-H404 VanDerWaalsContact O-CD2 3.23Å; S400-H404 PolarHBondContact O-N 2.86Å
401	L	97.3	Very high	96.3	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-62	-32.7	-178.5	-175.7	61.5	0	0	0	112.2	T164 F167 V171 V219 G397 I398 H404 V405	T164-L401 HydrophobicContact CG2-CD1 3.79Å; F167-L401 HydrophobicContact CD1-CB 4.21Å; F167-L401 HydrophobicContact CD1-CD1 4.04Å; F167-L401 HydrophobicContact CE1-CB 4.04Å; V171-L401 HydrophobicContact CG2-CB 4.35Å; V171-L401 HydrophobicContact CG2-CD2 4.32Å; V219-L401 HydrophobicContact CB-CD2 4.46Å; V219-L401 HydrophobicContact CG1-CG 4.48Å; V219-L401 HydrophobicContact CG2-CB 3.98Å; V219-L401 HydrophobicContact CG2-CD2 3.7Å; V219-L401 HydrophobicContact CG2-CG 3.79Å; G397-L401 VanDerWaalsContact O-CB 3.28Å; G397-L401 WeakPolarHBondContact O-CB 3.21Å; G397-L401 PolarHBondContact O-N 3.13Å; I398-L401 PolarHBondContact O-N 2.9Å; L401-H404 PolarHBondContact O-N 2.92Å; L401-V405 HydrophobicContact CD1-CG2 4.13Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.35Å; L401-V405 PolarHBondContact O-N 3.32Å
402	I	97.4	Very high	96.2	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-57.3	-49.5	170.8	-68.6	164.9	0	0	0	110.8	V219 C222 I223 I230 A233 I398 S400 H404 V405 Q406	V219-I402 HydrophobicContact CB-CG1 4.46Å; V219-I402 HydrophobicContact CG1-CG1 4.03Å; V219-I402 HydrophobicContact CG2-CG1 4.05Å; C222-I402 HydrophobicContact CB-CD1 3.72Å; C222-I402 HydrophobicContact CB-CG1 4.03Å; I223-I402 HydrophobicContact CG1-CG2 4.31Å; I230-I402 HydrophobicContact CB-CG2 4.2Å; I230-I402 HydrophobicContact CD1-CG2 4.08Å; I230-I402 HydrophobicContact CG1-CG2 3.75Å; I230-I402 HydrophobicContact CG2-CG2 3.6Å; A233-I402 HydrophobicContact CB-CD1 4.37Å; I398-I402 HydrophobicContact CG2-CD1 4.12Å; I398-I402 VanDerWaalsContact O-CG1 3.29Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.2Å; S400-I402 PolarHBondContact O-N 2.91Å; I402-H404 VanDerWaalsContact C-N 3.34Å; I402-H404 PolarHBondContact O-N 3.29Å; I402-V405 PolarHBondContact O-N 3.07Å; I402-Q406 WeakPolarHBondContact O-CB 3.3Å; I402-Q406 PolarHBondContact O-N 2.94Å
403	G	95.3	Very high	96.1	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-62.4	-40.7	178.8	0	0	0	0	0	113	Y300 T399 S400 Q406 L407	Y300-G403 WeakPolarHBondContact OH-CA 3.36Å; T399-G403 PolarHBondContact O-N 3.23Å; S400-G403 PolarHBondContact O-N 3.49Å; G403-Q406 PolarHBondContact O-N 3.45Å; G403-L407 PolarHBondContact O-N 3.48Å
404	H	96.1	Very high	95.9	Very high	12 Å²	12	8.6 Å²	8.6	6%	0.056	5%	0.046	C	C	.	.	H	α-helix	trans	-61.5	-51	177	-87.2	-105.1	0	0	0	113.1	T164 L296 S400 L401 I402 Q406 L407	T164-H404 HydrophobicContact CG2-CB 3.78Å; T164-H404 WeakPolarHBondContact OG1-CB 3.43Å; T164-H404 PolarHBondContact OG1-ND1 3.5Å; T164-H404 VanDerWaalsContact OG1-ND1 3.15Å; L296-H404 WeakPolarHBondContact CD1-NE2 3.42Å; L296-H404 HydrophobicContact CD2-CB 4.37Å; S400-H404 PolarHBondContact O-CD2 2.86Å; S400-H404 VanDerWaalsContact O-CD2 3.23Å; S400-H404 PolarHBondContact O-N 2.86Å; L401-H404 PolarHBondContact O-N 2.92Å; I402-H404 VanDerWaalsContact C-N 3.34Å; I402-H404 PolarHBondContact O-N 3.29Å; H404-Q406 VanDerWaalsContact C-N 3.31Å; H404-Q406 PolarHBondContact O-N 3.32Å; H404-L407 PolarHBondContact O-N 3.31Å
405	V	97.2	Very high	95.5	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.012	7%	0.066	C	C	.	.	H	α-helix	trans	-68.2	-35.4	177.9	177.9	0	0	0	0	110.5	T164 V219 I223 L401 I402 L407 T408 V409 L427	T164-V405 HydrophobicContact CG2-CG2 3.79Å; V219-V405 HydrophobicContact CG1-CB 4.34Å; V219-V405 HydrophobicContact CG1-CG2 4.21Å; I223-V405 HydrophobicContact CD1-CB 3.44Å; I223-V405 VanDerWaalsContact CD1-CB 3.44Å; I223-V405 HydrophobicContact CD1-CG1 3.37Å; L401-V405 HydrophobicContact CD1-CG2 4.13Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.35Å; L401-V405 PolarHBondContact O-N 3.32Å; I402-V405 PolarHBondContact O-N 3.07Å; V405-L407 VanDerWaalsContact C-N 3.28Å; V405-L407 PolarHBondContact O-N 3.22Å; V405-T408 WeakPolarHBondContact O-CA 3.09Å; V405-T408 VanDerWaalsContact O-CB 3.32Å; V405-T408 WeakPolarHBondContact O-CB 3.37Å; V405-T408 PolarHBondContact O-N 2.95Å; V405-V409 HydrophobicContact CG1-CG2 4.34Å; V405-V409 WeakPolarHBondContact O-CG2 3.33Å; V405-V409 PolarHBondContact O-N 3.07Å; V405-L427 HydrophobicContact CG1-CD2 4.02Å; V405-L427 HydrophobicContact CG1-CG 4.29Å
406	Q	96.4	Very high	95.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.4	-36.8	177.5	179	62.1	7.1	0	0	112.7	I230 I402 G403 H404 T408 V409 V410	I230-Q406 HydrophobicContact CD1-CB 4.25Å; I230-Q406 HydrophobicContact CD1-CG 4Å; I402-Q406 WeakPolarHBondContact O-CB 3.3Å; I402-Q406 PolarHBondContact O-N 2.94Å; G403-Q406 PolarHBondContact O-N 3.45Å; H404-Q406 VanDerWaalsContact C-N 3.31Å; H404-Q406 PolarHBondContact O-N 3.32Å; Q406-T408 VanDerWaalsContact C-N 3.31Å; Q406-T408 PolarHBondContact O-N 3.19Å; Q406-V409 PolarHBondContact O-N 2.99Å; Q406-V410 HydrophobicContact CG-CG2 4.43Å; Q406-V410 WeakPolarHBondContact O-CG2 3.41Å; Q406-V410 PolarHBondContact O-N 2.71Å
407	L	96.5	Very high	94.9	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-57.9	-45.2	172.2	176.6	62.1	0	0	0	111.6	P137 V157 T160 M294 A295 L296 G403 H404 V405 V409 V410 T411	P137-L407 HydrophobicContact CG-CD1 4.23Å; V157-L407 HydrophobicContact CG2-CD1 4.45Å; T160-L407 HydrophobicContact CG2-CD2 3.56Å; M294-L407 WeakPolarHBondContact O-CD2 3.49Å; A295-L407 HydrophobicContact CB-CD1 4.3Å; A295-L407 HydrophobicContact CB-CD2 4.23Å; L296-L407 HydrophobicContact CD2-CB 4.49Å; L296-L407 HydrophobicContact CD2-CD2 4.48Å; G403-L407 PolarHBondContact O-N 3.48Å; H404-L407 PolarHBondContact O-N 3.31Å; V405-L407 VanDerWaalsContact C-N 3.28Å; V405-L407 PolarHBondContact O-N 3.22Å; L407-V409 VanDerWaalsContact C-N 3.3Å; L407-V409 PolarHBondContact O-N 2.59Å; L407-V410 PolarHBondContact O-N 3.48Å; L407-T411 PolarHBondContact O-N 3.32Å; L407-T411 PolarHBondContact O-OG1 3.27Å
408	T	95.2	Very high	94.7	Very high	15 Å²	15	18 Å²	18	9%	0.092	11%	0.113	C	C	.	.	H	α-helix	trans	-62.7	-39.9	177.9	-51.3	0	0	0	0	111.1	Y161 V405 Q406 T411 A412	Y161-T408 HydrophobicContact CD2-CG2 4.28Å; V405-T408 WeakPolarHBondContact O-CA 3.09Å; V405-T408 VanDerWaalsContact O-CB 3.32Å; V405-T408 WeakPolarHBondContact O-CB 3.37Å; V405-T408 PolarHBondContact O-N 2.95Å; Q406-T408 VanDerWaalsContact C-N 3.31Å; Q406-T408 PolarHBondContact O-N 3.19Å; T408-T411 PolarHBondContact O-N 3.26Å; T408-A412 WeakPolarHBondContact O-CB 3.41Å; T408-A412 PolarHBondContact O-N 3.46Å
409	V	95.5	Very high	94.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.9	-46.3	176.4	177.8	0	0	0	0	111.5	I223 V405 Q406 L407 A412 K413 A422 A423	I223-V409 HydrophobicContact CG2-CG2 3.83Å; V405-V409 HydrophobicContact CG1-CG2 4.34Å; V405-V409 WeakPolarHBondContact O-CG2 3.33Å; V405-V409 PolarHBondContact O-N 3.07Å; Q406-V409 PolarHBondContact O-N 2.99Å; L407-V409 VanDerWaalsContact C-N 3.3Å; L407-V409 PolarHBondContact O-N 2.59Å; V409-A412 PolarHBondContact O-N 3.15Å; V409-K413 HydrophobicContact CG1-CD 4.22Å; V409-K413 WeakPolarHBondContact O-CG 3.22Å; V409-K413 PolarHBondContact O-N 3.23Å; V409-A422 HydrophobicContact CG1-CB 3.88Å; V409-A423 HydrophobicContact CG2-CB 4.42Å
410	V	94.1	Very high	94.4	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.03	15%	0.149	C	C	.	.	H	α-helix	trans	-63.2	-42.9	178.1	176.3	0	0	0	0	110.6	Y303 Q406 L407 A412 K413 D414	Y303-V410 HydrophobicContact CE2-CG2 3.9Å; Q406-V410 HydrophobicContact CG-CG2 4.43Å; Q406-V410 WeakPolarHBondContact O-CG2 3.41Å; Q406-V410 PolarHBondContact O-N 2.71Å; L407-V410 PolarHBondContact O-N 3.48Å; V410-A412 PolarHBondContact O-N 3.28Å; V410-K413 WeakPolarHBondContact O-CB 3.19Å; V410-K413 PolarHBondContact O-N 3.24Å; V410-D414 PolarHBondContact O-N 3.42Å
411	T	95	Very high	94.4	Very high	12 Å²	12	34 Å²	34	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-44.6	175	-61.5	0	0	0	0	112.5	S136 L138 V157 L407 T408 K413 D414 L415	S136-T411 WeakPolarHBondContact CB-OG1 3.44Å; S136-T411 PolarHBondContact OG-OG1 3.03Å; L138-T411 HydrophobicContact CD1-CG2 3.76Å; L138-T411 HydrophobicContact CD2-CG2 4.09Å; L138-T411 HydrophobicContact CG-CG2 4.49Å; V157-T411 HydrophobicContact CG1-CG2 4.13Å; V157-T411 WeakPolarHBondContact CG2-OG1 3.42Å; L407-T411 PolarHBondContact O-N 3.32Å; L407-T411 PolarHBondContact O-OG1 3.27Å; T408-T411 PolarHBondContact O-N 3.26Å; T411-K413 VanDerWaalsContact C-N 3.3Å; T411-K413 PolarHBondContact O-N 3.09Å; T411-D414 PolarHBondContact O-N 3.35Å; T411-L415 HydrophobicContact CG2-CD1 4.49Å; T411-L415 WeakPolarHBondContact O-CG 3.31Å; T411-L415 PolarHBondContact O-N 2.91Å
412	A	94.2	Very high	94.4	Very high	14 Å²	14	34 Å²	34	12%	0.116	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-35.3	176.8	0	0	0	0	0	112.3	T408 V409 V410 L415 G416 L417 A422	T408-A412 WeakPolarHBondContact O-CB 3.41Å; T408-A412 PolarHBondContact O-N 3.46Å; V409-A412 PolarHBondContact O-N 3.15Å; V410-A412 PolarHBondContact O-N 3.28Å; A412-L415 CarbonylContact O-C 3.58Å; A412-L415 PolarHBondContact O-N 2.79Å; A412-G416 PolarHBondContact O-N 3.5Å; A412-L417 HydrophobicContact CB-CD2 4.28Å; A412-L417 WeakPolarHBondContact O-CB 3.49Å; A412-L417 WeakPolarHBondContact O-CD1 3.19Å; A412-L417 PolarHBondContact O-N 3.4Å; A412-L417 VanDerWaalsContact O-N 3.14Å; A412-A422 HydrophobicContact CB-CB 3.7Å
413	K	92.4	Very high	94.4	Very high	25 Å²	25	34 Å²	34	11%	0.109	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-41.4	173.8	-76.1	176	64.1	179.4	0	112.3	Y303 V409 V410 T411 L415 G416 L417 H419 A422	Y303-K413 PolarHBondContact OH-NZ 3.41Å; Y303-K413 VanDerWaalsContact OH-NZ 3.08Å; V409-K413 HydrophobicContact CG1-CD 4.22Å; V409-K413 WeakPolarHBondContact O-CG 3.22Å; V409-K413 PolarHBondContact O-N 3.23Å; V410-K413 WeakPolarHBondContact O-CB 3.19Å; V410-K413 PolarHBondContact O-N 3.24Å; T411-K413 VanDerWaalsContact C-N 3.3Å; T411-K413 PolarHBondContact O-N 3.09Å; K413-L415 PolarHBondContact O-N 3.37Å; K413-G416 WeakPolarHBondContact O-CA 3.4Å; K413-G416 PolarHBondContact O-N 3.45Å; K413-L417 WeakPolarHBondContact CA-O 3.37Å; K413-H419 HydrophobicContact CD-CB 4.44Å; K413-A422 HydrophobicContact CG-CB 3.85Å
414	D	90.5	Very high	94.5	Very high	33 Å²	33	40.1 Å²	40.1	18%	0.176	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-31.9	175.7	-71	-9.2	0	0	0	112	S136 V410 T411 G416 F560	S136-D414 WeakPolarHBondContact CA-OD2 3.32Å; S136-D414 WeakPolarHBondContact CB-OD2 3.13Å; S136-D414 PolarHBondContact N-OD2 2.79Å; S136-D414 PolarHBondContact OG-OD2 3.28Å; V410-D414 PolarHBondContact O-N 3.42Å; T411-D414 PolarHBondContact O-N 3.35Å; D414-G416 PolarHBondContact O-N 3.01Å; D414-F560 HydrophobicContact CB-CD1 4.24Å; D414-F560 HydrophobicContact CB-CE1 4Å
415	L	90.4	Very high	94.5	Very high	81 Å²	81	40.8 Å²	40.8	42%	0.424	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	8.5	173.7	-61.8	174.7	0	0	0	113.6	T411 A412 K413 F559	T411-L415 HydrophobicContact CG2-CD1 4.49Å; T411-L415 WeakPolarHBondContact O-CG 3.31Å; T411-L415 PolarHBondContact O-N 2.91Å; A412-L415 CarbonylContact O-C 3.58Å; A412-L415 PolarHBondContact O-N 2.79Å; K413-L415 PolarHBondContact O-N 3.37Å; L415-F559 HydrophobicContact CD2-CB 4.39Å; L415-F559 HydrophobicContact CD2-CD1 4.48Å
416	G	88.8	Confident	94.4	Very high	48 Å²	48	40.7 Å²	40.7	50%	0.495	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.7	1.1	170.8	0	0	0	0	0	115.7	A412 K413 D414	A412-G416 PolarHBondContact O-N 3.5Å; K413-G416 WeakPolarHBondContact O-CA 3.4Å; K413-G416 PolarHBondContact O-N 3.45Å; D414-G416 PolarHBondContact O-N 3.01Å
417	L	92.2	Very high	94.5	Very high	62 Å²	62	41.4 Å²	41.4	33%	0.325	21%	0.214	S	C	.	.			trans	-74.9	138.4	178.1	-75.3	69.3	0	0	0	110.8	A412 K413 K421 A422 A425	A412-L417 HydrophobicContact CB-CD2 4.28Å; A412-L417 WeakPolarHBondContact O-CB 3.49Å; A412-L417 WeakPolarHBondContact O-CD1 3.19Å; A412-L417 PolarHBondContact O-N 3.4Å; A412-L417 VanDerWaalsContact O-N 3.14Å; K413-L417 WeakPolarHBondContact CA-O 3.37Å; L417-K421 HydrophobicContact CB-CB 4.43Å; L417-K421 HydrophobicContact CD2-CB 4.45Å; L417-A422 HydrophobicContact CB-CB 4.09Å; L417-A425 HydrophobicContact CD2-CB 4.43Å
418	S	93.3	Very high	94.5	Very high	50 Å²	50	46.6 Å²	46.6	35%	0.35	24%	0.237	S	C	.	.			trans	-61.1	151.9	166.9	63.2	0	0	0	0	110.7	R420 K421 A422	S418-R420 PolarHBondContact O-N 3.5Å; S418-R420 VanDerWaalsContact O-N 3.17Å; S418-K421 PolarHBondContact O-N 3.44Å; S418-K421 WeakPolarHBondContact OG-CD 3.26Å; S418-K421 VanDerWaalsContact OG-CG 3.3Å; S418-K421 WeakPolarHBondContact OG-CG 3.4Å; S418-A422 PolarHBondContact O-N 3.13Å
419	H	92.2	Very high	94.5	Very high	19 Å²	19	49 Å²	49	9%	0.088	25%	0.249	C	C	.	.	H	α-helix	trans	-48.1	-49.3	-176.4	-174.6	76.3	0	0	0	114.3	I223 F224 G226 K413 K421 A422 A423	I223-H419 PolarHBondContact O-NE2 3.16Å; F224-H419 PolarHBondContact O-CD2 3.17Å; G226-H419 VanDerWaalsContact CA-CE1 3.47Å; G226-H419 WeakPolarHBondContact CA-CE1 3.22Å; G226-H419 VanDerWaalsContact CA-NE2 3.3Å; G226-H419 WeakPolarHBondContact CA-NE2 3.19Å; G226-H419 PolarHBondContact N-NE2 2.88Å; K413-H419 HydrophobicContact CD-CB 4.44Å; H419-K421 PolarHBondContact O-N 3.14Å; H419-A422 PolarHBondContact O-N 2.69Å; H419-A423 WeakPolarHBondContact O-CB 3.21Å; H419-A423 PolarHBondContact O-N 2.86Å
420	R	95.4	Very high	94.6	Very high	193 Å²	193	49 Å²	49	73%	0.728	25%	0.249	S	C	*	.	H	α-helix	trans	-65.2	-37.9	-178.5	-67.8	-173.8	179.9	-179.9	2	113.2	S418 F424	S418-R420 PolarHBondContact O-N 3.5Å; S418-R420 VanDerWaalsContact O-N 3.17Å; R420-F424 WeakPolarHBondContact O-CB 3.37Å; R420-F424 PolarHBondContact O-N 2.62Å
421	K	97.1	Very high	94.8	Very high	142 Å²	142	50.8 Å²	50.8	62%	0.617	26%	0.258	S	S	*	.	H	α-helix	trans	-68.1	-41.1	175.2	-67.4	179.7	-176.4	177.9	0	110.9	L417 S418 H419 F424 A425	L417-K421 HydrophobicContact CB-CB 4.43Å; L417-K421 HydrophobicContact CD2-CB 4.45Å; S418-K421 PolarHBondContact O-N 3.44Å; S418-K421 WeakPolarHBondContact OG-CD 3.26Å; S418-K421 VanDerWaalsContact OG-CG 3.3Å; S418-K421 WeakPolarHBondContact OG-CG 3.4Å; H419-K421 PolarHBondContact O-N 3.14Å; K421-F424 PolarHBondContact O-N 3.33Å; K421-A425 VanDerWaalsContact O-CB 3.28Å; K421-A425 WeakPolarHBondContact O-CB 3.43Å; K421-A425 PolarHBondContact O-N 3.28Å
422	A	96.6	Very high	94.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-43.6	175.5	0	0	0	0	0	112	V409 A412 K413 L417 S418 H419 A425 G426	V409-A422 HydrophobicContact CG1-CB 3.88Å; A412-A422 HydrophobicContact CB-CB 3.7Å; K413-A422 HydrophobicContact CG-CB 3.85Å; L417-A422 HydrophobicContact CB-CB 4.09Å; S418-A422 PolarHBondContact O-N 3.13Å; H419-A422 PolarHBondContact O-N 2.69Å; A422-A425 PolarHBondContact O-N 3.4Å; A422-G426 PolarHBondContact O-N 3.45Å
423	A	97.6	Very high	94.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-51	173.8	0	0	0	0	0	111.7	I223 F224 V409 H419 A425 G426 L427	I223-A423 HydrophobicContact CG2-CB 3.81Å; F224-A423 HydrophobicContact CD1-CB 3.84Å; F224-A423 HydrophobicContact CE1-CB 3.92Å; V409-A423 HydrophobicContact CG2-CB 4.42Å; H419-A423 WeakPolarHBondContact O-CB 3.21Å; H419-A423 PolarHBondContact O-N 2.86Å; A423-A425 PolarHBondContact O-N 2.93Å; A423-G426 PolarHBondContact O-N 3.43Å; A423-L427 WeakPolarHBondContact O-CB 3.34Å; A423-L427 WeakPolarHBondContact O-CD1 3.41Å; A423-L427 VanDerWaalsContact O-CG 3.23Å; A423-L427 WeakPolarHBondContact O-CG 3.38Å; A423-L427 PolarHBondContact O-N 3.22Å
424	F	97.9	Very high	95.2	Very high	128 Å²	128	56.2 Å²	56.2	56%	0.561	28%	0.283	S	S	*	.	H	α-helix	trans	-59.4	-46.9	176.8	-179.4	-94.4	0	0	0	111.9	F224 R420 K421 G426 L427 F428	F224-F424 HydrophobicContact CE1-CB 4.26Å; F224-F424 HydrophobicContact CZ-CB 4.38Å; R420-F424 WeakPolarHBondContact O-CB 3.37Å; R420-F424 PolarHBondContact O-N 2.62Å; K421-F424 PolarHBondContact O-N 3.33Å; F424-G426 PolarHBondContact O-N 3.32Å; F424-L427 PolarHBondContact O-N 2.89Å; F424-F428 HydrophobicContact CE1-CB 4.37Å; F424-F428 WeakPolarHBondContact O-CB 3.31Å; F424-F428 PolarHBondContact O-N 3.46Å
425	A	95.9	Very high	95.5	Very high	26 Å²	26	57.4 Å²	57.4	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-47.3	178.3	0	0	0	0	0	111.6	L417 K421 A422 A423 L427 F428 L429	L417-A425 HydrophobicContact CD2-CB 4.43Å; K421-A425 VanDerWaalsContact O-CB 3.28Å; K421-A425 WeakPolarHBondContact O-CB 3.43Å; K421-A425 PolarHBondContact O-N 3.28Å; A422-A425 PolarHBondContact O-N 3.4Å; A423-A425 PolarHBondContact O-N 2.93Å; A425-L427 PolarHBondContact O-N 3.33Å; A425-F428 PolarHBondContact O-N 3.27Å; A425-L429 WeakPolarHBondContact O-CB 3.36Å; A425-L429 WeakPolarHBondContact O-CG 3.36Å; A425-L429 PolarHBondContact O-N 3.1Å
426	G	96.1	Very high	95.8	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-48.5	177.8	0	0	0	0	0	112.6	A422 A423 F424 L429 T430	A422-G426 PolarHBondContact O-N 3.45Å; A423-G426 PolarHBondContact O-N 3.43Å; F424-G426 PolarHBondContact O-N 3.32Å; G426-L429 PolarHBondContact O-N 3.26Å; G426-T430 PolarHBondContact O-N 2.65Å; G426-T430 PolarHBondContact O-OG1 3.3Å
427	L	97.8	Very high	96.2	Very high	15 Å²	15	54.5 Å²	54.5	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-44.7	178.8	-66.3	163.4	0	0	0	112.3	V216 V219 G220 F224 V405 A423 F424 A425 T430 L431	V216-L427 HydrophobicContact CG1-CB 4.06Å; V216-L427 HydrophobicContact CG1-CD2 3.93Å; V219-L427 HydrophobicContact CG1-CD2 4.25Å; G220-L427 VanDerWaalsContact CA-CD1 3.5Å; F224-L427 HydrophobicContact CD2-CD1 4.32Å; F224-L427 HydrophobicContact CE2-CD1 3.59Å; F224-L427 HydrophobicContact CZ-CD1 3.8Å; V405-L427 HydrophobicContact CG1-CD2 4.02Å; V405-L427 HydrophobicContact CG1-CG 4.29Å; A423-L427 WeakPolarHBondContact O-CB 3.34Å; A423-L427 WeakPolarHBondContact O-CD1 3.41Å; A423-L427 VanDerWaalsContact O-CG 3.23Å; A423-L427 WeakPolarHBondContact O-CG 3.38Å; A423-L427 PolarHBondContact O-N 3.22Å; F424-L427 PolarHBondContact O-N 2.89Å; A425-L427 PolarHBondContact O-N 3.33Å; L427-T430 PolarHBondContact O-N 3.31Å; L427-L431 PolarHBondContact O-N 2.82Å
428	F	97.2	Very high	96.4	Very high	109 Å²	109	51.8 Å²	51.8	48%	0.478	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-44.9	178.4	178.6	-101.3	0	0	0	111.2	F424 A425 L431 V432	F424-F428 HydrophobicContact CE1-CB 4.37Å; F424-F428 WeakPolarHBondContact O-CB 3.31Å; F424-F428 PolarHBondContact O-N 3.46Å; A425-F428 PolarHBondContact O-N 3.27Å; F428-L431 WeakPolarHBondContact O-CB 3.31Å; F428-L431 PolarHBondContact O-N 3.27Å; F428-V432 HydrophobicContact CD1-CG2 4.27Å; F428-V432 HydrophobicContact CD2-CG2 4.48Å; F428-V432 HydrophobicContact CE1-CG2 3.83Å; F428-V432 HydrophobicContact CE2-CG2 4.06Å; F428-V432 HydrophobicContact CZ-CG2 3.71Å; F428-V432 WeakPolarHBondContact O-CG2 3.47Å; F428-V432 PolarHBondContact O-N 2.87Å
429	L	95	Very high	96.6	Very high	66 Å²	66	54.2 Å²	54.2	35%	0.346	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-46.2	175.2	-77.2	177.8	0	0	0	110.9	Y161 A425 G426 L431 V432 F433	Y161-L429 HydrophobicContact CE2-CB 3.68Å; Y161-L429 WeakPolarHBondContact OH-CA 3.31Å; Y161-L429 VanDerWaalsContact OH-CB 3.26Å; Y161-L429 WeakPolarHBondContact OH-CB 3.38Å; Y161-L429 PolarHBondContact OH-O 2.92Å; A425-L429 WeakPolarHBondContact O-CB 3.36Å; A425-L429 WeakPolarHBondContact O-CG 3.36Å; A425-L429 PolarHBondContact O-N 3.1Å; G426-L429 PolarHBondContact O-N 3.26Å; L429-L431 VanDerWaalsContact C-N 3.29Å; L429-L431 PolarHBondContact O-N 2.86Å; L429-V432 PolarHBondContact O-N 3.31Å; L429-F433 HydrophobicContact CD2-CD2 4.33Å; L429-F433 HydrophobicContact CD2-CE2 3.92Å; L429-F433 PolarHBondContact O-N 2.89Å
430	T	97.6	Very high	96.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-41.3	174.8	-60	0	0	0	0	111.9	T164 H212 V216 G426 L427 G434	T164-T430 HydrophobicContact CG2-CG2 4.01Å; H212-T430 PolarHBondContact CE1-O 3.4Å; V216-T430 HydrophobicContact CG2-CG2 3.89Å; G426-T430 PolarHBondContact O-N 2.65Å; G426-T430 PolarHBondContact O-OG1 3.3Å; L427-T430 PolarHBondContact O-N 3.31Å; T430-G434 WeakPolarHBondContact O-CA 3.4Å; T430-G434 PolarHBondContact O-N 2.84Å
431	L	96.9	Very high	96.5	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.225	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-50.3	177.2	-170.5	79.9	0	0	0	111.6	H212 T213 V216 L427 F428 L429 M435	H212-L431 PolarHBondContact NE2-O 3.42Å; T213-L431 HydrophobicContact CG2-CD1 3.97Å; V216-L431 HydrophobicContact CB-CD1 4.5Å; L427-L431 PolarHBondContact O-N 2.82Å; F428-L431 WeakPolarHBondContact O-CB 3.31Å; F428-L431 PolarHBondContact O-N 3.27Å; L429-L431 VanDerWaalsContact C-N 3.29Å; L429-L431 PolarHBondContact O-N 2.86Å; L431-M435 HydrophobicContact CG-CE 4.37Å; L431-M435 PolarHBondContact O-N 3.48Å
432	V	97	Very high	96.2	Very high	64 Å²	64	44.4 Å²	44.4	39%	0.388	23%	0.232	S	C	.	.	H	α-helix	trans	-66.5	-50.9	-175.3	170.8	0	0	0	0	111.6	F428 L429 G434 M435	F428-V432 HydrophobicContact CD1-CG2 4.27Å; F428-V432 HydrophobicContact CD2-CG2 4.48Å; F428-V432 HydrophobicContact CE1-CG2 3.83Å; F428-V432 HydrophobicContact CE2-CG2 4.06Å; F428-V432 HydrophobicContact CZ-CG2 3.71Å; F428-V432 WeakPolarHBondContact O-CG2 3.47Å; F428-V432 PolarHBondContact O-N 2.87Å; L429-V432 PolarHBondContact O-N 3.31Å; V432-G434 VanDerWaalsContact C-N 3.34Å; V432-M435 VanDerWaalsContact O-CB 3.26Å; V432-M435 WeakPolarHBondContact O-CB 3.16Å; V432-M435 PolarHBondContact O-N 3.43Å
433	F	96	Very high	96.1	Very high	101 Å²	101	46.1 Å²	46.1	44%	0.443	24%	0.243	S	C	.	.	H	α-helix	trans	-78.5	-20.1	-176.8	-76.3	-101.9	0	0	0	112.9	Y161 M162 A165 L429 M435 P436	Y161-F433 HydrophobicContact CE1-CB 4.25Å; Y161-F433 HydrophobicContact CE1-CD1 4.29Å; Y161-F433 HydrophobicContact CE1-CD2 4.15Å; Y161-F433 AromaticContact CE1-CG 3.98Å; Y161-F433 HydrophobicContact CE1-CG 3.98Å; Y161-F433 AromaticContact CZ-CD2 3.93Å; Y161-F433 VanDerWaalsContact OH-CB 3.29Å; Y161-F433 WeakPolarHBondContact OH-CB 3.14Å; Y161-F433 WeakPolarHBondContact OH-CD2 3.34Å; Y161-F433 WeakPolarHBondContact OH-CG 3.33Å; M162-F433 HydrophobicContact SD-CD1 4.24Å; A165-F433 HydrophobicContact CB-CB 3.88Å; L429-F433 HydrophobicContact CD2-CD2 4.33Å; L429-F433 HydrophobicContact CD2-CE2 3.92Å; L429-F433 PolarHBondContact O-N 2.89Å; F433-M435 VanDerWaalsContact C-N 3.32Å; F433-P436 WeakPolarHBondContact O-CD 3.49Å
434	G	97.7	Very high	96	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.6	-19	170.4	0	0	0	0	0	113.3	A165 T430 V432 S437 A438	A165-G434 VanDerWaalsContact O-CA 3.27Å; A165-G434 WeakPolarHBondContact O-CA 3.36Å; T430-G434 WeakPolarHBondContact O-CA 3.4Å; T430-G434 PolarHBondContact O-N 2.84Å; V432-G434 VanDerWaalsContact C-N 3.34Å; G434-S437 PolarHBondContact O-N 3.44Å; G434-A438 PolarHBondContact O-N 3.39Å
435	M	97.6	Very high	95.6	Very high	57 Å²	57	42 Å²	42	28%	0.281	23%	0.228	S	C	.	.	H	α-helix	trans	-58.6	-45.4	-175.2	-161.1	72.7	71	0	0	113.7	V209 L431 V432 F433 S437 A438 I439	V209-M435 HydrophobicContact CG1-SD 3.71Å; V209-M435 HydrophobicContact CG2-SD 4.35Å; L431-M435 HydrophobicContact CG-CE 4.37Å; L431-M435 PolarHBondContact O-N 3.48Å; V432-M435 VanDerWaalsContact O-CB 3.26Å; V432-M435 WeakPolarHBondContact O-CB 3.16Å; V432-M435 PolarHBondContact O-N 3.43Å; F433-M435 VanDerWaalsContact C-N 3.32Å; M435-S437 VanDerWaalsContact C-N 3.31Å; M435-S437 PolarHBondContact O-N 2.88Å; M435-A438 WeakPolarHBondContact O-CB 3.39Å; M435-A438 PolarHBondContact O-N 2.85Å; M435-A438 VanDerWaalsContact O-N 3.09Å; M435-I439 HydrophobicContact CG-CD1 3.86Å; M435-I439 HydrophobicContact CG-CG1 4.46Å; M435-I439 WeakPolarHBondContact O-CG1 3.16Å; M435-I439 PolarHBondContact O-N 3.09Å
436	P	96.9	Very high	95.4	Very high	64 Å²	64	41 Å²	41	42%	0.416	22%	0.219	S	C	.	.	H	α-helix	trans	-59	-40.7	176.8	-25.7	37.5	0	0	0	113	F433 A438 I439 S440 V443	F433-P436 WeakPolarHBondContact O-CD 3.49Å; P436-A438 VanDerWaalsContact C-N 3.33Å; P436-I439 PolarHBondContact O-N 3.31Å; P436-S440 PolarHBondContact O-N 2.99Å; P436-V443 HydrophobicContact CB-CG1 3.84Å
437	S	96.4	Very high	95.3	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.028	22%	0.224	C	C	.	.	H	α-helix	trans	-69.8	-28.9	175.9	-61	0	0	0	0	112.7	G434 M435	G434-S437 PolarHBondContact O-N 3.44Å; M435-S437 VanDerWaalsContact C-N 3.31Å; M435-S437 PolarHBondContact O-N 2.88Å
438	A	97.2	Very high	95	Very high	6 Å²	6	42.9 Å²	42.9	5%	0.05	23%	0.228	C	C	.	.	H	α-helix	trans	-75.2	-29.3	173.1	0	0	0	0	0	112.5	V169 P208 V209 H212 G434 M435 P436	V169-A438 HydrophobicContact CG1-CB 4.22Å; V169-A438 HydrophobicContact CG2-CB 3.87Å; P208-A438 WeakPolarHBondContact CB-O 3.28Å; V209-A438 HydrophobicContact CG2-CB 3.96Å; H212-A438 HydrophobicContact CB-CB 4.1Å; G434-A438 PolarHBondContact O-N 3.39Å; M435-A438 WeakPolarHBondContact O-CB 3.39Å; M435-A438 PolarHBondContact O-N 2.85Å; M435-A438 VanDerWaalsContact O-N 3.09Å; P436-A438 VanDerWaalsContact C-N 3.33Å
439	I	96.7	Very high	94.5	Very high	101 Å²	101	41 Å²	41	52%	0.518	22%	0.223	S	C	.	.	H	α-helix	trans	-82.3	-34	178	-67.4	165.5	0	0	0	111.2	V209 M435 P436	V209-I439 HydrophobicContact CG2-CG1 3.92Å; M435-I439 HydrophobicContact CG-CD1 3.86Å; M435-I439 HydrophobicContact CG-CG1 4.46Å; M435-I439 WeakPolarHBondContact O-CG1 3.16Å; M435-I439 PolarHBondContact O-N 3.09Å; P436-I439 PolarHBondContact O-N 3.31Å
440	S	94.2	Very high	94.4	Very high	36 Å²	36	37.8 Å²	37.8	25%	0.252	21%	0.206	S	C	.	.			trans	-136.6	120.6	-175.2	-175.8	0	0	0	0	112.8	P436 N442 V443 L444	P436-S440 PolarHBondContact O-N 2.99Å; S440-N442 PolarHBondContact O-N 3.02Å; S440-N442 PolarHBondContact OG-N 3.2Å; S440-V443 PolarHBondContact O-N 3.09Å; S440-V443 VanDerWaalsContact O-N 3.14Å; S440-L444 PolarHBondContact O-N 3.29Å
441	I	91.3	Very high	94.1	Very high	12 Å²	12	38 Å²	38	6%	0.062	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-28	172.8	-166.7	166.9	0	0	0	113	W173 F198 Q203 P361 L444 T445	W173-I441 HydrophobicContact CH2-CD1 3.68Å; W173-I441 HydrophobicContact CH2-CG1 3.98Å; W173-I441 HydrophobicContact CZ2-CD1 4.44Å; W173-I441 HydrophobicContact CZ2-CG1 4.48Å; F198-I441 HydrophobicContact CE1-CD1 4.09Å; F198-I441 HydrophobicContact CZ-CD1 3.92Å; Q203-I441 HydrophobicContact CG-CG2 4.23Å; P361-I441 HydrophobicContact CB-CD1 3.75Å; I441-L444 PolarHBondContact O-N 3.23Å; I441-T445 WeakPolarHBondContact O-CB 3.45Å; I441-T445 PolarHBondContact O-N 3.15Å; I441-T445 PolarHBondContact O-OG1 3.48Å
442	N	91.6	Very high	93.7	Very high	99 Å²	99	36.7 Å²	36.7	53%	0.529	20%	0.204	S	C	.	.	H	α-helix	trans	-70.1	-40.5	177	-65.4	-22.9	0	0	0	110.6	S440 T445 N446 L528	S440-N442 PolarHBondContact O-N 3.02Å; S440-N442 PolarHBondContact OG-N 3.2Å; N442-T445 PolarHBondContact O-N 3.4Å; N442-N446 WeakPolarHBondContact O-CB 3.34Å; N442-N446 PolarHBondContact O-N 2.65Å; N442-L528 HydrophobicContact CB-CD1 3.9Å
443	V	94.1	Very high	93.2	Very high	37 Å²	37	35.4 Å²	35.4	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-45.7	172.8	178	0	0	0	0	109.9	P436 S440 T445 N446 Q447	P436-V443 HydrophobicContact CB-CG1 3.84Å; S440-V443 PolarHBondContact O-N 3.09Å; S440-V443 VanDerWaalsContact O-N 3.14Å; V443-T445 VanDerWaalsContact C-N 3.29Å; V443-T445 PolarHBondContact O-N 3.08Å; V443-N446 PolarHBondContact O-N 2.82Å; V443-Q447 HydrophobicContact CG1-CG 4.06Å; V443-Q447 WeakPolarHBondContact O-CB 3.43Å; V443-Q447 VanDerWaalsContact O-CG 3.23Å; V443-Q447 WeakPolarHBondContact O-CG 3.26Å; V443-Q447 PolarHBondContact O-N 3.2Å
444	L	93.9	Very high	93.1	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-55	-45.6	175.7	-173.9	152.1	0	0	0	112	V169 I170 W173 S440 I441 Q447 D448	V169-L444 HydrophobicContact CB-CD1 4.01Å; V169-L444 HydrophobicContact CG1-CD1 3.79Å; I170-L444 HydrophobicContact CD1-CD1 3.92Å; I170-L444 HydrophobicContact CD1-CD2 4.05Å; I170-L444 HydrophobicContact CG1-CD1 4.39Å; W173-L444 HydrophobicContact CH2-CD1 4.46Å; W173-L444 HydrophobicContact CZ2-CD1 3.96Å; S440-L444 PolarHBondContact O-N 3.29Å; I441-L444 PolarHBondContact O-N 3.23Å; L444-Q447 PolarHBondContact O-N 3.44Å; L444-D448 PolarHBondContact O-N 3.39Å
445	T	90.6	Very high	92.8	Very high	34 Å²	34	30.8 Å²	30.8	21%	0.209	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-43.5	-178.9	-57.1	0	0	0	0	111.5	I441 N442 V443 D448 N449	I441-T445 WeakPolarHBondContact O-CB 3.45Å; I441-T445 PolarHBondContact O-N 3.15Å; I441-T445 PolarHBondContact O-OG1 3.48Å; N442-T445 PolarHBondContact O-N 3.4Å; V443-T445 VanDerWaalsContact C-N 3.29Å; V443-T445 PolarHBondContact O-N 3.08Å; T445-D448 PolarHBondContact O-N 3.4Å; T445-N449 PolarHBondContact O-N 3.25Å; T445-N449 VanDerWaalsContact O-N 3.13Å; T445-N449 PolarHBondContact O-ND2 3.49Å
446	N	92.5	Very high	92.6	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-59.1	-49.3	173	156	-89.2	0	0	0	110.8	N442 V443 D448 N449 V450 L528 E537	N442-N446 WeakPolarHBondContact O-CB 3.34Å; N442-N446 PolarHBondContact O-N 2.65Å; V443-N446 PolarHBondContact O-N 2.82Å; N446-D448 PolarHBondContact O-N 2.87Å; N446-N449 PolarHBondContact O-N 2.86Å; N446-N449 VanDerWaalsContact O-N 3.14Å; N446-V450 VanDerWaalsContact O-CG2 3.27Å; N446-V450 WeakPolarHBondContact O-CG2 3.22Å; N446-V450 PolarHBondContact O-N 3.19Å; N446-L528 HydrophobicContact CB-CB 4.14Å; N446-L528 HydrophobicContact CB-CD2 4.31Å; N446-L528 WeakPolarHBondContact CB-O 3.5Å; N446-L528 PolarHBondContact ND2-O 3.43Å; N446-E537 PolarHBondContact ND2-OE1 2.86Å; N446-E537 VanDerWaalsContact ND2-OE1 3.14Å; N446-E537 PolarHBondContact OD1-OE1 3.27Å
447	Q	93.6	Very high	92.4	Very high	25 Å²	25	27 Å²	27	12%	0.117	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-38.5	-178.5	-63.8	-64.4	-72.6	0	0	112.4	M162 Y166 V443 L444 N449 W451 E537	M162-Q447 VanDerWaalsContact CE-OE1 3.27Å; Y166-Q447 HydrophobicContact CD1-CB 3.93Å; Y166-Q447 HydrophobicContact CG-CB 4.34Å; V443-Q447 HydrophobicContact CG1-CG 4.06Å; V443-Q447 WeakPolarHBondContact O-CB 3.43Å; V443-Q447 VanDerWaalsContact O-CG 3.23Å; V443-Q447 WeakPolarHBondContact O-CG 3.26Å; V443-Q447 PolarHBondContact O-N 3.2Å; L444-Q447 PolarHBondContact O-N 3.44Å; Q447-N449 VanDerWaalsContact C-N 3.33Å; Q447-N449 PolarHBondContact O-N 2.66Å; Q447-W451 PolarHBondContact O-N 3.45Å; Q447-E537 PolarHBondContact NE2-OE2 2.96Å
448	D	90.3	Very high	92.4	Very high	32 Å²	32	26.8 Å²	26.8	17%	0.171	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-42.3	173.1	-172.7	46.7	0	0	0	111.6	R90 Y166 L444 T445 N446 G452	R90-D448 IonicContact CZ-OD2 3.84Å; R90-D448 IonicContact NH2-OD1 3.66Å; R90-D448 PolarHBondContact NH2-OD1 2.78Å; R90-D448 IonicContact NH2-OD2 2.75Å; R90-D448 PolarHBondContact NH2-OD2 3.39Å; Y166-D448 HydrophobicContact CD2-CB 4.43Å; Y166-D448 HydrophobicContact CE2-CB 3.83Å; Y166-D448 WeakPolarHBondContact CE2-OD1 3.27Å; Y166-D448 VanDerWaalsContact CZ-OD1 3.29Å; Y166-D448 PolarHBondContact OH-OD1 3.29Å; L444-D448 PolarHBondContact O-N 3.39Å; T445-D448 PolarHBondContact O-N 3.4Å; N446-D448 PolarHBondContact O-N 2.87Å; D448-G452 WeakPolarHBondContact O-CA 3.33Å; D448-G452 PolarHBondContact O-N 3.49Å
449	N	87.5	Confident	92.4	Very high	68 Å²	68	26.5 Å²	26.5	36%	0.364	15%	0.146	S	C	.	.	H	α-helix	trans	-67.4	-52.3	178	-72	-28	0	0	0	111.7	T445 N446 Q447 F453	T445-N449 PolarHBondContact O-N 3.25Å; T445-N449 VanDerWaalsContact O-N 3.13Å; T445-N449 PolarHBondContact O-ND2 3.49Å; N446-N449 PolarHBondContact O-N 2.86Å; N446-N449 VanDerWaalsContact O-N 3.14Å; Q447-N449 VanDerWaalsContact C-N 3.33Å; Q447-N449 PolarHBondContact O-N 2.66Å; N449-F453 VanDerWaalsContact O-CD2 3.3Å; N449-F453 WeakPolarHBondContact O-CD2 3.42Å; N449-F453 PolarHBondContact O-N 2.95Å
450	V	92.1	Very high	92.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-52.7	-175.2	172.2	0	0	0	0	111.1	N446 A454 T534 E537 W538	N446-V450 VanDerWaalsContact O-CG2 3.27Å; N446-V450 WeakPolarHBondContact O-CG2 3.22Å; N446-V450 PolarHBondContact O-N 3.19Å; V450-A454 PolarHBondContact O-N 3.35Å; V450-T534 HydrophobicContact CB-CG2 4.37Å; V450-T534 HydrophobicContact CG1-CG2 4.25Å; V450-T534 HydrophobicContact CG2-CG2 4.17Å; V450-E537 HydrophobicContact CG1-CB 3.9Å; V450-W538 WeakPolarHBondContact O-CZ2 3.27Å; V450-W538 PolarHBondContact O-NE1 3.49Å
451	W	92.6	Very high	92.5	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-83.3	-25.4	-173.5	-54.8	113	0	0	0	112.5	V159 M162 I163 Q447 F453 A454 L455 E537 V541	V159-W451 HydrophobicContact CG2-CE3 4.22Å; V159-W451 HydrophobicContact CG2-CZ3 4.48Å; M162-W451 HydrophobicContact CB-CB 4.41Å; M162-W451 HydrophobicContact CB-CD2 3.49Å; M162-W451 VanDerWaalsContact CB-CD2 3.49Å; M162-W451 HydrophobicContact CB-CE3 4.14Å; M162-W451 HydrophobicContact CB-CG 3.56Å; M162-W451 HydrophobicContact CB-CZ2 4.23Å; M162-W451 HydrophobicContact CE-CZ2 3.67Å; M162-W451 HydrophobicContact CG-CD2 3.94Å; M162-W451 HydrophobicContact CG-CE3 4.31Å; M162-W451 HydrophobicContact CG-CH2 4.23Å; M162-W451 HydrophobicContact CG-CZ2 3.82Å; M162-W451 HydrophobicContact CG-CZ3 4.44Å; I163-W451 HydrophobicContact CD1-CB 4.41Å; I163-W451 HydrophobicContact CG1-CB 3.69Å; Q447-W451 PolarHBondContact O-N 3.45Å; W451-F453 PolarHBondContact O-N 2.87Å; W451-A454 HydrophobicContact CE3-CB 4.06Å; W451-A454 WeakPolarHBondContact O-CB 3.25Å; W451-A454 PolarHBondContact O-N 2.91Å; W451-L455 PolarHBondContact O-N 3.34Å; W451-E537 HydrophobicContact CH2-CB 4.49Å; W451-E537 HydrophobicContact CZ2-CB 4.38Å; W451-V541 HydrophobicContact CH2-CG2 3.64Å; W451-V541 HydrophobicContact CZ3-CG2 4.27Å
452	G	88.2	Confident	92.8	Very high	16 Å²	16	22.2 Å²	22.2	17%	0.165	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-43.7	171.7	0	0	0	0	0	112.7	D448 L455	D448-G452 WeakPolarHBondContact O-CA 3.33Å; D448-G452 PolarHBondContact O-N 3.49Å; G452-L455 WeakPolarHBondContact O-CB 3.29Å
453	F	87.2	Confident	93.1	Very high	36 Å²	36	17.5 Å²	17.5	16%	0.158	10%	0.098	C	C	.	.	H	α-helix	trans	-77.6	-26.2	176.1	-75.9	-75.2	0	0	0	113.3	V280 N449 W451 L455 M456 W512 W538	V280-F453 HydrophobicContact CG1-CE1 4.33Å; N449-F453 VanDerWaalsContact O-CD2 3.3Å; N449-F453 WeakPolarHBondContact O-CD2 3.42Å; N449-F453 PolarHBondContact O-N 2.95Å; W451-F453 PolarHBondContact O-N 2.87Å; F453-L455 PolarHBondContact O-N 3.46Å; F453-M456 HydrophobicContact CB-CE 4.5Å; F453-M456 HydrophobicContact CD1-CE 3.49Å; F453-M456 VanDerWaalsContact CD1-CE 3.49Å; F453-M456 HydrophobicContact CE1-CE 4.1Å; F453-M456 HydrophobicContact CG-CE 4.38Å; F453-M456 PolarHBondContact O-N 2.92Å; F453-M456 VanDerWaalsContact O-N 3.15Å; F453-W512 HydrophobicContact CD1-CB 4.01Å; F453-W512 AromaticContact CD1-CD1 3.63Å; F453-W512 AromaticContact CD1-CD2 3.95Å; F453-W512 HydrophobicContact CD1-CD2 3.95Å; F453-W512 AromaticContact CD1-CG 3.56Å; F453-W512 HydrophobicContact CD1-CG 3.56Å; F453-W512 AromaticContact CD1-NE1 3.97Å; F453-W512 AromaticContact CD2-CD1 3.8Å; F453-W512 HydrophobicContact CD2-CD2 4.37Å; F453-W512 AromaticContact CD2-CE2 3.77Å; F453-W512 HydrophobicContact CD2-CG 4.36Å; F453-W512 HydrophobicContact CD2-CZ2 4.3Å; F453-W512 AromaticContact CD2-NE1 3.36Å; F453-W512 HydrophobicContact CE1-CB 3.79Å; F453-W512 AromaticContact CE1-CD1 3.22Å; F453-W512 HydrophobicContact CE1-CD2 4.3Å; F453-W512 AromaticContact CE1-CG 3.47Å; F453-W512 HydrophobicContact CE1-CG 3.47Å; F453-W512 VanDerWaalsContact CE1-CG 3.47Å; F453-W512 AromaticContact CE1-NE1 3.86Å; F453-W512 AromaticContact CE2-CD1 3.42Å; F453-W512 VanDerWaalsContact CE2-CD1 3.42Å; F453-W512 HydrophobicContact CE2-CG 4.29Å; F453-W512 AromaticContact CE2-NE1 3.24Å; F453-W512 AromaticContact CG-CD1 3.93Å; F453-W512 HydrophobicContact CG-CD2 4.02Å; F453-W512 AromaticContact CG-CE2 3.85Å; F453-W512 HydrophobicContact CG-CG 4.05Å; F453-W512 HydrophobicContact CG-CZ2 4.44Å; F453-W512 AromaticContact CG-NE1 3.76Å; F453-W512 HydrophobicContact CZ-CB 4.5Å; F453-W512 AromaticContact CZ-CD1 3.11Å; F453-W512 AromaticContact CZ-CG 3.88Å; F453-W512 HydrophobicContact CZ-CG 3.88Å; F453-W512 AromaticContact CZ-NE1 3.52Å; F453-W538 HydrophobicContact CB-CH2 4.01Å; F453-W538 HydrophobicContact CB-CZ2 3.76Å
454	A	93.1	Very high	93.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.1	-23.4	175.2	0	0	0	0	0	112.9	W155 V159 V450 W451 M456 L457 S458 W538	W155-A454 HydrophobicContact CH2-CB 4.37Å; W155-A454 HydrophobicContact CZ2-CB 3.83Å; V159-A454 HydrophobicContact CB-CB 4.4Å; V159-A454 HydrophobicContact CG1-CB 3.79Å; V159-A454 HydrophobicContact CG2-CB 3.66Å; V450-A454 PolarHBondContact O-N 3.35Å; W451-A454 HydrophobicContact CE3-CB 4.06Å; W451-A454 WeakPolarHBondContact O-CB 3.25Å; W451-A454 PolarHBondContact O-N 2.91Å; A454-M456 VanDerWaalsContact C-N 3.26Å; A454-M456 PolarHBondContact O-N 2.98Å; A454-L457 WeakPolarHBondContact O-CB 3.45Å; A454-L457 PolarHBondContact O-N 3.38Å; A454-S458 PolarHBondContact O-N 2.99Å; A454-S458 VanDerWaalsContact O-N 3.12Å; A454-W538 HydrophobicContact CB-CZ2 4.12Å
455	L	91.7	Very high	93.4	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-59.2	-32.7	174.7	-67.8	172.2	0	0	0	113.5	V159 I163 F288 M294 W451 G452 F453 L457 S458 G459	V159-L455 HydrophobicContact CG1-CD2 3.81Å; V159-L455 HydrophobicContact CG1-CG 4.25Å; I163-L455 HydrophobicContact CD1-CD1 3.84Å; I163-L455 HydrophobicContact CD1-CD2 3.63Å; I163-L455 HydrophobicContact CD1-CG 3.79Å; F288-L455 HydrophobicContact CD2-CD1 4.23Å; M294-L455 HydrophobicContact CB-CD2 4.49Å; M294-L455 HydrophobicContact CE-CD1 3.5Å; M294-L455 VanDerWaalsContact CE-CD1 3.5Å; M294-L455 HydrophobicContact CE-CD2 4.3Å; M294-L455 HydrophobicContact CG-CD1 4.4Å; M294-L455 HydrophobicContact CG-CD2 3.5Å; M294-L455 VanDerWaalsContact CG-CD2 3.5Å; W451-L455 PolarHBondContact O-N 3.34Å; G452-L455 WeakPolarHBondContact O-CB 3.29Å; F453-L455 PolarHBondContact O-N 3.46Å; L455-L457 VanDerWaalsContact C-N 3.28Å; L455-L457 PolarHBondContact O-N 2.9Å; L455-S458 WeakPolarHBondContact O-CB 3.13Å; L455-S458 PolarHBondContact O-N 3.39Å; L455-G459 PolarHBondContact O-N 3.46Å
456	M	91.9	Very high	93.8	Very high	4 Å²	4	14.9 Å²	14.9	2%	0.02	9%	0.087	C	C	.	.	H	α-helix	trans	-63.1	-38.3	174.5	-92.9	69.4	77.8	0	0	111.1	W118 F453 A454 S458 G459 L460 L508 I509	W118-M456 HydrophobicContact CH2-CB 4.44Å; W118-M456 HydrophobicContact CH2-CG 4.12Å; W118-M456 HydrophobicContact CZ2-CG 4.19Å; F453-M456 HydrophobicContact CB-CE 4.5Å; F453-M456 HydrophobicContact CD1-CE 3.49Å; F453-M456 VanDerWaalsContact CD1-CE 3.49Å; F453-M456 HydrophobicContact CE1-CE 4.1Å; F453-M456 HydrophobicContact CG-CE 4.38Å; F453-M456 PolarHBondContact O-N 2.92Å; F453-M456 VanDerWaalsContact O-N 3.15Å; A454-M456 VanDerWaalsContact C-N 3.26Å; A454-M456 PolarHBondContact O-N 2.98Å; M456-S458 VanDerWaalsContact C-N 3.35Å; M456-G459 PolarHBondContact O-N 3.25Å; M456-L460 WeakPolarHBondContact O-CG 3.42Å; M456-L460 PolarHBondContact O-N 2.95Å; M456-L508 HydrophobicContact CG-CB 4.17Å; M456-L508 HydrophobicContact CG-CD1 4.24Å; M456-L508 HydrophobicContact SD-CD1 4.4Å; M456-I509 HydrophobicContact CB-CD1 3.85Å; M456-I509 HydrophobicContact CB-CG1 3.78Å; M456-I509 HydrophobicContact CG-CG1 4.47Å
457	L	94.5	Very high	94.1	Very high	37 Å²	37	18.2 Å²	18.2	19%	0.194	10%	0.104	C	C	.	.	H	α-helix	trans	-67.6	-36.2	175.3	-64.1	172.6	0	0	0	111.6	W155 A454 L455 G459 L460 S461 I509 W538 F542	W155-L457 HydrophobicContact CH2-CD1 4.13Å; W155-L457 HydrophobicContact CZ2-CB 3.84Å; W155-L457 HydrophobicContact CZ2-CD1 3.61Å; W155-L457 HydrophobicContact CZ2-CG 4.35Å; A454-L457 WeakPolarHBondContact O-CB 3.45Å; A454-L457 PolarHBondContact O-N 3.38Å; L455-L457 VanDerWaalsContact C-N 3.28Å; L455-L457 PolarHBondContact O-N 2.9Å; L457-G459 VanDerWaalsContact C-N 3.35Å; L457-L460 PolarHBondContact O-N 2.97Å; L457-S461 WeakPolarHBondContact O-CB 3.43Å; L457-S461 PolarHBondContact O-N 3.45Å; L457-S461 PolarHBondContact O-OG 3.43Å; L457-I509 HydrophobicContact CD2-CD1 3.47Å; L457-I509 VanDerWaalsContact CD2-CD1 3.47Å; L457-I509 HydrophobicContact CG-CD1 3.93Å; L457-W538 HydrophobicContact CD1-CD2 4.19Å; L457-W538 HydrophobicContact CD1-CE3 3.65Å; L457-W538 HydrophobicContact CD1-CH2 4.28Å; L457-W538 HydrophobicContact CD1-CZ3 3.7Å; L457-F542 HydrophobicContact CD1-CE2 4.33Å; L457-F542 HydrophobicContact CD1-CZ 4.13Å
458	S	96.2	Very high	94.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.4	-43	171.3	-61.4	0	0	0	0	111.7	W155 A293 A454 L455 M456 S461 M462	W155-S458 PolarHBondContact NE1-OG 2.91Å; A293-S458 VanDerWaalsContact O-CB 3.24Å; A293-S458 WeakPolarHBondContact O-CB 3.45Å; A454-S458 PolarHBondContact O-N 2.99Å; A454-S458 VanDerWaalsContact O-N 3.12Å; L455-S458 WeakPolarHBondContact O-CB 3.13Å; L455-S458 PolarHBondContact O-N 3.39Å; M456-S458 VanDerWaalsContact C-N 3.35Å; S458-S461 WeakPolarHBondContact O-CB 3.46Å; S458-S461 PolarHBondContact O-N 3.41Å; S458-M462 PolarHBondContact O-N 3.4Å
459	G	96	Very high	94.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.5	-41.9	178.1	0	0	0	0	0	112.6	A293 L455 M456 L457 S461 M462 A463	A293-G459 VanDerWaalsContact CB-N 3.31Å; L455-G459 PolarHBondContact O-N 3.46Å; M456-G459 PolarHBondContact O-N 3.25Å; L457-G459 VanDerWaalsContact C-N 3.35Å; G459-S461 VanDerWaalsContact C-N 3.35Å; G459-M462 PolarHBondContact O-N 3.44Å; G459-A463 WeakPolarHBondContact O-CB 3.35Å; G459-A463 PolarHBondContact O-N 3.01Å
460	L	97	Very high	95.1	Very high	39 Å²	39	19.5 Å²	19.5	20%	0.204	12%	0.115	C	C	.	.	H	α-helix	trans	-63.8	-39.1	173.5	-69.8	176.9	0	0	0	112.1	M456 L457 A463 G464 I509	M456-L460 WeakPolarHBondContact O-CG 3.42Å; M456-L460 PolarHBondContact O-N 2.95Å; L457-L460 PolarHBondContact O-N 2.97Å; L460-A463 PolarHBondContact O-N 2.86Å; L460-G464 PolarHBondContact O-N 3.26Å; L460-I509 HydrophobicContact CD1-CD1 3.82Å
461	S	97.1	Very high	95.4	Very high	20 Å²	20	20.4 Å²	20.4	14%	0.14	12%	0.121	C	C	.	.	H	α-helix	trans	-63.5	-42.9	176.4	-60.2	0	0	0	0	111.4	L457 S458 G459 G464 L465	L457-S461 WeakPolarHBondContact O-CB 3.43Å; L457-S461 PolarHBondContact O-N 3.45Å; L457-S461 PolarHBondContact O-OG 3.43Å; S458-S461 WeakPolarHBondContact O-CB 3.46Å; S458-S461 PolarHBondContact O-N 3.41Å; G459-S461 VanDerWaalsContact C-N 3.35Å; S461-G464 PolarHBondContact O-N 2.82Å; S461-L465 PolarHBondContact O-N 3.31Å
462	M	96.9	Very high	95.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.8	-43.1	177.8	-167.5	171.6	-63.3	0	0	112.2	L122 V125 E126 I156 A295 I298 S458 G459 G464 L465 I466	L122-M462 HydrophobicContact CD2-CB 4.18Å; L122-M462 HydrophobicContact CD2-CG 4.36Å; L122-M462 HydrophobicContact CD2-SD 4.36Å; V125-M462 HydrophobicContact CB-CG 4.18Å; V125-M462 HydrophobicContact CB-SD 3.97Å; V125-M462 HydrophobicContact CG1-CG 3.49Å; V125-M462 VanDerWaalsContact CG1-CG 3.49Å; V125-M462 HydrophobicContact CG1-SD 3.69Å; E126-M462 HydrophobicContact CG-CE 3.76Å; E126-M462 HydrophobicContact CG-SD 3.58Å; E126-M462 VanDerWaalsContact CG-SD 3.58Å; I156-M462 HydrophobicContact CD1-CB 4.5Å; I156-M462 HydrophobicContact CD1-CE 4.09Å; A295-M462 HydrophobicContact CB-CE 4.48Å; I298-M462 HydrophobicContact CD1-CE 4.06Å; S458-M462 PolarHBondContact O-N 3.4Å; G459-M462 PolarHBondContact O-N 3.44Å; M462-G464 VanDerWaalsContact C-N 3.29Å; M462-G464 PolarHBondContact O-N 3.45Å; M462-L465 WeakPolarHBondContact O-CB 3.48Å; M462-L465 PolarHBondContact O-N 3.3Å; M462-I466 PolarHBondContact O-N 3.42Å
463	A	97.8	Very high	96.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-60.8	-40	171.2	0	0	0	0	0	111.5	G459 L460 L465 I466 L467 I497 V501 P502	G459-A463 WeakPolarHBondContact O-CB 3.35Å; G459-A463 PolarHBondContact O-N 3.01Å; L460-A463 PolarHBondContact O-N 2.86Å; A463-L465 VanDerWaalsContact C-N 3.34Å; A463-L465 PolarHBondContact O-N 3.11Å; A463-I466 PolarHBondContact O-N 3.45Å; A463-I466 VanDerWaalsContact O-N 3.15Å; A463-L467 WeakPolarHBondContact O-CB 3.24Å; A463-L467 VanDerWaalsContact O-CG 3.32Å; A463-L467 WeakPolarHBondContact O-CG 3.14Å; A463-L467 PolarHBondContact O-N 3.48Å; A463-I497 HydrophobicContact CB-CD1 4.04Å; A463-V501 HydrophobicContact CB-CG1 3.86Å; A463-P502 HydrophobicContact CB-CG 4.49Å
464	G	97.7	Very high	96.6	Very high	21 Å²	21	26 Å²	26	22%	0.216	14%	0.143	C	C	.	.	H	α-helix	trans	-57.2	-42.4	175	0	0	0	0	0	113.1	L460 S461 M462 I466 L467 I468	L460-G464 PolarHBondContact O-N 3.26Å; S461-G464 PolarHBondContact O-N 2.82Å; M462-G464 VanDerWaalsContact C-N 3.29Å; M462-G464 PolarHBondContact O-N 3.45Å; G464-I466 VanDerWaalsContact C-N 3.34Å; G464-I466 PolarHBondContact O-N 3.49Å; G464-L467 PolarHBondContact O-N 2.85Å; G464-I468 WeakPolarHBondContact O-CD1 3.34Å; G464-I468 VanDerWaalsContact O-CG1 3.23Å; G464-I468 WeakPolarHBondContact O-CG1 3.41Å; G464-I468 PolarHBondContact O-N 3.31Å
465	L	97.9	Very high	96.8	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-57.7	-47.2	174.2	-179.4	156.5	0	0	0	111.6	L129 F141 F144 L145 S461 M462 A463 I468 Y469	L129-L465 HydrophobicContact CD1-CD2 4.36Å; L129-L465 HydrophobicContact CD2-CD1 4.4Å; F141-L465 HydrophobicContact CB-CD1 4.49Å; F141-L465 HydrophobicContact CD1-CD1 3.89Å; F141-L465 HydrophobicContact CD2-CD1 3.57Å; F141-L465 HydrophobicContact CE1-CB 3.93Å; F141-L465 HydrophobicContact CE1-CD1 3.92Å; F141-L465 HydrophobicContact CE1-CG 4.48Å; F141-L465 HydrophobicContact CE2-CD1 3.63Å; F141-L465 HydrophobicContact CG-CD1 3.73Å; F141-L465 HydrophobicContact CZ-CB 3.92Å; F141-L465 HydrophobicContact CZ-CD1 3.81Å; F144-L465 HydrophobicContact CB-CD1 4.2Å; F144-L465 HydrophobicContact CB-CD2 4.2Å; F144-L465 HydrophobicContact CB-CG 4.16Å; F144-L465 HydrophobicContact CD1-CD2 3.91Å; F144-L465 HydrophobicContact CE1-CD2 4.48Å; F144-L465 HydrophobicContact CG-CD2 3.97Å; F144-L465 HydrophobicContact CG-CG 4.46Å; L145-L465 HydrophobicContact CD1-CB 4.27Å; L145-L465 HydrophobicContact CD1-CG 4.19Å; L145-L465 HydrophobicContact CG-CG 4.35Å; S461-L465 PolarHBondContact O-N 3.31Å; M462-L465 WeakPolarHBondContact O-CB 3.48Å; M462-L465 PolarHBondContact O-N 3.3Å; A463-L465 VanDerWaalsContact C-N 3.34Å; A463-L465 PolarHBondContact O-N 3.11Å; L465-I468 PolarHBondContact O-N 3.36Å; L465-Y469 WeakPolarHBondContact O-CB 3.5Å; L465-Y469 PolarHBondContact O-N 3.49Å
466	I	98.2	Very high	97.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-41	179.7	-55.9	-58.9	0	0	0	111.3	V125 M462 A463 G464 G470 P471 Y474 W493 I497	V125-I466 HydrophobicContact CG1-CD1 3.88Å; V125-I466 HydrophobicContact CG1-CG1 4.1Å; V125-I466 HydrophobicContact CG2-CD1 4.14Å; V125-I466 HydrophobicContact CG2-CG1 3.84Å; M462-I466 PolarHBondContact O-N 3.42Å; A463-I466 PolarHBondContact O-N 3.45Å; A463-I466 VanDerWaalsContact O-N 3.15Å; G464-I466 VanDerWaalsContact C-N 3.34Å; G464-I466 PolarHBondContact O-N 3.49Å; I466-G470 CarbonylContact O-C 3.58Å; I466-G470 PolarHBondContact O-N 2.83Å; I466-P471 HydrophobicContact CG2-CB 4.13Å; I466-P471 HydrophobicContact CG2-CG 4.21Å; I466-P471 VanDerWaalsContact O-CD 3.3Å; I466-P471 WeakPolarHBondContact O-CD 3.48Å; I466-Y474 HydrophobicContact CD1-CD1 3.91Å; I466-Y474 HydrophobicContact CD1-CD2 3.55Å; I466-Y474 HydrophobicContact CD1-CE1 3.73Å; I466-Y474 HydrophobicContact CD1-CE2 3.37Å; I466-Y474 HydrophobicContact CD1-CG 3.81Å; I466-Y474 VanDerWaalsContact CD1-CZ 3.45Å; I466-Y474 HydrophobicContact CG2-CG 4.36Å; I466-W493 HydrophobicContact CG2-CH2 3.86Å; I466-W493 HydrophobicContact CG2-CZ3 4.3Å; I466-I497 HydrophobicContact CB-CG1 4.19Å; I466-I497 HydrophobicContact CG1-CG1 4.32Å; I466-I497 HydrophobicContact CG2-CG1 4.12Å; I466-I497 HydrophobicContact CG2-CG2 4.07Å
467	L	98.2	Very high	97.2	Very high	74 Å²	74	36.2 Å²	36.2	39%	0.387	19%	0.185	S	C	.	.	H	α-helix	trans	-62.4	-45.1	177.7	-75.7	174	0	0	0	112	A463 G464 G470 P471 P502	A463-L467 WeakPolarHBondContact O-CB 3.24Å; A463-L467 VanDerWaalsContact O-CG 3.32Å; A463-L467 WeakPolarHBondContact O-CG 3.14Å; A463-L467 PolarHBondContact O-N 3.48Å; G464-L467 PolarHBondContact O-N 2.85Å; L467-G470 PolarHBondContact O-N 2.92Å; L467-P471 HydrophobicContact CD2-CG 3.99Å; L467-P502 HydrophobicContact CD1-CG 4.14Å
468	I	97.6	Very high	97.3	Very high	110 Å²	110	34.5 Å²	34.5	56%	0.564	18%	0.176	S	C	*	.	H	α-helix	trans	-68.8	-42.7	179.9	-64.7	163	0	0	0	111	L145 L149 G464 L465 G470	L145-I468 HydrophobicContact CD1-CD1 4.19Å; L145-I468 HydrophobicContact CD2-CB 3.93Å; L145-I468 HydrophobicContact CD2-CG2 3.59Å; L149-I468 HydrophobicContact CD1-CD1 4.43Å; G464-I468 WeakPolarHBondContact O-CD1 3.34Å; G464-I468 VanDerWaalsContact O-CG1 3.23Å; G464-I468 WeakPolarHBondContact O-CG1 3.41Å; G464-I468 PolarHBondContact O-N 3.31Å; L465-I468 PolarHBondContact O-N 3.36Å; I468-G470 VanDerWaalsContact C-N 3.29Å; I468-G470 PolarHBondContact O-N 3.01Å
469	Y	96.9	Very high	97.3	Very high	20 Å²	20	34.5 Å²	34.5	8%	0.078	18%	0.176	C	C	.	.	H	α-helix	trans	-69.4	-27.5	179.2	180	-101.7	0	0	0	113.1	F144 L465 K473 Y474 I478 P570 H571	F144-Y469 HydrophobicContact CD1-CD1 4.17Å; F144-Y469 AromaticContact CD1-CD2 3.57Å; F144-Y469 HydrophobicContact CD1-CD2 3.57Å; F144-Y469 HydrophobicContact CD1-CE2 4.07Å; F144-Y469 AromaticContact CD1-CG 3.63Å; F144-Y469 HydrophobicContact CD1-CG 3.63Å; F144-Y469 AromaticContact CE1-CD1 3.96Å; F144-Y469 HydrophobicContact CE1-CD1 3.96Å; F144-Y469 AromaticContact CE1-CD2 3.99Å; F144-Y469 HydrophobicContact CE1-CD2 3.99Å; F144-Y469 HydrophobicContact CE1-CE1 4.08Å; F144-Y469 HydrophobicContact CE1-CE2 4.13Å; F144-Y469 AromaticContact CE1-CG 3.91Å; F144-Y469 HydrophobicContact CE1-CG 3.91Å; L465-Y469 WeakPolarHBondContact O-CB 3.5Å; L465-Y469 PolarHBondContact O-N 3.49Å; Y469-K473 HydrophobicContact CE1-CB 4.24Å; Y469-K473 HydrophobicContact CE1-CD 3.96Å; Y469-K473 HydrophobicContact CE1-CG 3.96Å; Y469-K473 HydrophobicContact CE2-CD 4.33Å; Y469-K473 WeakPolarHBondContact OH-CE 3.49Å; Y469-K473 PolarHBondContact OH-NZ 3.16Å; Y469-Y474 AromaticContact CD1-CD2 3.9Å; Y469-Y474 HydrophobicContact CD1-CD2 3.9Å; Y469-Y474 HydrophobicContact CD1-CG 4.42Å; Y469-Y474 HydrophobicContact CE1-CD2 4.2Å; Y469-I478 HydrophobicContact CE1-CD1 4.48Å; Y469-I478 HydrophobicContact CE1-CG1 3.9Å; Y469-P570 HydrophobicContact CE2-CB 3.9Å; Y469-P570 PolarHBondContact OH-O 3.3Å; Y469-H571 AromaticContact CE2-CE1 3.96Å
470	G	97.9	Very high	97.4	Very high	23 Å²	23	35.1 Å²	35.1	24%	0.237	18%	0.179	C	C	.	.			trans	106.3	102.1	-177.2	0	0	0	0	0	111.2	I466 L467 I468 M472 K473 Y474	I466-G470 CarbonylContact O-C 3.58Å; I466-G470 PolarHBondContact O-N 2.83Å; L467-G470 PolarHBondContact O-N 2.92Å; I468-G470 VanDerWaalsContact C-N 3.29Å; I468-G470 PolarHBondContact O-N 3.01Å; G470-M472 VanDerWaalsContact C-N 3.29Å; G470-M472 PolarHBondContact O-N 3.3Å; G470-K473 WeakPolarHBondContact O-CB 3.31Å; G470-K473 PolarHBondContact O-N 3.26Å; G470-Y474 PolarHBondContact O-N 3.27Å
471	P	98.3	Very high	97.2	Very high	19 Å²	19	38.3 Å²	38.3	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-56.3	-37.8	-174.5	-28.6	34.4	0	0	0	114.4	I466 L467 R475 V494 I497 S498	I466-P471 HydrophobicContact CG2-CB 4.13Å; I466-P471 HydrophobicContact CG2-CG 4.21Å; I466-P471 VanDerWaalsContact O-CD 3.3Å; I466-P471 WeakPolarHBondContact O-CD 3.48Å; L467-P471 HydrophobicContact CD2-CG 3.99Å; P471-R475 WeakPolarHBondContact O-CB 3.21Å; P471-R475 PolarHBondContact O-N 3.08Å; P471-V494 HydrophobicContact CB-CG1 3.73Å; P471-V494 HydrophobicContact CB-CG2 4.42Å; P471-I497 HydrophobicContact CB-CG2 4.35Å; P471-S498 VanDerWaalsContact CG-OG 3.3Å; P471-S498 WeakPolarHBondContact CG-OG 3.16Å
472	M	98.2	Very high	97	Very high	76 Å²	76	37.8 Å²	37.8	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-68.8	-40.4	176.6	-76.5	-63.8	-71.5	0	0	112.5	G470 R476 V491 V494	G470-M472 VanDerWaalsContact C-N 3.29Å; G470-M472 PolarHBondContact O-N 3.3Å; M472-R476 WeakPolarHBondContact O-CG 3.37Å; M472-R476 PolarHBondContact O-N 2.98Å; M472-V491 HydrophobicContact CE-CG2 4.49Å; M472-V491 HydrophobicContact SD-CG2 4.08Å; M472-V494 HydrophobicContact CG-CG1 4.25Å; M472-V494 HydrophobicContact SD-CB 4.32Å; M472-V494 HydrophobicContact SD-CG1 4.15Å; M472-V494 HydrophobicContact SD-CG2 3.8Å
473	K	97.2	Very high	96.8	Very high	97 Å²	97	38.3 Å²	38.3	42%	0.422	20%	0.198	S	C	.	.	H	α-helix	trans	-65.5	-46.6	175.6	-173.4	-174.2	-179.9	-164.9	0	109.9	Y469 G470 R475 R476 V477	Y469-K473 HydrophobicContact CE1-CB 4.24Å; Y469-K473 HydrophobicContact CE1-CD 3.96Å; Y469-K473 HydrophobicContact CE1-CG 3.96Å; Y469-K473 HydrophobicContact CE2-CD 4.33Å; Y469-K473 WeakPolarHBondContact OH-CE 3.49Å; Y469-K473 PolarHBondContact OH-NZ 3.16Å; G470-K473 WeakPolarHBondContact O-CB 3.31Å; G470-K473 PolarHBondContact O-N 3.26Å; K473-R475 PolarHBondContact O-N 2.79Å; K473-R476 PolarHBondContact O-N 2.92Å; K473-V477 HydrophobicContact CG-CG2 4.28Å; K473-V477 WeakPolarHBondContact O-CB 3.42Å; K473-V477 PolarHBondContact O-N 3.46Å
474	Y	98	Very high	96.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-53.7	-55	175.7	-168.5	-92.2	0	0	0	111.7	T128 L129 F144 I466 Y469 G470 R476 I478 V479 W493	T128-Y474 PolarHBondContact OG1-OH 3.5Å; L129-Y474 HydrophobicContact CD1-CE2 4.5Å; L129-Y474 PolarHBondContact N-OH 2.99Å; F144-Y474 AromaticContact CE1-CD2 3.81Å; F144-Y474 HydrophobicContact CE1-CD2 3.81Å; F144-Y474 AromaticContact CE1-CE2 3.74Å; F144-Y474 HydrophobicContact CE1-CE2 3.74Å; F144-Y474 HydrophobicContact CZ-CD2 4.32Å; F144-Y474 AromaticContact CZ-CE2 3.83Å; F144-Y474 HydrophobicContact CZ-CE2 3.83Å; I466-Y474 HydrophobicContact CD1-CD1 3.91Å; I466-Y474 HydrophobicContact CD1-CD2 3.55Å; I466-Y474 HydrophobicContact CD1-CE1 3.73Å; I466-Y474 HydrophobicContact CD1-CE2 3.37Å; I466-Y474 HydrophobicContact CD1-CG 3.81Å; I466-Y474 VanDerWaalsContact CD1-CZ 3.45Å; I466-Y474 HydrophobicContact CG2-CG 4.36Å; Y469-Y474 AromaticContact CD1-CD2 3.9Å; Y469-Y474 HydrophobicContact CD1-CD2 3.9Å; Y469-Y474 HydrophobicContact CD1-CG 4.42Å; Y469-Y474 HydrophobicContact CE1-CD2 4.2Å; G470-Y474 PolarHBondContact O-N 3.27Å; Y474-R476 VanDerWaalsContact C-N 3.31Å; Y474-R476 PolarHBondContact O-N 2.95Å; Y474-I478 HydrophobicContact CD2-CB 4.01Å; Y474-I478 HydrophobicContact CD2-CG1 3.91Å; Y474-I478 HydrophobicContact CD2-CG2 4.2Å; Y474-I478 HydrophobicContact CE2-CB 4.06Å; Y474-I478 HydrophobicContact CE2-CG1 4.25Å; Y474-I478 HydrophobicContact CE2-CG2 3.71Å; Y474-I478 HydrophobicContact CG-CB 4.31Å; Y474-I478 HydrophobicContact CG-CG1 4.43Å; Y474-I478 WeakPolarHBondContact O-CB 3.07Å; Y474-I478 PolarHBondContact O-N 2.89Å; Y474-V479 HydrophobicContact CD1-CG2 3.71Å; Y474-V479 HydrophobicContact CE1-CG2 3.51Å; Y474-V479 PolarHBondContact O-N 3.2Å; Y474-W493 AromaticContact CD1-CH2 3.65Å; Y474-W493 HydrophobicContact CD1-CH2 3.65Å; Y474-W493 HydrophobicContact CD1-CZ3 4.13Å; Y474-W493 AromaticContact CE1-CH2 3.99Å; Y474-W493 HydrophobicContact CE1-CH2 3.99Å
475	R	98.2	Very high	96.1	Very high	42 Å²	42	47.4 Å²	47.4	16%	0.158	24%	0.24	C	C	.	.	I	π-helix	trans	-56.2	-43.6	-179.6	175.7	-173.3	166.4	-81.9	-5.7	112.6	P471 K473 V479 N480 L489 S490 W493 V494	P471-R475 WeakPolarHBondContact O-CB 3.21Å; P471-R475 PolarHBondContact O-N 3.08Å; K473-R475 PolarHBondContact O-N 2.79Å; R475-V479 WeakPolarHBondContact O-CB 3.35Å; R475-N480 WeakPolarHBondContact O-CB 3.48Å; R475-N480 VanDerWaalsContact O-CG 3.29Å; R475-N480 PolarHBondContact O-N 2.92Å; R475-N480 VanDerWaalsContact O-N 3.08Å; R475-N480 PolarHBondContact O-ND2 2.95Å; R475-L489 HydrophobicContact CG-CB 4.32Å; R475-L489 HydrophobicContact CG-CD2 4.29Å; R475-L489 HydrophobicContact CG-CG 4.37Å; R475-L489 PolarHBondContact NE-O 3.48Å; R475-L489 PolarHBondContact NH2-O 3.25Å; R475-S490 WeakPolarHBondContact CD-O 3.46Å; R475-S490 PolarHBondContact NE-O 3.29Å; R475-S490 VanDerWaalsContact NE-O 3.14Å; R475-W493 HydrophobicContact CB-CZ3 4.39Å; R475-V494 HydrophobicContact CB-CG2 4.17Å
476	R	96.6	Very high	96	Very high	142 Å²	142	48.3 Å²	48.3	54%	0.536	25%	0.245	S	C	.	.	I	π-helix	trans	-72.4	-62.9	-177.6	-70.7	178.3	-179	-179.1	-0.5	110.4	M472 K473 Y474 N480 D481	M472-R476 WeakPolarHBondContact O-CG 3.37Å; M472-R476 PolarHBondContact O-N 2.98Å; K473-R476 PolarHBondContact O-N 2.92Å; Y474-R476 VanDerWaalsContact C-N 3.31Å; Y474-R476 PolarHBondContact O-N 2.95Å; R476-N480 WeakPolarHBondContact O-CB 3.24Å; R476-N480 PolarHBondContact O-N 3.16Å; R476-D481 WeakPolarHBondContact O-CB 3.39Å; R476-D481 PolarHBondContact O-N 3.01Å
477	V	95	Very high	95.9	Very high	39 Å²	39	54.3 Å²	54.3	24%	0.236	27%	0.268	C	S	.	.	I	π-helix	trans	-75.7	-55.3	-168.4	-179	0	0	0	0	111.8	K473 F482 P573	K473-V477 HydrophobicContact CG-CG2 4.28Å; K473-V477 WeakPolarHBondContact O-CB 3.42Å; K473-V477 PolarHBondContact O-N 3.46Å; V477-F482 WeakPolarHBondContact O-CB 3.39Å; V477-F482 PolarHBondContact O-N 3.46Å; V477-P573 HydrophobicContact CG1-CB 3.74Å; V477-P573 HydrophobicContact CG1-CG 3.66Å
478	I	95.7	Very high	95.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	I	π-helix	trans	-77.7	-30.1	-169.4	-52	-59.3	0	0	0	111.8	F132 F144 Y469 Y474 F482 P570	F132-I478 HydrophobicContact CB-CG2 3.94Å; F132-I478 HydrophobicContact CD1-CD1 4.3Å; F132-I478 HydrophobicContact CD1-CG2 4.22Å; F132-I478 HydrophobicContact CD2-CD1 4.13Å; F132-I478 HydrophobicContact CD2-CG2 3.84Å; F132-I478 HydrophobicContact CE1-CD1 3.84Å; F132-I478 HydrophobicContact CE2-CD1 3.64Å; F132-I478 HydrophobicContact CE2-CG2 4.44Å; F132-I478 HydrophobicContact CG-CD1 4.44Å; F132-I478 HydrophobicContact CG-CG2 3.72Å; F132-I478 HydrophobicContact CZ-CD1 3.49Å; F132-I478 VanDerWaalsContact CZ-CD1 3.49Å; F144-I478 HydrophobicContact CE1-CD1 4.47Å; F144-I478 HydrophobicContact CE1-CG1 4.25Å; F144-I478 HydrophobicContact CZ-CD1 4.25Å; F144-I478 HydrophobicContact CZ-CG1 4.23Å; F144-I478 HydrophobicContact CZ-CG2 4.19Å; Y469-I478 HydrophobicContact CE1-CD1 4.48Å; Y469-I478 HydrophobicContact CE1-CG1 3.9Å; Y474-I478 HydrophobicContact CD2-CB 4.01Å; Y474-I478 HydrophobicContact CD2-CG1 3.91Å; Y474-I478 HydrophobicContact CD2-CG2 4.2Å; Y474-I478 HydrophobicContact CE2-CB 4.06Å; Y474-I478 HydrophobicContact CE2-CG1 4.25Å; Y474-I478 HydrophobicContact CE2-CG2 3.71Å; Y474-I478 HydrophobicContact CG-CB 4.31Å; Y474-I478 HydrophobicContact CG-CG1 4.43Å; Y474-I478 WeakPolarHBondContact O-CB 3.07Å; Y474-I478 PolarHBondContact O-N 2.89Å; I478-F482 VanDerWaalsContact O-CB 3.31Å; I478-F482 WeakPolarHBondContact O-CB 3.06Å; I478-P570 HydrophobicContact CD1-CB 4Å
479	V	97.3	Very high	95.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	25%	0.253	C	S	.	.	I	π-helix	trans	-101.1	-67	-177	-173.2	0	0	0	0	111.7	T128 V311 Y474 R475 G483 L489	T128-V479 HydrophobicContact CG2-CB 4.32Å; T128-V479 HydrophobicContact CG2-CG1 3.81Å; T128-V479 HydrophobicContact CG2-CG2 3.84Å; V311-V479 HydrophobicContact CG2-CG1 3.31Å; Y474-V479 HydrophobicContact CD1-CG2 3.71Å; Y474-V479 HydrophobicContact CE1-CG2 3.51Å; Y474-V479 PolarHBondContact O-N 3.2Å; R475-V479 WeakPolarHBondContact O-CB 3.35Å; V479-G483 PolarHBondContact O-N 3.36Å; V479-G483 VanDerWaalsContact O-N 3.13Å; V479-L489 HydrophobicContact CB-CD2 4.26Å; V479-L489 HydrophobicContact CG1-CB 3.9Å; V479-L489 HydrophobicContact CG1-CD2 3.88Å; V479-L489 HydrophobicContact CG2-CD2 4.11Å
480	N	96.9	Very high	95.8	Very high	13 Å²	13	54.5 Å²	54.5	7%	0.07	27%	0.27	C	S	.	.	I	π-helix	trans	-74.6	-45.4	-167.5	-74.1	-17.1	0	0	0	113.4	R475 R476 K488 L489	R475-N480 WeakPolarHBondContact O-CB 3.48Å; R475-N480 VanDerWaalsContact O-CG 3.29Å; R475-N480 PolarHBondContact O-N 2.92Å; R475-N480 VanDerWaalsContact O-N 3.08Å; R475-N480 PolarHBondContact O-ND2 2.95Å; R476-N480 WeakPolarHBondContact O-CB 3.24Å; R476-N480 PolarHBondContact O-N 3.16Å; N480-K488 HydrophobicContact CB-CD 3.9Å; N480-K488 PolarHBondContact O-NZ 3.18Å; N480-K488 WeakPolarHBondContact OD1-CA 3.47Å; N480-L489 PolarHBondContact ND2-O 2.99Å; N480-L489 PolarHBondContact OD1-N 2.9Å
481	D	94.1	Very high	95.8	Very high	105 Å²	105	57.3 Å²	57.3	56%	0.561	28%	0.283	S	S	*	.	I	π-helix	trans	-79.9	-31.8	-176	-58.9	-21.7	0	0	0	110.7	R306 R476	R306-D481 PolarHBondContact NH2-O 2.94Å; R476-D481 WeakPolarHBondContact O-CB 3.39Å; R476-D481 PolarHBondContact O-N 3.01Å
482	F	93.2	Very high	95.8	Very high	9 Å²	9	60.5 Å²	60.5	4%	0.039	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-33.2	175.9	-170.1	-106.7	0	0	0	113.7	R131 F132 R306 V477 I478 Y568	R131-F482 HydrophobicContact CG-CE1 4.27Å; F132-F482 HydrophobicContact CB-CE1 4.3Å; F132-F482 HydrophobicContact CD2-CB 4.4Å; F132-F482 AromaticContact CD2-CD1 3.79Å; F132-F482 HydrophobicContact CD2-CD1 3.79Å; F132-F482 AromaticContact CD2-CD2 3.74Å; F132-F482 HydrophobicContact CD2-CD2 3.74Å; F132-F482 AromaticContact CD2-CE1 3.93Å; F132-F482 HydrophobicContact CD2-CE1 3.93Å; F132-F482 AromaticContact CD2-CE2 3.87Å; F132-F482 HydrophobicContact CD2-CE2 3.87Å; F132-F482 AromaticContact CD2-CG 3.71Å; F132-F482 HydrophobicContact CD2-CG 3.71Å; F132-F482 AromaticContact CD2-CZ 3.97Å; F132-F482 HydrophobicContact CD2-CZ 3.97Å; F132-F482 AromaticContact CE2-CD2 3.81Å; F132-F482 HydrophobicContact CE2-CD2 3.81Å; F132-F482 HydrophobicContact CE2-CE2 4.04Å; F132-F482 HydrophobicContact CE2-CG 4.14Å; R306-F482 HydrophobicContact CG-CD1 4.48Å; R306-F482 HydrophobicContact CG-CE1 3.89Å; R306-F482 HydrophobicContact CG-CE2 4.01Å; R306-F482 HydrophobicContact CG-CZ 3.62Å; R306-F482 PolarHBondContact NE-O 2.83Å; R306-F482 PolarHBondContact NH2-O 2.66Å; V477-F482 WeakPolarHBondContact O-CB 3.39Å; V477-F482 PolarHBondContact O-N 3.46Å; I478-F482 VanDerWaalsContact O-CB 3.31Å; I478-F482 WeakPolarHBondContact O-CB 3.06Å; F482-Y568 AromaticContact CE2-CD1 3.73Å; F482-Y568 HydrophobicContact CE2-CD1 3.73Å; F482-Y568 AromaticContact CE2-CD2 3.52Å; F482-Y568 HydrophobicContact CE2-CD2 3.52Å; F482-Y568 AromaticContact CE2-CE1 3.72Å; F482-Y568 HydrophobicContact CE2-CE1 3.72Å; F482-Y568 AromaticContact CE2-CE2 3.54Å; F482-Y568 HydrophobicContact CE2-CE2 3.54Å; F482-Y568 AromaticContact CE2-CG 3.63Å; F482-Y568 HydrophobicContact CE2-CG 3.63Å; F482-Y568 AromaticContact CE2-CZ 3.62Å; F482-Y568 HydrophobicContact CZ-CD1 4.41Å; F482-Y568 AromaticContact CZ-CD2 3.34Å; F482-Y568 HydrophobicContact CZ-CD2 3.34Å; F482-Y568 HydrophobicContact CZ-CE1 4.37Å; F482-Y568 AromaticContact CZ-CE2 3.31Å; F482-Y568 HydrophobicContact CZ-CE2 3.31Å; F482-Y568 AromaticContact CZ-CG 3.94Å; F482-Y568 HydrophobicContact CZ-CG 3.94Å; F482-Y568 AromaticContact CZ-CZ 3.84Å
483	G	90.9	Very high	95.8	Very high	12 Å²	12	57.1 Å²	57.1	12%	0.124	29%	0.285	C	S	.	.			trans	-72.5	128.4	178	0	0	0	0	0	115.1	R131 V479	R131-G483 VanDerWaalsContact NH1-CA 3.29Å; V479-G483 PolarHBondContact O-N 3.36Å; V479-G483 VanDerWaalsContact O-N 3.13Å
484	I	91	Very high	95.8	Very high	66 Å²	66	53.5 Å²	53.5	34%	0.338	27%	0.27	S	S	.	.	S	Bend	trans	-101.4	128.2	170.6	-57.3	173.9	0	0	0	107.8	R306 K307 D486	R306-I484 HydrophobicContact CB-CD1 3.86Å; R306-I484 HydrophobicContact CB-CG1 4.06Å; R306-I484 PolarHBondContact O-N 3.07Å; K307-I484 HydrophobicContact CG-CB 4.35Å; K307-I484 HydrophobicContact CG-CG2 4.37Å; I484-D486 PolarHBondContact O-N 3.24Å; I484-D486 VanDerWaalsContact O-N 3.16Å
485	D	90.3	Very high	95.8	Very high	146 Å²	146	58.8 Å²	58.8	78%	0.781	29%	0.294	S	S	*	.	S	Bend	trans	53.7	31	-180	-56	-35.1	0	0	0	115
486	D	95.3	Very high	95.8	Very high	21 Å²	21	58.4 Å²	58.4	11%	0.112	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-103.8	161.7	174.9	-163.2	11.4	0	0	0	111.6	G309 A310 V311 R312 I484	G309-D486 VanDerWaalsContact C-OD2 3.29Å; G309-D486 WeakPolarHBondContact CA-OD1 3.46Å; G309-D486 WeakPolarHBondContact CA-OD2 3.35Å; A310-D486 PolarHBondContact N-OD2 3.45Å; V311-D486 PolarHBondContact N-OD2 2.72Å; R312-D486 PolarHBondContact N-OD1 2.95Å; R312-D486 VanDerWaalsContact N-OD1 3.15Å; I484-D486 PolarHBondContact O-N 3.24Å; I484-D486 VanDerWaalsContact O-N 3.16Å
487	W	97.5	Very high	95.9	Very high	125 Å²	125	51.7 Å²	51.7	47%	0.473	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-64.9	134.6	171.5	-67	-6.9	0	0	0	110.8	V311 R312 T315 M316 L489	V311-W487 HydrophobicContact CB-CB 4.31Å; V311-W487 WeakPolarHBondContact CB-O 3.44Å; V311-W487 HydrophobicContact CG1-CB 4.05Å; V311-W487 WeakPolarHBondContact CG2-O 3.47Å; R312-W487 HydrophobicContact CB-CD2 4.01Å; R312-W487 HydrophobicContact CB-CE3 4.16Å; R312-W487 HydrophobicContact CB-CG 4.32Å; R312-W487 HydrophobicContact CG-CD2 4.1Å; R312-W487 HydrophobicContact CG-CE3 4.23Å; R312-W487 HydrophobicContact CG-CH2 4.13Å; R312-W487 HydrophobicContact CG-CZ2 3.97Å; R312-W487 HydrophobicContact CG-CZ3 4.25Å; T315-W487 HydrophobicContact CG2-CZ3 4.34Å; M316-W487 HydrophobicContact CE-CH2 3.82Å; M316-W487 HydrophobicContact CE-CZ3 3.9Å; M316-W487 HydrophobicContact CG-CH2 4.14Å; M316-W487 HydrophobicContact CG-CZ3 4.38Å; M316-W487 HydrophobicContact SD-CH2 4.12Å; W487-L489 PolarHBondContact O-N 3Å
488	K	97	Very high	96	Very high	137 Å²	137	51.4 Å²	51.4	60%	0.596	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-74.2	123	174.6	-62.1	-66.5	177.4	177.8	0	109.4	N480 S490	N480-K488 HydrophobicContact CB-CD 3.9Å; N480-K488 PolarHBondContact O-NZ 3.18Å; N480-K488 WeakPolarHBondContact OD1-CA 3.47Å; K488-S490 PolarHBondContact O-N 2.79Å
489	L	97.5	Very high	96.1	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.042	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-65.2	127.6	178.4	-172.7	57.7	0	0	0	109.9	I124 V311 R475 V479 N480 W487 W493	I124-L489 HydrophobicContact CD1-CD1 3.93Å; I124-L489 HydrophobicContact CG2-CD1 4.11Å; I124-L489 HydrophobicContact CG2-CD2 4Å; V311-L489 HydrophobicContact CG1-CB 4.49Å; V311-L489 HydrophobicContact CG1-CD1 4.13Å; V311-L489 HydrophobicContact CG2-CB 4.22Å; R475-L489 HydrophobicContact CG-CB 4.32Å; R475-L489 HydrophobicContact CG-CD2 4.29Å; R475-L489 HydrophobicContact CG-CG 4.37Å; R475-L489 PolarHBondContact NE-O 3.48Å; R475-L489 PolarHBondContact NH2-O 3.25Å; V479-L489 HydrophobicContact CB-CD2 4.26Å; V479-L489 HydrophobicContact CG1-CB 3.9Å; V479-L489 HydrophobicContact CG1-CD2 3.88Å; V479-L489 HydrophobicContact CG2-CD2 4.11Å; N480-L489 PolarHBondContact ND2-O 2.99Å; N480-L489 PolarHBondContact OD1-N 2.9Å; W487-L489 PolarHBondContact O-N 3Å; L489-W493 HydrophobicContact CD1-CB 3.69Å; L489-W493 HydrophobicContact CD1-CD2 4.28Å; L489-W493 HydrophobicContact CD1-CG 3.65Å; L489-W493 HydrophobicContact CD2-CB 4.31Å; L489-W493 HydrophobicContact CD2-CD2 3.54Å; L489-W493 HydrophobicContact CD2-CE3 3.69Å; L489-W493 HydrophobicContact CD2-CG 3.83Å; L489-W493 HydrophobicContact CD2-CH2 4.48Å; L489-W493 HydrophobicContact CD2-CZ2 4.36Å; L489-W493 HydrophobicContact CD2-CZ3 4.17Å; L489-W493 HydrophobicContact CG-CB 3.86Å; L489-W493 HydrophobicContact CG-CD2 4.11Å; L489-W493 HydrophobicContact CG-CE3 4.39Å; L489-W493 HydrophobicContact CG-CG 3.88Å
490	S	96.4	Very high	96.1	Very high	64 Å²	64	56.3 Å²	56.3	45%	0.448	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-66.8	155.2	-179.4	178.6	0	0	0	0	112.1	R475 K488 V492 W493	R475-S490 WeakPolarHBondContact CD-O 3.46Å; R475-S490 PolarHBondContact NE-O 3.29Å; R475-S490 VanDerWaalsContact NE-O 3.14Å; K488-S490 PolarHBondContact O-N 2.79Å; S490-V492 PolarHBondContact O-N 3.18Å; S490-V492 PolarHBondContact OG-N 3.42Å; S490-W493 WeakPolarHBondContact O-CB 3.48Å; S490-W493 PolarHBondContact O-N 2.97Å
491	V	97.7	Very high	96.1	Very high	82 Å²	82	55.7 Å²	55.7	50%	0.497	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.1	170.7	70.2	0	0	0	0	111.7	M472 W493 V494	M472-V491 HydrophobicContact CE-CG2 4.49Å; M472-V491 HydrophobicContact SD-CG2 4.08Å; V491-W493 PolarHBondContact O-N 3.18Å; V491-V494 VanDerWaalsContact O-CB 3.3Å; V491-V494 WeakPolarHBondContact O-CB 3.49Å; V491-V494 PolarHBondContact O-N 3.03Å
492	V	97.4	Very high	96.3	Very high	85 Å²	85	52 Å²	52	52%	0.515	28%	0.275	S	S	.	.	H	α-helix	trans	-57	-35.8	174.7	178.1	0	0	0	0	111	S490 V494 F495 M496	S490-V492 PolarHBondContact O-N 3.18Å; S490-V492 PolarHBondContact OG-N 3.42Å; V492-V494 PolarHBondContact O-N 3.44Å; V492-F495 WeakPolarHBondContact O-CB 3.32Å; V492-F495 PolarHBondContact O-N 3.24Å; V492-M496 HydrophobicContact CG1-CG 4.3Å; V492-M496 HydrophobicContact CG1-SD 4.09Å; V492-M496 WeakPolarHBondContact O-CG 3.25Å; V492-M496 PolarHBondContact O-N 3.32Å
493	W	98.3	Very high	96.4	Very high	6 Å²	6	57.1 Å²	57.1	2%	0.023	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-32	176.7	177.6	91.8	0	0	0	112.8	P121 V125 I466 Y474 R475 L489 S490 V491 F495 M496 I497	P121-W493 PolarHBondContact O-NE1 2.99Å; V125-W493 HydrophobicContact CG2-CH2 4.31Å; V125-W493 HydrophobicContact CG2-CZ2 3.62Å; I466-W493 HydrophobicContact CG2-CH2 3.86Å; I466-W493 HydrophobicContact CG2-CZ3 4.3Å; Y474-W493 AromaticContact CD1-CH2 3.65Å; Y474-W493 HydrophobicContact CD1-CH2 3.65Å; Y474-W493 HydrophobicContact CD1-CZ3 4.13Å; Y474-W493 AromaticContact CE1-CH2 3.99Å; Y474-W493 HydrophobicContact CE1-CH2 3.99Å; R475-W493 HydrophobicContact CB-CZ3 4.39Å; L489-W493 HydrophobicContact CD1-CB 3.69Å; L489-W493 HydrophobicContact CD1-CD2 4.28Å; L489-W493 HydrophobicContact CD1-CG 3.65Å; L489-W493 HydrophobicContact CD2-CB 4.31Å; L489-W493 HydrophobicContact CD2-CD2 3.54Å; L489-W493 HydrophobicContact CD2-CE3 3.69Å; L489-W493 HydrophobicContact CD2-CG 3.83Å; L489-W493 HydrophobicContact CD2-CH2 4.48Å; L489-W493 HydrophobicContact CD2-CZ2 4.36Å; L489-W493 HydrophobicContact CD2-CZ3 4.17Å; L489-W493 HydrophobicContact CG-CB 3.86Å; L489-W493 HydrophobicContact CG-CD2 4.11Å; L489-W493 HydrophobicContact CG-CE3 4.39Å; L489-W493 HydrophobicContact CG-CG 3.88Å; S490-W493 WeakPolarHBondContact O-CB 3.48Å; S490-W493 PolarHBondContact O-N 2.97Å; V491-W493 PolarHBondContact O-N 3.18Å; W493-F495 VanDerWaalsContact C-N 3.34Å; W493-F495 PolarHBondContact O-N 3.34Å; W493-M496 WeakPolarHBondContact O-CB 3.31Å; W493-M496 PolarHBondContact O-N 3.32Å; W493-M496 VanDerWaalsContact O-N 3.15Å; W493-I497 HydrophobicContact CD2-CB 4.47Å; W493-I497 HydrophobicContact CD2-CG2 4.28Å; W493-I497 HydrophobicContact CE3-CG2 3.97Å; W493-I497 HydrophobicContact CH2-CB 4.32Å; W493-I497 HydrophobicContact CH2-CG1 4.35Å; W493-I497 HydrophobicContact CH2-CG2 3.92Å; W493-I497 HydrophobicContact CZ2-CB 4.14Å; W493-I497 HydrophobicContact CZ2-CG1 4.17Å; W493-I497 HydrophobicContact CZ2-CG2 4.22Å; W493-I497 HydrophobicContact CZ3-CG2 3.78Å; W493-I497 WeakPolarHBondContact O-CG2 2.82Å; W493-I497 PolarHBondContact O-N 3.22Å
494	V	98.5	Very high	96.5	Very high	20 Å²	20	58.1 Å²	58.1	12%	0.121	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-42.5	176.5	171.7	0	0	0	0	110.7	P471 M472 R475 V491 V492 M496 S498	P471-V494 HydrophobicContact CB-CG1 3.73Å; P471-V494 HydrophobicContact CB-CG2 4.42Å; M472-V494 HydrophobicContact CG-CG1 4.25Å; M472-V494 HydrophobicContact SD-CB 4.32Å; M472-V494 HydrophobicContact SD-CG1 4.15Å; M472-V494 HydrophobicContact SD-CG2 3.8Å; R475-V494 HydrophobicContact CB-CG2 4.17Å; V491-V494 VanDerWaalsContact O-CB 3.3Å; V491-V494 WeakPolarHBondContact O-CB 3.49Å; V491-V494 PolarHBondContact O-N 3.03Å; V492-V494 PolarHBondContact O-N 3.44Å; V494-M496 VanDerWaalsContact C-N 3.33Å; V494-S498 WeakPolarHBondContact O-CB 3.3Å; V494-S498 PolarHBondContact O-N 2.99Å; V494-S498 PolarHBondContact O-OG 3.36Å
495	F	98	Very high	96.5	Very high	112 Å²	112	55 Å²	55	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-41.2	172.9	173.2	-105.1	0	0	0	111.4	V492 W493 S498 V499 L500	V492-F495 WeakPolarHBondContact O-CB 3.32Å; V492-F495 PolarHBondContact O-N 3.24Å; W493-F495 VanDerWaalsContact C-N 3.34Å; W493-F495 PolarHBondContact O-N 3.34Å; F495-S498 PolarHBondContact O-N 3.14Å; F495-V499 HydrophobicContact CD2-CB 4.02Å; F495-V499 HydrophobicContact CD2-CG2 3.82Å; F495-V499 HydrophobicContact CE2-CB 3.81Å; F495-V499 HydrophobicContact CE2-CG1 3.88Å; F495-V499 HydrophobicContact CE2-CG2 3.88Å; F495-V499 HydrophobicContact CZ-CB 4.36Å; F495-V499 HydrophobicContact CZ-CG1 4.23Å; F495-V499 WeakPolarHBondContact O-CB 3.49Å; F495-V499 PolarHBondContact O-N 3.05Å; F495-L500 HydrophobicContact CD1-CD1 4.22Å; F495-L500 HydrophobicContact CD1-CG 4.15Å; F495-L500 HydrophobicContact CE1-CD1 3.91Å; F495-L500 HydrophobicContact CE1-CD2 3.79Å; F495-L500 HydrophobicContact CE1-CG 3.71Å; F495-L500 HydrophobicContact CZ-CD2 4.02Å; F495-L500 HydrophobicContact CZ-CG 4.3Å; F495-L500 PolarHBondContact O-N 2.85Å
496	M	97.8	Very high	96.7	Very high	34 Å²	34	51.2 Å²	51.2	17%	0.167	27%	0.274	C	S	.	.	I	π-helix	trans	-61.9	-53	179.8	-58.5	170.1	86.1	0	0	111.7	F116 P121 V492 W493 V494 S498 L500 V501	F116-M496 WeakPolarHBondContact O-CE 3.02Å; P121-M496 HydrophobicContact CB-CB 4.18Å; P121-M496 HydrophobicContact CG-CB 4.33Å; V492-M496 HydrophobicContact CG1-CG 4.3Å; V492-M496 HydrophobicContact CG1-SD 4.09Å; V492-M496 WeakPolarHBondContact O-CG 3.25Å; V492-M496 PolarHBondContact O-N 3.32Å; W493-M496 WeakPolarHBondContact O-CB 3.31Å; W493-M496 PolarHBondContact O-N 3.32Å; W493-M496 VanDerWaalsContact O-N 3.15Å; V494-M496 VanDerWaalsContact C-N 3.33Å; M496-S498 VanDerWaalsContact C-N 3.33Å; M496-S498 PolarHBondContact O-N 3.35Å; M496-L500 HydrophobicContact CB-CD1 4.42Å; M496-L500 HydrophobicContact CG-CD1 4.08Å; M496-L500 WeakPolarHBondContact O-CB 3.41Å; M496-L500 PolarHBondContact O-N 3.13Å; M496-L500 VanDerWaalsContact O-N 3.09Å; M496-V501 PolarHBondContact O-N 3.31Å
497	I	98.1	Very high	96.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-70.9	-28.3	-178	-163	60.1	0	0	0	112.9	L122 V125 A463 I466 P471 W493 V501 P502	L122-I497 HydrophobicContact CD2-CD1 4.17Å; V125-I497 HydrophobicContact CG2-CD1 4.04Å; V125-I497 HydrophobicContact CG2-CG1 4.43Å; A463-I497 HydrophobicContact CB-CD1 4.04Å; I466-I497 HydrophobicContact CB-CG1 4.19Å; I466-I497 HydrophobicContact CG1-CG1 4.32Å; I466-I497 HydrophobicContact CG2-CG1 4.12Å; I466-I497 HydrophobicContact CG2-CG2 4.07Å; P471-I497 HydrophobicContact CB-CG2 4.35Å; W493-I497 HydrophobicContact CD2-CB 4.47Å; W493-I497 HydrophobicContact CD2-CG2 4.28Å; W493-I497 HydrophobicContact CE3-CG2 3.97Å; W493-I497 HydrophobicContact CH2-CB 4.32Å; W493-I497 HydrophobicContact CH2-CG1 4.35Å; W493-I497 HydrophobicContact CH2-CG2 3.92Å; W493-I497 HydrophobicContact CZ2-CB 4.14Å; W493-I497 HydrophobicContact CZ2-CG1 4.17Å; W493-I497 HydrophobicContact CZ2-CG2 4.22Å; W493-I497 HydrophobicContact CZ3-CG2 3.78Å; W493-I497 WeakPolarHBondContact O-CG2 2.82Å; W493-I497 PolarHBondContact O-N 3.22Å; I497-V501 HydrophobicContact CD1-CB 4.35Å; I497-V501 HydrophobicContact CD1-CG1 4.38Å; I497-V501 HydrophobicContact CD1-CG2 4.18Å; I497-P502 VanDerWaalsContact O-CD 3.25Å; I497-P502 WeakPolarHBondContact O-CD 3.18Å
498	S	98.1	Very high	96	Very high	34 Å²	34	46.9 Å²	46.9	24%	0.238	27%	0.267	C	S	.	.	I	π-helix	trans	-91	-24.5	-175	-48	0	0	0	0	113.8	P471 V494 F495 M496	P471-S498 VanDerWaalsContact CG-OG 3.3Å; P471-S498 WeakPolarHBondContact CG-OG 3.16Å; V494-S498 WeakPolarHBondContact O-CB 3.3Å; V494-S498 PolarHBondContact O-N 2.99Å; V494-S498 PolarHBondContact O-OG 3.36Å; F495-S498 PolarHBondContact O-N 3.14Å; M496-S498 VanDerWaalsContact C-N 3.33Å; M496-S498 PolarHBondContact O-N 3.35Å
499	V	97.8	Very high	95.7	Very high	56 Å²	56	42 Å²	42	34%	0.339	25%	0.247	S	C	.	.	I	π-helix	trans	-124.2	-59	-174.3	-177.6	0	0	0	0	110.6	F495 P502 L503	F495-V499 HydrophobicContact CD2-CB 4.02Å; F495-V499 HydrophobicContact CD2-CG2 3.82Å; F495-V499 HydrophobicContact CE2-CB 3.81Å; F495-V499 HydrophobicContact CE2-CG1 3.88Å; F495-V499 HydrophobicContact CE2-CG2 3.88Å; F495-V499 HydrophobicContact CZ-CB 4.36Å; F495-V499 HydrophobicContact CZ-CG1 4.23Å; F495-V499 WeakPolarHBondContact O-CB 3.49Å; F495-V499 PolarHBondContact O-N 3.05Å; V499-P502 WeakPolarHBondContact O-CD 3.34Å; V499-L503 HydrophobicContact CG1-CD1 3.64Å; V499-L503 HydrophobicContact CG1-CG 4.47Å; V499-L503 VanDerWaalsContact O-CB 3.29Å; V499-L503 WeakPolarHBondContact O-CB 3.13Å; V499-L503 WeakPolarHBondContact O-CG 3.27Å; V499-L503 PolarHBondContact O-N 2.95Å
500	L	96.9	Very high	95.3	Very high	48 Å²	48	46.9 Å²	46.9	25%	0.251	27%	0.272	S	S	.	.	I	π-helix	trans	-66.2	-44.9	-172.2	-63.4	-172.7	0	0	0	113	V117 F495 M496 S504	V117-L500 HydrophobicContact CG1-CB 3.94Å; V117-L500 HydrophobicContact CG2-CD1 4.49Å; F495-L500 HydrophobicContact CD1-CD1 4.22Å; F495-L500 HydrophobicContact CD1-CG 4.15Å; F495-L500 HydrophobicContact CE1-CD1 3.91Å; F495-L500 HydrophobicContact CE1-CD2 3.79Å; F495-L500 HydrophobicContact CE1-CG 3.71Å; F495-L500 HydrophobicContact CZ-CD2 4.02Å; F495-L500 HydrophobicContact CZ-CG 4.3Å; F495-L500 PolarHBondContact O-N 2.85Å; M496-L500 HydrophobicContact CB-CD1 4.42Å; M496-L500 HydrophobicContact CG-CD1 4.08Å; M496-L500 WeakPolarHBondContact O-CB 3.41Å; M496-L500 PolarHBondContact O-N 3.13Å; M496-L500 VanDerWaalsContact O-N 3.09Å; L500-S504 VanDerWaalsContact O-CB 3.24Å; L500-S504 WeakPolarHBondContact O-CB 3.34Å; L500-S504 PolarHBondContact O-N 3.47Å; L500-S504 PolarHBondContact O-OG 2.92Å
501	V	97.1	Very high	94.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-52.7	179	171.3	0	0	0	0	111	V117 W118 P121 L122 A463 M496 I497 L503 S504 G505	V117-V501 VanDerWaalsContact O-CG2 3.31Å; V117-V501 WeakPolarHBondContact O-CG2 3.36Å; W118-V501 HydrophobicContact CE3-CG1 3.97Å; W118-V501 HydrophobicContact CZ3-CG1 3.85Å; W118-V501 WeakPolarHBondContact CZ3-O 3.41Å; P121-V501 HydrophobicContact CB-CG2 4.1Å; P121-V501 HydrophobicContact CG-CG2 3.56Å; L122-V501 HydrophobicContact CD1-CG1 4.09Å; L122-V501 HydrophobicContact CD2-CG1 4.14Å; L122-V501 HydrophobicContact CG-CG1 4.14Å; L122-V501 HydrophobicContact CG-CG2 4.49Å; A463-V501 HydrophobicContact CB-CG1 3.86Å; M496-V501 PolarHBondContact O-N 3.31Å; I497-V501 HydrophobicContact CD1-CB 4.35Å; I497-V501 HydrophobicContact CD1-CG1 4.38Å; I497-V501 HydrophobicContact CD1-CG2 4.18Å; V501-L503 PolarHBondContact O-N 3.15Å; V501-S504 PolarHBondContact O-N 2.99Å; V501-G505 PolarHBondContact O-N 3.02Å
502	P	97.2	Very high	94.2	Very high	28 Å²	28	45.7 Å²	45.7	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-43	176.8	-28.5	36.4	0	0	0	114	A463 L467 I497 V499 T506	A463-P502 HydrophobicContact CB-CG 4.49Å; L467-P502 HydrophobicContact CD1-CG 4.14Å; I497-P502 VanDerWaalsContact O-CD 3.25Å; I497-P502 WeakPolarHBondContact O-CD 3.18Å; V499-P502 WeakPolarHBondContact O-CD 3.34Å; P502-T506 VanDerWaalsContact O-CB 3.25Å; P502-T506 WeakPolarHBondContact O-CB 2.94Å; P502-T506 PolarHBondContact O-N 3.06Å; P502-T506 PolarHBondContact O-OG1 3Å
503	L	95.2	Very high	93.7	Very high	115 Å²	115	42.9 Å²	42.9	60%	0.602	24%	0.235	S	C	*	.	H	α-helix	trans	-64.2	-43.6	177.5	-73.8	174.8	0	0	0	111.7	V499 V501 G507	V499-L503 HydrophobicContact CG1-CD1 3.64Å; V499-L503 HydrophobicContact CG1-CG 4.47Å; V499-L503 VanDerWaalsContact O-CB 3.29Å; V499-L503 WeakPolarHBondContact O-CB 3.13Å; V499-L503 WeakPolarHBondContact O-CG 3.27Å; V499-L503 PolarHBondContact O-N 2.95Å; V501-L503 PolarHBondContact O-N 3.15Å; L503-G507 WeakPolarHBondContact O-CA 3.41Å; L503-G507 PolarHBondContact O-N 3.09Å
504	S	92.9	Very high	93.2	Very high	34 Å²	34	48.7 Å²	48.7	24%	0.238	26%	0.257	C	S	.	.	H	α-helix	trans	-67	-46.1	-179.8	-57.3	0	0	0	0	111.5	V117 L500 V501 G507 L508	V117-S504 WeakPolarHBondContact CG1-OG 3.3Å; L500-S504 VanDerWaalsContact O-CB 3.24Å; L500-S504 WeakPolarHBondContact O-CB 3.34Å; L500-S504 PolarHBondContact O-N 3.47Å; L500-S504 PolarHBondContact O-OG 2.92Å; V501-S504 PolarHBondContact O-N 2.99Å; S504-G507 PolarHBondContact O-N 3.35Å; S504-L508 VanDerWaalsContact O-CB 3.31Å; S504-L508 WeakPolarHBondContact O-CB 3.38Å; S504-L508 WeakPolarHBondContact O-CD1 3.44Å; S504-L508 WeakPolarHBondContact O-CG 3.5Å; S504-L508 PolarHBondContact O-N 3.19Å
505	G	92.6	Very high	92.5	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-45.7	179.8	0	0	0	0	0	112.4	W118 V501 L508 I509	W118-G505 VanDerWaalsContact CZ3-N 3.34Å; V501-G505 PolarHBondContact O-N 3.02Å; G505-L508 PolarHBondContact O-N 2.65Å; G505-I509 WeakPolarHBondContact O-CG1 3.39Å; G505-I509 PolarHBondContact O-N 2.77Å; G505-I509 VanDerWaalsContact O-N 3.11Å
506	T	93.8	Very high	91.7	Very high	67 Å²	67	47.3 Å²	47.3	41%	0.411	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-45	177.3	-51.9	0	0	0	0	110.9	P502 L508 I509 I510	P502-T506 VanDerWaalsContact O-CB 3.25Å; P502-T506 WeakPolarHBondContact O-CB 2.94Å; P502-T506 PolarHBondContact O-N 3.06Å; P502-T506 PolarHBondContact O-OG1 3Å; T506-L508 PolarHBondContact O-N 2.7Å; T506-I509 PolarHBondContact O-N 3.13Å; T506-I510 HydrophobicContact CG2-CD1 3.82Å; T506-I510 HydrophobicContact CG2-CG1 4.48Å; T506-I510 WeakPolarHBondContact O-CG1 3.2Å; T506-I510 PolarHBondContact O-N 2.84Å
507	G	90.9	Very high	91.2	Very high	33 Å²	33	49 Å²	49	34%	0.34	26%	0.263	S	S	.	.	H	α-helix	trans	-58	-47.4	176.8	0	0	0	0	0	111.9	L503 S504 I509 I510 W511	L503-G507 WeakPolarHBondContact O-CA 3.41Å; L503-G507 PolarHBondContact O-N 3.09Å; S504-G507 PolarHBondContact O-N 3.35Å; G507-I509 PolarHBondContact O-N 3.49Å; G507-I510 PolarHBondContact O-N 2.86Å; G507-W511 WeakPolarHBondContact O-CB 3.12Å; G507-W511 PolarHBondContact O-N 3.15Å
508	L	87.5	Confident	90.7	Very high	21 Å²	21	55.8 Å²	55.8	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-39.6	179.1	-73.2	168.5	0	0	0	113	V280 A283 M456 S504 G505 T506 W511 W512	V280-L508 HydrophobicContact CG2-CD2 4.24Å; A283-L508 HydrophobicContact CB-CD1 3.72Å; A283-L508 HydrophobicContact CB-CD2 3.76Å; A283-L508 HydrophobicContact CB-CG 4.37Å; M456-L508 HydrophobicContact CG-CB 4.17Å; M456-L508 HydrophobicContact CG-CD1 4.24Å; M456-L508 HydrophobicContact SD-CD1 4.4Å; S504-L508 VanDerWaalsContact O-CB 3.31Å; S504-L508 WeakPolarHBondContact O-CB 3.38Å; S504-L508 WeakPolarHBondContact O-CD1 3.44Å; S504-L508 WeakPolarHBondContact O-CG 3.5Å; S504-L508 PolarHBondContact O-N 3.19Å; G505-L508 PolarHBondContact O-N 2.65Å; T506-L508 PolarHBondContact O-N 2.7Å; L508-W511 PolarHBondContact O-N 3.29Å; L508-W512 VanDerWaalsContact O-CB 3.25Å; L508-W512 WeakPolarHBondContact O-CB 3.44Å; L508-W512 PolarHBondContact O-N 2.74Å
509	I	89.5	Confident	89.9	Confident	35 Å²	35	57.9 Å²	57.9	18%	0.179	31%	0.307	C	S	.	.	H	α-helix	trans	-66.5	-48.3	177.2	-70.4	166.8	0	0	0	110.8	M456 L457 L460 G505 T506 G507 W511 W512 A513	M456-I509 HydrophobicContact CB-CD1 3.85Å; M456-I509 HydrophobicContact CB-CG1 3.78Å; M456-I509 HydrophobicContact CG-CG1 4.47Å; L457-I509 HydrophobicContact CD2-CD1 3.47Å; L457-I509 VanDerWaalsContact CD2-CD1 3.47Å; L457-I509 HydrophobicContact CG-CD1 3.93Å; L460-I509 HydrophobicContact CD1-CD1 3.82Å; G505-I509 WeakPolarHBondContact O-CG1 3.39Å; G505-I509 PolarHBondContact O-N 2.77Å; G505-I509 VanDerWaalsContact O-N 3.11Å; T506-I509 PolarHBondContact O-N 3.13Å; G507-I509 PolarHBondContact O-N 3.49Å; I509-W511 VanDerWaalsContact C-N 3.25Å; I509-W511 PolarHBondContact O-N 3.16Å; I509-W512 PolarHBondContact O-N 3.07Å; I509-A513 WeakPolarHBondContact O-CB 3.37Å; I509-A513 PolarHBondContact O-N 3Å
510	I	90.4	Very high	89.3	Confident	111 Å²	111	57.1 Å²	57.1	57%	0.569	30%	0.302	S	S	*	.	H	α-helix	trans	-60.3	-43	177.1	-68	170.7	0	0	0	109.7	T506 G507 A513 Y514	T506-I510 HydrophobicContact CG2-CD1 3.82Å; T506-I510 HydrophobicContact CG2-CG1 4.48Å; T506-I510 WeakPolarHBondContact O-CG1 3.2Å; T506-I510 PolarHBondContact O-N 2.84Å; G507-I510 PolarHBondContact O-N 2.86Å; I510-A513 PolarHBondContact O-N 3.33Å; I510-Y514 WeakPolarHBondContact O-CB 3.27Å; I510-Y514 PolarHBondContact O-N 3.16Å
511	W	85.8	Confident	88.8	Confident	98 Å²	98	59.9 Å²	59.9	37%	0.371	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-51.9	179.5	-159.6	-60.2	0	0	0	111.7	P276 V280 G507 L508 I509 A513 Y514 D515	P276-W511 HydrophobicContact CB-CH2 3.93Å; P276-W511 HydrophobicContact CB-CZ2 3.06Å; P276-W511 HydrophobicContact CG-CH2 3.5Å; P276-W511 HydrophobicContact CG-CZ2 2.99Å; V280-W511 HydrophobicContact CG2-CB 3.99Å; V280-W511 HydrophobicContact CG2-CD2 4.42Å; V280-W511 HydrophobicContact CG2-CG 3.57Å; G507-W511 WeakPolarHBondContact O-CB 3.12Å; G507-W511 PolarHBondContact O-N 3.15Å; L508-W511 PolarHBondContact O-N 3.29Å; I509-W511 VanDerWaalsContact C-N 3.25Å; I509-W511 PolarHBondContact O-N 3.16Å; W511-A513 VanDerWaalsContact C-N 3.33Å; W511-A513 PolarHBondContact O-N 3.06Å; W511-Y514 PolarHBondContact O-N 3.02Å; W511-D515 WeakPolarHBondContact O-CB 3.48Å; W511-D515 PolarHBondContact O-N 3.06Å
512	W	84.8	Confident	88.4	Confident	23 Å²	23	65.8 Å²	65.8	9%	0.087	35%	0.348	C	S	.	.	H	α-helix	trans	-57.8	-46.3	178.5	164.6	72.3	0	0	0	111.5	F453 L508 I509 Y514 D515 L516 M531 T534 W538	F453-W512 HydrophobicContact CD1-CB 4.01Å; F453-W512 AromaticContact CD1-CD1 3.63Å; F453-W512 AromaticContact CD1-CD2 3.95Å; F453-W512 HydrophobicContact CD1-CD2 3.95Å; F453-W512 AromaticContact CD1-CG 3.56Å; F453-W512 HydrophobicContact CD1-CG 3.56Å; F453-W512 AromaticContact CD1-NE1 3.97Å; F453-W512 AromaticContact CD2-CD1 3.8Å; F453-W512 HydrophobicContact CD2-CD2 4.37Å; F453-W512 AromaticContact CD2-CE2 3.77Å; F453-W512 HydrophobicContact CD2-CG 4.36Å; F453-W512 HydrophobicContact CD2-CZ2 4.3Å; F453-W512 AromaticContact CD2-NE1 3.36Å; F453-W512 HydrophobicContact CE1-CB 3.79Å; F453-W512 AromaticContact CE1-CD1 3.22Å; F453-W512 HydrophobicContact CE1-CD2 4.3Å; F453-W512 AromaticContact CE1-CG 3.47Å; F453-W512 HydrophobicContact CE1-CG 3.47Å; F453-W512 VanDerWaalsContact CE1-CG 3.47Å; F453-W512 AromaticContact CE1-NE1 3.86Å; F453-W512 AromaticContact CE2-CD1 3.42Å; F453-W512 VanDerWaalsContact CE2-CD1 3.42Å; F453-W512 HydrophobicContact CE2-CG 4.29Å; F453-W512 AromaticContact CE2-NE1 3.24Å; F453-W512 AromaticContact CG-CD1 3.93Å; F453-W512 HydrophobicContact CG-CD2 4.02Å; F453-W512 AromaticContact CG-CE2 3.85Å; F453-W512 HydrophobicContact CG-CG 4.05Å; F453-W512 HydrophobicContact CG-CZ2 4.44Å; F453-W512 AromaticContact CG-NE1 3.76Å; F453-W512 HydrophobicContact CZ-CB 4.5Å; F453-W512 AromaticContact CZ-CD1 3.11Å; F453-W512 AromaticContact CZ-CG 3.88Å; F453-W512 HydrophobicContact CZ-CG 3.88Å; F453-W512 AromaticContact CZ-NE1 3.52Å; L508-W512 VanDerWaalsContact O-CB 3.25Å; L508-W512 WeakPolarHBondContact O-CB 3.44Å; L508-W512 PolarHBondContact O-N 2.74Å; I509-W512 PolarHBondContact O-N 3.07Å; W512-Y514 VanDerWaalsContact C-N 3.34Å; W512-Y514 PolarHBondContact O-N 3.33Å; W512-D515 PolarHBondContact O-N 3.03Å; W512-L516 HydrophobicContact CH2-CD2 4.38Å; W512-L516 HydrophobicContact CZ2-CD2 3.68Å; W512-L516 WeakPolarHBondContact O-CB 3.32Å; W512-L516 PolarHBondContact O-N 3.01Å; W512-M531 HydrophobicContact CH2-CG 4.27Å; W512-T534 HydrophobicContact CH2-CG2 3.64Å; W512-T534 HydrophobicContact CZ2-CG2 3.93Å; W512-W538 HydrophobicContact CH2-CH2 4.04Å; W512-W538 AromaticContact CZ3-CH2 3.83Å; W512-W538 HydrophobicContact CZ3-CH2 3.83Å; W512-W538 HydrophobicContact CZ3-CZ3 4.17Å
513	A	87.1	Confident	88	Confident	25 Å²	25	68.3 Å²	68.3	21%	0.207	35%	0.354	C	S	.	.	H	α-helix	trans	-60.5	-44.2	177.8	0	0	0	0	0	111.6	I509 I510 W511 L516 I517 M531	I509-A513 WeakPolarHBondContact O-CB 3.37Å; I509-A513 PolarHBondContact O-N 3Å; I510-A513 PolarHBondContact O-N 3.33Å; W511-A513 VanDerWaalsContact C-N 3.33Å; W511-A513 PolarHBondContact O-N 3.06Å; A513-L516 PolarHBondContact O-N 3.37Å; A513-I517 WeakPolarHBondContact O-CB 3.49Å; A513-I517 WeakPolarHBondContact O-CD1 3.5Å; A513-I517 VanDerWaalsContact O-CG1 3.22Å; A513-I517 WeakPolarHBondContact O-CG1 3.29Å; A513-I517 PolarHBondContact O-N 3.44Å; A513-M531 HydrophobicContact CB-SD 4.19Å
514	Y	88	Confident	87.8	Confident	128 Å²	128	69 Å²	69	50%	0.502	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-47.1	175.8	173.6	-96.6	0	0	0	112.2	I510 W511 W512 L516 I517 K518	I510-Y514 WeakPolarHBondContact O-CB 3.27Å; I510-Y514 PolarHBondContact O-N 3.16Å; W511-Y514 PolarHBondContact O-N 3.02Å; W512-Y514 VanDerWaalsContact C-N 3.34Å; W512-Y514 PolarHBondContact O-N 3.33Å; Y514-L516 PolarHBondContact O-N 2.91Å; Y514-I517 PolarHBondContact O-N 2.93Å; Y514-K518 HydrophobicContact CE1-CD 3.92Å; Y514-K518 VanDerWaalsContact O-CB 3.26Å; Y514-K518 WeakPolarHBondContact O-CB 3.22Å; Y514-K518 PolarHBondContact O-N 3.27Å
515	D	82.5	Confident	87.8	Confident	70 Å²	70	71 Å²	71	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-63.5	-41.4	-179.4	-168.5	60	0	0	0	111.6	W511 W512 K518 S519	W511-D515 WeakPolarHBondContact O-CB 3.48Å; W511-D515 PolarHBondContact O-N 3.06Å; W512-D515 PolarHBondContact O-N 3.03Å; D515-K518 PolarHBondContact O-N 2.81Å; D515-S519 WeakPolarHBondContact O-CB 3.25Å; D515-S519 PolarHBondContact O-N 3.33Å; D515-S519 PolarHBondContact O-OG 3.43Å
516	L	82	Confident	87.7	Confident	33 Å²	33	77 Å²	77	17%	0.173	39%	0.386	C	S	.	.	H	α-helix	trans	-68.6	-41.4	179.7	-164.6	65.3	0	0	0	112.3	W512 A513 Y514 K518 S519 N520 M531	W512-L516 HydrophobicContact CH2-CD2 4.38Å; W512-L516 HydrophobicContact CZ2-CD2 3.68Å; W512-L516 WeakPolarHBondContact O-CB 3.32Å; W512-L516 PolarHBondContact O-N 3.01Å; A513-L516 PolarHBondContact O-N 3.37Å; Y514-L516 PolarHBondContact O-N 2.91Å; L516-K518 VanDerWaalsContact C-N 3.34Å; L516-S519 PolarHBondContact O-OG 3.38Å; L516-N520 WeakPolarHBondContact O-CB 3.42Å; L516-N520 PolarHBondContact O-N 3.17Å; L516-M531 HydrophobicContact CD2-CB 3.44Å; L516-M531 VanDerWaalsContact CD2-CB 3.44Å; L516-M531 HydrophobicContact CD2-CG 3.74Å; L516-M531 HydrophobicContact CD2-SD 4.46Å; L516-M531 HydrophobicContact CG-CB 4.15Å
517	I	87.8	Confident	87.5	Confident	69 Å²	69	76.9 Å²	76.9	35%	0.354	39%	0.386	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.6	-71.3	167.3	0	0	0	110.9	A513 Y514 W523 M531	A513-I517 WeakPolarHBondContact O-CB 3.49Å; A513-I517 WeakPolarHBondContact O-CD1 3.5Å; A513-I517 VanDerWaalsContact O-CG1 3.22Å; A513-I517 WeakPolarHBondContact O-CG1 3.29Å; A513-I517 PolarHBondContact O-N 3.44Å; Y514-I517 PolarHBondContact O-N 2.93Å; I517-W523 HydrophobicContact CB-CG 4.45Å; I517-W523 HydrophobicContact CG1-CD2 3.97Å; I517-W523 HydrophobicContact CG1-CE3 4.45Å; I517-W523 HydrophobicContact CG1-CG 4.07Å; I517-M531 HydrophobicContact CD1-CE 3.71Å; I517-M531 HydrophobicContact CD1-SD 4.11Å; I517-M531 HydrophobicContact CG1-CE 3.7Å; I517-M531 HydrophobicContact CG1-SD 3.88Å
518	K	86.2	Confident	87.2	Confident	144 Å²	144	79 Å²	79	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-71.4	-40.8	-178.1	-176.3	179.3	-178.8	177.7	0	112.4	Y514 D515 L516	Y514-K518 HydrophobicContact CE1-CD 3.92Å; Y514-K518 VanDerWaalsContact O-CB 3.26Å; Y514-K518 WeakPolarHBondContact O-CB 3.22Å; Y514-K518 PolarHBondContact O-N 3.27Å; D515-K518 PolarHBondContact O-N 2.81Å; L516-K518 VanDerWaalsContact C-N 3.34Å
519	S	83	Confident	87	Confident	77 Å²	77	82.6 Å²	82.6	54%	0.538	41%	0.408	S	S	.	.	H	α-helix	trans	-79.7	-26.8	-176.8	59.1	0	0	0	0	113.1	D515 L516	D515-S519 WeakPolarHBondContact O-CB 3.25Å; D515-S519 PolarHBondContact O-N 3.33Å; D515-S519 PolarHBondContact O-OG 3.43Å; L516-S519 PolarHBondContact O-OG 3.38Å
520	N	85.1	Confident	86.9	Confident	41 Å²	41	80.9 Å²	80.9	22%	0.219	40%	0.4	C	S	.	.			trans	-121.6	98.5	-179.5	-172.5	-11.4	0	0	0	111.5	L516 K522 W523	L516-N520 WeakPolarHBondContact O-CB 3.42Å; L516-N520 PolarHBondContact O-N 3.17Å; N520-K522 PolarHBondContact O-N 3.06Å; N520-K522 WeakPolarHBondContact OD1-CA 3.45Å; N520-K522 PolarHBondContact OD1-N 3.24Å; N520-W523 HydrophobicContact CB-CB 4.42Å; N520-W523 VanDerWaalsContact O-CB 3.24Å; N520-W523 WeakPolarHBondContact O-CB 3.29Å; N520-W523 PolarHBondContact O-N 3.1Å; N520-W523 PolarHBondContact OD1-N 2.86Å
521	P	85.8	Confident	86.8	Confident	106 Å²	106	76.2 Å²	76.2	69%	0.688	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.1	177.1	-24.9	34	0	0	0	114.6	Y524	P521-Y524 WeakPolarHBondContact O-CE1 3.47Å
522	K	88.9	Confident	87.2	Confident	123 Å²	123	73.5 Å²	73.5	54%	0.535	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	21.1	178.1	-65.4	177.1	173.8	-174.2	0	112.1	N520 Y524 Q525	N520-K522 PolarHBondContact O-N 3.06Å; N520-K522 WeakPolarHBondContact OD1-CA 3.45Å; N520-K522 PolarHBondContact OD1-N 3.24Å; K522-Y524 PolarHBondContact O-N 2.99Å; K522-Q525 HydrophobicContact CB-CG 4.2Å; K522-Q525 PolarHBondContact O-N 2.82Å
523	W	88.9	Confident	87.6	Confident	82 Å²	82	73.1 Å²	73.1	31%	0.311	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-26.8	179.9	65	-97.1	0	0	0	113.8	I517 N520 S530 M531 T532	I517-W523 HydrophobicContact CB-CG 4.45Å; I517-W523 HydrophobicContact CG1-CD2 3.97Å; I517-W523 HydrophobicContact CG1-CE3 4.45Å; I517-W523 HydrophobicContact CG1-CG 4.07Å; N520-W523 HydrophobicContact CB-CB 4.42Å; N520-W523 VanDerWaalsContact O-CB 3.24Å; N520-W523 WeakPolarHBondContact O-CB 3.29Å; N520-W523 PolarHBondContact O-N 3.1Å; N520-W523 PolarHBondContact OD1-N 2.86Å; W523-S530 WeakPolarHBondContact O-CB 3.45Å; W523-M531 HydrophobicContact CB-CB 4.25Å; W523-M531 HydrophobicContact CD2-CE 4.13Å; W523-M531 HydrophobicContact CE3-CB 4.26Å; W523-M531 HydrophobicContact CE3-CE 3.33Å; W523-M531 HydrophobicContact CH2-CE 4.23Å; W523-M531 HydrophobicContact CZ3-CE 3.39Å; W523-M531 PolarHBondContact O-N 2.92Å; W523-T532 PolarHBondContact O-N 3Å; W523-T532 PolarHBondContact O-OG1 3.37Å
524	Y	91.2	Very high	87.9	Confident	130 Å²	130	72.4 Å²	72.4	51%	0.51	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.2	-178.4	63.2	-92.7	0	0	0	114.2	P521 K522 T532	P521-Y524 WeakPolarHBondContact O-CE1 3.47Å; K522-Y524 PolarHBondContact O-N 2.99Å; Y524-T532 WeakPolarHBondContact CA-OG1 3.25Å; Y524-T532 PolarHBondContact O-OG1 3.25Å
525	Q	92.9	Very high	88.2	Confident	74 Å²	74	70 Å²	70	35%	0.346	36%	0.358	S	S	.	.	S	Bend	trans	-76	148.1	-179.5	-62.4	-173.2	-14.7	0	0	110.4	K522 T527 S530	K522-Q525 HydrophobicContact CB-CG 4.2Å; K522-Q525 PolarHBondContact O-N 2.82Å; Q525-T527 HydrophobicContact CB-CG2 4.49Å; Q525-T527 PolarHBondContact O-N 3.44Å; Q525-S530 WeakPolarHBondContact O-CB 3.36Å; Q525-S530 PolarHBondContact O-OG 3.02Å
526	L	90.4	Very high	88.8	Confident	126 Å²	126	70.3 Å²	70.3	66%	0.66	36%	0.36	S	S	*	.			trans	-77.8	90	176.3	-75.9	164.6	0	0	0	110.3	T532 L536	L526-T532 HydrophobicContact CD2-CG2 3.83Å; L526-T532 HydrophobicContact CG-CG2 4.31Å; L526-L536 HydrophobicContact CD2-CD2 3.88Å
527	T	89.8	Confident	89.4	Confident	65 Å²	65	70.5 Å²	70.5	40%	0.399	36%	0.36	S	S	.	.			trans	-128.1	158.9	170.5	68.2	0	0	0	0	109.3	Q525 D529 S530 T533	Q525-T527 HydrophobicContact CB-CG2 4.49Å; Q525-T527 PolarHBondContact O-N 3.44Å; T527-D529 PolarHBondContact O-N 2.74Å; T527-D529 VanDerWaalsContact O-N 3.07Å; T527-S530 PolarHBondContact N-OG 3.27Å; T527-S530 PolarHBondContact O-N 3.32Å; T527-S530 VanDerWaalsContact O-N 3.12Å; T527-S530 PolarHBondContact O-OG 2.8Å; T527-S530 WeakPolarHBondContact OG1-CB 3.31Å; T527-T533 VanDerWaalsContact O-CB 3.24Å; T527-T533 WeakPolarHBondContact O-CB 3.43Å; T527-T533 PolarHBondContact O-OG1 3.39Å
528	L	84.8	Confident	89.8	Confident	79 Å²	79	67.9 Å²	67.9	41%	0.414	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.6	-177	-72.7	175.5	0	0	0	113.6	N442 N446	N442-L528 HydrophobicContact CB-CD1 3.9Å; N446-L528 HydrophobicContact CB-CB 4.14Å; N446-L528 HydrophobicContact CB-CD2 4.31Å; N446-L528 WeakPolarHBondContact CB-O 3.5Å; N446-L528 PolarHBondContact ND2-O 3.43Å
529	D	82.1	Confident	90.3	Very high	95 Å²	95	66.8 Å²	66.8	51%	0.508	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	9.4	-176.6	-52.8	-38.4	0	0	0	113.3	T527	T527-D529 PolarHBondContact O-N 2.74Å; T527-D529 VanDerWaalsContact O-N 3.07Å
530	S	88.2	Confident	91	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-88.8	154.8	-176.3	81.2	0	0	0	0	113.4	W523 Q525 T527 T532 T533 T534	W523-S530 WeakPolarHBondContact O-CB 3.45Å; Q525-S530 WeakPolarHBondContact O-CB 3.36Å; Q525-S530 PolarHBondContact O-OG 3.02Å; T527-S530 PolarHBondContact N-OG 3.27Å; T527-S530 PolarHBondContact O-N 3.32Å; T527-S530 VanDerWaalsContact O-N 3.12Å; T527-S530 PolarHBondContact O-OG 2.8Å; T527-S530 WeakPolarHBondContact OG1-CB 3.31Å; S530-T532 VanDerWaalsContact C-N 3.28Å; S530-T532 PolarHBondContact O-N 3.23Å; S530-T533 PolarHBondContact O-N 3.23Å; S530-T533 PolarHBondContact OG-N 3.47Å; S530-T533 PolarHBondContact OG-OG1 3.47Å; S530-T533 VanDerWaalsContact OG-OG1 3.13Å; S530-T534 PolarHBondContact O-N 3.14Å; S530-T534 PolarHBondContact O-OG1 3.44Å
531	M	89	Confident	91.6	Very high	13 Å²	13	66.3 Å²	66.3	6%	0.064	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-39.1	174.2	-166.3	174.3	73.4	0	0	111.5	W512 A513 L516 I517 W523 T533 T534 L535	W512-M531 HydrophobicContact CH2-CG 4.27Å; A513-M531 HydrophobicContact CB-SD 4.19Å; L516-M531 HydrophobicContact CD2-CB 3.44Å; L516-M531 VanDerWaalsContact CD2-CB 3.44Å; L516-M531 HydrophobicContact CD2-CG 3.74Å; L516-M531 HydrophobicContact CD2-SD 4.46Å; L516-M531 HydrophobicContact CG-CB 4.15Å; I517-M531 HydrophobicContact CD1-CE 3.71Å; I517-M531 HydrophobicContact CD1-SD 4.11Å; I517-M531 HydrophobicContact CG1-CE 3.7Å; I517-M531 HydrophobicContact CG1-SD 3.88Å; W523-M531 HydrophobicContact CB-CB 4.25Å; W523-M531 HydrophobicContact CD2-CE 4.13Å; W523-M531 HydrophobicContact CE3-CB 4.26Å; W523-M531 HydrophobicContact CE3-CE 3.33Å; W523-M531 HydrophobicContact CH2-CE 4.23Å; W523-M531 HydrophobicContact CZ3-CE 3.39Å; W523-M531 PolarHBondContact O-N 2.92Å; M531-T533 VanDerWaalsContact C-N 3.29Å; M531-T533 PolarHBondContact O-N 2.98Å; M531-T534 PolarHBondContact O-N 2.91Å; M531-L535 HydrophobicContact CE-CD1 4.05Å; M531-L535 HydrophobicContact CG-CD1 4Å; M531-L535 HydrophobicContact CG-CG 4.22Å; M531-L535 WeakPolarHBondContact O-CG 3.49Å; M531-L535 PolarHBondContact O-N 2.91Å; M531-L535 HydrophobicContact SD-CD1 4.48Å
532	T	92.7	Very high	92.1	Very high	40 Å²	40	63.9 Å²	63.9	25%	0.245	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-42.5	178.9	-61.5	0	0	0	0	111.8	W523 Y524 L526 S530 L535 L536	W523-T532 PolarHBondContact O-N 3Å; W523-T532 PolarHBondContact O-OG1 3.37Å; Y524-T532 WeakPolarHBondContact CA-OG1 3.25Å; Y524-T532 PolarHBondContact O-OG1 3.25Å; L526-T532 HydrophobicContact CD2-CG2 3.83Å; L526-T532 HydrophobicContact CG-CG2 4.31Å; S530-T532 VanDerWaalsContact C-N 3.28Å; S530-T532 PolarHBondContact O-N 3.23Å; T532-L535 PolarHBondContact O-N 2.9Å; T532-L536 WeakPolarHBondContact O-CB 3.3Å; T532-L536 PolarHBondContact O-N 3.04Å
533	T	92.8	Very high	92.5	Very high	16 Å²	16	62.4 Å²	62.4	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-45.7	178.4	-60.1	0	0	0	0	110.9	T527 S530 M531 L535 L536 E537	T527-T533 VanDerWaalsContact O-CB 3.24Å; T527-T533 WeakPolarHBondContact O-CB 3.43Å; T527-T533 PolarHBondContact O-OG1 3.39Å; S530-T533 PolarHBondContact O-N 3.23Å; S530-T533 PolarHBondContact OG-N 3.47Å; S530-T533 PolarHBondContact OG-OG1 3.47Å; S530-T533 VanDerWaalsContact OG-OG1 3.13Å; M531-T533 VanDerWaalsContact C-N 3.29Å; M531-T533 PolarHBondContact O-N 2.98Å; T533-L535 PolarHBondContact O-N 3.35Å; T533-L536 PolarHBondContact O-N 3.29Å; T533-E537 WeakPolarHBondContact CG2-OE1 3.42Å; T533-E537 WeakPolarHBondContact O-CG 3.42Å; T533-E537 PolarHBondContact O-N 2.88Å
534	T	93.4	Very high	92.9	Very high	9 Å²	9	63.2 Å²	63.2	6%	0.055	32%	0.318	C	S	.	.	H	α-helix	trans	-57.1	-48.1	174.5	-56	0	0	0	0	112.6	V450 W512 S530 M531 L536 E537 W538	V450-T534 HydrophobicContact CB-CG2 4.37Å; V450-T534 HydrophobicContact CG1-CG2 4.25Å; V450-T534 HydrophobicContact CG2-CG2 4.17Å; W512-T534 HydrophobicContact CH2-CG2 3.64Å; W512-T534 HydrophobicContact CZ2-CG2 3.93Å; S530-T534 PolarHBondContact O-N 3.14Å; S530-T534 PolarHBondContact O-OG1 3.44Å; M531-T534 PolarHBondContact O-N 2.91Å; T534-L536 VanDerWaalsContact C-N 3.32Å; T534-L536 PolarHBondContact O-N 3.36Å; T534-E537 PolarHBondContact O-N 3.43Å; T534-W538 HydrophobicContact CG2-CD2 4.22Å; T534-W538 HydrophobicContact CG2-CH2 4.3Å; T534-W538 HydrophobicContact CG2-CZ2 3.68Å; T534-W538 VanDerWaalsContact O-CG 3.3Å; T534-W538 PolarHBondContact O-N 3.06Å
535	L	94	Very high	93.2	Very high	77 Å²	77	58.8 Å²	58.8	40%	0.403	30%	0.303	S	S	.	.	H	α-helix	trans	-65.6	-36.6	179.2	-68.2	175.3	0	0	0	112	M531 T532 T533 W538 F539	M531-L535 HydrophobicContact CE-CD1 4.05Å; M531-L535 HydrophobicContact CG-CD1 4Å; M531-L535 HydrophobicContact CG-CG 4.22Å; M531-L535 WeakPolarHBondContact O-CG 3.49Å; M531-L535 PolarHBondContact O-N 2.91Å; M531-L535 HydrophobicContact SD-CD1 4.48Å; T532-L535 PolarHBondContact O-N 2.9Å; T533-L535 PolarHBondContact O-N 3.35Å; L535-W538 HydrophobicContact CD2-CE3 4.2Å; L535-W538 HydrophobicContact CD2-CZ3 4.39Å; L535-F539 WeakPolarHBondContact O-CB 3.31Å; L535-F539 PolarHBondContact O-N 3.37Å
536	L	95.5	Very high	93.4	Very high	78 Å²	78	58.8 Å²	58.8	41%	0.408	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-46.8	177	179.8	63.5	0	0	0	111.2	L526 T532 T533 T534 W538 F539 I540	L526-L536 HydrophobicContact CD2-CD2 3.88Å; T532-L536 WeakPolarHBondContact O-CB 3.3Å; T532-L536 PolarHBondContact O-N 3.04Å; T533-L536 PolarHBondContact O-N 3.29Å; T534-L536 VanDerWaalsContact C-N 3.32Å; T534-L536 PolarHBondContact O-N 3.36Å; L536-W538 PolarHBondContact O-N 2.87Å; L536-F539 PolarHBondContact O-N 2.68Å; L536-I540 HydrophobicContact CD1-CD1 4.25Å; L536-I540 HydrophobicContact CD1-CG1 4.42Å; L536-I540 HydrophobicContact CG-CD1 4.02Å; L536-I540 VanDerWaalsContact O-CG1 3.27Å; L536-I540 WeakPolarHBondContact O-CG1 3.33Å; L536-I540 PolarHBondContact O-N 2.94Å
537	E	95.8	Very high	93.7	Very high	36 Å²	36	56 Å²	56	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-44.1	177.3	-73.1	-176.3	-131	0	0	111.5	N446 Q447 V450 W451 T533 T534 I540 V541	N446-E537 PolarHBondContact ND2-OE1 2.86Å; N446-E537 VanDerWaalsContact ND2-OE1 3.14Å; N446-E537 PolarHBondContact OD1-OE1 3.27Å; Q447-E537 PolarHBondContact NE2-OE2 2.96Å; V450-E537 HydrophobicContact CG1-CB 3.9Å; W451-E537 HydrophobicContact CH2-CB 4.49Å; W451-E537 HydrophobicContact CZ2-CB 4.38Å; T533-E537 WeakPolarHBondContact CG2-OE1 3.42Å; T533-E537 WeakPolarHBondContact O-CG 3.42Å; T533-E537 PolarHBondContact O-N 2.88Å; T534-E537 PolarHBondContact O-N 3.43Å; E537-I540 PolarHBondContact O-N 2.92Å; E537-V541 PolarHBondContact O-N 3.13Å
538	W	96.6	Very high	93.9	Very high	14 Å²	14	56.5 Å²	56.5	5%	0.053	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-46.7	173.6	-67.6	0.7	0	0	0	111.8	W155 V450 F453 A454 L457 W512 T534 L535 L536 I540 V541 F542	W155-W538 HydrophobicContact CH2-CB 3.98Å; W155-W538 HydrophobicContact CH2-CD2 4.45Å; W155-W538 AromaticContact CH2-CG 3.93Å; W155-W538 HydrophobicContact CH2-CG 3.93Å; W155-W538 HydrophobicContact CZ3-CB 4.47Å; V450-W538 WeakPolarHBondContact O-CZ2 3.27Å; V450-W538 PolarHBondContact O-NE1 3.49Å; F453-W538 HydrophobicContact CB-CH2 4.01Å; F453-W538 HydrophobicContact CB-CZ2 3.76Å; A454-W538 HydrophobicContact CB-CZ2 4.12Å; L457-W538 HydrophobicContact CD1-CD2 4.19Å; L457-W538 HydrophobicContact CD1-CE3 3.65Å; L457-W538 HydrophobicContact CD1-CH2 4.28Å; L457-W538 HydrophobicContact CD1-CZ3 3.7Å; W512-W538 HydrophobicContact CH2-CH2 4.04Å; W512-W538 AromaticContact CZ3-CH2 3.83Å; W512-W538 HydrophobicContact CZ3-CH2 3.83Å; W512-W538 HydrophobicContact CZ3-CZ3 4.17Å; T534-W538 HydrophobicContact CG2-CD2 4.22Å; T534-W538 HydrophobicContact CG2-CH2 4.3Å; T534-W538 HydrophobicContact CG2-CZ2 3.68Å; T534-W538 VanDerWaalsContact O-CG 3.3Å; T534-W538 PolarHBondContact O-N 3.06Å; L535-W538 HydrophobicContact CD2-CE3 4.2Å; L535-W538 HydrophobicContact CD2-CZ3 4.39Å; L536-W538 PolarHBondContact O-N 2.87Å; W538-I540 VanDerWaalsContact C-N 3.32Å; W538-I540 PolarHBondContact O-N 3.36Å; W538-V541 PolarHBondContact O-N 2.76Å; W538-F542 HydrophobicContact CB-CD2 4.34Å; W538-F542 HydrophobicContact CB-CE2 4.22Å; W538-F542 WeakPolarHBondContact O-CD2 3.36Å; W538-F542 PolarHBondContact O-N 3.08Å
539	F	96.5	Very high	94.4	Very high	122 Å²	122	53.2 Å²	53.2	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-60.2	-41	-179.6	178.7	-101.6	0	0	0	112.2	L535 L536 V541 F542 L543	L535-F539 WeakPolarHBondContact O-CB 3.31Å; L535-F539 PolarHBondContact O-N 3.37Å; L536-F539 PolarHBondContact O-N 2.68Å; F539-V541 PolarHBondContact O-N 3.12Å; F539-F542 PolarHBondContact O-N 2.96Å; F539-L543 HydrophobicContact CE1-CD2 4.37Å; F539-L543 WeakPolarHBondContact O-CB 3.27Å; F539-L543 PolarHBondContact O-N 2.87Å
540	I	97.3	Very high	95	Very high	82 Å²	82	51.3 Å²	51.3	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-59.1	-48.2	176.1	-70.8	164.3	0	0	0	110.4	L536 E537 W538 L543 I544	L536-I540 HydrophobicContact CD1-CD1 4.25Å; L536-I540 HydrophobicContact CD1-CG1 4.42Å; L536-I540 HydrophobicContact CG-CD1 4.02Å; L536-I540 VanDerWaalsContact O-CG1 3.27Å; L536-I540 WeakPolarHBondContact O-CG1 3.33Å; L536-I540 PolarHBondContact O-N 2.94Å; E537-I540 PolarHBondContact O-N 2.92Å; W538-I540 VanDerWaalsContact C-N 3.32Å; W538-I540 PolarHBondContact O-N 3.36Å; I540-L543 PolarHBondContact O-N 2.96Å; I540-I544 HydrophobicContact CG2-CD1 3.82Å; I540-I544 VanDerWaalsContact O-CG1 3.28Å; I540-I544 WeakPolarHBondContact O-CG1 3.31Å; I540-I544 PolarHBondContact O-N 3.4Å
541	V	97	Very high	95.4	Very high	26 Å²	26	55 Å²	55	16%	0.158	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-42.5	178.9	174.9	0	0	0	0	111.4	W155 A158 W451 E537 W538 F539 L543 I544 L545	W155-V541 HydrophobicContact CE3-CG1 4.06Å; W155-V541 HydrophobicContact CZ3-CB 4.27Å; W155-V541 HydrophobicContact CZ3-CG1 4.12Å; A158-V541 HydrophobicContact CB-CG1 3.9Å; W451-V541 HydrophobicContact CH2-CG2 3.64Å; W451-V541 HydrophobicContact CZ3-CG2 4.27Å; E537-V541 PolarHBondContact O-N 3.13Å; W538-V541 PolarHBondContact O-N 2.76Å; F539-V541 PolarHBondContact O-N 3.12Å; V541-L543 PolarHBondContact O-N 3.24Å; V541-I544 PolarHBondContact O-N 3.38Å; V541-L545 HydrophobicContact CG1-CD1 3.7Å; V541-L545 HydrophobicContact CG1-CG 4.22Å; V541-L545 WeakPolarHBondContact O-CB 3.47Å; V541-L545 VanDerWaalsContact O-CG 3.29Å; V541-L545 WeakPolarHBondContact O-CG 3.12Å; V541-L545 PolarHBondContact O-N 2.7Å
542	F	96	Very high	95.5	Very high	54 Å²	54	54.7 Å²	54.7	24%	0.237	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-49	174.1	-80.5	-56.8	0	0	0	111.9	W151 W155 L457 W538 F539 I544 L545 I546	W151-F542 AromaticContact CZ3-CD1 3.87Å; W151-F542 HydrophobicContact CZ3-CD1 3.87Å; W151-F542 AromaticContact CZ3-CE1 3.95Å; W151-F542 HydrophobicContact CZ3-CE1 3.95Å; W155-F542 HydrophobicContact CD2-CD1 4.43Å; W155-F542 AromaticContact CD2-CE1 3.71Å; W155-F542 HydrophobicContact CD2-CE1 3.71Å; W155-F542 AromaticContact CD2-CZ 3.9Å; W155-F542 HydrophobicContact CD2-CZ 3.9Å; W155-F542 AromaticContact CE3-CD1 3.69Å; W155-F542 HydrophobicContact CE3-CD1 3.69Å; W155-F542 HydrophobicContact CE3-CD2 4.38Å; W155-F542 AromaticContact CE3-CE1 3.36Å; W155-F542 HydrophobicContact CE3-CE1 3.36Å; W155-F542 HydrophobicContact CE3-CE2 4.11Å; W155-F542 HydrophobicContact CE3-CG 4.18Å; W155-F542 AromaticContact CE3-CZ 3.59Å; W155-F542 HydrophobicContact CE3-CZ 3.59Å; W155-F542 HydrophobicContact CG-CE1 4.36Å; W155-F542 HydrophobicContact CH2-CD2 4.24Å; W155-F542 HydrophobicContact CH2-CE1 4.22Å; W155-F542 AromaticContact CH2-CE2 3.57Å; W155-F542 HydrophobicContact CH2-CE2 3.57Å; W155-F542 AromaticContact CH2-CZ 3.55Å; W155-F542 HydrophobicContact CH2-CZ 3.55Å; W155-F542 HydrophobicContact CZ2-CE2 4.27Å; W155-F542 AromaticContact CZ2-CZ 3.85Å; W155-F542 HydrophobicContact CZ2-CZ 3.85Å; W155-F542 AromaticContact CZ3-CD1 3.91Å; W155-F542 HydrophobicContact CZ3-CD1 3.91Å; W155-F542 AromaticContact CZ3-CD2 3.75Å; W155-F542 HydrophobicContact CZ3-CD2 3.75Å; W155-F542 AromaticContact CZ3-CE1 3.64Å; W155-F542 HydrophobicContact CZ3-CE1 3.64Å; W155-F542 AromaticContact CZ3-CE2 3.47Å; W155-F542 HydrophobicContact CZ3-CE2 3.47Å; W155-F542 VanDerWaalsContact CZ3-CE2 3.47Å; W155-F542 AromaticContact CZ3-CG 3.95Å; W155-F542 HydrophobicContact CZ3-CG 3.95Å; W155-F542 AromaticContact CZ3-CZ 3.41Å; W155-F542 HydrophobicContact CZ3-CZ 3.41Å; W155-F542 VanDerWaalsContact CZ3-CZ 3.41Å; L457-F542 HydrophobicContact CD1-CE2 4.33Å; L457-F542 HydrophobicContact CD1-CZ 4.13Å; W538-F542 HydrophobicContact CB-CD2 4.34Å; W538-F542 HydrophobicContact CB-CE2 4.22Å; W538-F542 WeakPolarHBondContact O-CD2 3.36Å; W538-F542 PolarHBondContact O-N 3.08Å; F539-F542 PolarHBondContact O-N 2.96Å; F542-I544 PolarHBondContact O-N 3.21Å; F542-L545 PolarHBondContact O-N 3.38Å; F542-I546 WeakPolarHBondContact O-CB 3.42Å; F542-I546 VanDerWaalsContact O-CG1 3.25Å; F542-I546 WeakPolarHBondContact O-CG1 3.41Å; F542-I546 PolarHBondContact O-N 3.4Å
543	L	97.4	Very high	95.5	Very high	93 Å²	93	55.1 Å²	55.1	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-45.1	-178.6	-176.2	66.3	0	0	0	111.2	F539 I540 V541 T547	F539-L543 HydrophobicContact CE1-CD2 4.37Å; F539-L543 WeakPolarHBondContact O-CB 3.27Å; F539-L543 PolarHBondContact O-N 2.87Å; I540-L543 PolarHBondContact O-N 2.96Å; V541-L543 PolarHBondContact O-N 3.24Å; L543-T547 WeakPolarHBondContact O-CB 3.42Å; L543-T547 PolarHBondContact O-N 3.39Å; L543-T547 PolarHBondContact O-OG1 3.39Å
544	I	97.8	Very high	95.5	Very high	98 Å²	98	63.5 Å²	63.5	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-60.4	-52.6	177.8	-69	167	0	0	0	110.2	I540 V541 F542 I546 T547 V548	I540-I544 HydrophobicContact CG2-CD1 3.82Å; I540-I544 VanDerWaalsContact O-CG1 3.28Å; I540-I544 WeakPolarHBondContact O-CG1 3.31Å; I540-I544 PolarHBondContact O-N 3.4Å; V541-I544 PolarHBondContact O-N 3.38Å; F542-I544 PolarHBondContact O-N 3.21Å; I544-I546 PolarHBondContact O-N 2.83Å; I544-T547 PolarHBondContact O-N 3.27Å; I544-V548 HydrophobicContact CG2-CG2 4.38Å; I544-V548 WeakPolarHBondContact O-CB 3.48Å; I544-V548 VanDerWaalsContact O-CG2 3.26Å; I544-V548 WeakPolarHBondContact O-CG2 3.47Å; I544-V548 PolarHBondContact O-N 3.37Å
545	L	97.3	Very high	95.4	Very high	37 Å²	37	70.7 Å²	70.7	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-64.4	-43.7	-175.9	-69	173.5	0	0	0	112.5	W151 W155 A158 V541 F542 N549	W151-L545 HydrophobicContact CB-CB 4.19Å; W155-L545 HydrophobicContact CB-CD1 4.1Å; A158-L545 HydrophobicContact CB-CD1 4.36Å; V541-L545 HydrophobicContact CG1-CD1 3.7Å; V541-L545 HydrophobicContact CG1-CG 4.22Å; V541-L545 WeakPolarHBondContact O-CB 3.47Å; V541-L545 VanDerWaalsContact O-CG 3.29Å; V541-L545 WeakPolarHBondContact O-CG 3.12Å; V541-L545 PolarHBondContact O-N 2.7Å; F542-L545 PolarHBondContact O-N 3.38Å; L545-N549 VanDerWaalsContact O-CB 3.27Å; L545-N549 WeakPolarHBondContact O-CB 3.42Å; L545-N549 PolarHBondContact O-N 2.89Å
546	I	96.3	Very high	95.1	Very high	75 Å²	75	74.1 Å²	74.1	39%	0.385	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-43	178.2	-68.2	168.9	0	0	0	110.3	W151 F542 I544 N549 A550	W151-I546 HydrophobicContact CD2-CG1 3.83Å; W151-I546 HydrophobicContact CE3-CD1 4.41Å; W151-I546 HydrophobicContact CE3-CG1 3.89Å; W151-I546 HydrophobicContact CG-CG1 4.22Å; W151-I546 HydrophobicContact CH2-CD1 4.43Å; W151-I546 HydrophobicContact CZ3-CD1 4.32Å; W151-I546 HydrophobicContact CZ3-CG1 4.31Å; F542-I546 WeakPolarHBondContact O-CB 3.42Å; F542-I546 VanDerWaalsContact O-CG1 3.25Å; F542-I546 WeakPolarHBondContact O-CG1 3.41Å; F542-I546 PolarHBondContact O-N 3.4Å; I544-I546 PolarHBondContact O-N 2.83Å; I546-N549 PolarHBondContact O-N 2.85Å; I546-A550 VanDerWaalsContact O-CB 3.22Å; I546-A550 WeakPolarHBondContact O-CB 3.11Å; I546-A550 PolarHBondContact O-N 3.34Å
547	T	97.1	Very high	94.5	Very high	66 Å²	66	74.2 Å²	74.2	41%	0.405	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-46.8	180	-57.9	0	0	0	0	111.2	L543 I544 N549 A550 I551	L543-T547 WeakPolarHBondContact O-CB 3.42Å; L543-T547 PolarHBondContact O-N 3.39Å; L543-T547 PolarHBondContact O-OG1 3.39Å; I544-T547 PolarHBondContact O-N 3.27Å; T547-N549 VanDerWaalsContact C-N 3.32Å; T547-N549 PolarHBondContact O-N 3.48Å; T547-A550 PolarHBondContact O-N 3.3Å; T547-I551 HydrophobicContact CG2-CD1 3.91Å; T547-I551 HydrophobicContact CG2-CG1 4.49Å; T547-I551 VanDerWaalsContact O-CG1 3.27Å; T547-I551 WeakPolarHBondContact O-CG1 3.4Å; T547-I551 PolarHBondContact O-N 3.01Å
548	V	95.4	Very high	93.7	Very high	77 Å²	77	75.4 Å²	75.4	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-44.7	176.6	170.1	0	0	0	0	110.6	I544 I551 A552 F559	I544-V548 HydrophobicContact CG2-CG2 4.38Å; I544-V548 WeakPolarHBondContact O-CB 3.48Å; I544-V548 VanDerWaalsContact O-CG2 3.26Å; I544-V548 WeakPolarHBondContact O-CG2 3.47Å; I544-V548 PolarHBondContact O-N 3.37Å; V548-I551 PolarHBondContact O-N 3.02Å; V548-A552 WeakPolarHBondContact O-CB 3.21Å; V548-A552 PolarHBondContact O-N 3.3Å; V548-F559 HydrophobicContact CG1-CE1 4.45Å; V548-F559 HydrophobicContact CG1-CZ 4.21Å
549	N	95	Very high	92.7	Very high	9 Å²	9	77.4 Å²	77.4	5%	0.048	39%	0.388	C	S	.	.	H	α-helix	trans	-67.3	-39.1	178.6	-162.2	60.6	0	0	0	112.5	N147 K148 W151 L545 I546 T547 A552 V553 F559	N147-N549 PolarHBondContact O-ND2 2.97Å; N147-N549 PolarHBondContact O-OD1 3.09Å; K148-N549 PolarHBondContact O-ND2 2.71Å; K148-N549 VanDerWaalsContact O-ND2 3.1Å; W151-N549 HydrophobicContact CB-CB 3.9Å; L545-N549 VanDerWaalsContact O-CB 3.27Å; L545-N549 WeakPolarHBondContact O-CB 3.42Å; L545-N549 PolarHBondContact O-N 2.89Å; I546-N549 PolarHBondContact O-N 2.85Å; T547-N549 VanDerWaalsContact C-N 3.32Å; T547-N549 PolarHBondContact O-N 3.48Å; N549-A552 PolarHBondContact O-N 2.89Å; N549-V553 WeakPolarHBondContact O-CB 3.23Å; N549-V553 VanDerWaalsContact O-CG2 3.29Å; N549-V553 WeakPolarHBondContact O-CG2 3.2Å; N549-V553 PolarHBondContact O-N 3.19Å; N549-F559 WeakPolarHBondContact OD1-CE2 3.37Å
550	A	94.9	Very high	91.8	Very high	55 Å²	55	72.9 Å²	72.9	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-42.4	176.7	0	0	0	0	0	111.8	I546 T547 V553 W554	I546-A550 VanDerWaalsContact O-CB 3.22Å; I546-A550 WeakPolarHBondContact O-CB 3.11Å; I546-A550 PolarHBondContact O-N 3.34Å; T547-A550 PolarHBondContact O-N 3.3Å; A550-V553 PolarHBondContact O-N 2.82Å; A550-W554 WeakPolarHBondContact O-CB 3.48Å; A550-W554 PolarHBondContact O-N 3.15Å
551	I	95.2	Very high	90.2	Very high	79 Å²	79	75.8 Å²	75.8	41%	0.405	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-43.9	175	-68.1	168.2	0	0	0	110.6	T547 V548 W554 R555	T547-I551 HydrophobicContact CG2-CD1 3.91Å; T547-I551 HydrophobicContact CG2-CG1 4.49Å; T547-I551 VanDerWaalsContact O-CG1 3.27Å; T547-I551 WeakPolarHBondContact O-CG1 3.4Å; T547-I551 PolarHBondContact O-N 3.01Å; V548-I551 PolarHBondContact O-N 3.02Å; I551-W554 PolarHBondContact O-N 3.45Å; I551-R555 WeakPolarHBondContact O-CB 3.32Å; I551-R555 WeakPolarHBondContact O-CG 3.35Å; I551-R555 PolarHBondContact O-N 2.91Å
552	A	92	Very high	88.1	Confident	5 Å²	5	82.4 Å²	82.4	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-63.5	-45.3	178.8	0	0	0	0	0	112.1	V548 N549 R555 N556 I557 F559	V548-A552 WeakPolarHBondContact O-CB 3.21Å; V548-A552 PolarHBondContact O-N 3.3Å; N549-A552 PolarHBondContact O-N 2.89Å; A552-R555 CarbonylContact O-C 3.45Å; A552-R555 PolarHBondContact O-N 3.42Å; A552-N556 PolarHBondContact O-N 3.44Å; A552-I557 HydrophobicContact CB-CB 4.26Å; A552-I557 PolarHBondContact O-N 2.93Å; A552-F559 HydrophobicContact CB-CD2 4.26Å; A552-F559 HydrophobicContact CB-CE1 3.92Å; A552-F559 HydrophobicContact CB-CE2 3.32Å; A552-F559 HydrophobicContact CB-CZ 3.12Å
553	V	92.3	Very high	85.5	Confident	49 Å²	49	87.9 Å²	87.9	30%	0.297	43%	0.432	S	S	.	.	H	α-helix	trans	-62.3	-45	174.8	172.1	0	0	0	0	111	N147 N549 A550 R555 N556	N147-V553 HydrophobicContact CB-CG2 4.11Å; N549-V553 WeakPolarHBondContact O-CB 3.23Å; N549-V553 VanDerWaalsContact O-CG2 3.29Å; N549-V553 WeakPolarHBondContact O-CG2 3.2Å; N549-V553 PolarHBondContact O-N 3.19Å; A550-V553 PolarHBondContact O-N 2.82Å; V553-R555 VanDerWaalsContact C-N 3.3Å; V553-R555 PolarHBondContact O-N 3.45Å; V553-N556 PolarHBondContact O-N 3.09Å
554	W	92.4	Very high	83.2	Confident	193 Å²	193	87.6 Å²	87.6	73%	0.731	43%	0.427	S	S	*	.	H	α-helix	trans	-62.3	-37.7	179.4	176.5	59.2	0	0	0	112.5	A550 I551 N556	A550-W554 WeakPolarHBondContact O-CB 3.48Å; A550-W554 PolarHBondContact O-N 3.15Å; I551-W554 PolarHBondContact O-N 3.45Å; W554-N556 VanDerWaalsContact C-N 3.34Å
555	R	92	Very high	81.2	Confident	159 Å²	159	87.3 Å²	87.3	60%	0.6	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	5.3	178.3	-67.5	-170.1	172.7	-168.6	-0.5	114.1	I551 A552 V553 I557	I551-R555 WeakPolarHBondContact O-CB 3.32Å; I551-R555 WeakPolarHBondContact O-CG 3.35Å; I551-R555 PolarHBondContact O-N 2.91Å; A552-R555 CarbonylContact O-C 3.45Å; A552-R555 PolarHBondContact O-N 3.42Å; V553-R555 VanDerWaalsContact C-N 3.3Å; V553-R555 PolarHBondContact O-N 3.45Å; R555-I557 HydrophobicContact CB-CD1 3.75Å; R555-I557 HydrophobicContact CB-CG1 3.75Å; R555-I557 PolarHBondContact O-N 2.83Å; R555-I557 VanDerWaalsContact O-N 3.17Å
556	N	86.8	Confident	80.1	Confident	149 Å²	149	88.3 Å²	88.3	80%	0.797	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	35.8	-173.1	-65.2	-49.8	0	0	0	113.2	A552 V553 W554 D558	A552-N556 PolarHBondContact O-N 3.44Å; V553-N556 PolarHBondContact O-N 3.09Å; W554-N556 VanDerWaalsContact C-N 3.34Å; N556-D558 PolarHBondContact O-N 3.46Å
557	I	84.1	Confident	79.6	Confident	81 Å²	81	85 Å²	85	42%	0.415	41%	0.413	S	S	.	.			trans	-80.3	115.6	174.5	-61.6	170.3	0	0	0	107.1	A552 R555	A552-I557 HydrophobicContact CB-CB 4.26Å; A552-I557 PolarHBondContact O-N 2.93Å; R555-I557 HydrophobicContact CB-CD1 3.75Å; R555-I557 HydrophobicContact CB-CG1 3.75Å; R555-I557 PolarHBondContact O-N 2.83Å; R555-I557 VanDerWaalsContact O-N 3.17Å
558	D	78.8	Confident	79.1	Confident	61 Å²	61	82 Å²	82	33%	0.326	39%	0.394	S	S	.	.			trans	-82.6	115.6	168.7	-160.5	-13	0	0	0	109	H142 N556 F560	H142-D558 IonicContact CE1-OD1 3.58Å; N556-D558 PolarHBondContact O-N 3.46Å; D558-F560 VanDerWaalsContact CG-O 3.27Å; D558-F560 PolarHBondContact O-N 3.46Å; D558-F560 PolarHBondContact OD1-N 2.99Å
559	F	75.2	Confident	78.9	Confident	56 Å²	56	81.5 Å²	81.5	25%	0.246	39%	0.389	C	S	.	.	S	Bend	trans	-64.1	-25.8	177.4	-70.1	-70.4	0	0	0	112	V150 L415 V548 N549 A552	V150-F559 HydrophobicContact CG1-CD2 4.43Å; L415-F559 HydrophobicContact CD2-CB 4.39Å; L415-F559 HydrophobicContact CD2-CD1 4.48Å; V548-F559 HydrophobicContact CG1-CE1 4.45Å; V548-F559 HydrophobicContact CG1-CZ 4.21Å; N549-F559 WeakPolarHBondContact OD1-CE2 3.37Å; A552-F559 HydrophobicContact CB-CD2 4.26Å; A552-F559 HydrophobicContact CB-CE1 3.92Å; A552-F559 HydrophobicContact CB-CE2 3.32Å; A552-F559 HydrophobicContact CB-CZ 3.12Å
560	F	78.6	Confident	78.7	Confident	26 Å²	26	81.1 Å²	81.1	11%	0.114	39%	0.387	C	S	.	.	S	Bend	trans	-109	121.2	-174.5	-54.3	-80.3	0	0	0	109.1	L138 G139 H142 V150 D414 D558 K562	L138-F560 VanDerWaalsContact C-CZ 3.43Å; L138-F560 HydrophobicContact CB-CE1 4.36Å; L138-F560 HydrophobicContact CB-CZ 3.82Å; G139-F560 VanDerWaalsContact CA-CE1 3.46Å; H142-F560 HydrophobicContact CB-CD2 3.77Å; H142-F560 HydrophobicContact CB-CE2 3.37Å; H142-F560 HydrophobicContact CB-CZ 4.1Å; H142-F560 AromaticContact CD2-CD2 3.58Å; H142-F560 AromaticContact CE1-CD2 3.91Å; H142-F560 AromaticContact CG-CD2 3.38Å; H142-F560 AromaticContact CG-CE2 3.54Å; H142-F560 AromaticContact ND1-CD2 3.61Å; H142-F560 AromaticContact ND1-CE2 3.91Å; H142-F560 AromaticContact NE2-CD2 3.93Å; V150-F560 HydrophobicContact CG1-CE2 4.19Å; V150-F560 HydrophobicContact CG1-CZ 4.28Å; V150-F560 HydrophobicContact CG2-CE2 4.38Å; D414-F560 HydrophobicContact CB-CD1 4.24Å; D414-F560 HydrophobicContact CB-CE1 4Å; D558-F560 VanDerWaalsContact CG-O 3.27Å; D558-F560 PolarHBondContact O-N 3.46Å; D558-F560 PolarHBondContact OD1-N 2.99Å; F560-K562 PolarHBondContact O-N 3.03Å
561	H	63.1	Low	78.4	Confident	144 Å²	144	83.7 Å²	83.7	67%	0.667	39%	0.39	S	S	*	.			trans	-70.1	121.1	-177.9	-139.6	40.1	0	0	0	110	H563 K564	H561-H563 PolarHBondContact O-N 2.64Å; H561-K564 PolarHBondContact O-N 3.49Å
562	K	52.1	Low	78.1	Confident	164 Å²	164	83.8 Å²	83.8	71%	0.713	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-25.4	-179.5	-75.7	-175.6	177.8	-180	0	114.4	F560 Q565	F560-K562 PolarHBondContact O-N 3.03Å; K562-Q565 VanDerWaalsContact O-CG 3.3Å; K562-Q565 WeakPolarHBondContact O-CG 3.3Å
563	H	40.8	Very low	77.4	Confident	169 Å²	169	85.3 Å²	85.3	78%	0.782	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-9.6	-178.1	-75.4	-70.3	0	0	0	115.4	H561	H561-H563 PolarHBondContact O-N 2.64Å
564	K	50.1	Low	76.5	Confident	88 Å²	88	90 Å²	90	38%	0.383	42%	0.424	S	S	.	.			trans	-102.1	56.2	175.4	-76	-165.7	168	-159.1	0	111.8	E64 H561 N566	E64-K564 IonicContact OE1-NZ 3.79Å; E64-K564 PolarHBondContact OE1-NZ 3.24Å; E64-K564 IonicContact OE2-NZ 2.91Å; H561-K564 PolarHBondContact O-N 3.49Å; K564-N566 PolarHBondContact O-N 3.06Å
565	Q	55.7	Low	75.7	Confident	91 Å²	91	85.2 Å²	85.2	43%	0.425	41%	0.406	S	S	.	.			trans	-72.8	59.5	179.2	-63.6	-166.7	-18.7	0	0	112.8	K562 Y575	K562-Q565 VanDerWaalsContact O-CG 3.3Å; K562-Q565 WeakPolarHBondContact O-CG 3.3Å; Q565-Y575 PolarHBondContact OE1-OH 3.15Å; Q565-Y575 VanDerWaalsContact OE1-OH 3.12Å
566	N	74	Confident	74.7	Confident	59 Å²	59	80.9 Å²	80.9	32%	0.316	40%	0.395	S	S	.	.			trans	-76.1	132.4	169.1	-69	-0.7	0	0	0	108.8	R134 R143 K564 D579	R134-N566 HydrophobicContact CB-CB 4.34Å; R143-N566 VanDerWaalsContact CZ-O 3.25Å; R143-N566 PolarHBondContact NH1-O 3.04Å; R143-N566 PolarHBondContact NH2-O 3.15Å; K564-N566 PolarHBondContact O-N 3.06Å; N566-D579 WeakPolarHBondContact CA-OD1 3.3Å
567	G	85.1	Confident	73.8	Confident	4 Å²	4	73.8 Å²	73.8	4%	0.041	36%	0.357	C	S	.	.	S	Bend	trans	74.5	177.8	176.2	0	0	0	0	0	115.5	R143 P577 D579	R143-G567 PolarHBondContact NH1-O 3.12Å; G567-P577 WeakPolarHBondContact O-CG 3.12Å; G567-D579 PolarHBondContact N-OD1 3.48Å
568	Y	88.6	Confident	72.8	Confident	3 Å²	3	76.2 Å²	76.2	1%	0.012	36%	0.364	C	S	.	.			trans	-95.8	158.1	-159.6	-62.5	-103.1	0	0	0	113.7	F132 R143 F482 Y575 P577 E580	F132-Y568 HydrophobicContact CE2-CG 4.42Å; F132-Y568 VanDerWaalsContact CZ-CB 3.49Å; F132-Y568 WeakPolarHBondContact O-CD2 3.33Å; F132-Y568 PolarHBondContact O-N 3.23Å; R143-Y568 PolarHBondContact NH1-O 2.89Å; F482-Y568 AromaticContact CE2-CD1 3.73Å; F482-Y568 HydrophobicContact CE2-CD1 3.73Å; F482-Y568 AromaticContact CE2-CD2 3.52Å; F482-Y568 HydrophobicContact CE2-CD2 3.52Å; F482-Y568 AromaticContact CE2-CE1 3.72Å; F482-Y568 HydrophobicContact CE2-CE1 3.72Å; F482-Y568 AromaticContact CE2-CE2 3.54Å; F482-Y568 HydrophobicContact CE2-CE2 3.54Å; F482-Y568 AromaticContact CE2-CG 3.63Å; F482-Y568 HydrophobicContact CE2-CG 3.63Å; F482-Y568 AromaticContact CE2-CZ 3.62Å; F482-Y568 HydrophobicContact CZ-CD1 4.41Å; F482-Y568 AromaticContact CZ-CD2 3.34Å; F482-Y568 HydrophobicContact CZ-CD2 3.34Å; F482-Y568 HydrophobicContact CZ-CE1 4.37Å; F482-Y568 AromaticContact CZ-CE2 3.31Å; F482-Y568 HydrophobicContact CZ-CE2 3.31Å; F482-Y568 AromaticContact CZ-CG 3.94Å; F482-Y568 HydrophobicContact CZ-CG 3.94Å; F482-Y568 AromaticContact CZ-CZ 3.84Å; Y568-Y575 VanDerWaalsContact CD1-O 3.27Å; Y568-Y575 WeakPolarHBondContact CD1-O 3.45Å; Y568-P577 HydrophobicContact CD1-CG 4Å; Y568-P577 HydrophobicContact CD2-CG 4.03Å; Y568-P577 HydrophobicContact CE1-CG 4.12Å; Y568-P577 HydrophobicContact CE2-CG 4.12Å; Y568-P577 HydrophobicContact CG-CG 3.96Å; Y568-E580 PolarHBondContact OH-OE1 3.46Å; Y568-E580 PolarHBondContact OH-OE2 2.98Å
569	D	89.1	Confident	72	Confident	68 Å²	68	74 Å²	74	36%	0.364	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-95.4	122.5	173.1	-176.2	-18.2	0	0	0	109.7	H571 N572 P573	D569-H571 PolarHBondContact O-N 3.21Å; D569-H571 IonicContact OD1-CD2 3.78Å; D569-H571 PolarHBondContact OD1-N 2.93Å; D569-N572 HydrophobicContact CB-CB 4.33Å; D569-N572 CarbonylContact O-C 3.12Å; D569-N572 PolarHBondContact O-N 3.3Å; D569-N572 VanDerWaalsContact O-N 3.12Å; D569-P573 WeakPolarHBondContact O-CA 3.4Å
570	P	91.2	Very high	71.4	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.8	-179.6	28.5	-36.7	0	0	0	113.7	F132 R143 F144 Y469 I478	F132-P570 HydrophobicContact CE1-CB 3.94Å; F132-P570 HydrophobicContact CZ-CB 4.48Å; R143-P570 HydrophobicContact CB-CG 4.25Å; R143-P570 WeakPolarHBondContact O-CG 3.41Å; F144-P570 HydrophobicContact CB-CG 4.43Å; F144-P570 HydrophobicContact CD1-CB 3.86Å; F144-P570 HydrophobicContact CD1-CG 4.01Å; F144-P570 HydrophobicContact CD2-CB 4.13Å; F144-P570 HydrophobicContact CD2-CG 3.7Å; F144-P570 HydrophobicContact CE1-CB 3.53Å; F144-P570 HydrophobicContact CE1-CG 4.12Å; F144-P570 HydrophobicContact CE2-CB 3.82Å; F144-P570 HydrophobicContact CE2-CG 3.82Å; F144-P570 HydrophobicContact CG-CB 4.16Å; F144-P570 HydrophobicContact CG-CG 3.81Å; F144-P570 HydrophobicContact CZ-CB 3.52Å; F144-P570 HydrophobicContact CZ-CG 4.04Å; Y469-P570 HydrophobicContact CE2-CB 3.9Å; Y469-P570 PolarHBondContact OH-O 3.3Å; I478-P570 HydrophobicContact CD1-CB 4Å
571	H	89.8	Confident	70.5	Confident	108 Å²	108	75.1 Å²	75.1	50%	0.5	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-11.3	176.7	-57.4	-66.4	0	0	0	112.9	R143 F144 Y469 D569	R143-H571 PolarHBondContact O-CD2 3.07Å; R143-H571 PolarHBondContact O-NE2 3.28Å; F144-H571 PolarHBondContact O-NE2 3.29Å; Y469-H571 AromaticContact CE2-CE1 3.96Å; D569-H571 PolarHBondContact O-N 3.21Å; D569-H571 IonicContact OD1-CD2 3.78Å; D569-H571 PolarHBondContact OD1-N 2.93Å
572	N	87.4	Confident	70.1	Confident	82 Å²	82	72.7 Å²	72.7	44%	0.439	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-138.6	67.7	172.4	-166.3	0.4	0	0	0	111	D569 D574 Y575	D569-N572 HydrophobicContact CB-CB 4.33Å; D569-N572 CarbonylContact O-C 3.12Å; D569-N572 PolarHBondContact O-N 3.3Å; D569-N572 VanDerWaalsContact O-N 3.12Å; N572-D574 PolarHBondContact O-N 3.48Å; N572-Y575 WeakPolarHBondContact O-CB 3.48Å; N572-Y575 PolarHBondContact O-N 2.98Å
573	P	77.7	Confident	70.1	Confident	37 Å²	37	67.6 Å²	67.6	24%	0.24	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.5	-170.9	30.1	-38.3	0	0	0	114	F132 V477 D569 Y575	F132-P573 HydrophobicContact CZ-CB 4.36Å; V477-P573 HydrophobicContact CG1-CB 3.74Å; V477-P573 HydrophobicContact CG1-CG 3.66Å; D569-P573 WeakPolarHBondContact O-CA 3.4Å; P573-Y575 VanDerWaalsContact C-N 3.31Å
574	D	74.3	Confident	70.6	Confident	147 Å²	147	64.6 Å²	64.6	79%	0.786	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-14.8	179.2	-59.2	-40	0	0	0	112.2	N572 I576	N572-D574 PolarHBondContact O-N 3.48Å; D574-I576 PolarHBondContact O-N 3.19Å
575	Y	74.3	Confident	70.3	Confident	92 Å²	92	65.1 Å²	65.1	36%	0.361	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-69.8	122	174.6	179	-102.2	0	0	0	110.8	Q565 Y568 N572 P573 P577	Q565-Y575 PolarHBondContact OE1-OH 3.15Å; Q565-Y575 VanDerWaalsContact OE1-OH 3.12Å; Y568-Y575 VanDerWaalsContact CD1-O 3.27Å; Y568-Y575 WeakPolarHBondContact CD1-O 3.45Å; N572-Y575 WeakPolarHBondContact O-CB 3.48Å; N572-Y575 PolarHBondContact O-N 2.98Å; P573-Y575 VanDerWaalsContact C-N 3.31Å; Y575-P577 WeakPolarHBondContact O-CD 3.21Å
576	I	72.2	Confident	69.8	Low	69 Å²	69	65.9 Å²	65.9	35%	0.354	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-88.9	118	175.3	-57.7	175.9	0	0	0	109.3	D574 E580 L581	D574-I576 PolarHBondContact O-N 3.19Å; I576-E580 HydrophobicContact CG2-CB 3.99Å; I576-L581 HydrophobicContact CG2-CG 4.2Å
577	P	66.8	Low	68	Low	0 Å²	0	71 Å²	71	0%	0	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-62.1	153.2	176.9	-26.7	38.3	0	0	0	113.7	G567 Y568 Y575 D579 E580 L581	G567-P577 WeakPolarHBondContact O-CG 3.12Å; Y568-P577 HydrophobicContact CD1-CG 4Å; Y568-P577 HydrophobicContact CD2-CG 4.03Å; Y568-P577 HydrophobicContact CE1-CG 4.12Å; Y568-P577 HydrophobicContact CE2-CG 4.12Å; Y568-P577 HydrophobicContact CG-CG 3.96Å; Y575-P577 WeakPolarHBondContact O-CD 3.21Å; P577-D579 VanDerWaalsContact C-N 3.27Å; P577-D579 WeakPolarHBondContact CB-OD1 3.48Å; P577-D579 PolarHBondContact O-N 3.37Å; P577-E580 PolarHBondContact O-N 3.2Å; P577-L581 PolarHBondContact O-N 2.97Å
578	K	63.2	Low	65.7	Low	131 Å²	131	75.4 Å²	75.4	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-59.5	-35.1	-179.5	-71.2	-173.3	178.7	-176.8	0	113.3	E580 L581 E582	K578-E580 VanDerWaalsContact C-N 3.27Å; K578-E580 PolarHBondContact O-N 3.22Å; K578-L581 WeakPolarHBondContact O-CB 3.34Å; K578-L581 PolarHBondContact O-N 3.28Å; K578-L581 VanDerWaalsContact O-N 3.09Å; K578-E582 PolarHBondContact O-N 3.19Å
579	D	63.7	Low	63.3	Low	14 Å²	14	79.8 Å²	79.8	8%	0.075	40%	0.395	C	S	.	.	H	α-helix	trans	-63.6	-30.5	-179.9	58.3	-55.7	0	0	0	112.6	L65 R134 N566 G567 P577	L65-D579 HydrophobicContact CD2-CB 3.58Å; L65-D579 VanDerWaalsContact CD2-O 3.31Å; L65-D579 WeakPolarHBondContact CD2-O 3.42Å; L65-D579 HydrophobicContact CG-CB 4.46Å; R134-D579 WeakPolarHBondContact CD-OD2 3.46Å; R134-D579 IonicContact CZ-OD2 3.64Å; R134-D579 IonicContact NE-OD2 3.63Å; R134-D579 IonicContact NH1-OD2 2.77Å; R134-D579 PolarHBondContact NH1-OD2 3.38Å; N566-D579 WeakPolarHBondContact CA-OD1 3.3Å; G567-D579 PolarHBondContact N-OD1 3.48Å; P577-D579 VanDerWaalsContact C-N 3.27Å; P577-D579 WeakPolarHBondContact CB-OD1 3.48Å; P577-D579 PolarHBondContact O-N 3.37Å
580	E	61.9	Low	60.8	Low	24 Å²	24	81.9 Å²	81.9	11%	0.112	41%	0.41	C	S	.	.	H	α-helix	trans	-75.8	-41.1	169.4	-73.8	-134.8	161.5	0	0	112.1	R134 Y568 I576 P577 K578 E582 S583 F584	R134-E580 IonicContact CZ-OE1 3.29Å; R134-E580 IonicContact NH1-OE1 2.81Å; R134-E580 IonicContact NH2-OE1 3.63Å; R134-E580 PolarHBondContact NH2-OE1 3.36Å; Y568-E580 PolarHBondContact OH-OE1 3.46Å; Y568-E580 PolarHBondContact OH-OE2 2.98Å; I576-E580 HydrophobicContact CG2-CB 3.99Å; P577-E580 PolarHBondContact O-N 3.2Å; K578-E580 VanDerWaalsContact C-N 3.27Å; K578-E580 PolarHBondContact O-N 3.22Å; E580-E582 VanDerWaalsContact C-N 3.3Å; E580-E582 PolarHBondContact O-N 3.41Å; E580-S583 WeakPolarHBondContact O-CB 3.39Å; E580-S583 PolarHBondContact O-N 2.74Å; E580-S583 VanDerWaalsContact O-N 3.09Å; E580-S583 PolarHBondContact O-OG 3.17Å; E580-F584 WeakPolarHBondContact O-CD2 3.35Å; E580-F584 PolarHBondContact O-N 3.23Å
581	L	59.3	Low	58.2	Low	83 Å²	83	84.3 Å²	84.3	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-59.4	-38.4	179.9	-74.3	162.2	0	0	0	112.7	I576 P577 K578 F584 N585	I576-L581 HydrophobicContact CG2-CG 4.2Å; P577-L581 PolarHBondContact O-N 2.97Å; K578-L581 WeakPolarHBondContact O-CB 3.34Å; K578-L581 PolarHBondContact O-N 3.28Å; K578-L581 VanDerWaalsContact O-N 3.09Å; L581-F584 PolarHBondContact O-N 3.24Å; L581-N585 PolarHBondContact O-N 2.86Å
582	E	54.9	Low	55.6	Low	93 Å²	93	82.4 Å²	82.4	44%	0.435	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-39.9	175.2	-72.5	178.2	-174.4	0	0	111.9	L65 K578 E580 F584 N585 E586	L65-E582 WeakPolarHBondContact CD1-OE2 3.3Å; K578-E582 PolarHBondContact O-N 3.19Å; E580-E582 VanDerWaalsContact C-N 3.3Å; E580-E582 PolarHBondContact O-N 3.41Å; E582-F584 VanDerWaalsContact C-N 3.3Å; E582-F584 PolarHBondContact O-N 3.45Å; E582-N585 PolarHBondContact O-N 3.14Å; E582-E586 PolarHBondContact O-N 2.74Å
583	S	53	Low	53.3	Low	57 Å²	57	85.9 Å²	85.9	40%	0.399	45%	0.445	S	S	.	.	H	α-helix	trans	-64.5	-32.9	175.4	79.2	0	0	0	0	113	E580	E580-S583 WeakPolarHBondContact O-CB 3.39Å; E580-S583 PolarHBondContact O-N 2.74Å; E580-S583 VanDerWaalsContact O-N 3.09Å; E580-S583 PolarHBondContact O-OG 3.17Å
584	F	50.2	Low	51.2	Low	106 Å²	106	87.9 Å²	87.9	47%	0.465	46%	0.459	S	S	.	.	H	α-helix	trans	-69.9	-44	172.2	-81.7	-76.9	0	0	0	111.3	E580 L581 E582 E586 F587 F588	E580-F584 WeakPolarHBondContact O-CD2 3.35Å; E580-F584 PolarHBondContact O-N 3.23Å; L581-F584 PolarHBondContact O-N 3.24Å; E582-F584 VanDerWaalsContact C-N 3.3Å; E582-F584 PolarHBondContact O-N 3.45Å; F584-E586 PolarHBondContact O-N 3Å; F584-F587 WeakPolarHBondContact O-CB 3.4Å; F584-F587 PolarHBondContact O-N 3.22Å; F584-F587 VanDerWaalsContact O-N 3.15Å; F584-F588 HydrophobicContact CB-CE2 4.5Å; F584-F588 WeakPolarHBondContact O-CD2 3.45Å; F584-F588 PolarHBondContact O-N 3.33Å
585	N	44.7	Very low	49.1	Very low	99 Å²	99	85.9 Å²	85.9	53%	0.529	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-38.5	-179	-76.7	-23.3	0	0	0	112.6	L581 E582 F587 F588 V589	L581-N585 PolarHBondContact O-N 2.86Å; E582-N585 PolarHBondContact O-N 3.14Å; N585-F587 VanDerWaalsContact C-N 3.27Å; N585-F587 PolarHBondContact O-N 3.28Å; N585-F588 PolarHBondContact O-N 3.43Å; N585-V589 WeakPolarHBondContact O-CG2 3.5Å; N585-V589 PolarHBondContact O-N 3.47Å
586	E	44	Very low	47.1	Very low	107 Å²	107	89.6 Å²	89.6	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-59.5	-39.5	172.7	-78.7	-165.6	154.1	0	0	111.6	R62 E582 F584 F588 V589 V590	R62-E586 IonicContact CZ-OE1 3.89Å; R62-E586 IonicContact NE-OE1 3.88Å; R62-E586 IonicContact NH2-OE1 2.7Å; R62-E586 PolarHBondContact NH2-OE1 3.37Å; R62-E586 IonicContact NH2-OE2 3.64Å; E582-E586 PolarHBondContact O-N 2.74Å; F584-E586 PolarHBondContact O-N 3Å; E586-F588 PolarHBondContact O-N 3.18Å; E586-V589 PolarHBondContact O-N 2.86Å; E586-V590 WeakPolarHBondContact O-CG2 3.49Å; E586-V590 PolarHBondContact O-N 3.17Å; E586-V590 VanDerWaalsContact O-N 3.08Å
587	F	37.5	Very low	45.2	Very low	167 Å²	167	92.2 Å²	92.2	73%	0.732	49%	0.492	S	S	*	.	H	α-helix	trans	-63.7	-40.5	175.6	-117.3	-86.5	0	0	0	112.3	F584 N585 S591	F584-F587 WeakPolarHBondContact O-CB 3.4Å; F584-F587 PolarHBondContact O-N 3.22Å; F584-F587 VanDerWaalsContact O-N 3.15Å; N585-F587 VanDerWaalsContact C-N 3.27Å; N585-F587 PolarHBondContact O-N 3.28Å; F587-S591 WeakPolarHBondContact O-CB 3.48Å; F587-S591 PolarHBondContact O-N 3.14Å
588	F	35.9	Very low	43.7	Very low	95 Å²	95	98.5 Å²	98.5	42%	0.417	53%	0.525	S	S	.	.	H	α-helix	trans	-73.5	-31.7	177.7	-76.1	-68.5	0	0	0	113.4	F584 N585 E586 S591 S592 M602	F584-F588 HydrophobicContact CB-CE2 4.5Å; F584-F588 WeakPolarHBondContact O-CD2 3.45Å; F584-F588 PolarHBondContact O-N 3.33Å; N585-F588 PolarHBondContact O-N 3.43Å; E586-F588 PolarHBondContact O-N 3.18Å; F588-S591 PolarHBondContact O-N 3.12Å; F588-S591 PolarHBondContact O-OG 3.16Å; F588-S592 WeakPolarHBondContact O-CA 3.45Å; F588-S592 WeakPolarHBondContact O-CB 3.4Å; F588-S592 PolarHBondContact O-N 3.27Å; F588-S592 PolarHBondContact O-OG 3.35Å; F588-M602 HydrophobicContact CE1-CE 3.77Å; F588-M602 HydrophobicContact CE1-SD 3.76Å; F588-M602 HydrophobicContact CZ-CE 4.33Å; F588-M602 HydrophobicContact CZ-SD 3.97Å
589	V	38.3	Very low	42.2	Very low	95 Å²	95	103.2 Å²	103.2	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-69.2	-44	175.7	173.6	0	0	0	0	109.9	N585 E586 S591 S592	N585-V589 WeakPolarHBondContact O-CG2 3.5Å; N585-V589 PolarHBondContact O-N 3.47Å; E586-V589 PolarHBondContact O-N 2.86Å; V589-S591 VanDerWaalsContact C-N 3.31Å; V589-S591 PolarHBondContact O-N 3.22Å; V589-S592 PolarHBondContact O-N 2.68Å; V589-S592 PolarHBondContact O-OG 3.21Å
590	V	37.4	Very low	40.7	Very low	113 Å²	113	109.2 Å²	109.2	69%	0.685	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-34.4	175	178	0	0	0	0	111.6	E586	E586-V590 WeakPolarHBondContact O-CG2 3.49Å; E586-V590 PolarHBondContact O-N 3.17Å; E586-V590 VanDerWaalsContact O-N 3.08Å
591	S	35.8	Very low	39.2	Very low	51 Å²	51	115.5 Å²	115.5	36%	0.357	60%	0.601	S	S	.	*	H	α-helix	trans	-78.6	-23.8	174.5	85.7	0	0	0	0	113.1	F587 F588 V589 D593 S594	F587-S591 WeakPolarHBondContact O-CB 3.48Å; F587-S591 PolarHBondContact O-N 3.14Å; F588-S591 PolarHBondContact O-N 3.12Å; F588-S591 PolarHBondContact O-OG 3.16Å; V589-S591 VanDerWaalsContact C-N 3.31Å; V589-S591 PolarHBondContact O-N 3.22Å; S591-D593 VanDerWaalsContact C-N 3.28Å; S591-D593 PolarHBondContact O-N 3.32Å; S591-S594 CarbonylContact O-C 3.16Å; S591-S594 VanDerWaalsContact O-CA 3.28Å; S591-S594 WeakPolarHBondContact O-CA 3.18Å; S591-S594 PolarHBondContact O-N 3.03Å; S591-S594 PolarHBondContact O-OG 3.1Å; S591-S594 VanDerWaalsContact O-OG 3.04Å
592	S	34.3	Very low	37.9	Very low	68 Å²	68	116.9 Å²	116.9	48%	0.476	61%	0.606	S	S	.	*	H	α-helix	trans	-72.1	-21.7	-175.9	64.4	0	0	0	0	113.8	F588 V589 S594	F588-S592 WeakPolarHBondContact O-CA 3.45Å; F588-S592 WeakPolarHBondContact O-CB 3.4Å; F588-S592 PolarHBondContact O-N 3.27Å; F588-S592 PolarHBondContact O-OG 3.35Å; V589-S592 PolarHBondContact O-N 2.68Å; V589-S592 PolarHBondContact O-OG 3.21Å; S592-S594 PolarHBondContact O-N 3.22Å
593	D	40.1	Very low	37	Very low	156 Å²	156	123.1 Å²	123.1	83%	0.834	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-15.3	165.6	-76	-19	0	0	0	111.9	S591	S591-D593 VanDerWaalsContact C-N 3.28Å; S591-D593 PolarHBondContact O-N 3.32Å
594	S	33.4	Very low	36.2	Very low	78 Å²	78	126 Å²	126	55%	0.545	64%	0.641	S	S	.	*	S	Bend	trans	-126.5	86.5	171.1	62	0	0	0	0	110.9	S591 S592	S591-S594 CarbonylContact O-C 3.16Å; S591-S594 VanDerWaalsContact O-CA 3.28Å; S591-S594 WeakPolarHBondContact O-CA 3.18Å; S591-S594 PolarHBondContact O-N 3.03Å; S591-S594 PolarHBondContact O-OG 3.1Å; S591-S594 VanDerWaalsContact O-OG 3.04Å; S592-S594 PolarHBondContact O-N 3.22Å
595	V	30.9	Very low	35.4	Very low	105 Å²	105	129.8 Å²	129.8	64%	0.636	66%	0.66	S	S	*	*			trans	103.8	103.5	161.4	-170.1	0	0	0	0	115.4	I597	V595-I597 HydrophobicContact CG1-CD1 3.64Å; V595-I597 HydrophobicContact CG1-CG1 3.76Å; V595-I597 PolarHBondContact O-N 3.27Å
596	N	32.4	Very low	34.6	Very low	170 Å²	170	134.9 Å²	134.9	91%	0.909	69%	0.686	S	S	*	*			trans	-56.6	94.4	159.9	-90.2	-39.5	0	0	0	110.9
597	I	31.7	Very low	34.2	Very low	125 Å²	125	136.3 Å²	136.3	64%	0.641	70%	0.695	S	S	*	*			trans	-120.2	133.9	162.9	-72.6	162.1	0	0	0	110.5	V595	V595-I597 HydrophobicContact CG1-CD1 3.64Å; V595-I597 HydrophobicContact CG1-CG1 3.76Å; V595-I597 PolarHBondContact O-N 3.27Å
598	N	34.3	Very low	34	Very low	132 Å²	132	134.6 Å²	134.6	71%	0.706	69%	0.694	S	S	*	*			trans	-65.9	123.1	-163.2	-143.7	-18.5	0	0	0	112.2	N600 Q601	N598-N600 PolarHBondContact O-N 3.09Å; N598-Q601 PolarHBondContact O-N 3.25Å
599	R	32.7	Very low	33.9	Very low	229 Å²	229	136.8 Å²	136.8	86%	0.864	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-17.9	-174.8	-84.8	-179.2	177.3	175.7	-0.6	116.1
600	N	32	Very low	33.6	Very low	141 Å²	141	139.3 Å²	139.3	75%	0.754	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-19.3	-174.1	-75.9	-12	0	0	0	114.8	N598	N598-N600 PolarHBondContact O-N 3.09Å
601	Q	31.2	Very low	33.4	Very low	155 Å²	155	140.9 Å²	140.9	72%	0.724	72%	0.719	S	S	*	*	S	Bend	trans	-82.1	-18.5	177.8	-92.2	-175	-22.3	0	0	114.3	N598	N598-Q601 PolarHBondContact O-N 3.25Å
602	M	31.7	Very low	33.2	Very low	112 Å²	112	146.9 Å²	146.9	55%	0.552	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-82.3	-17.8	-174.4	-83.5	178.6	179.5	0	0	114.8	F588 T604	F588-M602 HydrophobicContact CE1-CE 3.77Å; F588-M602 HydrophobicContact CE1-SD 3.76Å; F588-M602 HydrophobicContact CZ-CE 4.33Å; F588-M602 HydrophobicContact CZ-SD 3.97Å; M602-T604 PolarHBondContact O-N 3.23Å
603	R	35.2	Very low	33.2	Very low	225 Å²	225	152.6 Å²	152.6	85%	0.849	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-71.9	-14.4	178.3	-96	-172.9	-179.2	-179.1	0.5	114.4
604	T	37.5	Very low	32.6	Very low	117 Å²	117	152.3 Å²	152.3	72%	0.718	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-95.4	-6.1	-176.4	-16.4	0	0	0	0	113.6	M602	M602-T604 PolarHBondContact O-N 3.23Å
605	H	31.9	Very low	32.6	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.856	77%	0.774	S	S	*	*			trans	-109.2	-2.5	179.7	-96.5	-38.9	0	0	0	115
606	L	29.2	Very low	32.7	Very low	206 Å²	206	163.4 Å²	163.4	100%	1.079	79%	0.787	S	S	*	*			trans	-96.5	0	160.7	-77.9	162.3	0	0	0	108

Retrieved 606 of 606 residues in 959.5 ms (Link to these results)

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