A0A5K4F1M5_SCHMA Loading...

DUF4456 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1M5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 335 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	31.4	Very low	236 Å²	236	155.9 Å²	155.9	100%	1.163	84%	0.84	S	S	*	*				0	143.7	0	-80.8	-175.7	171.7	0	0	108.6
2	K	31.7	Very low	31.1	Very low	188 Å²	188	152.4 Å²	152.4	82%	0.817	84%	0.836	S	S	*	*			trans	62.6	120.1	169.9	-62	-178.9	179.3	-179.7	0	114.4
3	L	27.3	Very low	31.4	Very low	151 Å²	151	155.7 Å²	155.7	79%	0.791	84%	0.837	S	S	*	*				66.2	133.8	67.9	-63	170.8	0	0	0	111.7
4	N	30.9	Very low	31.4	Very low	149 Å²	149	153.8 Å²	153.8	80%	0.797	84%	0.837	S	S	*	*			cis	-153.8	172.8	3.4	-141	-1.2	0	0	0	112.4
5	A	31.8	Very low	31.4	Very low	86 Å²	86	154.4 Å²	154.4	71%	0.711	84%	0.837	S	S	*	*			trans	-79.2	158.1	174.1	0	0	0	0	0	113.5
6	S	33.3	Very low	31.5	Very low	126 Å²	126	151.5 Å²	151.5	88%	0.881	83%	0.832	S	S	*	*			trans	-159.8	147.7	161.5	-79.4	0	0	0	0	111
7	N	30.4	Very low	31.6	Very low	157 Å²	157	149.9 Å²	149.9	84%	0.84	83%	0.827	S	S	*	*			trans	-86.8	157	-172.9	-54.3	-57.9	0	0	0	112.7
8	L	32.8	Very low	31.8	Very low	176 Å²	176	151.9 Å²	151.9	92%	0.921	83%	0.826	S	S	*	*			trans	-151.8	148.3	137.1	-139.8	68.7	0	0	0	115
9	M	30.1	Very low	31.5	Very low	146 Å²	146	156.8 Å²	156.8	72%	0.719	83%	0.832	S	S	*	*			trans	-57.8	153.8	-173.4	-77.3	-76.2	173.1	0	0	118.7
10	Q	29.3	Very low	31.7	Very low	167 Å²	167	158.4 Å²	158.4	78%	0.78	83%	0.834	S	S	*	*			trans	64.3	146.5	143.3	-64.6	164.2	10.5	0	0	117.4
11	T	33.2	Very low	31.5	Very low	133 Å²	133	154.4 Å²	154.4	82%	0.816	83%	0.831	S	S	*	*			cis	-149.4	171.4	42.5	41	0	0	0	0	112.5
12	S	27.8	Very low	31.3	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	82%	0.818	S	S	*	*			trans	-86.5	153.6	-176.4	48.9	0	0	0	0	114.6
13	K	35.4	Very low	31.3	Very low	195 Å²	195	152.3 Å²	152.3	85%	0.848	82%	0.824	S	S	*	*			trans	-139.6	128.4	161.8	-72.9	-173.4	178.8	177.4	0	110.4
14	P	30.1	Very low	31.3	Very low	129 Å²	129	154.8 Å²	154.8	84%	0.838	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-79.7	139.1	173.9	32	-33.2	0	0	0	111.2
15	I	32.5	Very low	31.5	Very low	163 Å²	163	154.7 Å²	154.7	84%	0.836	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-88.6	120.2	173.1	-63.3	178.1	0	0	0	109
16	S	32.7	Very low	31.2	Very low	108 Å²	108	155.5 Å²	155.5	76%	0.755	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-84.1	125.3	178.7	-176.9	0	0	0	0	111.4
17	V	33	Very low	31	Very low	125 Å²	125	157.1 Å²	157.1	76%	0.758	83%	0.831	S	S	*	*			trans	-104.4	99.6	176.4	-177.3	0	0	0	0	109.6	R19	V17-R19 PolarHBondContact O-N 3.19Å
18	K	34.6	Very low	31.1	Very low	186 Å²	186	154.9 Å²	154.9	81%	0.809	82%	0.823	S	S	*	*			trans	-69.6	118.1	171.7	-76.2	-175.5	175.1	-179.3	0	110.3
19	R	27.5	Very low	30.9	Very low	245 Å²	245	152.5 Å²	152.5	93%	0.925	82%	0.816	S	S	*	*			trans	-80.3	124.7	158.2	-73.5	-174.6	174.9	-168.9	-0.8	109.1	V17	V17-R19 PolarHBondContact O-N 3.19Å
20	Q	34.7	Very low	30.8	Very low	187 Å²	187	156 Å²	156	87%	0.874	83%	0.828	S	S	*	*			trans	-145	131.7	162	-118.1	175.9	-13.8	0	0	107.8
21	G	27.8	Very low	30.7	Very low	75 Å²	75	151.1 Å²	151.1	77%	0.773	82%	0.822	S	S	*	*			trans	-128.5	151.6	179.2	0	0	0	0	0	110.8
22	C	30.7	Very low	30.5	Very low	131 Å²	131	151.6 Å²	151.6	89%	0.885	83%	0.825	S	S	*	*			trans	-134.8	111.1	179.1	-100	0	0	0	0	112.3
23	R	31.2	Very low	30.5	Very low	250 Å²	250	151 Å²	151	94%	0.943	82%	0.818	S	S	*	*			trans	36.7	141.3	145	-65.4	-177	172.3	-178.2	-3.3	121.8
24	K	28.7	Very low	30	Very low	203 Å²	203	151.6 Å²	151.6	88%	0.883	82%	0.817	S	S	*	*			trans	-73.4	155.2	171.4	-51.6	173.6	180	179.8	0	112.6
25	T	33.3	Very low	30	Very low	146 Å²	146	151.1 Å²	151.1	90%	0.896	82%	0.817	S	S	*	*			trans	-132.6	169.4	141.2	45.8	0	0	0	0	108.8
26	S	26.9	Very low	29.8	Very low	103 Å²	103	150.6 Å²	150.6	72%	0.72	81%	0.811	S	S	*	*			trans	-152.7	150.8	-162.1	54.4	0	0	0	0	112.7
27	L	27.8	Very low	29.6	Very low	160 Å²	160	153.3 Å²	153.3	84%	0.838	82%	0.817	S	S	*	*			trans	-164.5	154.7	138.1	-129.8	66	0	0	0	114.1
28	T	32.9	Very low	29.3	Very low	110 Å²	110	150.5 Å²	150.5	68%	0.675	81%	0.813	S	S	*	*			trans	-15.3	139.2	165.1	50.5	0	0	0	0	119.1
29	T	27.9	Very low	29.1	Very low	126 Å²	126	149.6 Å²	149.6	77%	0.773	82%	0.817	S	S	*	*			cis	84.4	97.1	38.2	-55.2	0	0	0	0	115.5
30	F	29.8	Very low	29	Very low	219 Å²	219	147 Å²	147	96%	0.961	82%	0.815	S	S	*	*			trans	-169.8	147.5	148.1	-89	-72.9	0	0	0	107.1
31	G	25.6	Very low	28.7	Very low	65 Å²	65	146.6 Å²	146.6	67%	0.67	82%	0.816	S	S	*	*			cis	151.2	56.1	-8.6	0	0	0	0	0	115.7
32	V	29.1	Very low	28.8	Very low	144 Å²	144	147.9 Å²	147.9	87%	0.873	81%	0.813	S	S	*	*			trans	-140.9	124.2	176.2	-173.3	0	0	0	0	112.2
33	P	29.1	Very low	28.6	Very low	101 Å²	101	149.2 Å²	149.2	66%	0.656	81%	0.811	S	S	*	*			trans	-112	177.2	172.9	38.7	-29.7	0	0	0	114.3
34	Y	24.2	Very low	28.4	Very low	207 Å²	207	143 Å²	143	81%	0.812	80%	0.803	S	S	*	*			trans	69.8	117.3	172	-73.5	-82.2	0	0	0	119.7
35	S	30.3	Very low	28.4	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	79%	0.79	S	S	*	*				-146.7	133.4	114.9	-170.9	0	0	0	0	109.7
36	Q	27.7	Very low	28.1	Very low	151 Å²	151	133.9 Å²	133.9	71%	0.706	79%	0.786	S	S	*	*			trans	-120.3	144.6	166.6	-76	-179.1	-57.9	0	0	108
37	N	29.2	Very low	28.1	Very low	165 Å²	165	139.2 Å²	139.2	88%	0.882	80%	0.797	S	S	*	*			trans	119.6	140.9	164.3	-61.9	-23.7	0	0	0	114.3
38	G	26	Very low	28.2	Very low	66 Å²	66	137.4 Å²	137.4	68%	0.68	79%	0.793	S	S	*	*			trans	76.2	118.8	172.9	0	0	0	0	0	114.3
39	D	30.2	Very low	27.7	Very low	168 Å²	168	137.9 Å²	137.9	90%	0.898	80%	0.799	S	S	*	*			cis	-143.7	158.7	6.8	-81	-44.2	0	0	0	112.6
40	Q	26.6	Very low	27.8	Very low	190 Å²	190	137.6 Å²	137.6	89%	0.888	80%	0.802	S	S	*	*			trans	-77.6	125.6	169.6	-60.2	171.8	-3.2	0	0	109.7
41	M	27.3	Very low	27.7	Very low	179 Å²	179	134.3 Å²	134.3	88%	0.882	80%	0.795	S	S	*	*			trans	-157.4	131.5	150.8	-95.2	-120.8	161	0	0	113
42	S	30.2	Very low	28.1	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	79%	0.794	S	S	*	*			trans	60.2	95.2	148.5	-55.1	0	0	0	0	118.5	P44	S42-P44 WeakPolarHBondContact O-CD 3.41Å
43	N	25.6	Very low	28.1	Very low	159 Å²	159	135.4 Å²	135.4	85%	0.85	78%	0.783	S	S	*	*			trans	-103.1	107.9	162	178.2	26.3	0	0	0	110.7
44	P	28	Very low	28	Very low	119 Å²	119	136 Å²	136	77%	0.773	79%	0.789	S	S	*	*			trans	-122.5	125.3	165	35.8	-23	0	0	0	111.5	S42	S42-P44 WeakPolarHBondContact O-CD 3.41Å
45	G	28.4	Very low	28.4	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	79%	0.788	S	S	*	*			cis	-171.5	159.9	-6.6	0	0	0	0	0	109.2
46	A	26.5	Very low	28.2	Very low	100 Å²	100	133.3 Å²	133.3	83%	0.826	79%	0.788	S	S	*	*			trans	-75	130.4	174.2	0	0	0	0	0	110
47	F	28.2	Very low	28.4	Very low	214 Å²	214	133.3 Å²	133.3	94%	0.939	79%	0.794	S	S	*	*			trans	-102.8	112	162.8	-100	-87.4	0	0	0	108.6
48	T	29.1	Very low	28.3	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	79%	0.793	S	S	*	*			trans	-87.8	157.2	171.1	44.9	0	0	0	0	110.6
49	C	23.5	Very low	28.5	Very low	120 Å²	120	135 Å²	135	81%	0.811	79%	0.791	S	S	*	*			trans	-69.4	154.2	178.4	-55.7	0	0	0	0	112.4
50	S	29.3	Very low	28.3	Very low	120 Å²	120	134.8 Å²	134.8	84%	0.839	79%	0.79	S	S	*	*			trans	-148.8	125.5	156	-63.5	0	0	0	0	107.2
51	D	28.1	Very low	28.4	Very low	151 Å²	151	133.4 Å²	133.4	81%	0.807	79%	0.788	S	S	*	*			trans	-84	150.3	173.5	-66.5	-70.4	0	0	0	110.3
52	E	33	Very low	28.4	Very low	140 Å²	140	132.3 Å²	132.3	65%	0.654	79%	0.785	S	S	*	*			trans	-149.6	160.6	165.2	-109.5	-73.4	50.2	0	0	111.3	I127	E52-I127 HydrophobicContact CG-CD1 3.38Å; E52-I127 HydrophobicContact CG-CG1 4.24Å
53	S	29.6	Very low	28.3	Very low	92 Å²	92	137.8 Å²	137.8	64%	0.643	80%	0.796	S	S	*	*			trans	-98	144.8	-147.3	-50.3	0	0	0	0	115.7
54	S	27.8	Very low	28.3	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	79%	0.785	S	S	*	*			trans	43.7	122.4	143.7	63.3	0	0	0	0	121.1
55	S	31.3	Very low	28.4	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	78%	0.783	S	S	*	*				-160.5	139.8	118	51.4	0	0	0	0	112.1	N57	S55-N57 PolarHBondContact O-N 2.84Å
56	D	27	Very low	28.6	Very low	160 Å²	160	142.7 Å²	142.7	86%	0.856	79%	0.789	S	S	*	*			trans	-71	112.1	175.8	-70	-77.5	0	0	0	111.7
57	N	30.7	Very low	28.8	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	79%	0.791	S	S	*	*			trans	-161	78.5	160.4	-95.9	-58.5	0	0	0	110.3	S55 P59	S55-N57 PolarHBondContact O-N 2.84Å; N57-P59 WeakPolarHBondContact O-CD 3.43Å
58	L	27.9	Very low	29.2	Very low	166 Å²	166	137.5 Å²	137.5	87%	0.869	77%	0.766	S	S	*	*			trans	-80.7	111.3	173.1	-90.3	167.8	0	0	0	111.1
59	P	29.8	Very low	29.8	Very low	99 Å²	99	136.6 Å²	136.6	64%	0.643	76%	0.757	S	S	*	*			trans	-71.7	141.8	164.5	31.7	-34.1	0	0	0	109.8	N57 L61	N57-P59 WeakPolarHBondContact O-CD 3.43Å; P59-L61 PolarHBondContact O-N 3.04Å
60	N	26.7	Very low	30.4	Very low	164 Å²	164	136.7 Å²	136.7	88%	0.877	75%	0.753	S	S	*	*			trans	-63.3	96.9	179.4	-82.5	-60.3	0	0	0	111.9	L62	N60-L62 PolarHBondContact O-N 2.85Å
61	L	29.2	Very low	30.5	Very low	161 Å²	161	135.8 Å²	135.8	84%	0.843	74%	0.743	S	S	*	*			trans	-74	104.9	177.5	-82.6	168.4	0	0	0	111.6	P59 K63	P59-L61 PolarHBondContact O-N 3.04Å; L61-K63 PolarHBondContact O-N 3.27Å
62	L	27.1	Very low	30.7	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	73%	0.729	S	S	*	*			trans	-67.5	112.8	173.2	-74.8	161.2	0	0	0	111.3	N60 S64	N60-L62 PolarHBondContact O-N 2.85Å; L62-S64 PolarHBondContact O-N 2.73Å
63	K	28.1	Very low	30.9	Very low	216 Å²	216	131.6 Å²	131.6	94%	0.939	72%	0.719	S	S	*	*	S	Bend	trans	17.9	76.1	155	-62.5	178.9	-179.9	175.8	0	116.1	L61	L61-K63 PolarHBondContact O-N 3.27Å
64	S	26	Very low	30.9	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	72%	0.721	S	S	*	*			trans	-149.8	165.6	172.5	-166.9	0	0	0	0	112	L62	L62-S64 PolarHBondContact O-N 2.73Å
65	E	29.3	Very low	31.2	Very low	156 Å²	156	133.9 Å²	133.9	73%	0.729	71%	0.705	S	S	*	*			trans	47.9	118.9	166.9	-74.2	133.3	139.3	0	0	119.7
66	R	31.6	Very low	31.6	Very low	195 Å²	195	132 Å²	132	74%	0.736	69%	0.686	S	S	*	*				62.4	99.8	59.9	-66.1	-176.7	167.3	-176	-3.3	113.9	P68	R66-P68 WeakPolarHBondContact O-CD 3.23Å
67	T	31.5	Very low	32.3	Very low	139 Å²	139	128.9 Å²	128.9	85%	0.853	67%	0.67	S	S	*	*			trans	-118.2	72.7	174.9	39.2	0	0	0	0	114.5
68	P	36.7	Very low	32.5	Very low	65 Å²	65	129 Å²	129	42%	0.422	66%	0.66	S	S	.	*			trans	-96.5	3.5	163.2	39	-34.8	0	0	0	113.4	R66 V70 Y72	R66-P68 WeakPolarHBondContact O-CD 3.23Å; P68-V70 PolarHBondContact O-N 3.22Å; P68-V70 VanDerWaalsContact O-N 3.09Å; P68-Y72 HydrophobicContact CB-CD2 3.96Å; P68-Y72 HydrophobicContact CB-CE2 3.85Å; P68-Y72 HydrophobicContact CG-CD2 4.45Å; P68-Y72 HydrophobicContact CG-CE2 4.43Å; P68-Y72 WeakPolarHBondContact O-CD2 3.37Å
69	N	41.5	Very low	32.9	Very low	103 Å²	103	125.3 Å²	125.3	55%	0.551	64%	0.641	S	S	*	*	H	α-helix	trans	-60.3	-28.1	-153.3	-75.3	-9.3	0	0	0	117.3	T73	N69-T73 WeakPolarHBondContact O-CB 3.35Å; N69-T73 WeakPolarHBondContact O-CG2 3.13Å; N69-T73 PolarHBondContact O-N 2.99Å; N69-T73 PolarHBondContact O-OG1 3.43Å
70	V	35.4	Very low	33.7	Very low	122 Å²	122	125.9 Å²	125.9	74%	0.739	63%	0.633	S	S	*	*	H	α-helix	trans	-71.5	-43.1	-168	-172.3	0	0	0	0	113.2	P68 T73 Y74	P68-V70 PolarHBondContact O-N 3.22Å; P68-V70 VanDerWaalsContact O-N 3.09Å; V70-T73 WeakPolarHBondContact CA-OG1 3.11Å; V70-T73 PolarHBondContact O-OG1 2.91Å; V70-Y74 PolarHBondContact O-N 3.11Å
71	V	32.1	Very low	34.3	Very low	102 Å²	102	120.8 Å²	120.8	62%	0.618	61%	0.614	S	S	*	*	H	α-helix	trans	-76.8	-31.2	177.9	-177.8	0	0	0	0	111.2	T75	V71-T75 PolarHBondContact O-N 3.12Å; V71-T75 VanDerWaalsContact O-N 3.17Å; V71-T75 PolarHBondContact O-OG1 2.82Å
72	Y	32.5	Very low	34.6	Very low	131 Å²	131	115.3 Å²	115.3	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-64	-46.1	174.2	-82	-109	0	0	0	110.9	P68 T75 D76	P68-Y72 HydrophobicContact CB-CD2 3.96Å; P68-Y72 HydrophobicContact CB-CE2 3.85Å; P68-Y72 HydrophobicContact CG-CD2 4.45Å; P68-Y72 HydrophobicContact CG-CE2 4.43Å; P68-Y72 WeakPolarHBondContact O-CD2 3.37Å; Y72-T75 PolarHBondContact O-N 2.61Å; Y72-D76 WeakPolarHBondContact O-CB 3.32Å; Y72-D76 PolarHBondContact O-N 2.82Å
73	T	36.7	Very low	35.2	Very low	72 Å²	72	113.1 Å²	113.1	44%	0.442	58%	0.575	S	S	.	*	H	α-helix	trans	-61.7	-43.2	176.3	40.2	0	0	0	0	112.7	N69 V70 T75 N77	N69-T73 WeakPolarHBondContact O-CB 3.35Å; N69-T73 WeakPolarHBondContact O-CG2 3.13Å; N69-T73 PolarHBondContact O-N 2.99Å; N69-T73 PolarHBondContact O-OG1 3.43Å; V70-T73 WeakPolarHBondContact CA-OG1 3.11Å; V70-T73 PolarHBondContact O-OG1 2.91Å; T73-T75 PolarHBondContact O-N 3.5Å; T73-N77 WeakPolarHBondContact O-CB 3.43Å; T73-N77 PolarHBondContact O-N 3.13Å; T73-N77 PolarHBondContact O-ND2 3.44Å
74	Y	30.5	Very low	36	Very low	179 Å²	179	104.5 Å²	104.5	70%	0.702	54%	0.542	S	S	*	.	H	α-helix	trans	-61.7	-44.8	177.2	-168.9	-89.9	0	0	0	112.6	V70 Y78	V70-Y74 PolarHBondContact O-N 3.11Å; Y74-Y78 WeakPolarHBondContact O-CB 3.42Å; Y74-Y78 PolarHBondContact O-N 3.01Å
75	T	33.2	Very low	36.7	Very low	72 Å²	72	104.2 Å²	104.2	44%	0.442	53%	0.534	S	S	.	.	H	α-helix	trans	-71.9	-40.1	-177.2	-45.7	0	0	0	0	112	V71 Y72 T73 Y78 L79	V71-T75 PolarHBondContact O-N 3.12Å; V71-T75 VanDerWaalsContact O-N 3.17Å; V71-T75 PolarHBondContact O-OG1 2.82Å; Y72-T75 PolarHBondContact O-N 2.61Å; T73-T75 PolarHBondContact O-N 3.5Å; T75-Y78 PolarHBondContact O-N 2.78Å; T75-L79 PolarHBondContact O-N 2.81Å
76	D	39.6	Very low	37	Very low	71 Å²	71	100.9 Å²	100.9	38%	0.38	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-39.1	175.5	-174.6	50.6	0	0	0	111.4	Y72 L79 K80	Y72-D76 WeakPolarHBondContact O-CB 3.32Å; Y72-D76 PolarHBondContact O-N 2.82Å; D76-L79 PolarHBondContact O-N 3.06Å; D76-K80 VanDerWaalsContact O-CB 3.26Å; D76-K80 WeakPolarHBondContact O-CB 3.27Å; D76-K80 VanDerWaalsContact O-CG 3.25Å; D76-K80 WeakPolarHBondContact O-CG 3.13Å; D76-K80 PolarHBondContact O-N 3.42Å; D76-K80 IonicContact OD1-NZ 3.96Å; D76-K80 WeakPolarHBondContact OD2-CE 3.37Å; D76-K80 IonicContact OD2-NZ 2.63Å; D76-K80 PolarHBondContact OD2-NZ 2.78Å
77	N	41.4	Very low	37.4	Very low	95 Å²	95	96.1 Å²	96.1	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-41.6	173	-72.7	-13.7	0	0	0	112	T73 K80 A81	T73-N77 WeakPolarHBondContact O-CB 3.43Å; T73-N77 PolarHBondContact O-N 3.13Å; T73-N77 PolarHBondContact O-ND2 3.44Å; N77-K80 PolarHBondContact O-N 3.25Å; N77-A81 VanDerWaalsContact O-CB 3.27Å; N77-A81 WeakPolarHBondContact O-CB 3.24Å; N77-A81 PolarHBondContact O-N 3.42Å
78	Y	35.8	Very low	38	Very low	154 Å²	154	96.7 Å²	96.7	60%	0.604	50%	0.5	S	S	*	.	H	α-helix	trans	-65.6	-39.7	175.9	-174.4	-95.2	0	0	0	112.1	Y74 T75 A81 C82	Y74-Y78 WeakPolarHBondContact O-CB 3.42Å; Y74-Y78 PolarHBondContact O-N 3.01Å; T75-Y78 PolarHBondContact O-N 2.78Å; Y78-A81 PolarHBondContact O-N 2.89Å; Y78-C82 VanDerWaalsContact CE1-SG 3.5Å; Y78-C82 WeakPolarHBondContact O-CB 3.2Å; Y78-C82 PolarHBondContact O-N 3.34Å; Y78-C82 PolarHBondContact O-SG 2.85Å
79	L	36.3	Very low	38.2	Very low	90 Å²	90	100 Å²	100	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-70.3	-40.7	175.3	-84.2	164.5	0	0	0	112.4	T75 D76 A81 C82 M83	T75-L79 PolarHBondContact O-N 2.81Å; D76-L79 PolarHBondContact O-N 3.06Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.39Å; L79-C82 PolarHBondContact O-N 2.9Å; L79-M83 WeakPolarHBondContact O-CG 3.44Å; L79-M83 PolarHBondContact O-N 3.34Å
80	K	47.6	Very low	38	Very low	111 Å²	111	98.7 Å²	98.7	48%	0.483	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-39.8	170.7	-77.3	167.7	173.2	168.4	0	111.7	D76 N77 S84	D76-K80 VanDerWaalsContact O-CB 3.26Å; D76-K80 WeakPolarHBondContact O-CB 3.27Å; D76-K80 VanDerWaalsContact O-CG 3.25Å; D76-K80 WeakPolarHBondContact O-CG 3.13Å; D76-K80 PolarHBondContact O-N 3.42Å; D76-K80 IonicContact OD1-NZ 3.96Å; D76-K80 WeakPolarHBondContact OD2-CE 3.37Å; D76-K80 IonicContact OD2-NZ 2.63Å; D76-K80 PolarHBondContact OD2-NZ 2.78Å; N77-K80 PolarHBondContact O-N 3.25Å; K80-S84 WeakPolarHBondContact O-CB 3.34Å; K80-S84 PolarHBondContact O-N 3.43Å
81	A	39.1	Very low	38.1	Very low	57 Å²	57	98.8 Å²	98.8	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-43.7	173.5	0	0	0	0	0	111.7	N77 Y78 L79 N85	N77-A81 VanDerWaalsContact O-CB 3.27Å; N77-A81 WeakPolarHBondContact O-CB 3.24Å; N77-A81 PolarHBondContact O-N 3.42Å; Y78-A81 PolarHBondContact O-N 2.89Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.39Å; A81-N85 WeakPolarHBondContact O-CB 3.32Å; A81-N85 PolarHBondContact O-N 3.05Å
82	C	35.6	Very low	38.4	Very low	46 Å²	46	95.2 Å²	95.2	31%	0.311	48%	0.475	S	S	.	.	H	α-helix	trans	-61.8	-49.5	175	-70.9	0	0	0	0	112.3	Y78 L79 N85 V86	Y78-C82 VanDerWaalsContact CE1-SG 3.5Å; Y78-C82 WeakPolarHBondContact O-CB 3.2Å; Y78-C82 PolarHBondContact O-N 3.34Å; Y78-C82 PolarHBondContact O-SG 2.85Å; L79-C82 PolarHBondContact O-N 2.9Å; C82-N85 PolarHBondContact O-N 3Å; C82-V86 WeakPolarHBondContact O-CG2 3.48Å; C82-V86 PolarHBondContact O-N 3.01Å
83	M	39.5	Very low	38.7	Very low	111 Å²	111	96.1 Å²	96.1	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-47.9	177.2	-65.8	-157	-43.2	0	0	110.7	L79 N85 V86 E87	L79-M83 WeakPolarHBondContact O-CG 3.44Å; L79-M83 PolarHBondContact O-N 3.34Å; M83-N85 PolarHBondContact O-N 3.03Å; M83-V86 CarbonylContact O-C 3.59Å; M83-V86 PolarHBondContact O-N 3.09Å; M83-E87 VanDerWaalsContact O-CB 3.32Å; M83-E87 WeakPolarHBondContact O-CB 3.5Å; M83-E87 WeakPolarHBondContact O-CG 3.36Å; M83-E87 PolarHBondContact O-N 3.49Å
84	S	44.3	Very low	38.8	Very low	35 Å²	35	96.5 Å²	96.5	25%	0.245	48%	0.481	C	S	.	.	H	α-helix	trans	-58.9	-32	176.5	-171.2	0	0	0	0	112.4	K80 K88	K80-S84 WeakPolarHBondContact O-CB 3.34Å; K80-S84 PolarHBondContact O-N 3.43Å; S84-K88 WeakPolarHBondContact O-CB 3.49Å; S84-K88 WeakPolarHBondContact O-CD 3.35Å; S84-K88 WeakPolarHBondContact O-CG 3.44Å; S84-K88 PolarHBondContact O-N 3.4Å; S84-K88 WeakPolarHBondContact OG-CE 3.3Å; S84-K88 PolarHBondContact OG-NZ 3.42Å
85	N	39.8	Very low	39.4	Very low	83 Å²	83	91.9 Å²	91.9	44%	0.444	47%	0.468	S	S	.	.	H	α-helix	trans	-73.6	-39.8	175.4	-165.6	-28.6	0	0	0	111.9	A81 C82 M83 K89	A81-N85 WeakPolarHBondContact O-CB 3.32Å; A81-N85 PolarHBondContact O-N 3.05Å; C82-N85 PolarHBondContact O-N 3Å; M83-N85 PolarHBondContact O-N 3.03Å; N85-K89 WeakPolarHBondContact O-CB 2.96Å; N85-K89 WeakPolarHBondContact O-CD 3.38Å; N85-K89 VanDerWaalsContact O-CG 3.3Å; N85-K89 WeakPolarHBondContact O-CG 3.41Å; N85-K89 PolarHBondContact O-N 2.75Å; N85-K89 VanDerWaalsContact O-N 3.08Å; N85-K89 WeakPolarHBondContact OD1-CD 3.39Å; N85-K89 WeakPolarHBondContact OD1-CE 3.26Å; N85-K89 PolarHBondContact OD1-NZ 2.7Å
86	V	36.9	Very low	39.9	Very low	86 Å²	86	94.1 Å²	94.1	52%	0.521	48%	0.477	S	S	.	.	H	α-helix	trans	-67.3	-45.7	173.3	171.4	0	0	0	0	111.1	C82 M83 K89 L90	C82-V86 WeakPolarHBondContact O-CG2 3.48Å; C82-V86 PolarHBondContact O-N 3.01Å; M83-V86 CarbonylContact O-C 3.59Å; M83-V86 PolarHBondContact O-N 3.09Å; V86-K89 PolarHBondContact O-N 3.06Å; V86-L90 HydrophobicContact CG1-CD1 3.99Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 PolarHBondContact O-N 3.48Å
87	E	38.6	Very low	39.8	Very low	95 Å²	95	93 Å²	93	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-60.3	-53.5	174.5	-73.2	174.9	150.5	0	0	110.6	M83 K89 L90 F91	M83-E87 VanDerWaalsContact O-CB 3.32Å; M83-E87 WeakPolarHBondContact O-CB 3.5Å; M83-E87 WeakPolarHBondContact O-CG 3.36Å; M83-E87 PolarHBondContact O-N 3.49Å; E87-K89 PolarHBondContact O-N 3.47Å; E87-K89 VanDerWaalsContact O-N 3.11Å; E87-L90 CarbonylContact O-C 3.5Å; E87-L90 PolarHBondContact O-N 2.82Å; E87-L90 VanDerWaalsContact O-N 3.09Å; E87-F91 HydrophobicContact CB-CD2 3.89Å; E87-F91 HydrophobicContact CB-CE2 4.28Å; E87-F91 HydrophobicContact CG-CD2 4.3Å; E87-F91 HydrophobicContact CG-CE2 4.18Å; E87-F91 WeakPolarHBondContact O-CA 3.46Å; E87-F91 VanDerWaalsContact O-CB 3.27Å; E87-F91 WeakPolarHBondContact O-CB 2.93Å; E87-F91 WeakPolarHBondContact O-CD2 3.48Å; E87-F91 PolarHBondContact O-N 3.26Å
88	K	45.1	Very low	39.8	Very low	150 Å²	150	92.8 Å²	92.8	65%	0.652	47%	0.472	S	S	*	.	H	α-helix	trans	-58.5	-26.4	175.9	-75.7	165.3	177.6	155.9	0	113.3	S84 G92	S84-K88 WeakPolarHBondContact O-CB 3.49Å; S84-K88 WeakPolarHBondContact O-CD 3.35Å; S84-K88 WeakPolarHBondContact O-CG 3.44Å; S84-K88 PolarHBondContact O-N 3.4Å; S84-K88 WeakPolarHBondContact OG-CE 3.3Å; S84-K88 PolarHBondContact OG-NZ 3.42Å; K88-G92 WeakPolarHBondContact O-CA 3.41Å; K88-G92 PolarHBondContact O-N 3.35Å
89	K	41.1	Very low	40.3	Very low	134 Å²	134	89.6 Å²	89.6	58%	0.583	47%	0.465	S	S	*	.	H	α-helix	trans	-83.4	-35.7	174.1	-77.6	169.7	175.7	158.9	0	113.7	N85 V86 E87 K93	N85-K89 WeakPolarHBondContact O-CB 2.96Å; N85-K89 WeakPolarHBondContact O-CD 3.38Å; N85-K89 VanDerWaalsContact O-CG 3.3Å; N85-K89 WeakPolarHBondContact O-CG 3.41Å; N85-K89 PolarHBondContact O-N 2.75Å; N85-K89 VanDerWaalsContact O-N 3.08Å; N85-K89 WeakPolarHBondContact OD1-CD 3.39Å; N85-K89 WeakPolarHBondContact OD1-CE 3.26Å; N85-K89 PolarHBondContact OD1-NZ 2.7Å; V86-K89 PolarHBondContact O-N 3.06Å; E87-K89 PolarHBondContact O-N 3.47Å; E87-K89 VanDerWaalsContact O-N 3.11Å; K89-K93 WeakPolarHBondContact O-CB 3.08Å; K89-K93 WeakPolarHBondContact O-CG 3.47Å; K89-K93 PolarHBondContact O-N 2.97Å
90	L	36.8	Very low	40.7	Very low	76 Å²	76	91.1 Å²	91.1	40%	0.398	47%	0.468	S	S	.	.	H	α-helix	trans	-80	-56	176.9	-90.8	164.2	0	0	0	111.5	V86 E87 G92 K93 L94	V86-L90 HydrophobicContact CG1-CD1 3.99Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 PolarHBondContact O-N 3.48Å; E87-L90 CarbonylContact O-C 3.5Å; E87-L90 PolarHBondContact O-N 2.82Å; E87-L90 VanDerWaalsContact O-N 3.09Å; L90-G92 VanDerWaalsContact C-N 3.32Å; L90-G92 PolarHBondContact O-N 3.42Å; L90-K93 PolarHBondContact O-N 3.28Å; L90-L94 WeakPolarHBondContact O-CB 3.5Å; L90-L94 WeakPolarHBondContact O-CG 3.29Å; L90-L94 PolarHBondContact O-N 2.91Å
91	F	37.2	Very low	40.5	Very low	124 Å²	124	89.8 Å²	89.8	54%	0.544	47%	0.465	S	S	.	.	H	α-helix	trans	-59.5	-39.8	170.3	-71.6	-75.1	0	0	0	111.5	E87 K93 L94 D95	E87-F91 HydrophobicContact CB-CD2 3.89Å; E87-F91 HydrophobicContact CB-CE2 4.28Å; E87-F91 HydrophobicContact CG-CD2 4.3Å; E87-F91 HydrophobicContact CG-CE2 4.18Å; E87-F91 WeakPolarHBondContact O-CA 3.46Å; E87-F91 VanDerWaalsContact O-CB 3.27Å; E87-F91 WeakPolarHBondContact O-CB 2.93Å; E87-F91 WeakPolarHBondContact O-CD2 3.48Å; E87-F91 PolarHBondContact O-N 3.26Å; F91-K93 PolarHBondContact O-N 3.43Å; F91-L94 CarbonylContact O-C 2.91Å; F91-L94 PolarHBondContact O-N 3.48Å; F91-D95 VanDerWaalsContact O-CB 3.32Å; F91-D95 WeakPolarHBondContact O-CB 3.33Å; F91-D95 PolarHBondContact O-N 3.45Å
92	G	39.4	Very low	40.8	Very low	27 Å²	27	91.6 Å²	91.6	28%	0.278	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-38.9	175.3	0	0	0	0	0	113.5	K88 L90 I96	K88-G92 WeakPolarHBondContact O-CA 3.41Å; K88-G92 PolarHBondContact O-N 3.35Å; L90-G92 VanDerWaalsContact C-N 3.32Å; L90-G92 PolarHBondContact O-N 3.42Å; G92-I96 WeakPolarHBondContact O-CB 3.31Å; G92-I96 WeakPolarHBondContact O-CD1 3.48Å; G92-I96 WeakPolarHBondContact O-CG1 3.29Å; G92-I96 PolarHBondContact O-N 3.37Å
93	K	39	Very low	41.2	Very low	151 Å²	151	91.8 Å²	91.8	66%	0.657	47%	0.466	S	S	*	.	H	α-helix	trans	-70.7	-38.5	171.7	-80.5	-174.5	171.3	-164.4	0	112.6	K89 L90 F91 I96 C97	K89-K93 WeakPolarHBondContact O-CB 3.08Å; K89-K93 WeakPolarHBondContact O-CG 3.47Å; K89-K93 PolarHBondContact O-N 2.97Å; L90-K93 PolarHBondContact O-N 3.28Å; F91-K93 PolarHBondContact O-N 3.43Å; K93-I96 PolarHBondContact O-N 3.46Å; K93-C97 PolarHBondContact O-N 2.9Å; K93-C97 PolarHBondContact O-SG 3.11Å
94	L	38.2	Very low	41.3	Very low	79 Å²	79	90.5 Å²	90.5	41%	0.414	46%	0.461	S	S	.	.	H	α-helix	trans	-65.8	-43	176.6	-83.1	160.9	0	0	0	111.4	L90 F91 C97 L98 F201	L90-L94 WeakPolarHBondContact O-CB 3.5Å; L90-L94 WeakPolarHBondContact O-CG 3.29Å; L90-L94 PolarHBondContact O-N 2.91Å; F91-L94 CarbonylContact O-C 2.91Å; F91-L94 PolarHBondContact O-N 3.48Å; L94-C97 CarbonylContact O-C 3.58Å; L94-C97 PolarHBondContact O-N 3.01Å; L94-L98 VanDerWaalsContact O-CB 3.23Å; L94-L98 WeakPolarHBondContact O-CB 3.44Å; L94-L98 PolarHBondContact O-N 3.3Å; L94-F201 HydrophobicContact CD2-CZ 4.31Å
95	D	42.5	Very low	41.1	Very low	83 Å²	83	94.1 Å²	94.1	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-62	-44.4	171.4	-87.8	6.6	0	0	0	110.6	F91 C97 L98 N99	F91-D95 VanDerWaalsContact O-CB 3.32Å; F91-D95 WeakPolarHBondContact O-CB 3.33Å; F91-D95 PolarHBondContact O-N 3.45Å; D95-C97 VanDerWaalsContact C-N 3.26Å; D95-C97 PolarHBondContact O-N 3.18Å; D95-L98 PolarHBondContact O-N 3.26Å; D95-N99 WeakPolarHBondContact O-CA 3.38Å; D95-N99 WeakPolarHBondContact O-CB 3.41Å; D95-N99 PolarHBondContact O-N 2.97Å; D95-N99 PolarHBondContact O-ND2 3.32Å
96	I	44.3	Very low	41.1	Very low	119 Å²	119	91.3 Å²	91.3	61%	0.61	46%	0.462	S	S	*	.	H	α-helix	trans	-58.6	-40.5	174.2	-72.9	163.9	0	0	0	110.8	G92 K93 K100	G92-I96 WeakPolarHBondContact O-CB 3.31Å; G92-I96 WeakPolarHBondContact O-CD1 3.48Å; G92-I96 WeakPolarHBondContact O-CG1 3.29Å; G92-I96 PolarHBondContact O-N 3.37Å; K93-I96 PolarHBondContact O-N 3.46Å; I96-K100 WeakPolarHBondContact O-CB 3.43Å; I96-K100 PolarHBondContact O-N 2.75Å
97	C	38	Very low	41.1	Very low	48 Å²	48	93.3 Å²	93.3	32%	0.324	47%	0.465	S	S	.	.	H	α-helix	trans	-71.4	-43.2	174.9	-71.5	0	0	0	0	112.8	K93 L94 D95 K100 I101	K93-C97 PolarHBondContact O-N 2.9Å; K93-C97 PolarHBondContact O-SG 3.11Å; L94-C97 CarbonylContact O-C 3.58Å; L94-C97 PolarHBondContact O-N 3.01Å; D95-C97 VanDerWaalsContact C-N 3.26Å; D95-C97 PolarHBondContact O-N 3.18Å; C97-K100 PolarHBondContact O-N 3.34Å; C97-I101 VanDerWaalsContact O-CG1 3.31Å; C97-I101 WeakPolarHBondContact O-CG1 3.43Å; C97-I101 PolarHBondContact O-N 3.21Å
98	L	41.2	Very low	40.9	Very low	90 Å²	90	92.5 Å²	92.5	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-71.1	-47.2	-176.1	-160.9	89	0	0	0	110.6	L94 D95 K100 I101 Q102	L94-L98 VanDerWaalsContact O-CB 3.23Å; L94-L98 WeakPolarHBondContact O-CB 3.44Å; L94-L98 PolarHBondContact O-N 3.3Å; D95-L98 PolarHBondContact O-N 3.26Å; L98-K100 PolarHBondContact O-N 2.74Å; L98-I101 PolarHBondContact O-N 2.9Å; L98-Q102 VanDerWaalsContact O-CB 3.29Å; L98-Q102 WeakPolarHBondContact O-CB 3.4Å; L98-Q102 WeakPolarHBondContact O-CG 3.32Å; L98-Q102 PolarHBondContact O-N 2.86Å
99	N	45.9	Very low	40.5	Very low	86 Å²	86	90 Å²	90	46%	0.46	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-27.4	171.6	-66.3	-36.8	0	0	0	111.5	D95 S103	D95-N99 WeakPolarHBondContact O-CA 3.38Å; D95-N99 WeakPolarHBondContact O-CB 3.41Å; D95-N99 PolarHBondContact O-N 2.97Å; D95-N99 PolarHBondContact O-ND2 3.32Å; N99-S103 WeakPolarHBondContact O-CA 3.42Å; N99-S103 WeakPolarHBondContact O-CB 3.29Å; N99-S103 PolarHBondContact O-N 3.35Å
100	K	45.2	Very low	40.6	Very low	123 Å²	123	88.9 Å²	88.9	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-80.7	-33.5	175	-163.3	166.5	-166.2	171.1	0	112.8	I96 C97 L98 L104	I96-K100 WeakPolarHBondContact O-CB 3.43Å; I96-K100 PolarHBondContact O-N 2.75Å; C97-K100 PolarHBondContact O-N 3.34Å; L98-K100 PolarHBondContact O-N 2.74Å; K100-L104 WeakPolarHBondContact O-CD1 3.39Å; K100-L104 VanDerWaalsContact O-CG 3.24Å; K100-L104 WeakPolarHBondContact O-CG 3.23Å; K100-L104 PolarHBondContact O-N 3.08Å
101	I	42	Very low	40.9	Very low	82 Å²	82	92.3 Å²	92.3	42%	0.421	48%	0.484	S	S	.	.	H	α-helix	trans	-65.8	-51.8	168.1	-69.6	162.2	0	0	0	109.5	C97 L98 S103 L104 E105	C97-I101 VanDerWaalsContact O-CG1 3.31Å; C97-I101 WeakPolarHBondContact O-CG1 3.43Å; C97-I101 PolarHBondContact O-N 3.21Å; L98-I101 PolarHBondContact O-N 2.9Å; I101-S103 VanDerWaalsContact C-N 3.27Å; I101-S103 PolarHBondContact O-N 2.87Å; I101-L104 CarbonylContact O-C 3.57Å; I101-L104 WeakPolarHBondContact O-CA 3.07Å; I101-L104 WeakPolarHBondContact O-CB 3.45Å; I101-L104 PolarHBondContact O-N 3.2Å; I101-E105 WeakPolarHBondContact O-CG 3.49Å; I101-E105 PolarHBondContact O-N 2.9Å
102	Q	46.6	Very low	40.9	Very low	96 Å²	96	93.5 Å²	93.5	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-30.9	175.4	-72.4	179	-16.6	0	0	112.4	L98 A106	L98-Q102 VanDerWaalsContact O-CB 3.29Å; L98-Q102 WeakPolarHBondContact O-CB 3.4Å; L98-Q102 WeakPolarHBondContact O-CG 3.32Å; L98-Q102 PolarHBondContact O-N 2.86Å; Q102-A106 WeakPolarHBondContact O-CA 3.44Å; Q102-A106 WeakPolarHBondContact O-CB 3.29Å; Q102-A106 PolarHBondContact O-N 3.42Å
103	S	44.7	Very low	40.6	Very low	49 Å²	49	97 Å²	97	34%	0.343	51%	0.505	S	S	.	.	H	α-helix	trans	-72.5	-31.5	172	169.4	0	0	0	0	112.1	N99 I101 H107	N99-S103 WeakPolarHBondContact O-CA 3.42Å; N99-S103 WeakPolarHBondContact O-CB 3.29Å; N99-S103 PolarHBondContact O-N 3.35Å; I101-S103 VanDerWaalsContact C-N 3.27Å; I101-S103 PolarHBondContact O-N 2.87Å; S103-H107 WeakPolarHBondContact O-CB 3.48Å; S103-H107 PolarHBondContact O-CD2 2.95Å; S103-H107 PolarHBondContact O-N 2.79Å; S103-H107 PolarHBondContact OG-CD2 3.21Å
104	L	41.2	Very low	40.5	Very low	84 Å²	84	96.9 Å²	96.9	44%	0.44	51%	0.507	S	S	.	.	H	α-helix	trans	-74.3	-42	172.1	-71.6	165.2	0	0	0	111.3	K100 I101 A106 H107 A108 L243	K100-L104 WeakPolarHBondContact O-CD1 3.39Å; K100-L104 VanDerWaalsContact O-CG 3.24Å; K100-L104 WeakPolarHBondContact O-CG 3.23Å; K100-L104 PolarHBondContact O-N 3.08Å; I101-L104 CarbonylContact O-C 3.57Å; I101-L104 WeakPolarHBondContact O-CA 3.07Å; I101-L104 WeakPolarHBondContact O-CB 3.45Å; I101-L104 PolarHBondContact O-N 3.2Å; L104-A106 VanDerWaalsContact C-N 3.29Å; L104-A106 PolarHBondContact O-N 2.9Å; L104-H107 PolarHBondContact O-N 3.35Å; L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3.33Å; L104-L243 HydrophobicContact CD1-CD1 4.24Å
105	E	40.2	Very low	40.2	Very low	111 Å²	111	100.7 Å²	100.7	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-37.7	169.1	-68.4	179.3	148.6	0	0	111.3	I101 A108 N109	I101-E105 WeakPolarHBondContact O-CG 3.49Å; I101-E105 PolarHBondContact O-N 2.9Å; E105-A108 PolarHBondContact O-N 2.88Å; E105-N109 VanDerWaalsContact O-CB 3.32Å; E105-N109 WeakPolarHBondContact O-CB 3.18Å; E105-N109 PolarHBondContact O-N 3.43Å; E105-N109 VanDerWaalsContact O-N 3.13Å; E105-N109 PolarHBondContact O-ND2 3.42Å
106	A	38.4	Very low	40	Very low	24 Å²	24	102.9 Å²	102.9	20%	0.198	54%	0.54	C	S	.	.	H	α-helix	trans	-72.7	-43.6	176.6	0	0	0	0	0	111.5	Q102 L104 A108 N109 Q110	Q102-A106 WeakPolarHBondContact O-CA 3.44Å; Q102-A106 WeakPolarHBondContact O-CB 3.29Å; Q102-A106 PolarHBondContact O-N 3.42Å; L104-A106 VanDerWaalsContact C-N 3.29Å; L104-A106 PolarHBondContact O-N 2.9Å; A106-A108 PolarHBondContact O-N 2.88Å; A106-N109 CarbonylContact O-C 3.59Å; A106-N109 WeakPolarHBondContact O-CA 3.37Å; A106-N109 PolarHBondContact O-N 3.06Å; A106-Q110 HydrophobicContact CB-CG 4.35Å; A106-Q110 WeakPolarHBondContact O-CA 3.18Å; A106-Q110 VanDerWaalsContact O-CB 3.23Å; A106-Q110 WeakPolarHBondContact O-CB 3.37Å; A106-Q110 PolarHBondContact O-N 3.27Å
107	H	38.6	Very low	39.8	Very low	128 Å²	128	104.7 Å²	104.7	59%	0.593	55%	0.551	S	S	*	*	H	α-helix	trans	-64.6	-25.9	173.3	-77.4	-60	0	0	0	112.2	S103 L104 N109 N111	S103-H107 WeakPolarHBondContact O-CB 3.48Å; S103-H107 PolarHBondContact O-CD2 2.95Å; S103-H107 PolarHBondContact O-N 2.79Å; S103-H107 PolarHBondContact OG-CD2 3.21Å; L104-H107 PolarHBondContact O-N 3.35Å; H107-N109 VanDerWaalsContact C-N 3.32Å; H107-N111 PolarHBondContact O-ND2 2.7Å
108	A	32.7	Very low	39.5	Very low	79 Å²	79	113.1 Å²	113.1	65%	0.653	58%	0.576	S	S	*	*	H	α-helix	trans	-72.5	-19.3	167.1	0	0	0	0	0	114	L104 E105 A106	L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3.33Å; E105-A108 PolarHBondContact O-N 2.88Å; A106-A108 PolarHBondContact O-N 2.88Å
109	N	37.7	Very low	39.5	Very low	96 Å²	96	114.1 Å²	114.1	51%	0.513	59%	0.588	S	S	.	*	H	α-helix	trans	-118.9	-16.9	-173.6	-79.8	-64.4	0	0	0	116.2	E105 A106 H107 K112	E105-N109 VanDerWaalsContact O-CB 3.32Å; E105-N109 WeakPolarHBondContact O-CB 3.18Å; E105-N109 PolarHBondContact O-N 3.43Å; E105-N109 VanDerWaalsContact O-N 3.13Å; E105-N109 PolarHBondContact O-ND2 3.42Å; A106-N109 CarbonylContact O-C 3.59Å; A106-N109 WeakPolarHBondContact O-CA 3.37Å; A106-N109 PolarHBondContact O-N 3.06Å; H107-N109 VanDerWaalsContact C-N 3.32Å; N109-K112 WeakPolarHBondContact O-CD 3.45Å; N109-K112 WeakPolarHBondContact O-CE 3.35Å; N109-K112 WeakPolarHBondContact O-CG 3.32Å; N109-K112 PolarHBondContact O-NZ 2.73Å
110	Q	44.1	Very low	39	Very low	112 Å²	112	116.6 Å²	116.6	52%	0.523	61%	0.606	S	S	.	*			trans	-122.5	33.7	-169.7	-67.3	-164.7	-82.2	0	0	112.3	A106 K112	A106-Q110 HydrophobicContact CB-CG 4.35Å; A106-Q110 WeakPolarHBondContact O-CA 3.18Å; A106-Q110 VanDerWaalsContact O-CB 3.23Å; A106-Q110 WeakPolarHBondContact O-CB 3.37Å; A106-Q110 PolarHBondContact O-N 3.27Å; Q110-K112 PolarHBondContact O-N 3.16Å
111	N	41.1	Very low	38.5	Very low	147 Å²	147	117.7 Å²	117.7	79%	0.786	62%	0.618	S	S	*	*	S	Bend	trans	-68.7	58.7	143.2	-63.6	-57.8	0	0	0	108.1	H107	H107-N111 PolarHBondContact O-ND2 2.7Å
112	K	38.8	Very low	38.4	Very low	150 Å²	150	118.9 Å²	118.9	65%	0.652	63%	0.633	S	S	*	*	S	Bend	trans	-147.8	-49.8	-164.5	-64.7	-168.3	-173.4	136.7	0	117.4	N109 Q110	N109-K112 WeakPolarHBondContact O-CD 3.45Å; N109-K112 WeakPolarHBondContact O-CE 3.35Å; N109-K112 WeakPolarHBondContact O-CG 3.32Å; N109-K112 PolarHBondContact O-NZ 2.73Å; Q110-K112 PolarHBondContact O-N 3.16Å
113	T	32.8	Very low	38	Very low	99 Å²	99	122.9 Å²	122.9	61%	0.607	65%	0.652	S	S	*	*			trans	-174.8	157	-179.4	14	0	0	0	0	116.6
114	E	35.7	Very low	37.5	Very low	150 Å²	150	129.2 Å²	129.2	70%	0.701	68%	0.676	S	S	*	*			trans	-131.4	-174.4	-177.8	-45.5	68.6	-142.1	0	0	109.1
115	D	33.6	Very low	37.3	Very low	158 Å²	158	132 Å²	132	85%	0.845	70%	0.697	S	S	*	*			cis	-162.4	-158.1	-3.4	-151.2	-32.7	0	0	0	109.4
116	D	37.2	Very low	37.5	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	70%	0.704	S	S	*	*			trans	99.6	89.5	142.5	-126.5	-3.9	0	0	0	122.5
117	N	39.8	Very low	37.6	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	72%	0.721	S	S	*	*			trans	72.7	177.1	132.4	-83.2	-52.7	0	0	0	126.3
118	R	32.6	Very low	37.5	Very low	225 Å²	225	134.3 Å²	134.3	85%	0.849	73%	0.726	S	S	*	*			trans	-149.4	155.7	-140.2	171.5	-174.2	169.2	-168.9	-1.4	117.2
119	P	40.9	Very low	37.7	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	73%	0.732	S	S	*	*			trans	-111.5	-177.4	178	42.4	-35.9	0	0	0	118.2
120	T	35.4	Very low	37.6	Very low	137 Å²	137	141.3 Å²	141.3	84%	0.84	74%	0.742	S	S	*	*			trans	-149.1	175.8	-172.3	-34.6	0	0	0	0	115.2
121	N	35.6	Very low	37.3	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	76%	0.756	S	S	*	*			trans	-133.2	173.5	-157.8	-24.6	-44.7	0	0	0	117.5
122	S	38.7	Very low	37.1	Very low	106 Å²	106	144.3 Å²	144.3	74%	0.741	76%	0.756	S	S	*	*			trans	175.4	168	159.5	56.1	0	0	0	0	112.5
123	E	37.4	Very low	36.9	Very low	180 Å²	180	142.3 Å²	142.3	84%	0.841	76%	0.761	S	S	*	*			cis	-171.9	-180	-44.4	-97.5	141.9	-133.9	0	0	111
124	E	35.8	Very low	37.3	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	76%	0.764	S	S	*	*			trans	-132.6	167.4	-162.7	-51.9	174.9	127.1	0	0	117.1
125	T	36.3	Very low	37.3	Very low	143 Å²	143	143.3 Å²	143.3	88%	0.877	77%	0.769	S	S	*	*				172.8	156.9	129.1	28.4	0	0	0	0	117.9
126	P	44.3	Very low	37.6	Very low	103 Å²	103	144.7 Å²	144.7	67%	0.669	77%	0.773	S	S	*	*			trans	-147	179.8	-168.5	35.7	-9.7	0	0	0	121.1
127	I	41.5	Very low	38.2	Very low	109 Å²	109	140.8 Å²	140.8	56%	0.559	76%	0.756	S	S	*	*			trans	66.5	141.7	153.5	-55	134.4	0	0	0	125.9	E52	E52-I127 HydrophobicContact CG-CD1 3.38Å; E52-I127 HydrophobicContact CG-CG1 4.24Å
128	S	35.2	Very low	38	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	74%	0.739	S	S	*	*			trans	-169.7	170.1	152.9	62.9	0	0	0	0	109
129	Q	38.3	Very low	38.2	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	72%	0.72	S	S	*	*			cis	-172.8	169.1	-14.4	-116.9	166.2	-79.9	0	0	106.2
130	E	35.7	Very low	38.8	Very low	154 Å²	154	129.8 Å²	129.8	72%	0.72	71%	0.708	S	S	*	*			cis	-162	-165.4	-1.5	-160.7	164.8	-81.2	0	0	109.5
131	E	36.3	Very low	39.2	Very low	175 Å²	175	128 Å²	128	82%	0.818	69%	0.691	S	S	*	*			trans	-124.3	176.7	-173.9	-53	179.9	113	0	0	115.1
132	N	36.7	Very low	39.4	Very low	148 Å²	148	126.6 Å²	126.6	79%	0.791	68%	0.675	S	S	*	*			trans	176.6	153.9	138.6	-106.2	-67.9	0	0	0	120.6
133	S	35.4	Very low	39.6	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	66%	0.664	S	S	*	*			trans	73.2	152.3	148.3	73.9	0	0	0	0	123.3
134	S	41.3	Very low	40.3	Very low	96 Å²	96	122.8 Å²	122.8	67%	0.671	65%	0.652	S	S	*	*			cis	-170	143.9	-26.6	55.9	0	0	0	0	116	M136	S134-M136 PolarHBondContact O-N 2.97Å; S134-M136 VanDerWaalsContact O-N 3.11Å
135	E	34.9	Very low	41.1	Very low	173 Å²	173	116.1 Å²	116.1	81%	0.808	62%	0.624	S	S	*	*			trans	65.5	-28	141.7	-70.3	-174.4	144.6	0	0	126.1	S137	E135-S137 PolarHBondContact O-N 2.95Å
136	M	39.6	Very low	41.7	Very low	188 Å²	188	109.8 Å²	109.8	93%	0.926	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	21.7	-174	-157.4	74	-98.1	0	0	115.2	S134	S134-M136 PolarHBondContact O-N 2.97Å; S134-M136 VanDerWaalsContact O-N 3.11Å
137	S	50.9	Low	42.7	Very low	47 Å²	47	109.6 Å²	109.6	33%	0.329	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	-28.6	-160.4	173.8	0	0	0	0	115	E135 Y139 S140 E141	E135-S137 PolarHBondContact O-N 2.95Å; S137-Y139 PolarHBondContact O-N 3.41Å; S137-Y139 VanDerWaalsContact O-N 3.12Å; S137-S140 PolarHBondContact O-N 3.14Å; S137-S140 VanDerWaalsContact O-N 3.13Å; S137-S140 PolarHBondContact O-OG 2.95Å; S137-E141 WeakPolarHBondContact CB-OE2 3.4Å; S137-E141 PolarHBondContact O-N 2.83Å; S137-E141 PolarHBondContact OG-OE2 2.99Å
138	V	35.1	Very low	43.8	Very low	80 Å²	80	108.1 Å²	108.1	49%	0.485	57%	0.565	S	S	.	*	H	α-helix	trans	-52.1	-45.9	-150.6	-175.2	0	0	0	0	116.9	E141 Y142	V138-E141 VanDerWaalsContact O-CB 3.3Å; V138-E141 WeakPolarHBondContact O-CB 3.46Å; V138-E141 PolarHBondContact O-N 3.37Å; V138-Y142 HydrophobicContact CG1-CD2 3.91Å; V138-Y142 HydrophobicContact CG1-CE2 3.53Å; V138-Y142 WeakPolarHBondContact O-CD2 3.41Å; V138-Y142 PolarHBondContact O-N 3.09Å
139	Y	36.1	Very low	44.4	Very low	113 Å²	113	104.9 Å²	104.9	44%	0.443	54%	0.539	S	S	.	.	H	α-helix	trans	-74.1	-39.1	-176.1	-159	-83.8	0	0	0	112.2	S137 E141 Q143 E311	S137-Y139 PolarHBondContact O-N 3.41Å; S137-Y139 VanDerWaalsContact O-N 3.12Å; Y139-E141 VanDerWaalsContact C-N 3.29Å; Y139-Q143 PolarHBondContact O-N 3.04Å; Y139-E311 HydrophobicContact CE2-CB 4.18Å
140	S	54.3	Low	45.3	Very low	70 Å²	70	99.8 Å²	99.8	49%	0.49	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-37.8	167.1	23.2	0	0	0	0	111.4	S137 Q143 V144	S137-S140 PolarHBondContact O-N 3.14Å; S137-S140 VanDerWaalsContact O-N 3.13Å; S137-S140 PolarHBondContact O-OG 2.95Å; S140-Q143 PolarHBondContact O-N 3.21Å; S140-V144 WeakPolarHBondContact O-CB 3.41Å; S140-V144 VanDerWaalsContact O-CG2 3.29Å; S140-V144 WeakPolarHBondContact O-CG2 3.36Å; S140-V144 PolarHBondContact O-N 3.06Å
141	E	43.7	Very low	46.7	Very low	100 Å²	100	100.5 Å²	100.5	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-61.8	-44.7	178	-145.7	173.4	135.7	0	0	112.2	S137 V138 Y139 Q143 V144 T145	S137-E141 WeakPolarHBondContact CB-OE2 3.4Å; S137-E141 PolarHBondContact O-N 2.83Å; S137-E141 PolarHBondContact OG-OE2 2.99Å; V138-E141 VanDerWaalsContact O-CB 3.3Å; V138-E141 WeakPolarHBondContact O-CB 3.46Å; V138-E141 PolarHBondContact O-N 3.37Å; Y139-E141 VanDerWaalsContact C-N 3.29Å; E141-Q143 VanDerWaalsContact C-N 3.31Å; E141-Q143 PolarHBondContact O-N 3.26Å; E141-V144 PolarHBondContact O-N 3.39Å; E141-T145 WeakPolarHBondContact O-CB 3.47Å; E141-T145 VanDerWaalsContact O-CG2 3.31Å; E141-T145 WeakPolarHBondContact O-CG2 3.33Å; E141-T145 PolarHBondContact O-N 3.47Å; E141-T145 PolarHBondContact O-OG1 3.14Å
142	Y	39.3	Very low	47.1	Very low	116 Å²	116	97.4 Å²	97.4	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-34.7	174.7	-76.9	-52.5	0	0	0	113	V138 T145 L146 L304	V138-Y142 HydrophobicContact CG1-CD2 3.91Å; V138-Y142 HydrophobicContact CG1-CE2 3.53Å; V138-Y142 WeakPolarHBondContact O-CD2 3.41Å; V138-Y142 PolarHBondContact O-N 3.09Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.38Å; Y142-T145 PolarHBondContact O-OG1 3.41Å; Y142-L146 VanDerWaalsContact O-CB 3.26Å; Y142-L146 WeakPolarHBondContact O-CB 3.29Å; Y142-L146 PolarHBondContact O-N 3.42Å; Y142-L146 VanDerWaalsContact O-N 3.12Å; Y142-L304 HydrophobicContact CD1-CD2 3.72Å; Y142-L304 HydrophobicContact CE1-CD2 4.16Å
143	Q	43.7	Very low	47.6	Very low	111 Å²	111	91.8 Å²	91.8	52%	0.519	46%	0.461	S	S	.	.	H	α-helix	trans	-76.6	-39.2	177.6	-164.2	166.8	9.4	0	0	112.2	Y139 S140 E141 E147	Y139-Q143 PolarHBondContact O-N 3.04Å; S140-Q143 PolarHBondContact O-N 3.21Å; E141-Q143 VanDerWaalsContact C-N 3.31Å; E141-Q143 PolarHBondContact O-N 3.26Å; Q143-E147 PolarHBondContact O-N 3.4Å; Q143-E147 VanDerWaalsContact O-N 3.17Å
144	V	52	Low	48.6	Very low	96 Å²	96	92 Å²	92	58%	0.582	45%	0.45	S	S	*	.	H	α-helix	trans	-65.6	-46	174.8	169.1	0	0	0	0	111.1	S140 E141 L146 E147 E148	S140-V144 WeakPolarHBondContact O-CB 3.41Å; S140-V144 VanDerWaalsContact O-CG2 3.29Å; S140-V144 WeakPolarHBondContact O-CG2 3.36Å; S140-V144 PolarHBondContact O-N 3.06Å; E141-V144 PolarHBondContact O-N 3.39Å; V144-L146 PolarHBondContact O-N 3.31Å; V144-E147 PolarHBondContact O-N 2.89Å; V144-E148 VanDerWaalsContact O-CB 3.29Å; V144-E148 WeakPolarHBondContact O-CB 3.37Å; V144-E148 PolarHBondContact O-N 3.19Å
145	T	52.9	Low	49.2	Very low	43 Å²	43	92 Å²	92	26%	0.264	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-31.9	178.3	52.3	0	0	0	0	113	E141 Y142 H149	E141-T145 WeakPolarHBondContact O-CB 3.47Å; E141-T145 VanDerWaalsContact O-CG2 3.31Å; E141-T145 WeakPolarHBondContact O-CG2 3.33Å; E141-T145 PolarHBondContact O-N 3.47Å; E141-T145 PolarHBondContact O-OG1 3.14Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.38Å; Y142-T145 PolarHBondContact O-OG1 3.41Å; T145-H149 VanDerWaalsContact O-CB 3.28Å; T145-H149 WeakPolarHBondContact O-CB 3.18Å; T145-H149 PolarHBondContact O-N 3.21Å
146	L	47.7	Very low	49.5	Very low	9 Å²	9	86.3 Å²	86.3	5%	0.047	41%	0.414	C	S	.	.	H	α-helix	trans	-63.4	-51.1	172.2	178.3	62.4	0	0	0	111.7	Y142 V144 H149 K150 I301 L304 E305 L308	Y142-L146 VanDerWaalsContact O-CB 3.26Å; Y142-L146 WeakPolarHBondContact O-CB 3.29Å; Y142-L146 PolarHBondContact O-N 3.42Å; Y142-L146 VanDerWaalsContact O-N 3.12Å; V144-L146 PolarHBondContact O-N 3.31Å; L146-H149 PolarHBondContact O-N 2.81Å; L146-K150 HydrophobicContact CG-CD 4.49Å; L146-K150 WeakPolarHBondContact O-CG 3.38Å; L146-K150 PolarHBondContact O-N 2.85Å; L146-I301 HydrophobicContact CD1-CB 4.45Å; L146-I301 HydrophobicContact CD1-CG1 4.35Å; L146-I301 HydrophobicContact CD1-CG2 4.03Å; L146-L304 HydrophobicContact CB-CD1 4.43Å; L146-L304 HydrophobicContact CD1-CB 4.08Å; L146-L304 HydrophobicContact CD1-CD1 4.36Å; L146-E305 HydrophobicContact CD1-CG 3.9Å; L146-E305 HydrophobicContact CD2-CG 4.03Å; L146-L308 HydrophobicContact CD2-CD1 4.34Å
147	E	67.3	Low	49.9	Very low	100 Å²	100	80.5 Å²	80.5	47%	0.467	38%	0.384	S	S	.	.	H	α-helix	trans	-72.2	-29.5	-179	-64.3	-54.6	126	0	0	112.5	Q143 V144 K150 R151	Q143-E147 PolarHBondContact O-N 3.4Å; Q143-E147 VanDerWaalsContact O-N 3.17Å; V144-E147 PolarHBondContact O-N 2.89Å; E147-K150 WeakPolarHBondContact OE1-CD 3.45Å; E147-K150 IonicContact OE1-NZ 3.86Å; E147-K150 PolarHBondContact OE1-NZ 2.87Å; E147-R151 PolarHBondContact O-N 2.71Å
148	E	62.7	Low	49.9	Very low	78 Å²	78	84 Å²	84	36%	0.364	39%	0.393	S	S	.	.	H	α-helix	trans	-66.5	-45.6	168.8	-167.2	-170.7	-162.9	0	0	111.7	V144 K150 R151 R152	V144-E148 VanDerWaalsContact O-CB 3.29Å; V144-E148 WeakPolarHBondContact O-CB 3.37Å; V144-E148 PolarHBondContact O-N 3.19Å; E148-K150 VanDerWaalsContact C-N 3.3Å; E148-K150 PolarHBondContact O-N 2.95Å; E148-R151 PolarHBondContact O-N 3.3Å; E148-R152 VanDerWaalsContact CD-NE 3.33Å; E148-R152 HydrophobicContact CG-CG 4.38Å; E148-R152 WeakPolarHBondContact O-CG 3.27Å; E148-R152 PolarHBondContact O-N 3.18Å; E148-R152 IonicContact OE1-CZ 3.68Å; E148-R152 VanDerWaalsContact OE1-CZ 3.26Å; E148-R152 IonicContact OE1-NE 3.77Å; E148-R152 PolarHBondContact OE1-NE 3.41Å; E148-R152 VanDerWaalsContact OE1-NE 3.1Å; E148-R152 IonicContact OE1-NH2 2.66Å; E148-R152 PolarHBondContact OE1-NH2 2.85Å; E148-R152 IonicContact OE2-CZ 2.92Å; E148-R152 IonicContact OE2-NE 2.65Å; E148-R152 IonicContact OE2-NH2 3.19Å; E148-R152 PolarHBondContact OE2-NH2 2.85Å
149	H	49.4	Very low	50.2	Low	30 Å²	30	84.4 Å²	84.4	14%	0.139	39%	0.393	C	S	.	.	H	α-helix	trans	-62	-37.2	176.2	-80.7	-21.9	0	0	0	112.3	T145 L146 L153 L297 I301	T145-H149 VanDerWaalsContact O-CB 3.28Å; T145-H149 WeakPolarHBondContact O-CB 3.18Å; T145-H149 PolarHBondContact O-N 3.21Å; L146-H149 PolarHBondContact O-N 2.81Å; H149-L153 WeakPolarHBondContact O-CB 3.33Å; H149-L153 PolarHBondContact O-N 3.28Å; H149-L297 HydrophobicContact CB-CD2 4.47Å; H149-I301 HydrophobicContact CB-CD1 4.34Å; H149-I301 HydrophobicContact CB-CG1 4.1Å
150	K	55.8	Low	50.4	Low	61 Å²	61	81 Å²	81	27%	0.265	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-46.2	171.2	-72.1	170.3	-174.8	171.8	0	112.2	L146 E147 E148 L153 E154 I301 E305	L146-K150 HydrophobicContact CG-CD 4.49Å; L146-K150 WeakPolarHBondContact O-CG 3.38Å; L146-K150 PolarHBondContact O-N 2.85Å; E147-K150 WeakPolarHBondContact OE1-CD 3.45Å; E147-K150 IonicContact OE1-NZ 3.86Å; E147-K150 PolarHBondContact OE1-NZ 2.87Å; E148-K150 VanDerWaalsContact C-N 3.3Å; E148-K150 PolarHBondContact O-N 2.95Å; K150-L153 VanDerWaalsContact O-CB 3.32Å; K150-L153 WeakPolarHBondContact O-CB 3.35Å; K150-L153 PolarHBondContact O-N 3.5Å; K150-E154 PolarHBondContact O-N 2.99Å; K150-I301 HydrophobicContact CG-CD1 4.11Å; K150-E305 WeakPolarHBondContact CE-OE1 3.11Å; K150-E305 IonicContact NZ-OE1 3.94Å; K150-E305 PolarHBondContact NZ-OE1 3.08Å
151	R	64.9	Low	50.2	Low	169 Å²	169	84 Å²	84	64%	0.638	39%	0.388	S	S	*	.	H	α-helix	trans	-60	-48.1	176.6	-171.3	-173.8	-57.7	-168	3.2	112.1	E147 E148 L153 E154 E155	E147-R151 PolarHBondContact O-N 2.71Å; E148-R151 PolarHBondContact O-N 3.3Å; R151-L153 VanDerWaalsContact C-N 3.26Å; R151-L153 PolarHBondContact O-N 3.47Å; R151-E154 PolarHBondContact O-N 3.23Å; R151-E155 WeakPolarHBondContact CG-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CG 3.12Å; R151-E155 PolarHBondContact O-N 3.47Å
152	R	46.1	Very low	50.2	Low	109 Å²	109	84.5 Å²	84.5	41%	0.411	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-36.2	176.6	-68.7	176.4	-176.6	-159.8	9.2	111.5	E148 E155 M156	E148-R152 VanDerWaalsContact CD-NE 3.33Å; E148-R152 HydrophobicContact CG-CG 4.38Å; E148-R152 WeakPolarHBondContact O-CG 3.27Å; E148-R152 PolarHBondContact O-N 3.18Å; E148-R152 IonicContact OE1-CZ 3.68Å; E148-R152 VanDerWaalsContact OE1-CZ 3.26Å; E148-R152 IonicContact OE1-NE 3.77Å; E148-R152 PolarHBondContact OE1-NE 3.41Å; E148-R152 VanDerWaalsContact OE1-NE 3.1Å; E148-R152 IonicContact OE1-NH2 2.66Å; E148-R152 PolarHBondContact OE1-NH2 2.85Å; E148-R152 IonicContact OE2-CZ 2.92Å; E148-R152 IonicContact OE2-NE 2.65Å; E148-R152 IonicContact OE2-NH2 3.19Å; E148-R152 PolarHBondContact OE2-NH2 2.85Å; R152-E155 PolarHBondContact O-N 3Å; R152-M156 WeakPolarHBondContact O-CG 3.31Å; R152-M156 PolarHBondContact O-N 2.83Å
153	L	46.2	Very low	50.2	Low	30 Å²	30	82.1 Å²	82.1	16%	0.157	38%	0.382	C	S	.	.	H	α-helix	trans	-63.3	-47.2	174.7	-161.8	78.7	0	0	0	111.9	H149 K150 R151 E155 M156 E157 K294 L297 E298 I301	H149-L153 WeakPolarHBondContact O-CB 3.33Å; H149-L153 PolarHBondContact O-N 3.28Å; K150-L153 VanDerWaalsContact O-CB 3.32Å; K150-L153 WeakPolarHBondContact O-CB 3.35Å; K150-L153 PolarHBondContact O-N 3.5Å; R151-L153 VanDerWaalsContact C-N 3.26Å; R151-L153 PolarHBondContact O-N 3.47Å; L153-E155 PolarHBondContact O-N 2.7Å; L153-M156 PolarHBondContact O-N 2.87Å; L153-E157 PolarHBondContact O-N 2.95Å; L153-K294 HydrophobicContact CD1-CB 4.47Å; L153-K294 HydrophobicContact CD1-CG 3.69Å; L153-L297 HydrophobicContact CD1-CB 3.67Å; L153-L297 HydrophobicContact CD1-CD1 4.15Å; L153-E298 HydrophobicContact CD1-CG 4.15Å; L153-E298 HydrophobicContact CD2-CG 4.2Å; L153-I301 HydrophobicContact CD2-CD1 4.15Å
154	E	57.2	Low	50	Low	112 Å²	112	82.2 Å²	82.2	52%	0.523	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.3	-74.3	-167.5	-159.4	0	0	112.9	K150 R151 E157 K158	K150-E154 PolarHBondContact O-N 2.99Å; R151-E154 PolarHBondContact O-N 3.23Å; E154-E157 PolarHBondContact O-N 3.16Å; E154-K158 VanDerWaalsContact O-CD 3.31Å; E154-K158 WeakPolarHBondContact O-CD 3.45Å; E154-K158 WeakPolarHBondContact O-CG 3.43Å; E154-K158 PolarHBondContact O-N 3.11Å; E154-K158 IonicContact OE2-NZ 3.1Å; E154-K158 PolarHBondContact OE2-NZ 3.3Å
155	E	53.1	Low	49.4	Very low	96 Å²	96	79 Å²	79	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-42.1	178.1	-73.6	170.1	-172.2	0	0	111.1	R151 R152 L153 K158 L159	R151-E155 WeakPolarHBondContact CG-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CG 3.12Å; R151-E155 PolarHBondContact O-N 3.47Å; R152-E155 PolarHBondContact O-N 3Å; L153-E155 PolarHBondContact O-N 2.7Å; E155-K158 PolarHBondContact O-N 3.09Å; E155-L159 WeakPolarHBondContact O-CG 3.3Å; E155-L159 PolarHBondContact O-N 3.43Å
156	M	42	Very low	49	Very low	55 Å²	55	81.7 Å²	81.7	27%	0.271	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-40.9	172.3	-71.6	179.8	-172.9	0	0	112.4	R152 L153 K158 L159 V160 I290 V293 L297	R152-M156 WeakPolarHBondContact O-CG 3.31Å; R152-M156 PolarHBondContact O-N 2.83Å; L153-M156 PolarHBondContact O-N 2.87Å; M156-K158 PolarHBondContact O-N 3.23Å; M156-L159 PolarHBondContact O-N 3.27Å; M156-V160 WeakPolarHBondContact O-CG2 3.43Å; M156-V160 PolarHBondContact O-N 2.93Å; M156-I290 HydrophobicContact CB-CG2 4.1Å; M156-I290 HydrophobicContact CG-CG2 4.44Å; M156-V293 HydrophobicContact CE-CG1 3.74Å; M156-V293 HydrophobicContact SD-CB 4.48Å; M156-V293 HydrophobicContact SD-CG1 3.66Å; M156-L297 HydrophobicContact CE-CD1 4.16Å; M156-L297 HydrophobicContact SD-CD1 3.75Å
157	E	46.6	Very low	48.5	Very low	66 Å²	66	87.2 Å²	87.2	31%	0.308	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-42.2	173.7	-73.9	-138.1	156	0	0	112.8	L153 E154 L159 V160 K161 K294	L153-E157 PolarHBondContact O-N 2.95Å; E154-E157 PolarHBondContact O-N 3.16Å; E157-L159 VanDerWaalsContact C-N 3.31Å; E157-L159 PolarHBondContact O-N 3.2Å; E157-V160 PolarHBondContact O-N 2.79Å; E157-K161 WeakPolarHBondContact O-CB 3.49Å; E157-K161 WeakPolarHBondContact O-CD 3.45Å; E157-K161 VanDerWaalsContact O-CG 3.26Å; E157-K161 WeakPolarHBondContact O-CG 3.26Å; E157-K161 PolarHBondContact O-N 3.11Å; E157-K161 IonicContact OE2-NZ 3.84Å; E157-K161 PolarHBondContact OE2-NZ 2.98Å; E157-K294 IonicContact OE1-NZ 2.64Å; E157-K294 PolarHBondContact OE1-NZ 3.04Å
158	K	51.8	Low	46.8	Very low	119 Å²	119	83.6 Å²	83.6	52%	0.517	40%	0.399	S	S	.	.	H	α-helix	trans	-63.5	-38.6	177.8	-69.4	157.6	-165.2	164.5	0	110.7	E154 E155 M156 H162	E154-K158 VanDerWaalsContact O-CD 3.31Å; E154-K158 WeakPolarHBondContact O-CD 3.45Å; E154-K158 WeakPolarHBondContact O-CG 3.43Å; E154-K158 PolarHBondContact O-N 3.11Å; E154-K158 IonicContact OE2-NZ 3.1Å; E154-K158 PolarHBondContact OE2-NZ 3.3Å; E155-K158 PolarHBondContact O-N 3.09Å; M156-K158 PolarHBondContact O-N 3.23Å; K158-H162 WeakPolarHBondContact O-CB 3.46Å; K158-H162 PolarHBondContact O-N 3.43Å; K158-H162 VanDerWaalsContact O-N 3.1Å
159	L	42	Very low	45.9	Very low	90 Å²	90	82.7 Å²	82.7	47%	0.471	40%	0.397	S	S	.	.	H	α-helix	trans	-67.4	-46.4	175	-72.9	168.3	0	0	0	112.9	E155 M156 E157 K161 H162 F163	E155-L159 WeakPolarHBondContact O-CG 3.3Å; E155-L159 PolarHBondContact O-N 3.43Å; M156-L159 PolarHBondContact O-N 3.27Å; E157-L159 VanDerWaalsContact C-N 3.31Å; E157-L159 PolarHBondContact O-N 3.2Å; L159-K161 PolarHBondContact O-N 3.48Å; L159-H162 WeakPolarHBondContact O-CA 3.34Å; L159-H162 WeakPolarHBondContact O-CB 3.17Å; L159-H162 PolarHBondContact O-N 2.83Å; L159-F163 WeakPolarHBondContact O-CD2 3.48Å; L159-F163 PolarHBondContact O-N 3.03Å
160	V	38.7	Very low	45.6	Very low	41 Å²	41	86.3 Å²	86.3	25%	0.248	41%	0.414	C	S	.	.	H	α-helix	trans	-58.6	-48.9	176.4	172.6	0	0	0	0	110.5	M156 E157 H162 F163 D164 I290	M156-V160 WeakPolarHBondContact O-CG2 3.43Å; M156-V160 PolarHBondContact O-N 2.93Å; E157-V160 PolarHBondContact O-N 2.79Å; V160-H162 PolarHBondContact O-N 3.08Å; V160-H162 VanDerWaalsContact O-N 3.14Å; V160-F163 PolarHBondContact O-N 2.82Å; V160-F163 VanDerWaalsContact O-N 3.1Å; V160-D164 PolarHBondContact O-N 2.87Å; V160-I290 HydrophobicContact CG2-CB 4.19Å; V160-I290 HydrophobicContact CG2-CD1 4.48Å; V160-I290 HydrophobicContact CG2-CG2 3.52Å
161	K	50.5	Low	44.7	Very low	134 Å²	134	87 Å²	87	58%	0.583	42%	0.423	S	S	*	.	H	α-helix	trans	-61.1	-22.7	176.2	-69.2	162.7	-175.5	162.2	0	113.1	E157 L159	E157-K161 WeakPolarHBondContact O-CB 3.49Å; E157-K161 WeakPolarHBondContact O-CD 3.45Å; E157-K161 VanDerWaalsContact O-CG 3.26Å; E157-K161 WeakPolarHBondContact O-CG 3.26Å; E157-K161 PolarHBondContact O-N 3.11Å; E157-K161 IonicContact OE2-NZ 3.84Å; E157-K161 PolarHBondContact OE2-NZ 2.98Å; L159-K161 PolarHBondContact O-N 3.48Å
162	H	44.4	Very low	43.5	Very low	109 Å²	109	81.6 Å²	81.6	51%	0.505	41%	0.406	S	S	.	.	H	α-helix	trans	-79.6	-43.6	173.1	-168.7	80.7	0	0	0	112.2	K158 L159 V160 S165 V168	K158-H162 WeakPolarHBondContact O-CB 3.46Å; K158-H162 PolarHBondContact O-N 3.43Å; K158-H162 VanDerWaalsContact O-N 3.1Å; L159-H162 WeakPolarHBondContact O-CA 3.34Å; L159-H162 WeakPolarHBondContact O-CB 3.17Å; L159-H162 PolarHBondContact O-N 2.83Å; V160-H162 PolarHBondContact O-N 3.08Å; V160-H162 VanDerWaalsContact O-N 3.14Å; H162-S165 WeakPolarHBondContact O-CB 3.12Å; H162-S165 PolarHBondContact O-N 3.19Å; H162-S165 VanDerWaalsContact O-N 3.15Å; H162-V168 WeakPolarHBondContact O-CG2 3.35Å
163	F	38.3	Very low	43.4	Very low	66 Å²	66	82 Å²	82	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-68.6	-33.1	176.7	-71.9	-66.2	0	0	0	113.3	L159 V160 S165 N169 F283	L159-F163 WeakPolarHBondContact O-CD2 3.48Å; L159-F163 PolarHBondContact O-N 3.03Å; V160-F163 PolarHBondContact O-N 2.82Å; V160-F163 VanDerWaalsContact O-N 3.1Å; F163-S165 PolarHBondContact O-N 3.05Å; F163-N169 PolarHBondContact O-ND2 3Å; F163-F283 AromaticContact CD1-CD1 3.76Å; F163-F283 HydrophobicContact CD1-CD1 3.76Å; F163-F283 AromaticContact CD1-CE1 3.74Å; F163-F283 HydrophobicContact CD1-CE1 3.74Å; F163-F283 HydrophobicContact CE1-CD1 4.14Å; F163-F283 AromaticContact CE1-CE1 3.74Å; F163-F283 HydrophobicContact CE1-CE1 3.74Å; F163-F283 HydrophobicContact CG-CD1 4.41Å
164	D	39.7	Very low	43.2	Very low	113 Å²	113	84.2 Å²	84.2	60%	0.604	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.5	172	-74.8	-31.2	0	0	0	113.3	V160 P166	V160-D164 PolarHBondContact O-N 2.87Å; D164-P166 WeakPolarHBondContact O-CD 3.36Å
165	S	40.1	Very low	42.2	Very low	29 Å²	29	81.5 Å²	81.5	20%	0.203	42%	0.42	C	S	.	.			trans	-64.9	128.9	-179.3	-178.3	0	0	0	0	111.7	H162 F163 I167 V168 N169	H162-S165 WeakPolarHBondContact O-CB 3.12Å; H162-S165 PolarHBondContact O-N 3.19Å; H162-S165 VanDerWaalsContact O-N 3.15Å; F163-S165 PolarHBondContact O-N 3.05Å; S165-I167 PolarHBondContact O-N 2.92Å; S165-I167 PolarHBondContact OG-N 3.28Å; S165-V168 PolarHBondContact O-N 2.83Å; S165-N169 PolarHBondContact O-N 3.01Å; S165-N169 VanDerWaalsContact O-N 3.13Å; S165-N169 PolarHBondContact O-ND2 2.88Å
166	P	44.8	Very low	41.5	Very low	99 Å²	99	80.5 Å²	80.5	64%	0.643	42%	0.417	S	S	*	.	H	α-helix	trans	-57.2	-34.2	173.6	-26.2	35	0	0	0	112.8	D164 N169 E170	D164-P166 WeakPolarHBondContact O-CD 3.36Å; P166-N169 PolarHBondContact O-N 3.16Å; P166-E170 WeakPolarHBondContact O-CG 3.33Å; P166-E170 PolarHBondContact O-N 3.43Å
167	I	37	Very low	41.7	Very low	125 Å²	125	80.1 Å²	80.1	64%	0.641	42%	0.42	S	S	*	.	H	α-helix	trans	-66.9	-40.8	-179.4	-58.7	174	0	0	0	110.7	S165 T171	S165-I167 PolarHBondContact O-N 2.92Å; S165-I167 PolarHBondContact OG-N 3.28Å; I167-T171 VanDerWaalsContact O-CB 3.3Å; I167-T171 WeakPolarHBondContact O-CB 3.07Å; I167-T171 PolarHBondContact O-N 2.89Å; I167-T171 PolarHBondContact O-OG1 2.74Å
168	V	32.4	Very low	41.6	Very low	24 Å²	24	79.8 Å²	79.8	15%	0.145	43%	0.425	C	S	.	.	H	α-helix	trans	-68.2	-43.9	178.6	173.7	0	0	0	0	110.1	H162 S165 T171 I172	H162-V168 WeakPolarHBondContact O-CG2 3.35Å; S165-V168 PolarHBondContact O-N 2.83Å; V168-T171 PolarHBondContact O-N 3.38Å; V168-I172 HydrophobicContact CG1-CD1 3.81Å; V168-I172 VanDerWaalsContact O-CG1 3.28Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 2.91Å
169	N	41.8	Very low	41	Very low	59 Å²	59	78 Å²	78	32%	0.316	42%	0.421	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.3	-78.5	-80	0	0	0	113	F163 S165 P166 I172 K173	F163-N169 PolarHBondContact O-ND2 3Å; S165-N169 PolarHBondContact O-N 3.01Å; S165-N169 VanDerWaalsContact O-N 3.13Å; S165-N169 PolarHBondContact O-ND2 2.88Å; P166-N169 PolarHBondContact O-N 3.16Å; N169-I172 PolarHBondContact O-N 3.08Å; N169-K173 WeakPolarHBondContact O-CG 3.32Å; N169-K173 PolarHBondContact O-N 3.39Å
170	E	44.1	Very low	41	Very low	107 Å²	107	77.5 Å²	77.5	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-67.9	-34.6	174.2	-69.6	-51.9	131.3	0	0	112.6	P166 K173 S174	P166-E170 WeakPolarHBondContact O-CG 3.33Å; P166-E170 PolarHBondContact O-N 3.43Å; E170-K173 PolarHBondContact O-N 3.42Å; E170-K173 IonicContact OE1-NZ 3.26Å; E170-K173 PolarHBondContact OE1-NZ 2.95Å; E170-S174 VanDerWaalsContact O-CB 3.27Å; E170-S174 WeakPolarHBondContact O-CB 3.23Å; E170-S174 PolarHBondContact O-N 3.29Å
171	T	38	Very low	41.4	Very low	76 Å²	76	82.2 Å²	82.2	47%	0.466	44%	0.435	S	S	.	.	H	α-helix	trans	-63.9	-43	174.3	-58.6	0	0	0	0	111.3	I167 V168 S174 V175	I167-T171 VanDerWaalsContact O-CB 3.3Å; I167-T171 WeakPolarHBondContact O-CB 3.07Å; I167-T171 PolarHBondContact O-N 2.89Å; I167-T171 PolarHBondContact O-OG1 2.74Å; V168-T171 PolarHBondContact O-N 3.38Å; T171-S174 WeakPolarHBondContact O-CB 3.33Å; T171-S174 PolarHBondContact O-N 2.67Å; T171-V175 WeakPolarHBondContact O-CG2 3.39Å; T171-V175 PolarHBondContact O-N 2.79Å
172	I	38.5	Very low	41.4	Very low	54 Å²	54	78.6 Å²	78.6	28%	0.277	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-47.4	175.8	-69.6	163.6	0	0	0	110.6	V168 N169 S174 V175 L176 F283	V168-I172 HydrophobicContact CG1-CD1 3.81Å; V168-I172 VanDerWaalsContact O-CG1 3.28Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 2.91Å; N169-I172 PolarHBondContact O-N 3.08Å; I172-S174 VanDerWaalsContact C-N 3.31Å; I172-S174 PolarHBondContact O-N 3.47Å; I172-V175 PolarHBondContact O-N 2.97Å; I172-L176 HydrophobicContact CG2-CD1 3.83Å; I172-L176 HydrophobicContact CG2-CG 4.48Å; I172-L176 WeakPolarHBondContact O-CB 3.32Å; I172-L176 VanDerWaalsContact O-CG 3.28Å; I172-L176 WeakPolarHBondContact O-CG 3.38Å; I172-L176 PolarHBondContact O-N 3.28Å; I172-F283 HydrophobicContact CD1-CE2 3.97Å; I172-F283 HydrophobicContact CD1-CZ 3.79Å
173	K	44.5	Very low	41.4	Very low	117 Å²	117	80.9 Å²	80.9	51%	0.509	43%	0.431	S	S	.	.	H	α-helix	trans	-58.3	-41.8	174.4	-69.7	170.8	-169.3	174	0	112.3	N169 E170 S177	N169-K173 WeakPolarHBondContact O-CG 3.32Å; N169-K173 PolarHBondContact O-N 3.39Å; E170-K173 PolarHBondContact O-N 3.42Å; E170-K173 IonicContact OE1-NZ 3.26Å; E170-K173 PolarHBondContact OE1-NZ 2.95Å; K173-S177 WeakPolarHBondContact O-CB 3.45Å; K173-S177 PolarHBondContact O-N 3.06Å
174	S	42.3	Very low	42	Very low	78 Å²	78	82.2 Å²	82.2	55%	0.545	44%	0.438	S	S	.	.	H	α-helix	trans	-61.7	-50.6	179.4	-175.2	0	0	0	0	111.7	E170 T171 I172 S177 S178	E170-S174 VanDerWaalsContact O-CB 3.27Å; E170-S174 WeakPolarHBondContact O-CB 3.23Å; E170-S174 PolarHBondContact O-N 3.29Å; T171-S174 WeakPolarHBondContact O-CB 3.33Å; T171-S174 PolarHBondContact O-N 2.67Å; I172-S174 VanDerWaalsContact C-N 3.31Å; I172-S174 PolarHBondContact O-N 3.47Å; S174-S177 WeakPolarHBondContact O-CB 3.36Å; S174-S177 PolarHBondContact O-N 3.43Å; S174-S177 VanDerWaalsContact O-N 3.14Å; S174-S178 PolarHBondContact O-N 3.48Å; S174-S178 PolarHBondContact O-OG 2.8Å
175	V	36.2	Very low	42.7	Very low	55 Å²	55	83 Å²	83	33%	0.333	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-44.1	178	173.5	0	0	0	0	111.5	T171 I172 S177 S178 D179	T171-V175 WeakPolarHBondContact O-CG2 3.39Å; T171-V175 PolarHBondContact O-N 2.79Å; I172-V175 PolarHBondContact O-N 2.97Å; V175-S177 VanDerWaalsContact C-N 3.28Å; V175-S177 PolarHBondContact O-N 2.82Å; V175-S178 WeakPolarHBondContact CA-OG 3.22Å; V175-S178 PolarHBondContact O-N 2.8Å; V175-S178 PolarHBondContact O-OG 3.24Å; V175-D179 WeakPolarHBondContact O-CB 3.21Å; V175-D179 PolarHBondContact O-N 2.9Å
176	L	38.6	Very low	42.9	Very low	74 Å²	74	86.8 Å²	86.8	39%	0.387	45%	0.453	S	S	.	.	H	α-helix	trans	-61.2	-38.1	174.6	-69	170.4	0	0	0	111.6	I172 I180	I172-L176 HydrophobicContact CG2-CD1 3.83Å; I172-L176 HydrophobicContact CG2-CG 4.48Å; I172-L176 WeakPolarHBondContact O-CB 3.32Å; I172-L176 VanDerWaalsContact O-CG 3.28Å; I172-L176 WeakPolarHBondContact O-CG 3.38Å; I172-L176 PolarHBondContact O-N 3.28Å; L176-I180 WeakPolarHBondContact O-CB 3.48Å; L176-I180 WeakPolarHBondContact O-CD1 3.27Å; L176-I180 WeakPolarHBondContact O-CG1 3.5Å; L176-I180 PolarHBondContact O-N 2.77Å
177	S	44.4	Very low	43.1	Very low	48 Å²	48	84.7 Å²	84.7	34%	0.336	44%	0.436	S	S	.	.	H	α-helix	trans	-67.1	-39.7	176	-167.5	0	0	0	0	112.9	K173 S174 V175 K181	K173-S177 WeakPolarHBondContact O-CB 3.45Å; K173-S177 PolarHBondContact O-N 3.06Å; S174-S177 WeakPolarHBondContact O-CB 3.36Å; S174-S177 PolarHBondContact O-N 3.43Å; S174-S177 VanDerWaalsContact O-N 3.14Å; V175-S177 VanDerWaalsContact C-N 3.28Å; V175-S177 PolarHBondContact O-N 2.82Å; S177-K181 WeakPolarHBondContact O-CD 3.26Å; S177-K181 VanDerWaalsContact O-CG 3.27Å; S177-K181 WeakPolarHBondContact O-CG 3.46Å; S177-K181 PolarHBondContact O-N 3.46Å; S177-K181 VanDerWaalsContact O-N 3.16Å; S177-K181 PolarHBondContact OG-NZ 3.5Å; S177-K181 VanDerWaalsContact OG-NZ 3.1Å
178	S	44.7	Very low	43.9	Very low	59 Å²	59	86.3 Å²	86.3	41%	0.413	43%	0.434	S	S	.	.	H	α-helix	trans	-67.3	-40.7	175.4	54.1	0	0	0	0	112	S174 V175 K181 S182	S174-S178 PolarHBondContact O-N 3.48Å; S174-S178 PolarHBondContact O-OG 2.8Å; V175-S178 WeakPolarHBondContact CA-OG 3.22Å; V175-S178 PolarHBondContact O-N 2.8Å; V175-S178 PolarHBondContact O-OG 3.24Å; S178-K181 PolarHBondContact O-N 2.83Å; S178-S182 WeakPolarHBondContact O-CB 3.18Å; S178-S182 PolarHBondContact O-N 3.35Å
179	D	39.5	Very low	44.7	Very low	81 Å²	81	91 Å²	91	43%	0.433	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-38.4	-178.2	-72.6	3.8	0	0	0	111.8	V175 S182 R183	V175-D179 WeakPolarHBondContact O-CB 3.21Å; V175-D179 PolarHBondContact O-N 2.9Å; D179-S182 PolarHBondContact O-N 3.02Å; D179-R183 WeakPolarHBondContact O-CB 3.25Å; D179-R183 WeakPolarHBondContact O-CG 3.26Å; D179-R183 PolarHBondContact O-N 2.87Å
180	I	42.4	Very low	45	Very low	79 Å²	79	91.7 Å²	91.7	41%	0.405	46%	0.458	S	S	.	.	H	α-helix	trans	-60.1	-46.5	171.2	-71.7	166.2	0	0	0	110.4	L176 H184 I273	L176-I180 WeakPolarHBondContact O-CB 3.48Å; L176-I180 WeakPolarHBondContact O-CD1 3.27Å; L176-I180 WeakPolarHBondContact O-CG1 3.5Å; L176-I180 PolarHBondContact O-N 2.77Å; I180-H184 WeakPolarHBondContact O-CB 3.38Å; I180-H184 PolarHBondContact O-N 3.35Å; I180-I273 HydrophobicContact CD1-CG2 4.42Å
181	K	47.6	Very low	45.3	Very low	140 Å²	140	88.9 Å²	88.9	61%	0.609	45%	0.445	S	S	*	.	H	α-helix	trans	-62	-44.1	177	-73.5	164.2	-177.1	155.4	0	112	S177 S178 H184 Q185	S177-K181 WeakPolarHBondContact O-CD 3.26Å; S177-K181 VanDerWaalsContact O-CG 3.27Å; S177-K181 WeakPolarHBondContact O-CG 3.46Å; S177-K181 PolarHBondContact O-N 3.46Å; S177-K181 VanDerWaalsContact O-N 3.16Å; S177-K181 PolarHBondContact OG-NZ 3.5Å; S177-K181 VanDerWaalsContact OG-NZ 3.1Å; S178-K181 PolarHBondContact O-N 2.83Å; K181-H184 PolarHBondContact O-N 3.03Å; K181-Q185 PolarHBondContact O-N 3.17Å
182	S	49.3	Very low	46.1	Very low	59 Å²	59	92.4 Å²	92.4	41%	0.413	45%	0.454	S	S	.	.	H	α-helix	trans	-60.9	-51	178.1	-174.9	0	0	0	0	111.9	S178 D179 H184 Q185 Q186	S178-S182 WeakPolarHBondContact O-CB 3.18Å; S178-S182 PolarHBondContact O-N 3.35Å; D179-S182 PolarHBondContact O-N 3.02Å; S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 2.89Å; S182-Q185 WeakPolarHBondContact O-CB 3.37Å; S182-Q185 PolarHBondContact O-N 3.46Å; S182-Q185 VanDerWaalsContact O-N 3.1Å; S182-Q186 WeakPolarHBondContact O-CG 3.12Å; S182-Q186 PolarHBondContact O-N 3.28Å
183	R	45.8	Very low	46.5	Very low	156 Å²	156	94.3 Å²	94.3	59%	0.589	46%	0.464	S	S	*	.	H	α-helix	trans	-62.1	-38.1	176.1	-70.7	177.2	179.9	-157.4	-1.4	112.4	D179 Q185 Q186 N187	D179-R183 WeakPolarHBondContact O-CB 3.25Å; D179-R183 WeakPolarHBondContact O-CG 3.26Å; D179-R183 PolarHBondContact O-N 2.87Å; R183-Q185 VanDerWaalsContact C-N 3.3Å; R183-Q185 PolarHBondContact O-N 2.97Å; R183-Q186 PolarHBondContact O-N 2.78Å; R183-N187 WeakPolarHBondContact O-CB 3.41Å; R183-N187 PolarHBondContact O-N 2.83Å
184	H	51	Low	46.5	Very low	95 Å²	95	93.5 Å²	93.5	44%	0.44	46%	0.458	S	S	.	.	H	α-helix	trans	-67.4	-31.3	176.2	-161.9	93.1	0	0	0	112	I180 K181 S182 R188	I180-H184 WeakPolarHBondContact O-CB 3.38Å; I180-H184 PolarHBondContact O-N 3.35Å; K181-H184 PolarHBondContact O-N 3.03Å; S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 2.89Å; H184-R188 PolarHBondContact CD2-NE 2.63Å; H184-R188 PolarHBondContact CD2-NH2 3.34Å; H184-R188 PolarHBondContact NE2-NE 2.9Å; H184-R188 VanDerWaalsContact NE2-NE 3.1Å; H184-R188 PolarHBondContact NE2-NH2 2.9Å; H184-R188 VanDerWaalsContact O-CG 3.27Å; H184-R188 WeakPolarHBondContact O-CG 3.18Å; H184-R188 PolarHBondContact O-N 3.03Å
185	Q	52.7	Low	47	Very low	128 Å²	128	93.1 Å²	93.1	60%	0.598	45%	0.45	S	S	*	.	H	α-helix	trans	-72.3	-42.6	171.3	-179.4	168.9	-30.7	0	0	112.4	K181 S182 R183 R188 Q189	K181-Q185 PolarHBondContact O-N 3.17Å; S182-Q185 WeakPolarHBondContact O-CB 3.37Å; S182-Q185 PolarHBondContact O-N 3.46Å; S182-Q185 VanDerWaalsContact O-N 3.1Å; R183-Q185 VanDerWaalsContact C-N 3.3Å; R183-Q185 PolarHBondContact O-N 2.97Å; Q185-R188 PolarHBondContact O-N 3.46Å; Q185-Q189 PolarHBondContact O-N 3.27Å
186	Q	46.2	Very low	47.7	Very low	109 Å²	109	98.6 Å²	98.6	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-59.5	-47	174	-72	174.3	-27	0	0	111.6	S182 R183 R188 Q189 L190	S182-Q186 WeakPolarHBondContact O-CG 3.12Å; S182-Q186 PolarHBondContact O-N 3.28Å; R183-Q186 PolarHBondContact O-N 2.78Å; Q186-R188 VanDerWaalsContact C-N 3.31Å; Q186-R188 PolarHBondContact O-N 3.37Å; Q186-Q189 WeakPolarHBondContact O-CA 3.48Å; Q186-Q189 WeakPolarHBondContact O-CB 3.29Å; Q186-Q189 PolarHBondContact O-N 3.01Å; Q186-L190 PolarHBondContact O-N 3.46Å
187	N	47.9	Very low	48.1	Very low	56 Å²	56	98.5 Å²	98.5	30%	0.299	46%	0.464	S	S	.	.	H	α-helix	trans	-63.1	-35.1	177.2	-75.3	-8.3	0	0	0	112.6	R183 Q189 L190 Q191	R183-N187 WeakPolarHBondContact O-CB 3.41Å; R183-N187 PolarHBondContact O-N 2.83Å; N187-Q189 VanDerWaalsContact C-N 3.34Å; N187-L190 PolarHBondContact O-N 2.61Å; N187-Q191 PolarHBondContact O-N 2.93Å
188	R	54.9	Low	48.3	Very low	159 Å²	159	97.2 Å²	97.2	60%	0.6	45%	0.453	S	S	*	.	H	α-helix	trans	-67.3	-31.1	172.1	-74.6	175	-174.3	-159.1	5.3	112.9	H184 Q185 Q186 K192	H184-R188 PolarHBondContact CD2-NE 2.63Å; H184-R188 PolarHBondContact CD2-NH2 3.34Å; H184-R188 PolarHBondContact NE2-NE 2.9Å; H184-R188 VanDerWaalsContact NE2-NE 3.1Å; H184-R188 PolarHBondContact NE2-NH2 2.9Å; H184-R188 VanDerWaalsContact O-CG 3.27Å; H184-R188 WeakPolarHBondContact O-CG 3.18Å; H184-R188 PolarHBondContact O-N 3.03Å; Q185-R188 PolarHBondContact O-N 3.46Å; Q186-R188 VanDerWaalsContact C-N 3.31Å; Q186-R188 PolarHBondContact O-N 3.37Å; R188-K192 VanDerWaalsContact O-CG 3.29Å; R188-K192 WeakPolarHBondContact O-CG 3.49Å; R188-K192 PolarHBondContact O-N 3.1Å
189	Q	48.8	Very low	48.9	Very low	121 Å²	121	100.2 Å²	100.2	57%	0.565	46%	0.461	S	S	*	.	H	α-helix	trans	-71.7	-42.9	171.3	-71.1	175.7	-28.6	0	0	111.2	Q185 Q186 N187 K192 L193	Q185-Q189 PolarHBondContact O-N 3.27Å; Q186-Q189 WeakPolarHBondContact O-CA 3.48Å; Q186-Q189 WeakPolarHBondContact O-CB 3.29Å; Q186-Q189 PolarHBondContact O-N 3.01Å; N187-Q189 VanDerWaalsContact C-N 3.34Å; Q189-K192 WeakPolarHBondContact O-CB 3.47Å; Q189-K192 PolarHBondContact O-N 3.15Å; Q189-L193 PolarHBondContact O-N 3.3Å
190	L	47.7	Very low	49.3	Very low	75 Å²	75	103.9 Å²	103.9	39%	0.393	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177.8	-175.6	61.7	0	0	0	112.2	Q186 N187 K192 L193 Y194	Q186-L190 PolarHBondContact O-N 3.46Å; N187-L190 PolarHBondContact O-N 2.61Å; L190-K192 VanDerWaalsContact C-N 3.35Å; L190-K192 PolarHBondContact O-N 3.1Å; L190-L193 WeakPolarHBondContact O-CB 3.39Å; L190-L193 PolarHBondContact O-N 2.94Å; L190-L193 VanDerWaalsContact O-N 3.08Å; L190-Y194 HydrophobicContact CD1-CD2 4.13Å; L190-Y194 HydrophobicContact CD1-CE2 3.79Å; L190-Y194 HydrophobicContact CD2-CE2 4.22Å; L190-Y194 HydrophobicContact CG-CD2 3.95Å; L190-Y194 HydrophobicContact CG-CE2 3.76Å; L190-Y194 WeakPolarHBondContact O-CD2 3.12Å; L190-Y194 PolarHBondContact O-N 3.22Å
191	Q	49.6	Very low	49.5	Very low	48 Å²	48	104.3 Å²	104.3	22%	0.224	47%	0.472	C	S	.	.	H	α-helix	trans	-67.1	-35	176.4	-166.9	165.5	3.6	0	0	112	N187 L193 Y194 N195 L261	N187-Q191 PolarHBondContact O-N 2.93Å; Q191-L193 VanDerWaalsContact C-N 3.29Å; Q191-L193 PolarHBondContact O-N 3.32Å; Q191-Y194 PolarHBondContact O-N 2.81Å; Q191-N195 PolarHBondContact O-N 3.45Å; Q191-N195 PolarHBondContact O-OD1 3.39Å; Q191-N195 VanDerWaalsContact O-OD1 3.06Å; Q191-L261 PolarHBondContact NE2-O 3.29Å
192	K	55.8	Low	49.8	Very low	150 Å²	150	99.5 Å²	99.5	65%	0.652	45%	0.453	S	S	*	.	H	α-helix	trans	-63.6	-32.3	169.4	-76.4	178	178.5	-171	0	113	R188 Q189 L190 R196	R188-K192 VanDerWaalsContact O-CG 3.29Å; R188-K192 WeakPolarHBondContact O-CG 3.49Å; R188-K192 PolarHBondContact O-N 3.1Å; Q189-K192 WeakPolarHBondContact O-CB 3.47Å; Q189-K192 PolarHBondContact O-N 3.15Å; L190-K192 VanDerWaalsContact C-N 3.35Å; L190-K192 PolarHBondContact O-N 3.1Å; K192-R196 WeakPolarHBondContact O-CG 3.44Å; K192-R196 PolarHBondContact O-N 2.87Å
193	L	45.7	Very low	50.1	Low	94 Å²	94	98 Å²	98	49%	0.492	45%	0.447	S	S	.	.	H	α-helix	trans	-71.5	-45.6	174.9	-177.1	62.1	0	0	0	111.2	Q189 L190 Q191 N195 R196 I197	Q189-L193 PolarHBondContact O-N 3.3Å; L190-L193 WeakPolarHBondContact O-CB 3.39Å; L190-L193 PolarHBondContact O-N 2.94Å; L190-L193 VanDerWaalsContact O-N 3.08Å; Q191-L193 VanDerWaalsContact C-N 3.29Å; Q191-L193 PolarHBondContact O-N 3.32Å; L193-N195 PolarHBondContact O-N 2.92Å; L193-R196 PolarHBondContact O-N 2.86Å; L193-I197 HydrophobicContact CD1-CD1 4.3Å; L193-I197 HydrophobicContact CG-CD1 4Å; L193-I197 VanDerWaalsContact O-CG1 3.31Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.37Å
194	Y	45.1	Very low	50.3	Low	100 Å²	100	94.7 Å²	94.7	39%	0.392	44%	0.439	S	S	.	.	H	α-helix	trans	-57.6	-47	174.1	-85.5	-69.2	0	0	0	112.3	L190 Q191 R196 I197 I198	L190-Y194 HydrophobicContact CD1-CD2 4.13Å; L190-Y194 HydrophobicContact CD1-CE2 3.79Å; L190-Y194 HydrophobicContact CD2-CE2 4.22Å; L190-Y194 HydrophobicContact CG-CD2 3.95Å; L190-Y194 HydrophobicContact CG-CE2 3.76Å; L190-Y194 WeakPolarHBondContact O-CD2 3.12Å; L190-Y194 PolarHBondContact O-N 3.22Å; Q191-Y194 PolarHBondContact O-N 2.81Å; Y194-R196 PolarHBondContact O-N 3.17Å; Y194-I197 WeakPolarHBondContact O-CB 3.14Å; Y194-I197 PolarHBondContact O-N 3.04Å; Y194-I197 VanDerWaalsContact O-N 3.11Å; Y194-I198 WeakPolarHBondContact O-CG1 3.49Å; Y194-I198 PolarHBondContact O-N 3.38Å
195	N	54	Low	50.3	Low	69 Å²	69	90.9 Å²	90.9	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-59.4	-45.5	177	-72.9	30.7	0	0	0	111.6	Q191 L193 I197 I198 E199	Q191-N195 PolarHBondContact O-N 3.45Å; Q191-N195 PolarHBondContact O-OD1 3.39Å; Q191-N195 VanDerWaalsContact O-OD1 3.06Å; L193-N195 PolarHBondContact O-N 2.92Å; N195-I197 VanDerWaalsContact C-N 3.26Å; N195-I197 PolarHBondContact O-N 2.92Å; N195-I198 PolarHBondContact O-N 3.35Å; N195-I198 VanDerWaalsContact O-N 3.16Å; N195-E199 WeakPolarHBondContact O-CB 3.27Å; N195-E199 VanDerWaalsContact O-CG 3.26Å; N195-E199 WeakPolarHBondContact O-CG 3.44Å; N195-E199 PolarHBondContact O-N 2.86Å
196	R	51.1	Low	50.6	Low	171 Å²	171	89.1 Å²	89.1	65%	0.645	42%	0.417	S	S	*	.	H	α-helix	trans	-61.8	-29.6	174.9	-78.1	174.3	168.3	-171.2	-4.5	114.3	K192 L193 Y194 K200	K192-R196 WeakPolarHBondContact O-CG 3.44Å; K192-R196 PolarHBondContact O-N 2.87Å; L193-R196 PolarHBondContact O-N 2.86Å; Y194-R196 PolarHBondContact O-N 3.17Å; R196-K200 WeakPolarHBondContact O-CB 3.17Å; R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.16Å
197	I	46	Very low	51.3	Low	71 Å²	71	91.6 Å²	91.6	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-73.6	-44.1	174.9	-71	165.4	0	0	0	109.7	L193 Y194 N195 K200 F201	L193-I197 HydrophobicContact CD1-CD1 4.3Å; L193-I197 HydrophobicContact CG-CD1 4Å; L193-I197 VanDerWaalsContact O-CG1 3.31Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.37Å; Y194-I197 WeakPolarHBondContact O-CB 3.14Å; Y194-I197 PolarHBondContact O-N 3.04Å; Y194-I197 VanDerWaalsContact O-N 3.11Å; N195-I197 VanDerWaalsContact C-N 3.26Å; N195-I197 PolarHBondContact O-N 2.92Å; I197-K200 PolarHBondContact O-N 2.9Å; I197-F201 HydrophobicContact CG2-CD2 3.69Å; I197-F201 HydrophobicContact CG2-CE2 3.63Å; I197-F201 VanDerWaalsContact O-CD2 3.29Å; I197-F201 WeakPolarHBondContact O-CD2 3.49Å; I197-F201 PolarHBondContact O-N 2.91Å
198	I	48.9	Very low	51.5	Low	22 Å²	22	95 Å²	95	11%	0.113	44%	0.435	C	S	.	.	H	α-helix	trans	-61	-49.3	174.9	-68.5	165.8	0	0	0	110.8	Y194 N195 K200 F201 L202 I254 Q258 L261	Y194-I198 WeakPolarHBondContact O-CG1 3.49Å; Y194-I198 PolarHBondContact O-N 3.38Å; N195-I198 PolarHBondContact O-N 3.35Å; N195-I198 VanDerWaalsContact O-N 3.16Å; I198-K200 VanDerWaalsContact C-N 3.28Å; I198-K200 PolarHBondContact O-N 2.93Å; I198-F201 PolarHBondContact O-N 3.29Å; I198-F201 VanDerWaalsContact O-N 3.08Å; I198-L202 HydrophobicContact CG2-CD1 3.89Å; I198-L202 HydrophobicContact CG2-CG 4.32Å; I198-L202 WeakPolarHBondContact O-CG 3.5Å; I198-L202 PolarHBondContact O-N 2.89Å; I198-I254 HydrophobicContact CG2-CG2 4.02Å; I198-Q258 HydrophobicContact CD1-CB 4.49Å; I198-Q258 HydrophobicContact CG2-CB 4.44Å; I198-L261 HydrophobicContact CD1-CD1 3.9Å
199	E	56.1	Low	51.2	Low	122 Å²	122	91.8 Å²	91.8	57%	0.57	43%	0.427	S	S	*	.	H	α-helix	trans	-52.7	-43.8	174.1	-73.1	162.3	-168.7	0	0	111.9	N195 G203	N195-E199 WeakPolarHBondContact O-CB 3.27Å; N195-E199 VanDerWaalsContact O-CG 3.26Å; N195-E199 WeakPolarHBondContact O-CG 3.44Å; N195-E199 PolarHBondContact O-N 2.86Å; E199-G203 PolarHBondContact O-N 2.89Å
200	K	49.5	Very low	51.4	Low	158 Å²	158	89.3 Å²	89.3	69%	0.687	42%	0.421	S	S	*	.	H	α-helix	trans	-66.3	-41.8	175.7	-84.4	-173.7	172.1	-168.6	0	113.1	R196 I197 I198 G203 I204	R196-K200 WeakPolarHBondContact O-CB 3.17Å; R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.16Å; I197-K200 PolarHBondContact O-N 2.9Å; I198-K200 VanDerWaalsContact C-N 3.28Å; I198-K200 PolarHBondContact O-N 2.93Å; K200-G203 PolarHBondContact O-N 3.29Å; K200-I204 VanDerWaalsContact O-CG1 3.29Å; K200-I204 WeakPolarHBondContact O-CG1 3.43Å; K200-I204 PolarHBondContact O-N 3.17Å
201	F	45.8	Very low	51.5	Low	88 Å²	88	89.7 Å²	89.7	39%	0.386	42%	0.424	S	S	.	.	H	α-helix	trans	-69.3	-40.4	178.9	-84.6	-66.3	0	0	0	112.2	L94 I197 I198 I204 I205 I254	L94-F201 HydrophobicContact CD2-CZ 4.31Å; I197-F201 HydrophobicContact CG2-CD2 3.69Å; I197-F201 HydrophobicContact CG2-CE2 3.63Å; I197-F201 VanDerWaalsContact O-CD2 3.29Å; I197-F201 WeakPolarHBondContact O-CD2 3.49Å; I197-F201 PolarHBondContact O-N 2.91Å; I198-F201 PolarHBondContact O-N 3.29Å; I198-F201 VanDerWaalsContact O-N 3.08Å; F201-I204 WeakPolarHBondContact O-CB 3.35Å; F201-I204 PolarHBondContact O-N 3.13Å; F201-I204 VanDerWaalsContact O-N 3.14Å; F201-I205 WeakPolarHBondContact O-CG1 3.22Å; F201-I205 PolarHBondContact O-N 3.16Å; F201-I254 HydrophobicContact CB-CD1 3.93Å; F201-I254 HydrophobicContact CG-CD1 4.43Å
202	L	53.9	Low	51.3	Low	39 Å²	39	88.6 Å²	88.6	20%	0.204	42%	0.419	C	S	.	.	H	α-helix	trans	-59.4	-50.4	171.8	-67.6	172.8	0	0	0	110.4	I198 I204 I205 D206 I254	I198-L202 HydrophobicContact CG2-CD1 3.89Å; I198-L202 HydrophobicContact CG2-CG 4.32Å; I198-L202 WeakPolarHBondContact O-CG 3.5Å; I198-L202 PolarHBondContact O-N 2.89Å; L202-I204 PolarHBondContact O-N 2.57Å; L202-I205 CarbonylContact O-C 3.38Å; L202-I205 WeakPolarHBondContact O-CA 3.48Å; L202-I205 PolarHBondContact O-N 3.41Å; L202-D206 PolarHBondContact O-N 3.39Å; L202-I254 HydrophobicContact CD2-CG2 4.04Å; L202-I254 HydrophobicContact CG-CG2 4.31Å
203	G	55.6	Low	50.7	Low	28 Å²	28	85.6 Å²	85.6	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-67	-4	175.3	0	0	0	0	0	116.1	E199 K200 K207	E199-G203 PolarHBondContact O-N 2.89Å; K200-G203 PolarHBondContact O-N 3.29Å; G203-K207 WeakPolarHBondContact O-CD 3.46Å; G203-K207 WeakPolarHBondContact O-CE 3.4Å; G203-K207 WeakPolarHBondContact O-CG 3.27Å
204	I	51	Low	50.8	Low	85 Å²	85	86 Å²	86	44%	0.436	41%	0.413	S	S	.	.	H	α-helix	trans	-90.4	-48.6	163.7	-71.5	162.9	0	0	0	109.3	K200 F201 L202 D206 K207 W208	K200-I204 VanDerWaalsContact O-CG1 3.29Å; K200-I204 WeakPolarHBondContact O-CG1 3.43Å; K200-I204 PolarHBondContact O-N 3.17Å; F201-I204 WeakPolarHBondContact O-CB 3.35Å; F201-I204 PolarHBondContact O-N 3.13Å; F201-I204 VanDerWaalsContact O-N 3.14Å; L202-I204 PolarHBondContact O-N 2.57Å; I204-D206 VanDerWaalsContact C-N 3.33Å; I204-D206 PolarHBondContact O-N 2.84Å; I204-K207 WeakPolarHBondContact O-CB 3.39Å; I204-K207 PolarHBondContact O-N 3.06Å; I204-K207 VanDerWaalsContact O-N 3.09Å; I204-W208 VanDerWaalsContact O-CD1 3.32Å; I204-W208 PolarHBondContact O-N 3.19Å; I204-W208 VanDerWaalsContact O-N 3.08Å
205	I	50.9	Low	50.5	Low	15 Å²	15	85.2 Å²	85.2	8%	0.077	42%	0.415	C	S	.	.	H	α-helix	trans	-57.5	-46	177.8	-65.1	164.7	0	0	0	110.7	F201 L202 K207 W208 Q209 H251 I254	F201-I205 WeakPolarHBondContact O-CG1 3.22Å; F201-I205 PolarHBondContact O-N 3.16Å; L202-I205 CarbonylContact O-C 3.38Å; L202-I205 WeakPolarHBondContact O-CA 3.48Å; L202-I205 PolarHBondContact O-N 3.41Å; I205-K207 PolarHBondContact O-N 2.83Å; I205-K207 VanDerWaalsContact O-N 3.16Å; I205-W208 CarbonylContact O-C 3.18Å; I205-W208 PolarHBondContact O-N 3.24Å; I205-Q209 WeakPolarHBondContact O-CB 3.25Å; I205-Q209 PolarHBondContact O-N 2.84Å; I205-H251 HydrophobicContact CD1-CB 4.21Å; I205-I254 HydrophobicContact CD1-CD1 3.89Å
206	D	58.8	Low	49.9	Very low	92 Å²	92	87.5 Å²	87.5	49%	0.492	42%	0.424	S	S	.	.	H	α-helix	trans	-58.3	-29.9	178	-60.6	-20	0	0	0	112.8	L202 I204 P210	L202-D206 PolarHBondContact O-N 3.39Å; I204-D206 VanDerWaalsContact C-N 3.33Å; I204-D206 PolarHBondContact O-N 2.84Å; D206-P210 VanDerWaalsContact O-CD 3.29Å; D206-P210 WeakPolarHBondContact O-CD 3.35Å
207	K	59.8	Low	49.2	Very low	161 Å²	161	85 Å²	85	70%	0.7	42%	0.421	S	S	*	.	H	α-helix	trans	-81.7	-28.2	175.8	-69.1	177.1	-176.7	178.4	0	113.2	G203 I204 I205	G203-K207 WeakPolarHBondContact O-CD 3.46Å; G203-K207 WeakPolarHBondContact O-CE 3.4Å; G203-K207 WeakPolarHBondContact O-CG 3.27Å; I204-K207 WeakPolarHBondContact O-CB 3.39Å; I204-K207 PolarHBondContact O-N 3.06Å; I204-K207 VanDerWaalsContact O-N 3.09Å; I205-K207 PolarHBondContact O-N 2.83Å; I205-K207 VanDerWaalsContact O-N 3.16Å
208	W	52.1	Low	48.9	Very low	126 Å²	126	88.4 Å²	88.4	48%	0.477	44%	0.44	S	S	.	.	H	α-helix	trans	-88.6	-23.2	178.1	-82.3	79.6	0	0	0	112.7	I204 I205 N211 L212	I204-W208 VanDerWaalsContact O-CD1 3.32Å; I204-W208 PolarHBondContact O-N 3.19Å; I204-W208 VanDerWaalsContact O-N 3.08Å; I205-W208 CarbonylContact O-C 3.18Å; I205-W208 PolarHBondContact O-N 3.24Å; W208-N211 CarbonylContact O-C 3.6Å; W208-N211 WeakPolarHBondContact O-CA 3.34Å; W208-N211 WeakPolarHBondContact O-CB 3.41Å; W208-N211 PolarHBondContact O-N 3.09Å; W208-L212 WeakPolarHBondContact O-CG 3.35Å; W208-L212 PolarHBondContact O-N 2.96Å
209	Q	50	Low	48.3	Very low	92 Å²	92	91.2 Å²	91.2	43%	0.43	46%	0.462	S	S	.	.	H	α-helix	trans	-58.7	-39.2	-179.1	-168.8	172.2	4.6	0	0	114.1	I205 N211 L212 N213	I205-Q209 WeakPolarHBondContact O-CB 3.25Å; I205-Q209 PolarHBondContact O-N 2.84Å; Q209-N211 VanDerWaalsContact C-N 3.3Å; Q209-N211 PolarHBondContact O-N 3Å; Q209-L212 PolarHBondContact O-N 2.9Å; Q209-N213 VanDerWaalsContact O-CG 3.24Å; Q209-N213 PolarHBondContact O-N 3.37Å; Q209-N213 PolarHBondContact O-OD1 3.14Å
210	P	52.6	Low	47.2	Very low	69 Å²	69	92.4 Å²	92.4	45%	0.448	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-38.2	170.3	-24.5	35.2	0	0	0	113	D206 N214	D206-P210 VanDerWaalsContact O-CD 3.29Å; D206-P210 WeakPolarHBondContact O-CD 3.35Å; P210-N214 WeakPolarHBondContact O-CB 3.2Å; P210-N214 PolarHBondContact O-N 2.99Å; P210-N214 PolarHBondContact O-ND2 3.26Å
211	N	49.1	Very low	46.7	Very low	84 Å²	84	89.8 Å²	89.8	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-72.8	-35.1	179.1	-62.6	-20	0	0	0	111.8	W208 Q209 N214 L215	W208-N211 CarbonylContact O-C 3.6Å; W208-N211 WeakPolarHBondContact O-CA 3.34Å; W208-N211 WeakPolarHBondContact O-CB 3.41Å; W208-N211 PolarHBondContact O-N 3.09Å; Q209-N211 VanDerWaalsContact C-N 3.3Å; Q209-N211 PolarHBondContact O-N 3Å; N211-N214 PolarHBondContact O-N 2.86Å; N211-L215 WeakPolarHBondContact O-CG 3.41Å; N211-L215 PolarHBondContact O-N 2.93Å; N211-L215 VanDerWaalsContact O-N 3.09Å
212	L	46	Very low	46.3	Very low	24 Å²	24	92.9 Å²	92.9	13%	0.126	50%	0.495	C	S	.	.	H	α-helix	trans	-64.1	-46.6	172.1	-70.8	169.6	0	0	0	111.5	W208 Q209 N214 L215 E216 L247	W208-L212 WeakPolarHBondContact O-CG 3.35Å; W208-L212 PolarHBondContact O-N 2.96Å; Q209-L212 PolarHBondContact O-N 2.9Å; L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 3.45Å; L212-L215 WeakPolarHBondContact O-CB 3.4Å; L212-L215 PolarHBondContact O-N 3.1Å; L212-E216 PolarHBondContact O-N 3.29Å; L212-L247 HydrophobicContact CD1-CB 4.28Å; L212-L247 HydrophobicContact CD1-CD1 4.06Å; L212-L247 HydrophobicContact CD2-CD1 3.86Å; L212-L247 HydrophobicContact CG-CD1 4.42Å
213	N	43.8	Very low	45.4	Very low	87 Å²	87	98.6 Å²	98.6	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-60.1	-39.4	176.2	-67.2	-2.5	0	0	0	111.3	Q209 L215 E216 I217	Q209-N213 VanDerWaalsContact O-CG 3.24Å; Q209-N213 PolarHBondContact O-N 3.37Å; Q209-N213 PolarHBondContact O-OD1 3.14Å; N213-L215 VanDerWaalsContact C-N 3.27Å; N213-L215 PolarHBondContact O-N 3.06Å; N213-E216 PolarHBondContact O-N 2.82Å; N213-I217 WeakPolarHBondContact O-CD1 3.41Å; N213-I217 VanDerWaalsContact O-CG1 3.32Å; N213-I217 WeakPolarHBondContact O-CG1 3.44Å
214	N	45.9	Very low	44.6	Very low	104 Å²	104	100.1 Å²	100.1	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-69.6	-20.2	175.6	-68.5	-18.4	0	0	0	113.8	P210 N211 L212	P210-N214 WeakPolarHBondContact O-CB 3.2Å; P210-N214 PolarHBondContact O-N 2.99Å; P210-N214 PolarHBondContact O-ND2 3.26Å; N211-N214 PolarHBondContact O-N 2.86Å; L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 3.45Å
215	L	40.7	Very low	43.9	Very low	82 Å²	82	103.9 Å²	103.9	43%	0.429	57%	0.568	S	S	.	*	H	α-helix	trans	-81.1	-28.2	177.5	-82.4	162.9	0	0	0	113.2	N211 L212 N213	N211-L215 WeakPolarHBondContact O-CG 3.41Å; N211-L215 PolarHBondContact O-N 2.93Å; N211-L215 VanDerWaalsContact O-N 3.09Å; L212-L215 WeakPolarHBondContact O-CB 3.4Å; L212-L215 PolarHBondContact O-N 3.1Å; N213-L215 VanDerWaalsContact C-N 3.27Å; N213-L215 PolarHBondContact O-N 3.06Å
216	E	40.3	Very low	43.3	Very low	118 Å²	118	111 Å²	111	55%	0.551	61%	0.605	S	S	*	*	H	α-helix	trans	-86.1	-20.7	-179.2	-65.5	-172.4	162.4	0	0	113.3	L212 N213 S219	L212-E216 PolarHBondContact O-N 3.29Å; N213-E216 PolarHBondContact O-N 2.82Å; E216-S219 PolarHBondContact O-OG 3.48Å
217	I	36.8	Very low	42.4	Very low	117 Å²	117	114.6 Å²	114.6	60%	0.6	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-76.5	-24.7	-172.6	-71.8	169.3	0	0	0	114	N213 S219	N213-I217 WeakPolarHBondContact O-CD1 3.41Å; N213-I217 VanDerWaalsContact O-CG1 3.32Å; N213-I217 WeakPolarHBondContact O-CG1 3.44Å; I217-S219 PolarHBondContact O-N 2.79Å; I217-S219 VanDerWaalsContact O-N 3.12Å
218	N	38.6	Very low	41.3	Very low	143 Å²	143	110.5 Å²	110.5	77%	0.765	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-75.5	5.7	-179.8	-77.8	-2.7	0	0	0	114.7	N220	N218-N220 VanDerWaalsContact C-N 3.3Å; N218-N220 PolarHBondContact O-N 2.67Å
219	S	38	Very low	40.6	Very low	82 Å²	82	109.8 Å²	109.8	57%	0.573	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-83.9	5.4	-179.2	57.9	0	0	0	0	114.8	E216 I217	E216-S219 PolarHBondContact O-OG 3.48Å; I217-S219 PolarHBondContact O-N 2.79Å; I217-S219 VanDerWaalsContact O-N 3.12Å
220	N	33.2	Very low	40	Very low	147 Å²	147	112.7 Å²	112.7	79%	0.786	66%	0.661	S	S	*	*			trans	-134.6	78.1	-177.9	-75.3	-67.8	0	0	0	113	N218	N218-N220 VanDerWaalsContact C-N 3.3Å; N218-N220 PolarHBondContact O-N 2.67Å
221	S	37.8	Very low	39.3	Very low	102 Å²	102	119.8 Å²	119.8	71%	0.713	68%	0.679	S	S	*	*			trans	-150.2	128.2	160	60.2	0	0	0	0	111.6
222	D	37.8	Very low	38.8	Very low	153 Å²	153	121.3 Å²	121.3	82%	0.818	70%	0.696	S	S	*	*			trans	51.8	102.4	162.1	-57.7	-20.5	0	0	0	118.9	G224	D222-G224 PolarHBondContact O-N 3.47Å
223	T	35.5	Very low	38.5	Very low	159 Å²	159	124.7 Å²	124.7	98%	0.975	72%	0.717	S	S	*	*			trans	-64.9	69.3	143.7	51.3	0	0	0	0	109.9
224	G	37.7	Very low	38.4	Very low	60 Å²	60	125.2 Å²	125.2	62%	0.619	72%	0.72	S	S	*	*			trans	-102.1	113.6	179	0	0	0	0	0	111.8	D222	D222-G224 PolarHBondContact O-N 3.47Å
225	D	36.8	Very low	38.1	Very low	164 Å²	164	127.6 Å²	127.6	88%	0.877	73%	0.728	S	S	*	*			trans	36	112.6	171.6	-73	-36.7	0	0	0	120.6	N227	D225-N227 PolarHBondContact O-N 2.74Å
226	L	37.6	Very low	38.1	Very low	164 Å²	164	126.9 Å²	126.9	86%	0.859	73%	0.73	S	S	*	*			trans	-59.8	111.3	155.4	-65.1	162.4	0	0	0	110
227	N	39.6	Very low	38.1	Very low	169 Å²	169	126.8 Å²	126.8	90%	0.904	73%	0.73	S	S	*	*				165	104	130	-85.7	-45.5	0	0	0	112	D225	D225-N227 PolarHBondContact O-N 2.74Å
228	G	37.7	Very low	38.6	Very low	75 Å²	75	123.3 Å²	123.3	77%	0.773	72%	0.715	S	S	*	*			trans	166.1	114.7	167	0	0	0	0	0	116.5
229	S	36.9	Very low	38.7	Very low	111 Å²	111	119.9 Å²	119.9	78%	0.776	70%	0.697	S	S	*	*	S	Bend	trans	58.7	110.1	153.7	-151.4	0	0	0	0	120.4
230	N	38.9	Very low	39.1	Very low	152 Å²	152	119.3 Å²	119.3	81%	0.813	69%	0.688	S	S	*	*			trans	46.3	78.7	139.3	-62.3	-5.2	0	0	0	118.5	S232	N230-S232 PolarHBondContact O-N 3.17Å
231	R	35.8	Very low	40	Very low	218 Å²	218	115.1 Å²	115.1	82%	0.823	67%	0.67	S	S	*	*			trans	-58.6	94	170.5	-169.6	-172.3	-152.2	163.6	8.8	113.6
232	S	39.2	Very low	40.5	Very low	116 Å²	116	115.1 Å²	115.1	81%	0.811	66%	0.657	S	S	*	*			trans	-104.4	-2.3	162.9	59.6	0	0	0	0	113.6	N230	N230-S232 PolarHBondContact O-N 3.17Å
233	V	40	Very low	41.1	Very low	95 Å²	95	110.2 Å²	110.2	58%	0.576	63%	0.63	S	S	*	*			trans	-86.4	118.2	177.8	-174.7	0	0	0	0	109.6
234	N	41.7	Very low	41.9	Very low	98 Å²	98	103.1 Å²	103.1	52%	0.524	59%	0.587	S	S	.	*	S	Bend	trans	-178.5	-24.1	160.2	-102.9	-1.7	0	0	0	113.4
235	E	38.7	Very low	42.6	Very low	155 Å²	155	105.5 Å²	105.5	72%	0.724	58%	0.582	S	S	*	*	H	α-helix	trans	-75.8	-36	-175.4	-65	-159.2	143.4	0	0	113.9	S238 N239	E235-S238 WeakPolarHBondContact O-CB 3.36Å; E235-S238 PolarHBondContact O-N 3.04Å; E235-S238 PolarHBondContact O-OG 3.43Å; E235-N239 PolarHBondContact O-N 2.84Å; E235-N239 PolarHBondContact O-ND2 2.77Å
236	S	42.5	Very low	43.3	Very low	67 Å²	67	101.2 Å²	101.2	47%	0.469	56%	0.559	S	S	.	*	H	α-helix	trans	-61.4	-47.9	-177.1	46.6	0	0	0	0	112.9	S238 N239 N240	S236-S238 VanDerWaalsContact C-N 3.3Å; S236-S238 PolarHBondContact O-N 3.4Å; S236-N239 PolarHBondContact O-N 3.41Å; S236-N239 VanDerWaalsContact O-N 3.11Å; S236-N240 PolarHBondContact O-N 3.39Å
237	E	40.2	Very low	44.1	Very low	116 Å²	116	95 Å²	95	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-61.6	-39.7	175	-65.4	-174.7	123.1	0	0	111.5	N239 N240 S241	E237-N239 VanDerWaalsContact C-N 3.26Å; E237-N239 PolarHBondContact O-N 3.43Å; E237-N240 PolarHBondContact O-N 3.29Å; E237-S241 WeakPolarHBondContact O-CB 3.09Å; E237-S241 PolarHBondContact O-N 2.86Å
238	S	45.7	Very low	44.9	Very low	43 Å²	43	91.5 Å²	91.5	30%	0.301	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-35.5	175.2	92.1	0	0	0	0	112	E235 S236 K242	E235-S238 WeakPolarHBondContact O-CB 3.36Å; E235-S238 PolarHBondContact O-N 3.04Å; E235-S238 PolarHBondContact O-OG 3.43Å; S236-S238 VanDerWaalsContact C-N 3.3Å; S236-S238 PolarHBondContact O-N 3.4Å; S238-K242 VanDerWaalsContact O-CD 3.27Å; S238-K242 WeakPolarHBondContact O-CD 3.11Å; S238-K242 WeakPolarHBondContact O-CE 3Å; S238-K242 WeakPolarHBondContact O-CG 3.27Å; S238-K242 PolarHBondContact O-N 3.04Å; S238-K242 PolarHBondContact OG-NZ 2.84Å
239	N	40.6	Very low	45.7	Very low	72 Å²	72	92.7 Å²	92.7	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-79.2	-37.2	-178.9	-70.1	-17.6	0	0	0	112	E235 S236 E237 K242 L243	E235-N239 PolarHBondContact O-N 2.84Å; E235-N239 PolarHBondContact O-ND2 2.77Å; S236-N239 PolarHBondContact O-N 3.41Å; S236-N239 VanDerWaalsContact O-N 3.11Å; E237-N239 VanDerWaalsContact C-N 3.26Å; E237-N239 PolarHBondContact O-N 3.43Å; N239-K242 PolarHBondContact O-N 2.9Å; N239-K242 PolarHBondContact OD1-NZ 3.19Å; N239-L243 WeakPolarHBondContact O-CB 3.15Å; N239-L243 PolarHBondContact O-N 3Å
240	N	46.5	Very low	46.4	Very low	70 Å²	70	90.5 Å²	90.5	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-62.8	-44.2	170.2	-70.6	-14.7	0	0	0	111.1	S236 E237 K242 L243 S244	S236-N240 PolarHBondContact O-N 3.39Å; E237-N240 PolarHBondContact O-N 3.29Å; N240-K242 PolarHBondContact O-N 3.06Å; N240-L243 WeakPolarHBondContact O-CB 2.95Å; N240-L243 PolarHBondContact O-N 2.66Å; N240-L243 VanDerWaalsContact O-N 3.11Å; N240-S244 PolarHBondContact O-N 2.92Å; N240-S244 PolarHBondContact O-OG 3.17Å
241	S	52.1	Low	47.2	Very low	59 Å²	59	86 Å²	86	41%	0.413	45%	0.449	S	S	.	.	H	α-helix	trans	-58.9	-45.9	174.7	-173.3	0	0	0	0	112.3	E237 L243 S244 Q245	E237-S241 WeakPolarHBondContact O-CB 3.09Å; E237-S241 PolarHBondContact O-N 2.86Å; S241-L243 VanDerWaalsContact C-N 3.31Å; S241-L243 PolarHBondContact O-N 2.69Å; S241-S244 PolarHBondContact O-N 2.93Å; S241-Q245 WeakPolarHBondContact O-CB 3.36Å; S241-Q245 VanDerWaalsContact O-CG 3.26Å; S241-Q245 WeakPolarHBondContact O-CG 3.13Å; S241-Q245 PolarHBondContact O-N 3.11Å; S241-Q245 PolarHBondContact OG-NE2 3.45Å
242	K	49.3	Very low	48.3	Very low	102 Å²	102	82.2 Å²	82.2	44%	0.443	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-37	173.9	-69	160.5	-150.1	157.6	0	112.1	S238 N239 N240 Q245 L246	S238-K242 VanDerWaalsContact O-CD 3.27Å; S238-K242 WeakPolarHBondContact O-CD 3.11Å; S238-K242 WeakPolarHBondContact O-CE 3Å; S238-K242 WeakPolarHBondContact O-CG 3.27Å; S238-K242 PolarHBondContact O-N 3.04Å; S238-K242 PolarHBondContact OG-NZ 2.84Å; N239-K242 PolarHBondContact O-N 2.9Å; N239-K242 PolarHBondContact OD1-NZ 3.19Å; N240-K242 PolarHBondContact O-N 3.06Å; K242-Q245 PolarHBondContact O-N 3.08Å; K242-L246 WeakPolarHBondContact O-CB 3.13Å; K242-L246 VanDerWaalsContact O-CG 3.3Å; K242-L246 WeakPolarHBondContact O-CG 3.28Å; K242-L246 PolarHBondContact O-N 2.73Å
243	L	49.2	Very low	48.8	Very low	49 Å²	49	81.1 Å²	81.1	26%	0.257	42%	0.423	S	S	.	.	H	α-helix	trans	-68.2	-46.8	178.8	-167.8	72.5	0	0	0	111.5	L104 N239 N240 S241 Q245 L246 L247	L104-L243 HydrophobicContact CD1-CD1 4.24Å; N239-L243 WeakPolarHBondContact O-CB 3.15Å; N239-L243 PolarHBondContact O-N 3Å; N240-L243 WeakPolarHBondContact O-CB 2.95Å; N240-L243 PolarHBondContact O-N 2.66Å; N240-L243 VanDerWaalsContact O-N 3.11Å; S241-L243 VanDerWaalsContact C-N 3.31Å; S241-L243 PolarHBondContact O-N 2.69Å; L243-Q245 VanDerWaalsContact C-N 3.31Å; L243-Q245 PolarHBondContact O-N 2.69Å; L243-L246 PolarHBondContact O-N 2.78Å; L243-L247 HydrophobicContact CG-CD1 4.05Å; L243-L247 PolarHBondContact O-N 3.25Å
244	S	52.2	Low	49.4	Very low	10 Å²	10	77.5 Å²	77.5	7%	0.07	40%	0.401	C	S	.	.	H	α-helix	trans	-57.3	-43.9	172.7	-64.3	0	0	0	0	111.6	N240 S241 L247 L248	N240-S244 PolarHBondContact O-N 2.92Å; N240-S244 PolarHBondContact O-OG 3.17Å; S241-S244 PolarHBondContact O-N 2.93Å; S244-L247 PolarHBondContact O-N 3.44Å; S244-L248 WeakPolarHBondContact O-CB 3.3Å; S244-L248 PolarHBondContact O-N 3.13Å
245	Q	53.2	Low	50.2	Low	111 Å²	111	76.4 Å²	76.4	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-41.3	175.8	-71.3	173.1	34.4	0	0	112.7	S241 K242 L243 L248 L249	S241-Q245 WeakPolarHBondContact O-CB 3.36Å; S241-Q245 VanDerWaalsContact O-CG 3.26Å; S241-Q245 WeakPolarHBondContact O-CG 3.13Å; S241-Q245 PolarHBondContact O-N 3.11Å; S241-Q245 PolarHBondContact OG-NE2 3.45Å; K242-Q245 PolarHBondContact O-N 3.08Å; L243-Q245 VanDerWaalsContact C-N 3.31Å; L243-Q245 PolarHBondContact O-N 2.69Å; Q245-L248 PolarHBondContact O-N 2.61Å; Q245-L249 WeakPolarHBondContact O-CB 3.45Å; Q245-L249 WeakPolarHBondContact O-CG 3.34Å; Q245-L249 PolarHBondContact O-N 2.79Å
246	L	50.9	Low	51.3	Low	73 Å²	73	74.6 Å²	74.6	38%	0.382	39%	0.385	S	S	.	.	H	α-helix	trans	-65.1	-39.7	175.6	-79.2	165.3	0	0	0	112.2	K242 L243 L249 L250	K242-L246 WeakPolarHBondContact O-CB 3.13Å; K242-L246 VanDerWaalsContact O-CG 3.3Å; K242-L246 WeakPolarHBondContact O-CG 3.28Å; K242-L246 PolarHBondContact O-N 2.73Å; L243-L246 PolarHBondContact O-N 2.78Å; L246-L249 PolarHBondContact O-N 2.7Å; L246-L250 WeakPolarHBondContact O-CB 3.46Å; L246-L250 WeakPolarHBondContact O-CG 3.27Å; L246-L250 PolarHBondContact O-N 2.89Å
247	L	54.2	Low	51.8	Low	33 Å²	33	75.6 Å²	75.6	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-67.8	-39.7	175.4	-80.4	154.2	0	0	0	111.8	L212 L243 S244 L250 H251	L212-L247 HydrophobicContact CD1-CB 4.28Å; L212-L247 HydrophobicContact CD1-CD1 4.06Å; L212-L247 HydrophobicContact CD2-CD1 3.86Å; L212-L247 HydrophobicContact CG-CD1 4.42Å; L243-L247 HydrophobicContact CG-CD1 4.05Å; L243-L247 PolarHBondContact O-N 3.25Å; S244-L247 PolarHBondContact O-N 3.44Å; L247-L250 PolarHBondContact O-N 3.29Å; L247-H251 VanDerWaalsContact O-CB 3.29Å; L247-H251 WeakPolarHBondContact O-CB 3.29Å; L247-H251 PolarHBondContact O-N 3.47Å
248	L	58.2	Low	52.5	Low	97 Å²	97	73 Å²	73	51%	0.508	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-36.6	171.7	-87.2	158.5	0	0	0	113.1	S244 Q245 K252	S244-L248 WeakPolarHBondContact O-CB 3.3Å; S244-L248 PolarHBondContact O-N 3.13Å; Q245-L248 PolarHBondContact O-N 2.61Å; L248-K252 VanDerWaalsContact O-CG 3.31Å; L248-K252 WeakPolarHBondContact O-CG 3.33Å; L248-K252 PolarHBondContact O-N 3.23Å; L248-K252 VanDerWaalsContact O-N 3.14Å
249	L	54	Low	53.1	Low	99 Å²	99	74 Å²	74	52%	0.518	38%	0.377	S	S	.	.	H	α-helix	trans	-67.1	-49.4	173.1	-83.3	160.4	0	0	0	111.3	Q245 L246 H251 K252 D253	Q245-L249 WeakPolarHBondContact O-CB 3.45Å; Q245-L249 WeakPolarHBondContact O-CG 3.34Å; Q245-L249 PolarHBondContact O-N 2.79Å; L246-L249 PolarHBondContact O-N 2.7Å; L249-H251 VanDerWaalsContact C-N 3.33Å; L249-H251 PolarHBondContact O-N 3.29Å; L249-K252 PolarHBondContact O-N 3.03Å; L249-D253 PolarHBondContact O-N 2.82Å
250	L	51.8	Low	53.8	Low	65 Å²	65	75.9 Å²	75.9	34%	0.34	38%	0.382	S	S	.	.	H	α-helix	trans	-57.7	-44.4	175.8	-80.1	163.7	0	0	0	111.9	L246 L247 K252 D253 I254	L246-L250 WeakPolarHBondContact O-CB 3.46Å; L246-L250 WeakPolarHBondContact O-CG 3.27Å; L246-L250 PolarHBondContact O-N 2.89Å; L247-L250 PolarHBondContact O-N 3.29Å; L250-K252 PolarHBondContact O-N 2.59Å; L250-D253 PolarHBondContact O-N 3.28Å; L250-I254 WeakPolarHBondContact O-CB 3.32Å; L250-I254 WeakPolarHBondContact O-CD1 3.38Å; L250-I254 WeakPolarHBondContact O-CG1 3.04Å; L250-I254 PolarHBondContact O-N 2.77Å
251	H	55.7	Low	54.2	Low	59 Å²	59	74 Å²	74	27%	0.273	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-41.7	177.8	-170.9	80.2	0	0	0	111.9	I205 L247 L249 I255	I205-H251 HydrophobicContact CD1-CB 4.21Å; L247-H251 VanDerWaalsContact O-CB 3.29Å; L247-H251 WeakPolarHBondContact O-CB 3.29Å; L247-H251 PolarHBondContact O-N 3.47Å; L249-H251 VanDerWaalsContact C-N 3.33Å; L249-H251 PolarHBondContact O-N 3.29Å; H251-I255 WeakPolarHBondContact NE2-CD1 3.33Å; H251-I255 WeakPolarHBondContact O-CB 3.3Å; H251-I255 WeakPolarHBondContact O-CG1 3.07Å; H251-I255 PolarHBondContact O-N 3.03Å
252	K	58.6	Low	54.4	Low	137 Å²	137	77.2 Å²	77.2	60%	0.596	38%	0.38	S	S	*	.	H	α-helix	trans	-64.8	-43.7	173.8	-75	171.3	-178.8	175.8	0	112.7	L248 L249 L250 I255 H256	L248-K252 VanDerWaalsContact O-CG 3.31Å; L248-K252 WeakPolarHBondContact O-CG 3.33Å; L248-K252 PolarHBondContact O-N 3.23Å; L248-K252 VanDerWaalsContact O-N 3.14Å; L249-K252 PolarHBondContact O-N 3.03Å; L250-K252 PolarHBondContact O-N 2.59Å; K252-I255 PolarHBondContact O-N 3.1Å; K252-H256 WeakPolarHBondContact O-CB 3.28Å; K252-H256 PolarHBondContact O-N 2.88Å
253	D	49.3	Very low	54.7	Low	94 Å²	94	77.9 Å²	77.9	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-66	-38.6	178	-84.1	0.1	0	0	0	111.8	L249 L250 H256 L257	L249-D253 PolarHBondContact O-N 2.82Å; L250-D253 PolarHBondContact O-N 3.28Å; D253-H256 PolarHBondContact O-N 2.89Å; D253-L257 WeakPolarHBondContact O-CB 3.35Å; D253-L257 WeakPolarHBondContact O-CG 3.3Å; D253-L257 PolarHBondContact O-N 3.04Å
254	I	52.2	Low	54.8	Low	19 Å²	19	81.8 Å²	81.8	10%	0.097	41%	0.405	C	S	.	.	H	α-helix	trans	-66.2	-47.4	175.3	-70.6	161.8	0	0	0	110.8	I198 F201 L202 I205 L250 H256 L257 Q258	I198-I254 HydrophobicContact CG2-CG2 4.02Å; F201-I254 HydrophobicContact CB-CD1 3.93Å; F201-I254 HydrophobicContact CG-CD1 4.43Å; L202-I254 HydrophobicContact CD2-CG2 4.04Å; L202-I254 HydrophobicContact CG-CG2 4.31Å; I205-I254 HydrophobicContact CD1-CD1 3.89Å; L250-I254 WeakPolarHBondContact O-CB 3.32Å; L250-I254 WeakPolarHBondContact O-CD1 3.38Å; L250-I254 WeakPolarHBondContact O-CG1 3.04Å; L250-I254 PolarHBondContact O-N 2.77Å; I254-H256 VanDerWaalsContact C-N 3.3Å; I254-H256 PolarHBondContact O-N 2.95Å; I254-L257 PolarHBondContact O-N 3.36Å; I254-Q258 PolarHBondContact O-N 3.48Å
255	I	59.8	Low	54.6	Low	75 Å²	75	83.4 Å²	83.4	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175	-72.4	172.5	0	0	0	110.4	H251 K252 Q258 T259	H251-I255 WeakPolarHBondContact NE2-CD1 3.33Å; H251-I255 WeakPolarHBondContact O-CB 3.3Å; H251-I255 WeakPolarHBondContact O-CG1 3.07Å; H251-I255 PolarHBondContact O-N 3.03Å; K252-I255 PolarHBondContact O-N 3.1Å; I255-Q258 PolarHBondContact O-N 3.28Å; I255-T259 VanDerWaalsContact O-CB 3.23Å; I255-T259 WeakPolarHBondContact O-CB 3.47Å; I255-T259 PolarHBondContact O-N 2.95Å; I255-T259 PolarHBondContact O-OG1 3.3Å
256	H	61.3	Low	54.1	Low	117 Å²	117	82.5 Å²	82.5	54%	0.542	41%	0.413	S	S	.	.	H	α-helix	trans	-63.8	-42.6	175.7	-175.2	81.1	0	0	0	111.9	K252 D253 I254 K260	K252-H256 WeakPolarHBondContact O-CB 3.28Å; K252-H256 PolarHBondContact O-N 2.88Å; D253-H256 PolarHBondContact O-N 2.89Å; I254-H256 VanDerWaalsContact C-N 3.3Å; I254-H256 PolarHBondContact O-N 2.95Å; H256-K260 WeakPolarHBondContact O-CB 3.36Å; H256-K260 PolarHBondContact O-N 3.49Å
257	L	52.7	Low	53.6	Low	87 Å²	87	87 Å²	87	46%	0.455	43%	0.43	S	S	.	.	H	α-helix	trans	-61.6	-46.1	174.9	-83.8	162.2	0	0	0	112.1	D253 I254 K260 L261	D253-L257 WeakPolarHBondContact O-CB 3.35Å; D253-L257 WeakPolarHBondContact O-CG 3.3Å; D253-L257 PolarHBondContact O-N 3.04Å; I254-L257 PolarHBondContact O-N 3.36Å; L257-K260 PolarHBondContact O-N 3.48Å; L257-L261 WeakPolarHBondContact O-CB 3.19Å; L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 2.93Å
258	Q	54.3	Low	52.9	Low	62 Å²	62	92.1 Å²	92.1	29%	0.29	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-53.3	175.7	-179.7	176.6	-12.3	0	0	111.2	I198 I254 I255 K260 L261 E262	I198-Q258 HydrophobicContact CD1-CB 4.49Å; I198-Q258 HydrophobicContact CG2-CB 4.44Å; I254-Q258 PolarHBondContact O-N 3.48Å; I255-Q258 PolarHBondContact O-N 3.28Å; Q258-K260 PolarHBondContact O-N 3.1Å; Q258-K260 VanDerWaalsContact O-N 3.16Å; Q258-L261 CarbonylContact O-C 3.57Å; Q258-L261 PolarHBondContact O-N 2.99Å; Q258-E262 HydrophobicContact CG-CG 4.38Å; Q258-E262 VanDerWaalsContact CG-OE1 3.22Å; Q258-E262 WeakPolarHBondContact CG-OE1 3.27Å; Q258-E262 PolarHBondContact NE2-OE1 2.86Å; Q258-E262 WeakPolarHBondContact O-CG 3.24Å; Q258-E262 PolarHBondContact O-N 3.14Å
259	T	59.3	Low	51.9	Low	65 Å²	65	90.6 Å²	90.6	40%	0.399	44%	0.441	S	S	.	.	H	α-helix	trans	-53.8	-38.3	177	-55.4	0	0	0	0	111.3	I255 N263	I255-T259 VanDerWaalsContact O-CB 3.23Å; I255-T259 WeakPolarHBondContact O-CB 3.47Å; I255-T259 PolarHBondContact O-N 2.95Å; I255-T259 PolarHBondContact O-OG1 3.3Å; T259-N263 WeakPolarHBondContact CG2-ND2 3.46Å; T259-N263 WeakPolarHBondContact O-CB 3.25Å; T259-N263 PolarHBondContact O-N 2.98Å; T259-N263 PolarHBondContact O-ND2 3.45Å
260	K	56.1	Low	51.1	Low	110 Å²	110	93.1 Å²	93.1	48%	0.478	45%	0.45	S	S	.	.	H	α-helix	trans	-71.7	-41.9	176.9	-171.1	170.7	-175.4	172.5	0	112.2	H256 L257 Q258 E262 Q264	H256-K260 WeakPolarHBondContact O-CB 3.36Å; H256-K260 PolarHBondContact O-N 3.49Å; L257-K260 PolarHBondContact O-N 3.48Å; Q258-K260 PolarHBondContact O-N 3.1Å; Q258-K260 VanDerWaalsContact O-N 3.16Å; K260-E262 VanDerWaalsContact C-N 3.3Å; K260-E262 PolarHBondContact O-N 3.46Å; K260-Q264 CarbonylContact O-C 3.54Å; K260-Q264 WeakPolarHBondContact O-CA 3.15Å; K260-Q264 VanDerWaalsContact O-CB 3.26Å; K260-Q264 WeakPolarHBondContact O-CB 3.3Å; K260-Q264 PolarHBondContact O-N 3.04Å; K260-Q264 VanDerWaalsContact O-O 3.05Å
261	L	54.1	Low	50.4	Low	32 Å²	32	93.2 Å²	93.2	17%	0.168	45%	0.453	C	S	.	.	H	α-helix	trans	-69.1	-24.8	175.8	-74.3	167.2	0	0	0	113.7	Q191 I198 L257 Q258 Q264 P265	Q191-L261 PolarHBondContact NE2-O 3.29Å; I198-L261 HydrophobicContact CD1-CD1 3.9Å; L257-L261 WeakPolarHBondContact O-CB 3.19Å; L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 2.93Å; Q258-L261 CarbonylContact O-C 3.57Å; Q258-L261 PolarHBondContact O-N 2.99Å; L261-Q264 CarbonylContact O-C 3.46Å; L261-P265 WeakPolarHBondContact O-CA 3.31Å; L261-P265 VanDerWaalsContact O-N 3.15Å
262	E	57	Low	49.5	Very low	125 Å²	125	92.9 Å²	92.9	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-84	-43.2	176.8	-72.8	175.3	-172.4	0	0	112.8	Q258 K260 P265	Q258-E262 HydrophobicContact CG-CG 4.38Å; Q258-E262 VanDerWaalsContact CG-OE1 3.22Å; Q258-E262 WeakPolarHBondContact CG-OE1 3.27Å; Q258-E262 PolarHBondContact NE2-OE1 2.86Å; Q258-E262 WeakPolarHBondContact O-CG 3.24Å; Q258-E262 PolarHBondContact O-N 3.14Å; K260-E262 VanDerWaalsContact C-N 3.3Å; K260-E262 PolarHBondContact O-N 3.46Å; E262-P265 WeakPolarHBondContact O-CD 3.23Å
263	N	55.2	Low	48.4	Very low	116 Å²	116	88.4 Å²	88.4	62%	0.62	44%	0.439	S	S	*	.	H	α-helix	trans	-83.8	-33.4	178.7	-71.1	-76.9	0	0	0	112.7	T259 P265	T259-N263 WeakPolarHBondContact CG2-ND2 3.46Å; T259-N263 WeakPolarHBondContact O-CB 3.25Å; T259-N263 PolarHBondContact O-N 2.98Å; T259-N263 PolarHBondContact O-ND2 3.45Å; N263-P265 WeakPolarHBondContact O-CD 3.33Å
264	Q	50.6	Low	47.7	Very low	131 Å²	131	87 Å²	87	61%	0.612	43%	0.434	S	S	*	.	S	Bend	trans	-117.1	72.1	167.7	-60.7	-180	-8.6	0	0	108.7	K260 L261	K260-Q264 CarbonylContact O-C 3.54Å; K260-Q264 WeakPolarHBondContact O-CA 3.15Å; K260-Q264 VanDerWaalsContact O-CB 3.26Å; K260-Q264 WeakPolarHBondContact O-CB 3.3Å; K260-Q264 PolarHBondContact O-N 3.04Å; K260-Q264 VanDerWaalsContact O-O 3.05Å; L261-Q264 CarbonylContact O-C 3.46Å
265	P	47.4	Very low	46.9	Very low	45 Å²	45	92.5 Å²	92.5	29%	0.292	46%	0.457	S	S	.	.			trans	-56.2	158.2	159.6	29.2	-33.3	0	0	0	107.5	L261 E262 N263 K267	L261-P265 WeakPolarHBondContact O-CA 3.31Å; L261-P265 VanDerWaalsContact O-N 3.15Å; E262-P265 WeakPolarHBondContact O-CD 3.23Å; N263-P265 WeakPolarHBondContact O-CD 3.33Å; P265-K267 HydrophobicContact CG-CG 4.26Å; P265-K267 PolarHBondContact O-N 3.1Å
266	I	43.8	Very low	45.5	Very low	91 Å²	91	95.1 Å²	95.1	47%	0.467	47%	0.472	S	S	.	.			trans	-70.2	75.5	-174.1	-51.6	178.1	0	0	0	109.8	Y268	I266-Y268 VanDerWaalsContact C-N 3.26Å; I266-Y268 PolarHBondContact O-N 2.64Å
267	K	39.5	Very low	44.1	Very low	169 Å²	169	92 Å²	92	74%	0.735	47%	0.466	S	S	*	.			trans	-71.8	87.8	174.5	-74.4	-179.2	-179.3	174.1	0	106.2	P265 D269	P265-K267 HydrophobicContact CG-CG 4.26Å; P265-K267 PolarHBondContact O-N 3.1Å; K267-D269 PolarHBondContact O-N 3.42Å
268	Y	39.2	Very low	43.1	Very low	139 Å²	139	94.9 Å²	94.9	55%	0.545	48%	0.477	S	S	.	.			trans	-60.2	101	149.1	-115.9	-50.4	0	0	0	106.9	I266 E270 I273	I266-Y268 VanDerWaalsContact C-N 3.26Å; I266-Y268 PolarHBondContact O-N 2.64Å; Y268-E270 PolarHBondContact O-N 3.15Å; Y268-I273 HydrophobicContact CD1-CD1 3.62Å; Y268-I273 HydrophobicContact CD1-CG1 3.28Å; Y268-I273 HydrophobicContact CD2-CD1 3.98Å; Y268-I273 HydrophobicContact CE1-CD1 3.86Å; Y268-I273 HydrophobicContact CE1-CG1 3.33Å; Y268-I273 HydrophobicContact CE2-CD1 4.18Å; Y268-I273 HydrophobicContact CG-CD1 3.68Å; Y268-I273 HydrophobicContact CG-CG1 3.92Å
269	D	37.9	Very low	42	Very low	66 Å²	66	99.4 Å²	99.4	35%	0.353	50%	0.496	S	S	.	.			trans	-54.1	110.7	161	165.6	29.5	0	0	0	106.6	K267 T271 S272 I273	K267-D269 PolarHBondContact O-N 3.42Å; D269-T271 PolarHBondContact O-N 3.22Å; D269-T271 WeakPolarHBondContact OD1-CA 3.46Å; D269-T271 VanDerWaalsContact OD1-CB 3.25Å; D269-T271 WeakPolarHBondContact OD1-CB 3.08Å; D269-T271 WeakPolarHBondContact OD1-CG2 3.4Å; D269-T271 PolarHBondContact OD1-N 2.91Å; D269-T271 PolarHBondContact OD1-OG1 3.47Å; D269-T271 PolarHBondContact OD2-OG1 3.12Å; D269-S272 WeakPolarHBondContact O-CA 3.35Å; D269-S272 PolarHBondContact O-N 3.06Å; D269-S272 VanDerWaalsContact OD2-CB 3.27Å; D269-S272 WeakPolarHBondContact OD2-CB 3.35Å; D269-S272 PolarHBondContact OD2-N 2.88Å; D269-S272 PolarHBondContact OD2-OG 3.36Å; D269-I273 PolarHBondContact O-N 3Å; D269-I273 VanDerWaalsContact O-N 3.16Å
270	E	37.1	Very low	40.8	Very low	152 Å²	152	99.3 Å²	99.3	71%	0.71	50%	0.497	S	S	*	.	H	α-helix	trans	-55.8	-33.3	175.7	-71.7	-170.5	140.8	0	0	109.6	Y268 S272 I273 V274	Y268-E270 PolarHBondContact O-N 3.15Å; E270-S272 PolarHBondContact O-N 3.29Å; E270-I273 PolarHBondContact O-N 3.32Å; E270-V274 WeakPolarHBondContact O-CB 3.19Å; E270-V274 WeakPolarHBondContact O-CG2 3.29Å; E270-V274 PolarHBondContact O-N 3.35Å
271	T	38.1	Very low	40.1	Very low	67 Å²	67	99.1 Å²	99.1	41%	0.411	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-13.4	175.5	89.9	0	0	0	0	113.7	D269 K275	D269-T271 PolarHBondContact O-N 3.22Å; D269-T271 WeakPolarHBondContact OD1-CA 3.46Å; D269-T271 VanDerWaalsContact OD1-CB 3.25Å; D269-T271 WeakPolarHBondContact OD1-CB 3.08Å; D269-T271 WeakPolarHBondContact OD1-CG2 3.4Å; D269-T271 PolarHBondContact OD1-N 2.91Å; D269-T271 PolarHBondContact OD1-OG1 3.47Å; D269-T271 PolarHBondContact OD2-OG1 3.12Å; T271-K275 WeakPolarHBondContact O-CB 3.48Å; T271-K275 WeakPolarHBondContact O-CD 3.08Å; T271-K275 WeakPolarHBondContact O-CG 3.45Å; T271-K275 PolarHBondContact O-N 2.9Å; T271-K275 PolarHBondContact OG1-NZ 2.78Å
272	S	36.5	Very low	39.7	Very low	51 Å²	51	100.7 Å²	100.7	36%	0.357	51%	0.509	S	S	.	.	H	α-helix	trans	-97.4	-28.1	174.8	-72.5	0	0	0	0	113.6	D269 E270 N276	D269-S272 WeakPolarHBondContact O-CA 3.35Å; D269-S272 PolarHBondContact O-N 3.06Å; D269-S272 VanDerWaalsContact OD2-CB 3.27Å; D269-S272 WeakPolarHBondContact OD2-CB 3.35Å; D269-S272 PolarHBondContact OD2-N 2.88Å; D269-S272 PolarHBondContact OD2-OG 3.36Å; E270-S272 PolarHBondContact O-N 3.29Å; S272-N276 PolarHBondContact O-ND2 3.26Å; S272-N276 VanDerWaalsContact O-ND2 3.13Å
273	I	35.3	Very low	38.9	Very low	44 Å²	44	97.3 Å²	97.3	23%	0.226	49%	0.492	C	S	.	.	H	α-helix	trans	-65.4	-51.9	158.7	-59.7	-176	0	0	0	107.9	I180 Y268 D269 E270 K275 N276 A277	I180-I273 HydrophobicContact CD1-CG2 4.42Å; Y268-I273 HydrophobicContact CD1-CD1 3.62Å; Y268-I273 HydrophobicContact CD1-CG1 3.28Å; Y268-I273 HydrophobicContact CD2-CD1 3.98Å; Y268-I273 HydrophobicContact CE1-CD1 3.86Å; Y268-I273 HydrophobicContact CE1-CG1 3.33Å; Y268-I273 HydrophobicContact CE2-CD1 4.18Å; Y268-I273 HydrophobicContact CG-CD1 3.68Å; Y268-I273 HydrophobicContact CG-CG1 3.92Å; D269-I273 PolarHBondContact O-N 3Å; D269-I273 VanDerWaalsContact O-N 3.16Å; E270-I273 PolarHBondContact O-N 3.32Å; I273-K275 PolarHBondContact O-N 2.75Å; I273-N276 CarbonylContact O-C 3.56Å; I273-N276 PolarHBondContact O-N 3.43Å; I273-A277 HydrophobicContact CG2-CB 4.26Å; I273-A277 WeakPolarHBondContact O-CB 3.4Å; I273-A277 PolarHBondContact O-N 2.89Å
274	V	34.4	Very low	38.4	Very low	64 Å²	64	100.4 Å²	100.4	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-41.9	-177.9	170.3	0	0	0	0	111.5	E270 N276 A277 Q278	E270-V274 WeakPolarHBondContact O-CB 3.19Å; E270-V274 WeakPolarHBondContact O-CG2 3.29Å; E270-V274 PolarHBondContact O-N 3.35Å; V274-N276 PolarHBondContact O-N 2.9Å; V274-N276 VanDerWaalsContact O-N 3.17Å; V274-A277 PolarHBondContact O-N 3.13Å; V274-Q278 HydrophobicContact CG1-CB 3.71Å; V274-Q278 HydrophobicContact CG1-CG 4.4Å; V274-Q278 CarbonylContact O-C 3.59Å; V274-Q278 WeakPolarHBondContact O-CA 3.34Å; V274-Q278 WeakPolarHBondContact O-CB 3.47Å; V274-Q278 PolarHBondContact O-N 3.31Å
275	K	34.9	Very low	38.3	Very low	134 Å²	134	97.7 Å²	97.7	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-63.6	-24.6	175.3	-77.1	159.8	-162.6	147.9	0	113.9	T271 I273 K279	T271-K275 WeakPolarHBondContact O-CB 3.48Å; T271-K275 WeakPolarHBondContact O-CD 3.08Å; T271-K275 WeakPolarHBondContact O-CG 3.45Å; T271-K275 PolarHBondContact O-N 2.9Å; T271-K275 PolarHBondContact OG1-NZ 2.78Å; I273-K275 PolarHBondContact O-N 2.75Å; K275-K279 PolarHBondContact O-N 2.89Å
276	N	31.5	Very low	38.2	Very low	131 Å²	131	98.9 Å²	98.9	70%	0.701	49%	0.491	S	S	*	.	H	α-helix	trans	-101.8	-17.2	-179.2	-68.5	-37.2	0	0	0	114.8	S272 I273 V274	S272-N276 PolarHBondContact O-ND2 3.26Å; S272-N276 VanDerWaalsContact O-ND2 3.13Å; I273-N276 CarbonylContact O-C 3.56Å; I273-N276 PolarHBondContact O-N 3.43Å; V274-N276 PolarHBondContact O-N 2.9Å; V274-N276 VanDerWaalsContact O-N 3.17Å
277	A	30.9	Very low	38.2	Very low	51 Å²	51	96.1 Å²	96.1	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-113.7	-3.2	174.6	0	0	0	0	0	113.3	I273 V274 K279	I273-A277 HydrophobicContact CG2-CB 4.26Å; I273-A277 WeakPolarHBondContact O-CB 3.4Å; I273-A277 PolarHBondContact O-N 2.89Å; V274-A277 PolarHBondContact O-N 3.13Å; A277-K279 CarbonylContact C-O 3.54Å; A277-K279 VanDerWaalsContact O-O 3.12Å
278	Q	31	Very low	38.7	Very low	147 Å²	147	92.4 Å²	92.4	69%	0.687	47%	0.467	S	S	*	.	S	Bend	trans	-127.9	14.4	170.4	-150.3	166.5	-42.5	0	0	112.5	V274 P280	V274-Q278 HydrophobicContact CG1-CB 3.71Å; V274-Q278 HydrophobicContact CG1-CG 4.4Å; V274-Q278 CarbonylContact O-C 3.59Å; V274-Q278 WeakPolarHBondContact O-CA 3.34Å; V274-Q278 WeakPolarHBondContact O-CB 3.47Å; V274-Q278 PolarHBondContact O-N 3.31Å; Q278-P280 VanDerWaalsContact C-N 3.29Å; Q278-P280 WeakPolarHBondContact O-CD 3.32Å
279	K	31.8	Very low	39.1	Very low	157 Å²	157	88.7 Å²	88.7	68%	0.683	46%	0.462	S	S	*	.	S	Bend		-57.6	107.5	104.7	-88.7	-165.7	175.2	-172.1	0	105.8	K275 A277 L281	K275-K279 PolarHBondContact O-N 2.89Å; A277-K279 CarbonylContact C-O 3.54Å; A277-K279 VanDerWaalsContact O-O 3.12Å; K279-L281 PolarHBondContact O-N 3.12Å
280	P	33.8	Very low	39.6	Very low	63 Å²	63	87 Å²	87	41%	0.409	45%	0.452	S	S	.	.			trans	-51.5	148.8	167.5	24.6	-32.9	0	0	0	107.8	Q278 D282	Q278-P280 VanDerWaalsContact C-N 3.29Å; Q278-P280 WeakPolarHBondContact O-CD 3.32Å; P280-D282 HydrophobicContact CG-CB 4.48Å; P280-D282 WeakPolarHBondContact O-CA 3.35Å; P280-D282 VanDerWaalsContact O-CB 3.32Å; P280-D282 WeakPolarHBondContact O-CB 3.49Å; P280-D282 PolarHBondContact O-N 2.98Å
281	L	41	Very low	40.4	Very low	107 Å²	107	84.2 Å²	84.2	56%	0.56	44%	0.442	S	S	*	.	S	Bend	trans	-63.3	98.1	163.1	-171.6	152.6	0	0	0	104.7	K279 F283	K279-L281 PolarHBondContact O-N 3.12Å; L281-F283 VanDerWaalsContact C-N 3.3Å; L281-F283 HydrophobicContact CB-CE2 4.42Å; L281-F283 HydrophobicContact CD2-CZ 4.28Å; L281-F283 WeakPolarHBondContact O-CD2 3.27Å; L281-F283 VanDerWaalsContact O-CE2 3.3Å; L281-F283 WeakPolarHBondContact O-CE2 3.48Å; L281-F283 WeakPolarHBondContact O-CG 3.5Å; L281-F283 PolarHBondContact O-N 3.42Å
282	D	45.7	Very low	41.2	Very low	64 Å²	64	85 Å²	85	34%	0.342	45%	0.446	S	S	.	.	S	Bend		-73.2	85.1	-125.8	-170	-5	0	0	0	113.6	P280 R284 T285 L286	P280-D282 HydrophobicContact CG-CB 4.48Å; P280-D282 WeakPolarHBondContact O-CA 3.35Å; P280-D282 VanDerWaalsContact O-CB 3.32Å; P280-D282 WeakPolarHBondContact O-CB 3.49Å; P280-D282 PolarHBondContact O-N 2.98Å; D282-R284 PolarHBondContact O-N 2.69Å; D282-R284 VanDerWaalsContact O-N 3.08Å; D282-R284 WeakPolarHBondContact OD1-CA 3.15Å; D282-R284 VanDerWaalsContact OD1-CB 3.25Å; D282-R284 WeakPolarHBondContact OD1-CB 3.46Å; D282-R284 PolarHBondContact OD1-N 2.84Å; D282-T285 VanDerWaalsContact CG-CB 3.5Å; D282-T285 VanDerWaalsContact CG-OG1 3.29Å; D282-T285 CarbonylContact O-C 3.56Å; D282-T285 PolarHBondContact O-N 3.31Å; D282-T285 PolarHBondContact OD1-N 3.12Å; D282-T285 VanDerWaalsContact OD2-CB 3.29Å; D282-T285 WeakPolarHBondContact OD2-CB 3.39Å; D282-T285 PolarHBondContact OD2-OG1 3.43Å; D282-L286 VanDerWaalsContact O-CB 3.3Å; D282-L286 WeakPolarHBondContact O-CB 3.4Å; D282-L286 PolarHBondContact O-N 2.7Å
283	F	40.9	Very low	41.9	Very low	54 Å²	54	85.6 Å²	85.6	24%	0.237	45%	0.448	C	S	.	.	H	α-helix	trans	-59.9	-20.5	179.5	-63.7	-67.6	0	0	0	112.1	F163 I172 L281 L286 A287	F163-F283 AromaticContact CD1-CD1 3.76Å; F163-F283 HydrophobicContact CD1-CD1 3.76Å; F163-F283 AromaticContact CD1-CE1 3.74Å; F163-F283 HydrophobicContact CD1-CE1 3.74Å; F163-F283 HydrophobicContact CE1-CD1 4.14Å; F163-F283 AromaticContact CE1-CE1 3.74Å; F163-F283 HydrophobicContact CE1-CE1 3.74Å; F163-F283 HydrophobicContact CG-CD1 4.41Å; I172-F283 HydrophobicContact CD1-CE2 3.97Å; I172-F283 HydrophobicContact CD1-CZ 3.79Å; L281-F283 VanDerWaalsContact C-N 3.3Å; L281-F283 HydrophobicContact CB-CE2 4.42Å; L281-F283 HydrophobicContact CD2-CZ 4.28Å; L281-F283 WeakPolarHBondContact O-CD2 3.27Å; L281-F283 VanDerWaalsContact O-CE2 3.3Å; L281-F283 WeakPolarHBondContact O-CE2 3.48Å; L281-F283 WeakPolarHBondContact O-CG 3.5Å; L281-F283 PolarHBondContact O-N 3.42Å; F283-L286 HydrophobicContact CD1-CD2 4.28Å; F283-A287 WeakPolarHBondContact O-CB 3.48Å; F283-A287 PolarHBondContact O-N 2.9Å
284	R	45	Very low	42.8	Very low	182 Å²	182	85.7 Å²	85.7	69%	0.687	45%	0.447	S	S	*	.	H	α-helix	trans	-76.7	-53.6	171.4	-164.8	-168.2	-174.9	111	11	110.8	D282 L286 A287 E288	D282-R284 PolarHBondContact O-N 2.69Å; D282-R284 VanDerWaalsContact O-N 3.08Å; D282-R284 WeakPolarHBondContact OD1-CA 3.15Å; D282-R284 VanDerWaalsContact OD1-CB 3.25Å; D282-R284 WeakPolarHBondContact OD1-CB 3.46Å; D282-R284 PolarHBondContact OD1-N 2.84Å; R284-L286 PolarHBondContact O-N 3.47Å; R284-A287 PolarHBondContact O-N 3.21Å; R284-E288 WeakPolarHBondContact CG-OE1 3.28Å; R284-E288 IonicContact CZ-OE1 3.03Å; R284-E288 IonicContact NE-OE1 2.65Å; R284-E288 PolarHBondContact NE-OE1 3.17Å; R284-E288 IonicContact NH2-OE1 2.64Å; R284-E288 VanDerWaalsContact O-CB 3.27Å; R284-E288 WeakPolarHBondContact O-CB 3.34Å; R284-E288 VanDerWaalsContact O-CG 3.24Å; R284-E288 WeakPolarHBondContact O-CG 3.26Å; R284-E288 PolarHBondContact O-N 2.82Å
285	T	47.5	Very low	43.9	Very low	73 Å²	73	86.5 Å²	86.5	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-59.9	-32.9	174	-67.6	0	0	0	0	112	D282 S289	D282-T285 VanDerWaalsContact CG-CB 3.5Å; D282-T285 VanDerWaalsContact CG-OG1 3.29Å; D282-T285 CarbonylContact O-C 3.56Å; D282-T285 PolarHBondContact O-N 3.31Å; D282-T285 PolarHBondContact OD1-N 3.12Å; D282-T285 VanDerWaalsContact OD2-CB 3.29Å; D282-T285 WeakPolarHBondContact OD2-CB 3.39Å; D282-T285 PolarHBondContact OD2-OG1 3.43Å; T285-S289 WeakPolarHBondContact O-CB 3.28Å; T285-S289 PolarHBondContact O-N 3.31Å; T285-S289 PolarHBondContact O-OG 3.19Å
286	L	45.7	Very low	45.1	Very low	70 Å²	70	84.1 Å²	84.1	37%	0.366	44%	0.442	S	S	.	.	H	α-helix	trans	-72.7	-44.8	175.5	179.9	61.5	0	0	0	111.5	D282 F283 R284 E288 S289 I290	D282-L286 VanDerWaalsContact O-CB 3.3Å; D282-L286 WeakPolarHBondContact O-CB 3.4Å; D282-L286 PolarHBondContact O-N 2.7Å; F283-L286 HydrophobicContact CD1-CD2 4.28Å; R284-L286 PolarHBondContact O-N 3.47Å; L286-E288 VanDerWaalsContact C-N 3.34Å; L286-S289 PolarHBondContact O-N 2.84Å; L286-I290 HydrophobicContact CD1-CD1 4.04Å; L286-I290 HydrophobicContact CD1-CG1 4.3Å; L286-I290 HydrophobicContact CG-CD1 3.92Å; L286-I290 WeakPolarHBondContact O-CB 3.29Å; L286-I290 VanDerWaalsContact O-CG1 3.23Å; L286-I290 WeakPolarHBondContact O-CG1 3.4Å; L286-I290 PolarHBondContact O-N 3.05Å
287	A	44.4	Very low	46.2	Very low	33 Å²	33	78.7 Å²	78.7	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-37.6	173	0	0	0	0	0	111.8	F283 R284 I290 L291	F283-A287 WeakPolarHBondContact O-CB 3.48Å; F283-A287 PolarHBondContact O-N 2.9Å; R284-A287 PolarHBondContact O-N 3.21Å; A287-I290 PolarHBondContact O-N 3.2Å; A287-L291 WeakPolarHBondContact O-CB 3.32Å; A287-L291 PolarHBondContact O-N 3.4Å
288	E	49.2	Very low	47.6	Very low	91 Å²	91	79.6 Å²	79.6	43%	0.425	41%	0.408	S	S	.	.	H	α-helix	trans	-66.6	-37.4	173.8	-72.3	171	-172.8	0	0	110.6	R284 L286 L291 V292	R284-E288 WeakPolarHBondContact CG-OE1 3.28Å; R284-E288 IonicContact CZ-OE1 3.03Å; R284-E288 IonicContact NE-OE1 2.65Å; R284-E288 PolarHBondContact NE-OE1 3.17Å; R284-E288 IonicContact NH2-OE1 2.64Å; R284-E288 VanDerWaalsContact O-CB 3.27Å; R284-E288 WeakPolarHBondContact O-CB 3.34Å; R284-E288 VanDerWaalsContact O-CG 3.24Å; R284-E288 WeakPolarHBondContact O-CG 3.26Å; R284-E288 PolarHBondContact O-N 2.82Å; L286-E288 VanDerWaalsContact C-N 3.34Å; E288-L291 PolarHBondContact O-N 2.98Å; E288-V292 WeakPolarHBondContact O-CG2 3.26Å; E288-V292 PolarHBondContact O-N 3.01Å
289	S	48.6	Very low	49.6	Very low	61 Å²	61	77.6 Å²	77.6	43%	0.427	40%	0.401	S	S	.	.	H	α-helix	trans	-68.7	-44.2	173	-65.5	0	0	0	0	112.4	T285 L286 L291 V292 V293	T285-S289 WeakPolarHBondContact O-CB 3.28Å; T285-S289 PolarHBondContact O-N 3.31Å; T285-S289 PolarHBondContact O-OG 3.19Å; L286-S289 PolarHBondContact O-N 2.84Å; S289-L291 VanDerWaalsContact C-N 3.29Å; S289-L291 PolarHBondContact O-N 3Å; S289-V292 PolarHBondContact O-N 3.4Å; S289-V293 WeakPolarHBondContact O-CG2 3.31Å; S289-V293 PolarHBondContact O-N 2.98Å
290	I	49.1	Very low	51.2	Low	30 Å²	30	75.6 Å²	75.6	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-65.3	-35.2	174.2	-65	162.3	0	0	0	110.2	M156 V160 L286 A287 V293 K294	M156-I290 HydrophobicContact CB-CG2 4.1Å; M156-I290 HydrophobicContact CG-CG2 4.44Å; V160-I290 HydrophobicContact CG2-CB 4.19Å; V160-I290 HydrophobicContact CG2-CD1 4.48Å; V160-I290 HydrophobicContact CG2-CG2 3.52Å; L286-I290 HydrophobicContact CD1-CD1 4.04Å; L286-I290 HydrophobicContact CD1-CG1 4.3Å; L286-I290 HydrophobicContact CG-CD1 3.92Å; L286-I290 WeakPolarHBondContact O-CB 3.29Å; L286-I290 VanDerWaalsContact O-CG1 3.23Å; L286-I290 WeakPolarHBondContact O-CG1 3.4Å; L286-I290 PolarHBondContact O-N 3.05Å; A287-I290 PolarHBondContact O-N 3.2Å; I290-V293 PolarHBondContact O-N 3.19Å; I290-K294 VanDerWaalsContact O-CB 3.28Å; I290-K294 WeakPolarHBondContact O-CB 3.2Å; I290-K294 PolarHBondContact O-N 2.98Å
291	L	53.5	Low	52.5	Low	94 Å²	94	73.3 Å²	73.3	49%	0.492	38%	0.377	S	S	.	.	H	α-helix	trans	-66.5	-41.2	174.1	-177.3	64.1	0	0	0	111.7	A287 E288 S289 K294 I295	A287-L291 WeakPolarHBondContact O-CB 3.32Å; A287-L291 PolarHBondContact O-N 3.4Å; E288-L291 PolarHBondContact O-N 2.98Å; S289-L291 VanDerWaalsContact C-N 3.29Å; S289-L291 PolarHBondContact O-N 3Å; L291-K294 WeakPolarHBondContact O-CB 3.39Å; L291-K294 PolarHBondContact O-N 3.34Å; L291-I295 HydrophobicContact CD1-CD1 4.38Å; L291-I295 HydrophobicContact CG-CD1 4.1Å; L291-I295 WeakPolarHBondContact O-CD1 3.35Å; L291-I295 VanDerWaalsContact O-CG1 3.27Å; L291-I295 WeakPolarHBondContact O-CG1 3.47Å; L291-I295 PolarHBondContact O-N 3.48Å
292	V	55.4	Low	54.2	Low	83 Å²	83	73.1 Å²	73.1	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-41.7	172.2	166.8	0	0	0	0	111.1	E288 S289 N296	E288-V292 WeakPolarHBondContact O-CG2 3.26Å; E288-V292 PolarHBondContact O-N 3.01Å; S289-V292 PolarHBondContact O-N 3.4Å; V292-N296 WeakPolarHBondContact O-CB 3.5Å; V292-N296 VanDerWaalsContact O-CG 3.31Å; V292-N296 PolarHBondContact O-N 2.67Å; V292-N296 PolarHBondContact O-ND2 3.27Å
293	V	49.8	Very low	55.7	Low	64 Å²	64	76.6 Å²	76.6	39%	0.388	39%	0.388	S	S	.	.	H	α-helix	trans	-65.2	-40.7	174.1	174.5	0	0	0	0	111.2	M156 S289 I290 N296 L297	M156-V293 HydrophobicContact CE-CG1 3.74Å; M156-V293 HydrophobicContact SD-CB 4.48Å; M156-V293 HydrophobicContact SD-CG1 3.66Å; S289-V293 WeakPolarHBondContact O-CG2 3.31Å; S289-V293 PolarHBondContact O-N 2.98Å; I290-V293 PolarHBondContact O-N 3.19Å; V293-N296 PolarHBondContact O-N 2.95Å; V293-L297 HydrophobicContact CG1-CD1 4.11Å; V293-L297 HydrophobicContact CG1-CG 4.44Å; V293-L297 WeakPolarHBondContact O-CG 3.4Å; V293-L297 PolarHBondContact O-N 3.35Å
294	K	53.8	Low	57	Low	47 Å²	47	75.2 Å²	75.2	20%	0.204	38%	0.383	C	S	.	.	H	α-helix	trans	-58.2	-52.6	174.9	-175.8	-173.2	159.7	169.7	0	110.8	L153 E157 I290 L291 N296 L297 E298	L153-K294 HydrophobicContact CD1-CB 4.47Å; L153-K294 HydrophobicContact CD1-CG 3.69Å; E157-K294 IonicContact OE1-NZ 2.64Å; E157-K294 PolarHBondContact OE1-NZ 3.04Å; I290-K294 VanDerWaalsContact O-CB 3.28Å; I290-K294 WeakPolarHBondContact O-CB 3.2Å; I290-K294 PolarHBondContact O-N 2.98Å; L291-K294 WeakPolarHBondContact O-CB 3.39Å; L291-K294 PolarHBondContact O-N 3.34Å; K294-N296 VanDerWaalsContact C-N 3.29Å; K294-N296 PolarHBondContact O-N 2.9Å; K294-L297 WeakPolarHBondContact O-CB 3.33Å; K294-L297 PolarHBondContact O-N 2.84Å; K294-E298 VanDerWaalsContact CE-CD 3.43Å; K294-E298 WeakPolarHBondContact CE-OE1 3.46Å; K294-E298 IonicContact NZ-OE1 3.02Å; K294-E298 PolarHBondContact NZ-OE1 2.92Å; K294-E298 WeakPolarHBondContact O-CG 3.48Å; K294-E298 PolarHBondContact O-N 3.15Å
295	I	59.2	Low	58.2	Low	80 Å²	80	69.8 Å²	69.8	41%	0.41	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-41.6	178.3	-68.9	163	0	0	0	110.8	L291 L297 E298 L299	L291-I295 HydrophobicContact CD1-CD1 4.38Å; L291-I295 HydrophobicContact CG-CD1 4.1Å; L291-I295 WeakPolarHBondContact O-CD1 3.35Å; L291-I295 VanDerWaalsContact O-CG1 3.27Å; L291-I295 WeakPolarHBondContact O-CG1 3.47Å; L291-I295 PolarHBondContact O-N 3.48Å; I295-L297 VanDerWaalsContact C-N 3.34Å; I295-L297 PolarHBondContact O-N 3.48Å; I295-E298 PolarHBondContact O-N 3.31Å; I295-L299 HydrophobicContact CG2-CD1 4.1Å; I295-L299 WeakPolarHBondContact O-CB 3.42Å; I295-L299 VanDerWaalsContact O-CG 3.29Å; I295-L299 WeakPolarHBondContact O-CG 3.29Å; I295-L299 PolarHBondContact O-N 2.94Å
296	N	59.1	Low	59.6	Low	85 Å²	85	70 Å²	70	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-66.1	-32.9	175.9	-76.6	-46.4	0	0	0	113.2	V292 V293 K294 K300	V292-N296 WeakPolarHBondContact O-CB 3.5Å; V292-N296 VanDerWaalsContact O-CG 3.31Å; V292-N296 PolarHBondContact O-N 2.67Å; V292-N296 PolarHBondContact O-ND2 3.27Å; V293-N296 PolarHBondContact O-N 2.95Å; K294-N296 VanDerWaalsContact C-N 3.29Å; K294-N296 PolarHBondContact O-N 2.9Å; N296-K300 WeakPolarHBondContact O-CG 3.32Å; N296-K300 PolarHBondContact O-N 3.11Å; N296-K300 VanDerWaalsContact O-N 3.12Å
297	L	54	Low	60.8	Low	16 Å²	16	70.4 Å²	70.4	8%	0.084	37%	0.37	C	S	.	.	H	α-helix	trans	-72.6	-42.4	173	-73.7	171.2	0	0	0	111.7	H149 L153 M156 V293 K294 I295 L299 K300 I301	H149-L297 HydrophobicContact CB-CD2 4.47Å; L153-L297 HydrophobicContact CD1-CB 3.67Å; L153-L297 HydrophobicContact CD1-CD1 4.15Å; M156-L297 HydrophobicContact CE-CD1 4.16Å; M156-L297 HydrophobicContact SD-CD1 3.75Å; V293-L297 HydrophobicContact CG1-CD1 4.11Å; V293-L297 HydrophobicContact CG1-CG 4.44Å; V293-L297 WeakPolarHBondContact O-CG 3.4Å; V293-L297 PolarHBondContact O-N 3.35Å; K294-L297 WeakPolarHBondContact O-CB 3.33Å; K294-L297 PolarHBondContact O-N 2.84Å; I295-L297 VanDerWaalsContact C-N 3.34Å; I295-L297 PolarHBondContact O-N 3.48Å; L297-L299 VanDerWaalsContact C-N 3.34Å; L297-L299 PolarHBondContact O-N 3.45Å; L297-K300 WeakPolarHBondContact O-CB 3.45Å; L297-K300 PolarHBondContact O-N 2.85Å; L297-K300 VanDerWaalsContact O-N 3.15Å; L297-I301 WeakPolarHBondContact O-CG1 3.44Å; L297-I301 PolarHBondContact O-N 2.69Å
298	E	62	Low	62	Low	70 Å²	70	70.8 Å²	70.8	33%	0.327	37%	0.368	S	S	.	.	H	α-helix	trans	-59.1	-43.9	174.1	-71.3	172.9	148	0	0	111.2	L153 K294 I295 K300 I301 N302	L153-E298 HydrophobicContact CD1-CG 4.15Å; L153-E298 HydrophobicContact CD2-CG 4.2Å; K294-E298 VanDerWaalsContact CE-CD 3.43Å; K294-E298 WeakPolarHBondContact CE-OE1 3.46Å; K294-E298 IonicContact NZ-OE1 3.02Å; K294-E298 PolarHBondContact NZ-OE1 2.92Å; K294-E298 WeakPolarHBondContact O-CG 3.48Å; K294-E298 PolarHBondContact O-N 3.15Å; I295-E298 PolarHBondContact O-N 3.31Å; E298-K300 PolarHBondContact O-N 3.39Å; E298-I301 PolarHBondContact O-N 2.77Å; E298-N302 WeakPolarHBondContact O-CB 3.39Å; E298-N302 PolarHBondContact O-N 3.11Å; E298-N302 PolarHBondContact O-ND2 3.17Å; E298-N302 VanDerWaalsContact O-ND2 3.17Å
299	L	71.3	Confident	63.2	Low	105 Å²	105	69.5 Å²	69.5	55%	0.55	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-37.6	174.2	-71.2	171.3	0	0	0	112.9	I295 L297 K303	I295-L299 HydrophobicContact CG2-CD1 4.1Å; I295-L299 WeakPolarHBondContact O-CB 3.42Å; I295-L299 VanDerWaalsContact O-CG 3.29Å; I295-L299 WeakPolarHBondContact O-CG 3.29Å; I295-L299 PolarHBondContact O-N 2.94Å; L297-L299 VanDerWaalsContact C-N 3.34Å; L297-L299 PolarHBondContact O-N 3.45Å; L299-K303 WeakPolarHBondContact O-CB 3.19Å; L299-K303 PolarHBondContact O-N 3.38Å; L299-K303 VanDerWaalsContact O-N 3.11Å
300	K	66.1	Low	64.6	Low	116 Å²	116	71.2 Å²	71.2	50%	0.504	37%	0.367	S	S	.	.	H	α-helix	trans	-66.5	-44.6	173.5	-80	179.3	174.6	-169.6	0	112.2	N296 L297 E298 K303 L304	N296-K300 WeakPolarHBondContact O-CG 3.32Å; N296-K300 PolarHBondContact O-N 3.11Å; N296-K300 VanDerWaalsContact O-N 3.12Å; L297-K300 WeakPolarHBondContact O-CB 3.45Å; L297-K300 PolarHBondContact O-N 2.85Å; L297-K300 VanDerWaalsContact O-N 3.15Å; E298-K300 PolarHBondContact O-N 3.39Å; K300-K303 PolarHBondContact O-N 2.85Å; K300-L304 WeakPolarHBondContact O-CG 3.37Å; K300-L304 PolarHBondContact O-N 2.92Å
301	I	61.1	Low	65.7	Low	15 Å²	15	73.1 Å²	73.1	8%	0.077	38%	0.376	C	S	.	.	H	α-helix	trans	-60.2	-50.6	177.2	-71.8	164.9	0	0	0	109.8	L146 H149 K150 L153 L297 E298 K303 L304 E305	L146-I301 HydrophobicContact CD1-CB 4.45Å; L146-I301 HydrophobicContact CD1-CG1 4.35Å; L146-I301 HydrophobicContact CD1-CG2 4.03Å; H149-I301 HydrophobicContact CB-CD1 4.34Å; H149-I301 HydrophobicContact CB-CG1 4.1Å; K150-I301 HydrophobicContact CG-CD1 4.11Å; L153-I301 HydrophobicContact CD2-CD1 4.15Å; L297-I301 WeakPolarHBondContact O-CG1 3.44Å; L297-I301 PolarHBondContact O-N 2.69Å; E298-I301 PolarHBondContact O-N 2.77Å; I301-K303 VanDerWaalsContact C-N 3.26Å; I301-K303 PolarHBondContact O-N 2.61Å; I301-L304 PolarHBondContact O-N 2.65Å; I301-L304 VanDerWaalsContact O-N 3.11Å; I301-E305 HydrophobicContact CG2-CG 4.36Å; I301-E305 WeakPolarHBondContact O-CG 2.81Å; I301-E305 PolarHBondContact O-N 3.03Å
302	N	76	Confident	66.6	Low	102 Å²	102	74.3 Å²	74.3	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-56.9	-38.7	177	-71	-28.6	0	0	0	112.6	E298 S306	E298-N302 WeakPolarHBondContact O-CB 3.39Å; E298-N302 PolarHBondContact O-N 3.11Å; E298-N302 PolarHBondContact O-ND2 3.17Å; E298-N302 VanDerWaalsContact O-ND2 3.17Å; N302-S306 WeakPolarHBondContact O-CB 3.38Å; N302-S306 PolarHBondContact O-N 2.96Å
303	K	77.5	Confident	67.8	Low	137 Å²	137	74.6 Å²	74.6	60%	0.596	37%	0.372	S	S	*	.	H	α-helix	trans	-67	-47.4	175	-174.6	-176	173.8	-176.1	0	111.8	L299 K300 I301 S306 Q307	L299-K303 WeakPolarHBondContact O-CB 3.19Å; L299-K303 PolarHBondContact O-N 3.38Å; L299-K303 VanDerWaalsContact O-N 3.11Å; K300-K303 PolarHBondContact O-N 2.85Å; I301-K303 VanDerWaalsContact C-N 3.26Å; I301-K303 PolarHBondContact O-N 2.61Å; K303-S306 PolarHBondContact O-N 3.18Å; K303-Q307 WeakPolarHBondContact O-CG 3.34Å; K303-Q307 PolarHBondContact O-N 3.27Å
304	L	67.9	Low	69.1	Low	25 Å²	25	76.3 Å²	76.3	13%	0.131	37%	0.374	C	S	.	.	H	α-helix	trans	-62.1	-42.4	178.6	-73.7	172.5	0	0	0	111.7	Y142 L146 K300 I301 Q307 L308	Y142-L304 HydrophobicContact CD1-CD2 3.72Å; Y142-L304 HydrophobicContact CE1-CD2 4.16Å; L146-L304 HydrophobicContact CB-CD1 4.43Å; L146-L304 HydrophobicContact CD1-CB 4.08Å; L146-L304 HydrophobicContact CD1-CD1 4.36Å; K300-L304 WeakPolarHBondContact O-CG 3.37Å; K300-L304 PolarHBondContact O-N 2.92Å; I301-L304 PolarHBondContact O-N 2.65Å; I301-L304 VanDerWaalsContact O-N 3.11Å; L304-Q307 PolarHBondContact O-N 2.93Å; L304-L308 VanDerWaalsContact O-CB 3.31Å; L304-L308 WeakPolarHBondContact O-CB 3.49Å; L304-L308 PolarHBondContact O-N 3.04Å
305	E	70.7	Confident	70.1	Confident	69 Å²	69	78.4 Å²	78.4	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-67.7	-36.1	177.2	-68	-173.7	163.4	0	0	111.7	L146 K150 I301 L308 N309	L146-E305 HydrophobicContact CD1-CG 3.9Å; L146-E305 HydrophobicContact CD2-CG 4.03Å; K150-E305 WeakPolarHBondContact CE-OE1 3.11Å; K150-E305 IonicContact NZ-OE1 3.94Å; K150-E305 PolarHBondContact NZ-OE1 3.08Å; I301-E305 HydrophobicContact CG2-CG 4.36Å; I301-E305 WeakPolarHBondContact O-CG 2.81Å; I301-E305 PolarHBondContact O-N 3.03Å; E305-L308 PolarHBondContact O-N 3.25Å; E305-N309 WeakPolarHBondContact O-CB 3.26Å; E305-N309 PolarHBondContact O-N 3Å; E305-N309 PolarHBondContact O-ND2 3.45Å
306	S	76.2	Confident	71	Confident	78 Å²	78	81 Å²	81	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-42.8	170.5	177.5	0	0	0	0	112.6	N302 K303 L310	N302-S306 WeakPolarHBondContact O-CB 3.38Å; N302-S306 PolarHBondContact O-N 2.96Å; K303-S306 PolarHBondContact O-N 3.18Å; S306-L310 PolarHBondContact O-N 3.47Å; S306-L310 VanDerWaalsContact O-N 3.08Å
307	Q	72.4	Confident	72.2	Confident	77 Å²	77	80.6 Å²	80.6	36%	0.36	40%	0.398	S	S	.	.	H	α-helix	trans	-66.6	-43.6	176.2	-69.7	-179.5	-89.9	0	0	111.8	K303 L304 N309 L310 E311	K303-Q307 WeakPolarHBondContact O-CG 3.34Å; K303-Q307 PolarHBondContact O-N 3.27Å; L304-Q307 PolarHBondContact O-N 2.93Å; Q307-N309 PolarHBondContact O-N 3.08Å; Q307-L310 WeakPolarHBondContact O-CB 3.5Å; Q307-L310 PolarHBondContact O-N 3.29Å; Q307-E311 PolarHBondContact O-N 2.93Å
308	L	69.8	Low	73.3	Confident	42 Å²	42	84.3 Å²	84.3	22%	0.22	42%	0.415	C	S	.	.	H	α-helix	trans	-65.8	-36.6	178.9	-171.4	152.6	0	0	0	112	L146 L304 E305 R312	L146-L308 HydrophobicContact CD2-CD1 4.34Å; L304-L308 VanDerWaalsContact O-CB 3.31Å; L304-L308 WeakPolarHBondContact O-CB 3.49Å; L304-L308 PolarHBondContact O-N 3.04Å; E305-L308 PolarHBondContact O-N 3.25Å; L308-R312 WeakPolarHBondContact O-CB 3.26Å; L308-R312 PolarHBondContact O-N 3.33Å
309	N	73.9	Confident	73.9	Confident	64 Å²	64	85 Å²	85	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-63.5	-45.3	170.7	-71.4	-32.3	0	0	0	111.3	E305 Q307 E311 R312 D313	E305-N309 WeakPolarHBondContact O-CB 3.26Å; E305-N309 PolarHBondContact O-N 3Å; E305-N309 PolarHBondContact O-ND2 3.45Å; Q307-N309 PolarHBondContact O-N 3.08Å; N309-E311 PolarHBondContact O-N 3.5Å; N309-R312 WeakPolarHBondContact O-CB 3.4Å; N309-R312 PolarHBondContact O-N 3.03Å; N309-R312 PolarHBondContact OD1-NH1 3.18Å; N309-R312 PolarHBondContact OD1-NH2 3.45Å; N309-D313 VanDerWaalsContact O-CG 3.26Å; N309-D313 PolarHBondContact O-N 2.64Å
310	L	78.8	Confident	74.6	Confident	96 Å²	96	81.7 Å²	81.7	50%	0.503	42%	0.415	S	S	.	.	H	α-helix	trans	-61.5	-42.5	178.4	-178.9	64.7	0	0	0	112.8	S306 Q307 D313 K314	S306-L310 PolarHBondContact O-N 3.47Å; S306-L310 VanDerWaalsContact O-N 3.08Å; Q307-L310 WeakPolarHBondContact O-CB 3.5Å; Q307-L310 PolarHBondContact O-N 3.29Å; L310-D313 PolarHBondContact O-N 2.97Å; L310-K314 WeakPolarHBondContact O-CG 3.33Å; L310-K314 PolarHBondContact O-N 3.38Å; L310-K314 VanDerWaalsContact O-N 3.1Å
311	E	72.2	Confident	75.5	Confident	70 Å²	70	80.8 Å²	80.8	33%	0.327	41%	0.411	S	S	.	.	H	α-helix	trans	-68.3	-36.6	174.8	-60.4	-45.7	128.9	0	0	112	Y139 Q307 N309 D313 K314 I315	Y139-E311 HydrophobicContact CE2-CB 4.18Å; Q307-E311 PolarHBondContact O-N 2.93Å; N309-E311 PolarHBondContact O-N 3.5Å; E311-D313 VanDerWaalsContact C-N 3.33Å; E311-D313 PolarHBondContact O-N 2.84Å; E311-K314 PolarHBondContact O-N 2.99Å; E311-K314 IonicContact OE1-NZ 2.67Å; E311-K314 PolarHBondContact OE1-NZ 2.92Å; E311-K314 VanDerWaalsContact OE2-CD 3.26Å; E311-K314 WeakPolarHBondContact OE2-CD 3.4Å; E311-K314 IonicContact OE2-NZ 2.9Å; E311-K314 PolarHBondContact OE2-NZ 3.32Å; E311-I315 WeakPolarHBondContact O-CD1 3.28Å; E311-I315 VanDerWaalsContact O-CG1 3.26Å; E311-I315 WeakPolarHBondContact O-CG1 3.5Å; E311-I315 PolarHBondContact O-N 3.05Å
312	R	71.1	Confident	76.2	Confident	119 Å²	119	85.1 Å²	85.1	45%	0.449	43%	0.434	S	S	.	.	H	α-helix	trans	-59	-44.7	172.4	-167.6	-162.5	-56.4	122	8.4	111.4	L308 N309 I315 H316	L308-R312 WeakPolarHBondContact O-CB 3.26Å; L308-R312 PolarHBondContact O-N 3.33Å; N309-R312 WeakPolarHBondContact O-CB 3.4Å; N309-R312 PolarHBondContact O-N 3.03Å; N309-R312 PolarHBondContact OD1-NH1 3.18Å; N309-R312 PolarHBondContact OD1-NH2 3.45Å; R312-I315 PolarHBondContact O-N 2.83Å; R312-H316 WeakPolarHBondContact O-CB 3.31Å; R312-H316 PolarHBondContact O-N 3.3Å
313	D	80.7	Confident	76.6	Confident	90 Å²	90	86.8 Å²	86.8	48%	0.481	44%	0.436	S	S	.	.	H	α-helix	trans	-69.2	-36.3	-177.2	-66.2	-17.2	0	0	0	111.8	N309 L310 E311 T317	N309-D313 VanDerWaalsContact O-CG 3.26Å; N309-D313 PolarHBondContact O-N 2.64Å; L310-D313 PolarHBondContact O-N 2.97Å; E311-D313 VanDerWaalsContact C-N 3.33Å; E311-D313 PolarHBondContact O-N 2.84Å; D313-T317 WeakPolarHBondContact O-CB 3.42Å; D313-T317 PolarHBondContact O-N 3.1Å; D313-T317 PolarHBondContact O-OG1 2.97Å
314	K	77.8	Confident	76.9	Confident	99 Å²	99	85.3 Å²	85.3	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-60.3	-51.9	168.6	-70.5	171.1	-174.2	172.2	0	111.6	L310 E311 H316 T317 E318	L310-K314 WeakPolarHBondContact O-CG 3.33Å; L310-K314 PolarHBondContact O-N 3.38Å; L310-K314 VanDerWaalsContact O-N 3.1Å; E311-K314 PolarHBondContact O-N 2.99Å; E311-K314 IonicContact OE1-NZ 2.67Å; E311-K314 PolarHBondContact OE1-NZ 2.92Å; E311-K314 VanDerWaalsContact OE2-CD 3.26Å; E311-K314 WeakPolarHBondContact OE2-CD 3.4Å; E311-K314 IonicContact OE2-NZ 2.9Å; E311-K314 PolarHBondContact OE2-NZ 3.32Å; K314-H316 VanDerWaalsContact C-N 3.3Å; K314-H316 PolarHBondContact O-N 3.42Å; K314-T317 WeakPolarHBondContact O-CB 3.36Å; K314-T317 PolarHBondContact O-N 3.1Å; K314-T317 VanDerWaalsContact O-N 3.1Å; K314-E318 PolarHBondContact O-N 3.4Å
315	I	73.3	Confident	77.6	Confident	91 Å²	91	87.6 Å²	87.6	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-58.7	-44.5	179.4	-69	164.5	0	0	0	110.2	E311 R312 T317 E318 V319	E311-I315 WeakPolarHBondContact O-CD1 3.28Å; E311-I315 VanDerWaalsContact O-CG1 3.26Å; E311-I315 WeakPolarHBondContact O-CG1 3.5Å; E311-I315 PolarHBondContact O-N 3.05Å; R312-I315 PolarHBondContact O-N 2.83Å; I315-T317 VanDerWaalsContact C-N 3.28Å; I315-T317 PolarHBondContact O-N 3.37Å; I315-E318 PolarHBondContact O-N 2.92Å; I315-V319 HydrophobicContact CG2-CG2 4.33Å; I315-V319 WeakPolarHBondContact O-CB 3.38Å; I315-V319 VanDerWaalsContact O-CG2 3.28Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 2.75Å
316	H	78.5	Confident	77.9	Confident	134 Å²	134	87.6 Å²	87.6	62%	0.62	45%	0.45	S	S	*	.	H	α-helix	trans	-64	-34.2	178.4	-160.9	-26.1	0	0	0	112.2	R312 K314 G320	R312-H316 WeakPolarHBondContact O-CB 3.31Å; R312-H316 PolarHBondContact O-N 3.3Å; K314-H316 VanDerWaalsContact C-N 3.3Å; K314-H316 PolarHBondContact O-N 3.42Å; H316-G320 PolarHBondContact O-N 3.48Å
317	T	85.4	Confident	78.2	Confident	78 Å²	78	86.8 Å²	86.8	48%	0.479	44%	0.439	S	S	.	.	H	α-helix	trans	-67.2	-47.3	174.8	-59.7	0	0	0	0	111.7	D313 K314 I315 G320 K321	D313-T317 WeakPolarHBondContact O-CB 3.42Å; D313-T317 PolarHBondContact O-N 3.1Å; D313-T317 PolarHBondContact O-OG1 2.97Å; K314-T317 WeakPolarHBondContact O-CB 3.36Å; K314-T317 PolarHBondContact O-N 3.1Å; K314-T317 VanDerWaalsContact O-N 3.1Å; I315-T317 VanDerWaalsContact C-N 3.28Å; I315-T317 PolarHBondContact O-N 3.37Å; T317-G320 PolarHBondContact O-N 2.92Å; T317-K321 PolarHBondContact O-N 3.24Å; T317-K321 VanDerWaalsContact O-N 3.08Å
318	E	76.7	Confident	78.6	Confident	94 Å²	94	89 Å²	89	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-67	-39.4	177.7	-60.6	-46.4	126.9	0	0	112.2	K314 I315 G320 K321 L322	K314-E318 PolarHBondContact O-N 3.4Å; I315-E318 PolarHBondContact O-N 2.92Å; E318-G320 VanDerWaalsContact C-N 3.26Å; E318-G320 PolarHBondContact O-N 2.95Å; E318-K321 PolarHBondContact O-N 3.08Å; E318-K321 IonicContact OE1-NZ 2.69Å; E318-K321 PolarHBondContact OE1-NZ 2.81Å; E318-K321 WeakPolarHBondContact OE2-CD 3.35Å; E318-K321 IonicContact OE2-NZ 2.89Å; E318-K321 PolarHBondContact OE2-NZ 2.76Å; E318-L322 WeakPolarHBondContact O-CB 3.4Å; E318-L322 WeakPolarHBondContact O-CG 3.39Å; E318-L322 PolarHBondContact O-N 3.19Å
319	V	75.1	Confident	78.8	Confident	84 Å²	84	94 Å²	94	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-60	-37	171.8	169.5	0	0	0	0	111.3	I315 K323	I315-V319 HydrophobicContact CG2-CG2 4.33Å; I315-V319 WeakPolarHBondContact O-CB 3.38Å; I315-V319 VanDerWaalsContact O-CG2 3.28Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 2.75Å; V319-K323 WeakPolarHBondContact O-CB 3.28Å; V319-K323 PolarHBondContact O-N 3.34Å
320	G	84.3	Confident	78.9	Confident	36 Å²	36	96.9 Å²	96.9	37%	0.371	47%	0.474	S	S	.	.	H	α-helix	trans	-60.6	-50.4	173.1	0	0	0	0	0	112.8	H316 T317 E318 L322 K323 E324	H316-G320 PolarHBondContact O-N 3.48Å; T317-G320 PolarHBondContact O-N 2.92Å; E318-G320 VanDerWaalsContact C-N 3.26Å; E318-G320 PolarHBondContact O-N 2.95Å; G320-L322 PolarHBondContact O-N 3.01Å; G320-K323 PolarHBondContact O-N 3.25Å; G320-E324 PolarHBondContact O-N 3.44Å
321	K	85.4	Confident	78.6	Confident	96 Å²	96	96.5 Å²	96.5	42%	0.417	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-44.4	176.5	-64.8	170.9	-172.4	167.6	0	112.1	T317 E318 K323 E324 I325	T317-K321 PolarHBondContact O-N 3.24Å; T317-K321 VanDerWaalsContact O-N 3.08Å; E318-K321 PolarHBondContact O-N 3.08Å; E318-K321 IonicContact OE1-NZ 2.69Å; E318-K321 PolarHBondContact OE1-NZ 2.81Å; E318-K321 WeakPolarHBondContact OE2-CD 3.35Å; E318-K321 IonicContact OE2-NZ 2.89Å; E318-K321 PolarHBondContact OE2-NZ 2.76Å; K321-K323 VanDerWaalsContact C-N 3.32Å; K321-K323 PolarHBondContact O-N 3.06Å; K321-E324 PolarHBondContact O-N 3.27Å; K321-I325 VanDerWaalsContact O-CG1 3.32Å; K321-I325 WeakPolarHBondContact O-CG1 3.32Å; K321-I325 PolarHBondContact O-N 3.37Å
322	L	77.1	Confident	78.2	Confident	106 Å²	106	102.6 Å²	102.6	56%	0.555	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-41.3	177.7	-73.5	170.8	0	0	0	111.4	E318 G320 I325 C326	E318-L322 WeakPolarHBondContact O-CB 3.4Å; E318-L322 WeakPolarHBondContact O-CG 3.39Å; E318-L322 PolarHBondContact O-N 3.19Å; G320-L322 PolarHBondContact O-N 3.01Å; L322-I325 PolarHBondContact O-N 2.92Å; L322-C326 PolarHBondContact O-N 3.28Å; L322-C326 PolarHBondContact O-SG 3.19Å; L322-C326 VanDerWaalsContact O-SG 3.34Å
323	K	83.1	Confident	77.5	Confident	138 Å²	138	100 Å²	100	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-61.7	-46.2	174.5	-172.8	-177.5	176.3	-172.5	0	112.1	V319 G320 K321 I325 C326 D327	V319-K323 WeakPolarHBondContact O-CB 3.28Å; V319-K323 PolarHBondContact O-N 3.34Å; G320-K323 PolarHBondContact O-N 3.25Å; K321-K323 VanDerWaalsContact C-N 3.32Å; K321-K323 PolarHBondContact O-N 3.06Å; K323-I325 VanDerWaalsContact C-N 3.27Å; K323-I325 PolarHBondContact O-N 2.99Å; K323-C326 PolarHBondContact O-N 3.44Å; K323-C326 VanDerWaalsContact O-N 3.14Å; K323-D327 PolarHBondContact O-N 2.89Å
324	E	84.6	Confident	76.1	Confident	106 Å²	106	102.3 Å²	102.3	50%	0.495	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-34.8	176.6	-165.1	-158.8	140.1	0	0	112.3	G320 K321 R328	G320-E324 PolarHBondContact O-N 3.44Å; K321-E324 PolarHBondContact O-N 3.27Å; E324-R328 WeakPolarHBondContact O-CB 3.41Å; E324-R328 WeakPolarHBondContact O-CG 3.47Å; E324-R328 PolarHBondContact O-N 3.14Å; E324-R328 PolarHBondContact O-NE 3.29Å; E324-R328 VanDerWaalsContact O-NE 3.17Å; E324-R328 IonicContact OE1-CZ 2.69Å; E324-R328 IonicContact OE1-NH1 3.39Å; E324-R328 PolarHBondContact OE1-NH1 3.18Å; E324-R328 IonicContact OE1-NH2 3.03Å; E324-R328 PolarHBondContact OE1-NH2 3.07Å; E324-R328 IonicContact OE2-NH2 2.77Å
325	I	81.8	Confident	74.6	Confident	73 Å²	73	105.4 Å²	105.4	37%	0.374	55%	0.546	S	S	.	.	H	α-helix	trans	-66.7	-48.7	171.7	-68.6	165	0	0	0	110.7	K321 L322 K323 D327 R328 F329	K321-I325 VanDerWaalsContact O-CG1 3.32Å; K321-I325 WeakPolarHBondContact O-CG1 3.32Å; K321-I325 PolarHBondContact O-N 3.37Å; L322-I325 PolarHBondContact O-N 2.92Å; K323-I325 VanDerWaalsContact C-N 3.27Å; K323-I325 PolarHBondContact O-N 2.99Å; I325-D327 PolarHBondContact O-N 2.65Å; I325-R328 PolarHBondContact O-N 3.17Å; I325-F329 HydrophobicContact CG2-CD2 3.8Å; I325-F329 HydrophobicContact CG2-CE2 3.61Å; I325-F329 VanDerWaalsContact O-CD2 3.28Å; I325-F329 WeakPolarHBondContact O-CD2 3.41Å; I325-F329 PolarHBondContact O-N 3.05Å
326	C	77.3	Confident	74.7	Confident	69 Å²	69	106.2 Å²	106.2	47%	0.466	55%	0.55	S	S	.	*	H	α-helix	trans	-60.8	-41.4	178.5	-70.2	0	0	0	0	113.2	L322 K323 R328 F329 K330	L322-C326 PolarHBondContact O-N 3.28Å; L322-C326 PolarHBondContact O-SG 3.19Å; L322-C326 VanDerWaalsContact O-SG 3.34Å; K323-C326 PolarHBondContact O-N 3.44Å; K323-C326 VanDerWaalsContact O-N 3.14Å; C326-R328 VanDerWaalsContact C-N 3.35Å; C326-F329 PolarHBondContact O-N 3.28Å; C326-F329 VanDerWaalsContact O-N 3.16Å; C326-K330 PolarHBondContact O-N 3.35Å
327	D	83.1	Confident	74.5	Confident	60 Å²	60	104.7 Å²	104.7	32%	0.321	55%	0.546	S	S	.	.	H	α-helix	trans	-72.6	-28.6	-179.7	-67.4	-26.6	0	0	0	111.9	K323 I325 K330 T331	K323-D327 PolarHBondContact O-N 2.89Å; I325-D327 PolarHBondContact O-N 2.65Å; D327-K330 IonicContact OD1-NZ 2.61Å; D327-K330 PolarHBondContact OD1-NZ 2.8Å; D327-T331 PolarHBondContact O-N 2.89Å; D327-T331 PolarHBondContact O-OG1 3.36Å
328	R	81.3	Confident	73.9	Confident	125 Å²	125	106.2 Å²	106.2	47%	0.472	55%	0.55	S	S	.	*	H	α-helix	trans	-67.7	-30.2	165.7	-81.5	-177.2	-70	-134.6	-9.4	114.3	E324 I325 C326 T331 R332	E324-R328 WeakPolarHBondContact O-CB 3.41Å; E324-R328 WeakPolarHBondContact O-CG 3.47Å; E324-R328 PolarHBondContact O-N 3.14Å; E324-R328 PolarHBondContact O-NE 3.29Å; E324-R328 VanDerWaalsContact O-NE 3.17Å; E324-R328 IonicContact OE1-CZ 2.69Å; E324-R328 IonicContact OE1-NH1 3.39Å; E324-R328 PolarHBondContact OE1-NH1 3.18Å; E324-R328 IonicContact OE1-NH2 3.03Å; E324-R328 PolarHBondContact OE1-NH2 3.07Å; E324-R328 IonicContact OE2-NH2 2.77Å; I325-R328 PolarHBondContact O-N 3.17Å; C326-R328 VanDerWaalsContact C-N 3.35Å; R328-T331 WeakPolarHBondContact CA-OG1 3.47Å; R328-T331 PolarHBondContact O-OG1 3.28Å; R328-R332 PolarHBondContact O-N 2.81Å
329	F	74.3	Confident	73.7	Confident	146 Å²	146	106.9 Å²	106.9	64%	0.64	56%	0.557	S	S	*	*	H	α-helix	trans	-73.6	-40.8	174	-84.9	-67.2	0	0	0	112.1	I325 C326 R332 G333	I325-F329 HydrophobicContact CG2-CD2 3.8Å; I325-F329 HydrophobicContact CG2-CE2 3.61Å; I325-F329 VanDerWaalsContact O-CD2 3.28Å; I325-F329 WeakPolarHBondContact O-CD2 3.41Å; I325-F329 PolarHBondContact O-N 3.05Å; C326-F329 PolarHBondContact O-N 3.28Å; C326-F329 VanDerWaalsContact O-N 3.16Å; F329-R332 PolarHBondContact O-N 3.49Å; F329-G333 PolarHBondContact O-N 2.69Å
330	K	76	Confident	73.6	Confident	125 Å²	125	108.3 Å²	108.3	54%	0.543	56%	0.56	S	S	.	*	H	α-helix	trans	-58.8	-51.5	174.6	-67	170.8	-167.8	161.2	0	111.8	C326 D327 R332 G333 D334	C326-K330 PolarHBondContact O-N 3.35Å; D327-K330 IonicContact OD1-NZ 2.61Å; D327-K330 PolarHBondContact OD1-NZ 2.8Å; K330-R332 PolarHBondContact O-N 3.3Å; K330-G333 WeakPolarHBondContact O-CA 3.43Å; K330-G333 PolarHBondContact O-N 3.06Å; K330-D334 PolarHBondContact O-N 3.16Å
331	T	72	Confident	72.9	Confident	88 Å²	88	113.1 Å²	113.1	54%	0.54	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	-9.5	-179.3	45.6	0	0	0	0	114.8	D327 R328	D327-T331 PolarHBondContact O-N 2.89Å; D327-T331 PolarHBondContact O-OG1 3.36Å; R328-T331 WeakPolarHBondContact CA-OG1 3.47Å; R328-T331 PolarHBondContact O-OG1 3.28Å
332	R	63.2	Low	72	Confident	198 Å²	198	114.4 Å²	114.4	75%	0.747	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-10.1	167.4	-79.8	-175.8	169.8	-166.5	-2.4	114.2	R328 F329 K330	R328-R332 PolarHBondContact O-N 2.81Å; F329-R332 PolarHBondContact O-N 3.49Å; K330-R332 PolarHBondContact O-N 3.3Å
333	G	56.7	Low	71.6	Confident	64 Å²	64	115 Å²	115	66%	0.66	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-21.3	172.2	0	0	0	0	0	113	F329 K330 T335	F329-G333 PolarHBondContact O-N 2.69Å; K330-G333 WeakPolarHBondContact O-CA 3.43Å; K330-G333 PolarHBondContact O-N 3.06Å; G333-T335 VanDerWaalsContact C-N 3.34Å
334	D	52.2	Low	70.7	Confident	138 Å²	138	113.1 Å²	113.1	74%	0.738	58%	0.584	S	S	*	*			trans	-91	12.5	178.6	-58.7	-43	0	0	0	113.3	K330	K330-D334 PolarHBondContact O-N 3.16Å
335	T	45.6	Very low	69.4	Low	165 Å²	165	113.7 Å²	113.7	100%	1.012	59%	0.592	S	S	*	*			trans	-134.5	0	-175.9	60.4	0	0	0	0	113	G333	G333-T335 VanDerWaalsContact C-N 3.34Å

Retrieved 335 of 335 residues in 103.9 ms (Link to these results)

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