A0A061ACJ5_CAEEL Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A061ACJ5, Species CAEEL (Caenorhabditis elegans), Gene ttbk-3, Length 555 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	30.1	Very low	232 Å²	232	157 Å²	157	100%	1.143	80%	0.803	S	S	*	*				0	86	0	-70.8	172.6	166.5	0	0	105.9
2	V	30.1	Very low	29.8	Very low	133 Å²	133	163.7 Å²	163.7	81%	0.806	81%	0.814	S	S	*	*				58.8	122.3	76.3	-175.8	0	0	0	0	109.6
3	D	30.5	Very low	29.7	Very low	109 Å²	109	156.8 Å²	156.8	58%	0.583	80%	0.799	S	S	*	*			cis	-164.6	156	1.3	-130	-16.3	0	0	0	109.6
4	K	32.5	Very low	29.6	Very low	157 Å²	157	155.8 Å²	155.8	68%	0.683	80%	0.796	S	S	*	*			trans	36.6	129.7	138.1	-69	162.6	-162.8	146.6	0	121.9
5	N	29.2	Very low	29.5	Very low	160 Å²	160	155.1 Å²	155.1	86%	0.856	80%	0.795	S	S	*	*				-175.1	137.6	88.2	-105.9	-27.7	0	0	0	114.7
6	K	31.4	Very low	29.4	Very low	190 Å²	190	156.5 Å²	156.5	83%	0.826	79%	0.793	S	S	*	*			trans	-81.6	152.5	164.9	-69.9	173.4	171.9	177.2	0	109.8
7	K	30.2	Very low	29.2	Very low	180 Å²	180	154.9 Å²	154.9	78%	0.783	79%	0.787	S	S	*	*				161.4	138.2	110.9	-93.3	-176.2	179.2	178.6	0	114.9
8	N	27.6	Very low	29	Very low	140 Å²	140	155.6 Å²	155.6	75%	0.749	78%	0.783	S	S	*	*			trans	92.1	119	136.2	-68.6	-0.4	0	0	0	122
9	L	27.1	Very low	28.9	Very low	156 Å²	156	156.9 Å²	156.9	82%	0.817	78%	0.784	S	S	*	*			trans	-58.1	169.3	152.9	-70.7	102.2	0	0	0	112.3
10	P	32	Very low	28.8	Very low	130 Å²	130	155.2 Å²	155.2	84%	0.844	78%	0.777	S	S	*	*				-135.4	156	104.5	36.3	-24.6	0	0	0	115.1
11	N	27.4	Very low	28.9	Very low	140 Å²	140	155.1 Å²	155.1	75%	0.749	78%	0.779	S	S	*	*			trans	-95.1	145.1	168.5	-160.4	9.3	0	0	0	107.5
12	Y	26.8	Very low	28.6	Very low	237 Å²	237	151.1 Å²	151.1	93%	0.929	76%	0.762	S	S	*	*			trans	-175.8	151	144.2	-106.2	-73.1	0	0	0	112.5
13	A	28.3	Very low	29	Very low	75 Å²	75	150.8 Å²	150.8	62%	0.62	76%	0.763	S	S	*	*			trans	-92	177.6	-163.4	0	0	0	0	0	115.8
14	D	28	Very low	28.9	Very low	142 Å²	142	148.6 Å²	148.6	76%	0.759	77%	0.766	S	S	*	*			trans	54.8	117.8	144.8	-67.6	-29.1	0	0	0	120.7
15	N	28.2	Very low	28.7	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	77%	0.774	S	S	*	*				175	121.2	107.4	-96.5	-48.4	0	0	0	114.2
16	K	27.3	Very low	28.7	Very low	178 Å²	178	151.6 Å²	151.6	77%	0.774	77%	0.774	S	S	*	*				27.2	133.1	120.2	-85	179	179.7	173.7	0	121.5
17	L	26.1	Very low	28.6	Very low	130 Å²	130	151.7 Å²	151.7	68%	0.681	78%	0.778	S	S	*	*				94.9	130.8	127.4	-74.9	163.7	0	0	0	121.7
18	K	26.3	Very low	28.5	Very low	166 Å²	166	147.4 Å²	147.4	72%	0.722	78%	0.776	S	S	*	*			trans	83.1	119.2	136.7	-78.7	168.8	175.6	177.4	0	117.5
19	K	27.4	Very low	28.6	Very low	182 Å²	182	147.7 Å²	147.7	79%	0.791	78%	0.776	S	S	*	*				63	131.4	88.6	-81.7	-165.7	177.2	-170.2	0	110.8
20	N	27.3	Very low	28.7	Very low	121 Å²	121	149.5 Å²	149.5	65%	0.647	78%	0.777	S	S	*	*			cis	-161.3	164.2	14.8	-71.3	-43.4	0	0	0	106.6
21	N	29	Very low	28.4	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	77%	0.774	S	S	*	*				163.2	123.2	109.8	-87.7	-17.2	0	0	0	112.8
22	D	28.8	Very low	28.4	Very low	147 Å²	147	151.3 Å²	151.3	79%	0.786	78%	0.78	S	S	*	*			trans	-56.1	171.6	161.7	-131.2	-15.9	0	0	0	112.3
23	P	38.2	Very low	28.5	Very low	127 Å²	127	146.7 Å²	146.7	83%	0.825	77%	0.771	S	S	*	*				-149.9	157.9	56.5	36.5	-14.6	0	0	0	117.9
24	G	27	Very low	28.5	Very low	62 Å²	62	151.1 Å²	151.1	64%	0.639	78%	0.784	S	S	*	*			trans	160.1	82.6	144.4	0	0	0	0	0	120.3
25	K	29.4	Very low	28.3	Very low	196 Å²	196	152.9 Å²	152.9	85%	0.852	79%	0.788	S	S	*	*			trans	69.6	108.1	144.5	-61	-176.2	175.9	-174.9	0	118.9
26	E	28.4	Very low	29	Very low	185 Å²	185	151 Å²	151	86%	0.864	78%	0.783	S	S	*	*				79.2	109.9	66.8	-78.9	-172.1	156.9	0	0	115.2
27	E	28.8	Very low	28.9	Very low	192 Å²	192	152.7 Å²	152.7	90%	0.897	79%	0.791	S	S	*	*				175.9	97.3	128.6	-95.8	178.2	-177	0	0	108.2
28	A	29.4	Very low	28.9	Very low	90 Å²	90	155.8 Å²	155.8	74%	0.744	80%	0.799	S	S	*	*				56.9	121.5	99	0	0	0	0	0	113.8
29	I	29.3	Very low	28.8	Very low	145 Å²	145	156.1 Å²	156.1	74%	0.744	80%	0.803	S	S	*	*				-170.8	128.4	76.2	-83.5	171	0	0	0	111.7
30	K	29	Very low	28.7	Very low	194 Å²	194	153.2 Å²	153.2	84%	0.843	80%	0.8	S	S	*	*			trans	64.4	118.2	143.2	-65.5	174.8	-172	178	0	123.7
31	N	27	Very low	28.6	Very low	147 Å²	147	155.5 Å²	155.5	79%	0.786	81%	0.811	S	S	*	*			trans	-62.7	155.9	152.9	-66.3	-25.4	0	0	0	112.8
32	N	27	Very low	28.4	Very low	162 Å²	162	152 Å²	152	87%	0.866	80%	0.799	S	S	*	*				-161.4	129.4	122.4	-101.2	-8	0	0	0	111.6
33	D	28.2	Very low	28.3	Very low	140 Å²	140	154.2 Å²	154.2	75%	0.749	80%	0.801	S	S	*	*			trans	-62.4	146.6	165.8	-63.6	-55.9	0	0	0	111.6
34	N	27.5	Very low	27.6	Very low	167 Å²	167	158.6 Å²	158.6	89%	0.893	81%	0.807	S	S	*	*				179.5	126	126.5	-91.5	-29.9	0	0	0	111.2
35	E	24.6	Very low	27.6	Very low	180 Å²	180	160.7 Å²	160.7	84%	0.841	81%	0.812	S	S	*	*			trans	-92.9	179.1	169.4	-142.1	-171.4	-145	0	0	109.2
36	P	42.4	Very low	27.6	Very low	104 Å²	104	158.3 Å²	158.3	68%	0.675	81%	0.809	S	S	*	*				-113.4	167.5	-89.5	38.5	-27.1	0	0	0	113.1
37	K	25.2	Very low	27.6	Very low	214 Å²	214	158.6 Å²	158.6	93%	0.93	81%	0.81	S	S	*	*			trans	-158.1	150.3	153.7	-109.8	164.6	-167.2	-178.9	0	113.7
38	K	26.3	Very low	27.4	Very low	195 Å²	195	158 Å²	158	85%	0.848	81%	0.812	S	S	*	*			trans	-64.1	164.3	-166.8	-67	168.6	166.9	180	0	116.4
39	E	23.7	Very low	27.3	Very low	173 Å²	173	162.4 Å²	162.4	81%	0.808	81%	0.814	S	S	*	*			trans	107.9	115	146.9	-79.3	-177.7	174.8	0	0	120.3
40	V	26.2	Very low	27.4	Very low	121 Å²	121	162.2 Å²	162.2	73%	0.733	82%	0.815	S	S	*	*			trans	58.9	103.9	134.2	-171.7	0	0	0	0	118.3
41	I	25.1	Very low	27.3	Very low	169 Å²	169	160 Å²	160	87%	0.867	82%	0.818	S	S	*	*			trans	-138.3	117.9	138.7	-62.3	-174.7	0	0	0	110.2
42	S	24.2	Very low	27.3	Very low	83 Å²	83	162.2 Å²	162.2	58%	0.58	82%	0.823	S	S	*	*			trans	-76.6	153.3	166.1	63.9	0	0	0	0	112.1
43	K	26.6	Very low	27.3	Very low	193 Å²	193	158.1 Å²	158.1	84%	0.839	82%	0.819	S	S	*	*			trans	76.1	101	156.9	-60.8	178.1	-179.8	-179.7	0	117.6
44	K	25.3	Very low	27.4	Very low	218 Å²	218	157.9 Å²	157.9	95%	0.948	82%	0.822	S	S	*	*				-170.1	80.9	118.5	-103.1	179.2	-179.8	-175.6	0	109
45	S	25.6	Very low	27.5	Very low	106 Å²	106	153.6 Å²	153.6	74%	0.741	82%	0.817	S	S	*	*			trans	-103.6	96.5	162.7	52.4	0	0	0	0	106.4
46	D	29.5	Very low	27.8	Very low	147 Å²	147	154.1 Å²	154.1	79%	0.786	82%	0.817	S	S	*	*			trans	-174.3	88.5	160.1	-91	-31.7	0	0	0	107
47	E	29.5	Very low	27.4	Very low	190 Å²	190	158.2 Å²	158.2	89%	0.888	83%	0.827	S	S	*	*	S	Bend	trans	169.7	80.1	149.9	-95.7	172.1	-162.3	0	0	109
48	L	25.1	Very low	27.8	Very low	180 Å²	180	152.3 Å²	152.3	94%	0.942	81%	0.809	S	S	*	*			trans	-175.8	74.3	154.6	-98.4	152.2	0	0	0	106.7
49	K	26.9	Very low	28.2	Very low	182 Å²	182	147.5 Å²	147.5	79%	0.791	79%	0.791	S	S	*	*			trans	-89.7	136.7	165.6	-79.2	-178.3	177.1	174.4	0	108.8
50	N	30.1	Very low	28.8	Very low	142 Å²	142	146.6 Å²	146.6	76%	0.759	79%	0.785	S	S	*	*			trans	94	70.1	164.5	-57.6	-8	0	0	0	118.2
51	V	27.2	Very low	29.2	Very low	148 Å²	148	148 Å²	148	90%	0.897	78%	0.778	S	S	*	*			trans	-134.6	88	134.5	-175.9	0	0	0	0	106.8
52	E	27.1	Very low	30.1	Very low	193 Å²	193	142.8 Å²	142.8	90%	0.902	75%	0.752	S	S	*	*			trans	-90.1	125.7	173.2	-79.4	-172	155.2	0	0	110.1
53	G	27.3	Very low	30.8	Very low	76 Å²	76	146.2 Å²	146.2	78%	0.784	76%	0.763	S	S	*	*			trans	175	48.3	178.4	0	0	0	0	0	110.6
54	V	30.4	Very low	31.5	Very low	135 Å²	135	141.6 Å²	141.6	82%	0.818	75%	0.748	S	S	*	*			trans	-127.1	117.8	177.5	-176.5	0	0	0	0	107.5
55	G	30.3	Very low	32	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	73%	0.728	S	S	*	*			trans	-63.9	141.5	177.3	0	0	0	0	0	111.8
56	K	30.4	Very low	32.4	Very low	192 Å²	192	135.6 Å²	135.6	84%	0.835	73%	0.725	S	S	*	*			trans	-105.6	135.3	174	-78.4	-178.7	176.2	175.2	0	109.8	V58	K56-V58 PolarHBondContact O-N 3.48Å
57	E	32.7	Very low	32.6	Very low	189 Å²	189	131.8 Å²	131.8	88%	0.883	71%	0.71	S	S	*	*			trans	-64.2	123.6	161.3	-76.2	-173.5	140.7	0	0	108.9
58	V	35.4	Very low	32.9	Very low	90 Å²	90	128.6 Å²	128.6	55%	0.545	70%	0.695	S	S	.	*			trans	-118.4	109.5	171.9	-174.1	0	0	0	0	108.2	K56 K60	K56-V58 PolarHBondContact O-N 3.48Å; V58-K60 HydrophobicContact CG1-CG 4.1Å; V58-K60 PolarHBondContact O-N 3.44Å
59	I	33	Very low	33.3	Very low	94 Å²	94	129 Å²	129	48%	0.482	69%	0.689	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.5	113.4	167.7	-59.2	172.6	0	0	0	106.6	Y61	I59-Y61 HydrophobicContact CB-CE2 4.34Å; I59-Y61 HydrophobicContact CG2-CD2 4.08Å; I59-Y61 HydrophobicContact CG2-CE1 4Å; I59-Y61 HydrophobicContact CG2-CE2 3.51Å; I59-Y61 VanDerWaalsContact CG2-CZ 3.46Å
60	K	36.4	Very low	33.8	Very low	155 Å²	155	125.9 Å²	125.9	67%	0.674	69%	0.685	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.1	128.7	164.8	-75.3	-172.9	178.5	177.4	0	108.5	V58	V58-K60 HydrophobicContact CG1-CG 4.1Å; V58-K60 PolarHBondContact O-N 3.44Å
61	Y	36	Very low	34	Very low	150 Å²	150	124.6 Å²	124.6	59%	0.588	68%	0.676	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.8	132.9	169.7	-61.1	-85.4	0	0	0	107.2	I59 C67	I59-Y61 HydrophobicContact CB-CE2 4.34Å; I59-Y61 HydrophobicContact CG2-CD2 4.08Å; I59-Y61 HydrophobicContact CG2-CE1 4Å; I59-Y61 HydrophobicContact CG2-CE2 3.51Å; I59-Y61 VanDerWaalsContact CG2-CZ 3.46Å; Y61-C67 HydrophobicContact CE1-CB 4.47Å
62	D	44	Very low	34.4	Very low	59 Å²	59	126.5 Å²	126.5	32%	0.316	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-67.9	169.1	163.2	68	16.6	0	0	0	110.2	N64 G65 Q66	D62-N64 PolarHBondContact O-N 2.81Å; D62-N64 VanDerWaalsContact OD1-C 3.3Å; D62-N64 WeakPolarHBondContact OD1-CA 3.48Å; D62-N64 PolarHBondContact OD1-N 3.38Å; D62-G65 PolarHBondContact O-N 3.49Å; D62-G65 PolarHBondContact OD1-N 3.01Å; D62-Q66 PolarHBondContact N-O 2.62Å; D62-Q66 PolarHBondContact OD1-N 2.89Å
63	N	38.6	Very low	35	Very low	155 Å²	155	123.2 Å²	123.2	83%	0.829	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-2.2	-179.1	-68.3	-17.1	0	0	0	113.8
64	N	40.8	Very low	35.2	Very low	96 Å²	96	122.1 Å²	122.1	51%	0.513	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.8	5	176.3	-62.5	-25.7	0	0	0	112.5	D62	D62-N64 PolarHBondContact O-N 2.81Å; D62-N64 VanDerWaalsContact OD1-C 3.3Å; D62-N64 WeakPolarHBondContact OD1-CA 3.48Å; D62-N64 PolarHBondContact OD1-N 3.38Å
65	G	35.3	Very low	35.6	Very low	52 Å²	52	125 Å²	125	54%	0.536	66%	0.655	S	S	.	*			trans	78.5	11.8	175.9	0	0	0	0	0	115.5	D62	D62-G65 PolarHBondContact O-N 3.49Å; D62-G65 PolarHBondContact OD1-N 3.01Å
66	Q	35.4	Very low	36.3	Very low	146 Å²	146	124.5 Å²	124.5	68%	0.682	63%	0.634	S	S	*	*			trans	-85.5	135.9	171.5	-94.1	-176.1	-0.1	0	0	111.5	D62	D62-Q66 PolarHBondContact N-O 2.62Å; D62-Q66 PolarHBondContact OD1-N 2.89Å
67	C	32.4	Very low	36.4	Very low	67 Å²	67	121.7 Å²	121.7	45%	0.453	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.5	109.9	-177.4	178.9	0	0	0	0	109.9	Y61	Y61-C67 HydrophobicContact CE1-CB 4.47Å
68	E	35.7	Very low	37	Very low	124 Å²	124	115 Å²	115	58%	0.579	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.8	117.6	164.4	-84.9	-170.9	166.4	0	0	109.5	V70	E68-V70 PolarHBondContact O-N 3Å
69	K	34.2	Very low	37.7	Very low	189 Å²	189	114.6 Å²	114.6	82%	0.822	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.5	109.6	171	-72.6	-174.1	178	-172	0	108.9
70	V	37.3	Very low	39	Very low	116 Å²	116	114.5 Å²	114.5	70%	0.703	61%	0.614	S	S	*	*			trans	-111.8	125.7	170	-174.2	0	0	0	0	108	E68	E68-V70 PolarHBondContact O-N 3Å
71	M	35.1	Very low	41	Very low	114 Å²	114	111.8 Å²	111.8	56%	0.562	61%	0.605	S	S	*	*			trans	-98.6	130.5	175.2	-86.2	-162.1	-88.4	0	0	111	I76	M71-I76 HydrophobicContact CE-CG2 3.74Å; M71-I76 HydrophobicContact SD-CG2 4.43Å
72	E	34.8	Very low	43.3	Very low	188 Å²	188	108.3 Å²	108.3	88%	0.879	60%	0.595	S	S	*	*			trans	-83.2	140.2	159.6	-155.8	169.7	-151.5	0	0	108.1	G74	E72-G74 PolarHBondContact O-N 2.88Å
73	I	38.9	Very low	45.2	Very low	125 Å²	125	105.9 Å²	105.9	64%	0.641	58%	0.582	S	S	*	*	S	Bend	trans	-75.6	87.5	-163.8	-53.3	-178.6	0	0	0	111.2	I76	I73-I76 HydrophobicContact CB-CD1 4.49Å; I73-I76 HydrophobicContact CG1-CD1 4.19Å; I73-I76 HydrophobicContact CG2-CD1 3.88Å; I73-I76 HydrophobicContact CG2-CG1 4.3Å
74	G	32.5	Very low	47.3	Very low	53 Å²	53	100.7 Å²	100.7	55%	0.546	57%	0.565	S	S	.	*	S	Bend	trans	-132.3	128.3	149.9	0	0	0	0	0	107.1	E72	E72-G74 PolarHBondContact O-N 2.88Å
75	E	39.2	Very low	49.3	Very low	194 Å²	194	100.2 Å²	100.2	91%	0.907	56%	0.562	S	S	*	*	S	Bend	trans	39.6	87.5	179.8	-68.3	-172.2	157.2	0	0	116.2
76	I	43.2	Very low	51.8	Low	67 Å²	67	98.3 Å²	98.3	34%	0.344	54%	0.539	S	S	.	.			trans	-90.2	118.8	-178.5	-48.9	164.7	0	0	0	111.3	M71 I73 I78	M71-I76 HydrophobicContact CE-CG2 3.74Å; M71-I76 HydrophobicContact SD-CG2 4.43Å; I73-I76 HydrophobicContact CB-CD1 4.49Å; I73-I76 HydrophobicContact CG1-CD1 4.19Å; I73-I76 HydrophobicContact CG2-CD1 3.88Å; I73-I76 HydrophobicContact CG2-CG1 4.3Å; I76-I78 HydrophobicContact CB-CD1 4.47Å; I76-I78 HydrophobicContact CB-CG1 3.79Å; I76-I78 HydrophobicContact CG2-CB 4.23Å; I76-I78 HydrophobicContact CG2-CD1 4.3Å; I76-I78 HydrophobicContact CG2-CG1 3.25Å; I76-I78 PolarHBondContact O-N 2.93Å
77	V	34.2	Very low	54.5	Low	132 Å²	132	93.5 Å²	93.5	80%	0.8	52%	0.517	S	S	*	.			trans	-78.1	102	150	178.2	0	0	0	0	107.4
78	I	45.3	Very low	57.3	Low	50 Å²	50	90.4 Å²	90.4	26%	0.256	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-85.1	116	-174.2	-63.1	175.4	0	0	0	109.9	I76 M81 F101	I76-I78 HydrophobicContact CB-CD1 4.47Å; I76-I78 HydrophobicContact CB-CG1 3.79Å; I76-I78 HydrophobicContact CG2-CB 4.23Å; I76-I78 HydrophobicContact CG2-CD1 4.3Å; I76-I78 HydrophobicContact CG2-CG1 3.25Å; I76-I78 PolarHBondContact O-N 2.93Å; I78-M81 HydrophobicContact CG2-CB 4.46Å; I78-F101 HydrophobicContact CD1-CD1 3.96Å; I78-F101 HydrophobicContact CD1-CE1 3.23Å; I78-F101 HydrophobicContact CD1-CZ 3.94Å
79	A	48.9	Very low	59.8	Low	81 Å²	81	86 Å²	86	67%	0.669	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-63.7	145.1	156.5	0	0	0	0	0	109.2	M81	A79-M81 PolarHBondContact O-N 3.27Å
80	P	60.8	Low	62.5	Low	92 Å²	92	82.2 Å²	82.2	60%	0.597	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-51.9	117.6	-171.6	-24.2	31	0	0	0	112.9	M87 I88	P80-M87 HydrophobicContact CB-CG 3.96Å; P80-M87 HydrophobicContact CB-SD 4.15Å; P80-I88 VanDerWaalsContact CA-O 3.28Å; P80-I88 WeakPolarHBondContact CA-O 3.36Å
81	M	79.2	Confident	65.1	Low	97 Å²	97	79.9 Å²	79.9	48%	0.478	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	140.4	-179.3	-177.6	-175.5	-173.5	0	0	109.9	I78 A79 L83 I88	I78-M81 HydrophobicContact CG2-CB 4.46Å; A79-M81 PolarHBondContact O-N 3.27Å; M81-L83 HydrophobicContact CE-CD2 4Å; M81-I88 HydrophobicContact CB-CB 4.29Å; M81-I88 PolarHBondContact N-O 3.43Å; M81-I88 VanDerWaalsContact N-O 3.11Å; M81-I88 WeakPolarHBondContact O-CB 3.34Å; M81-I88 PolarHBondContact O-N 2.98Å
82	M	84.3	Confident	67.8	Low	77 Å²	77	78.3 Å²	78.3	38%	0.379	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.6	175.7	-67.3	-57.3	-49.1	0	0	111.4	G84 M87 L106	M82-G84 VanDerWaalsContact CE-O 3.27Å; M82-G84 WeakPolarHBondContact CE-O 3.4Å; M82-M87 HydrophobicContact CE-CB 4.32Å; M82-M87 HydrophobicContact SD-CB 3.72Å; M82-M87 HydrophobicContact SD-CG 3.93Å; M82-L106 HydrophobicContact CE-CD1 3.39Å; M82-L106 HydrophobicContact CE-CG 4.1Å; M82-L106 HydrophobicContact SD-CD1 4.31Å
83	L	83.1	Confident	70.3	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.042	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	88.9	167.5	-68.8	-178.2	0	0	0	109.3	M81 D85 W86 I88 I116 L157 F159	M81-L83 HydrophobicContact CE-CD2 4Å; L83-D85 PolarHBondContact O-N 3.18Å; L83-W86 PolarHBondContact N-O 3.28Å; L83-W86 WeakPolarHBondContact O-CB 3.2Å; L83-W86 VanDerWaalsContact O-CD1 3.26Å; L83-W86 PolarHBondContact O-N 3.39Å; L83-W86 VanDerWaalsContact O-N 3.16Å; L83-I88 HydrophobicContact CB-CD1 4.48Å; L83-I88 HydrophobicContact CB-CG1 4.37Å; L83-I88 HydrophobicContact CD1-CD1 4.07Å; L83-I88 HydrophobicContact CD1-CG1 3.9Å; L83-I88 HydrophobicContact CG-CD1 4.43Å; L83-I88 HydrophobicContact CG-CG1 3.97Å; L83-I116 HydrophobicContact CD1-CD1 3.56Å; L83-I116 HydrophobicContact CD1-CG1 4.17Å; L83-L157 HydrophobicContact CD2-CD1 4.48Å; L83-L157 HydrophobicContact CD2-CD2 4.17Å; L83-F159 HydrophobicContact CB-CE1 4.26Å; L83-F159 HydrophobicContact CB-CE2 4.3Å; L83-F159 HydrophobicContact CB-CZ 3.94Å; L83-F159 HydrophobicContact CD1-CD1 4.33Å; L83-F159 HydrophobicContact CD1-CD2 4.44Å; L83-F159 HydrophobicContact CD1-CG 4.27Å
84	G	82.6	Confident	72.5	Confident	46 Å²	46	71 Å²	71	47%	0.474	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	-122.2	-170.4	0	0	0	0	0	111	M82 W86	M82-G84 VanDerWaalsContact CE-O 3.27Å; M82-G84 WeakPolarHBondContact CE-O 3.4Å; G84-W86 VanDerWaalsContact C-N 3.28Å; G84-W86 PolarHBondContact O-N 3.5Å
85	D	83.8	Confident	74.5	Confident	86 Å²	86	70.4 Å²	70.4	46%	0.46	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.4	178.9	-64.1	-35.8	0	0	0	113.8	L83 L106 P107	L83-D85 PolarHBondContact O-N 3.18Å; D85-L106 PolarHBondContact O-N 3.43Å; D85-P107 HydrophobicContact CB-CG 4.32Å
86	W	87.6	Confident	76	Confident	13 Å²	13	67.2 Å²	67.2	5%	0.049	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.8	-176.1	-55.2	98.4	0	0	0	110.6	L83 G84 I88 S105 Y112 V149 F150 F159 V161	L83-W86 PolarHBondContact N-O 3.28Å; L83-W86 WeakPolarHBondContact O-CB 3.2Å; L83-W86 VanDerWaalsContact O-CD1 3.26Å; L83-W86 PolarHBondContact O-N 3.39Å; L83-W86 VanDerWaalsContact O-N 3.16Å; G84-W86 VanDerWaalsContact C-N 3.28Å; G84-W86 PolarHBondContact O-N 3.5Å; W86-I88 HydrophobicContact CB-CD1 4.23Å; W86-S105 VanDerWaalsContact CZ3-CB 3.5Å; W86-Y112 HydrophobicContact CE3-CD2 4.43Å; W86-Y112 HydrophobicContact CH2-CD2 4.08Å; W86-Y112 HydrophobicContact CH2-CE2 4.14Å; W86-Y112 HydrophobicContact CH2-CG 4.45Å; W86-Y112 AromaticContact CZ3-CD2 3.42Å; W86-Y112 HydrophobicContact CZ3-CD2 3.42Å; W86-Y112 VanDerWaalsContact CZ3-CD2 3.42Å; W86-Y112 AromaticContact CZ3-CE2 3.81Å; W86-Y112 HydrophobicContact CZ3-CE2 3.81Å; W86-Y112 AromaticContact CZ3-CG 3.96Å; W86-Y112 HydrophobicContact CZ3-CG 3.96Å; W86-V149 HydrophobicContact CH2-CG2 4Å; W86-V149 HydrophobicContact CZ2-CG2 4.45Å; W86-F150 HydrophobicContact CZ2-CB 3.72Å; W86-F150 HydrophobicContact CZ2-CG 4.17Å; W86-F150 AromaticContact NE1-CD1 3.51Å; W86-F150 AromaticContact NE1-CE1 3.91Å; W86-F150 AromaticContact NE1-CG 3.69Å; W86-F159 AromaticContact CD1-CE2 3.89Å; W86-V161 HydrophobicContact CD2-CG1 4.32Å; W86-V161 HydrophobicContact CD2-CG2 3.81Å; W86-V161 HydrophobicContact CE3-CG1 3.94Å; W86-V161 HydrophobicContact CE3-CG2 4.26Å; W86-V161 HydrophobicContact CG-CG2 4.16Å; W86-V161 HydrophobicContact CH2-CB 4.2Å; W86-V161 HydrophobicContact CH2-CG1 3.67Å; W86-V161 HydrophobicContact CH2-CG2 4.43Å; W86-V161 HydrophobicContact CZ2-CB 4.11Å; W86-V161 HydrophobicContact CZ2-CG1 4.08Å; W86-V161 HydrophobicContact CZ2-CG2 4Å; W86-V161 HydrophobicContact CZ3-CB 4.47Å; W86-V161 HydrophobicContact CZ3-CG1 3.61Å
87	M	90.8	Very high	77.4	Confident	44 Å²	44	70.1 Å²	70.1	22%	0.217	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	106.4	171	-175.3	177.1	71.5	0	0	109	P80 M82 T89 G103 R104 L106	P80-M87 HydrophobicContact CB-CG 3.96Å; P80-M87 HydrophobicContact CB-SD 4.15Å; M82-M87 HydrophobicContact CE-CB 4.32Å; M82-M87 HydrophobicContact SD-CB 3.72Å; M82-M87 HydrophobicContact SD-CG 3.93Å; M87-T89 HydrophobicContact CE-CG2 4.39Å; M87-G103 CarbonylContact O-C 3.53Å; M87-G103 WeakPolarHBondContact O-CA 3.22Å; M87-R104 HydrophobicContact CB-CB 4.49Å; M87-R104 HydrophobicContact CE-CB 4.16Å; M87-R104 PolarHBondContact N-O 3.34Å; M87-R104 PolarHBondContact O-N 3.49Å; M87-L106 HydrophobicContact CB-CD2 4.23Å
88	I	91.6	Very high	79.8	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	131	177.6	-48.3	-53.8	0	0	0	108.6	P80 M81 L83 W86 F101 V114	P80-I88 VanDerWaalsContact CA-O 3.28Å; P80-I88 WeakPolarHBondContact CA-O 3.36Å; M81-I88 HydrophobicContact CB-CB 4.29Å; M81-I88 PolarHBondContact N-O 3.43Å; M81-I88 VanDerWaalsContact N-O 3.11Å; M81-I88 WeakPolarHBondContact O-CB 3.34Å; M81-I88 PolarHBondContact O-N 2.98Å; L83-I88 HydrophobicContact CB-CD1 4.48Å; L83-I88 HydrophobicContact CB-CG1 4.37Å; L83-I88 HydrophobicContact CD1-CD1 4.07Å; L83-I88 HydrophobicContact CD1-CG1 3.9Å; L83-I88 HydrophobicContact CG-CD1 4.43Å; L83-I88 HydrophobicContact CG-CG1 3.97Å; W86-I88 HydrophobicContact CB-CD1 4.23Å; I88-F101 HydrophobicContact CG2-CB 3.46Å; I88-F101 VanDerWaalsContact CG2-CB 3.46Å; I88-F101 HydrophobicContact CG2-CD1 3.95Å; I88-F101 HydrophobicContact CG2-CD2 4.33Å; I88-F101 HydrophobicContact CG2-CG 3.65Å; I88-V114 HydrophobicContact CD1-CB 3.94Å; I88-V114 HydrophobicContact CD1-CG1 3.8Å; I88-V114 HydrophobicContact CD1-CG2 3.71Å
89	T	89.4	Confident	81.9	Confident	32 Å²	32	64.7 Å²	64.7	20%	0.196	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-93.1	-175.9	61.6	0	0	0	0	110.8	M87 V102	M87-T89 HydrophobicContact CE-CG2 4.39Å; T89-V102 PolarHBondContact N-O 3.03Å; T89-V102 WeakPolarHBondContact OG1-CB 3.44Å; T89-V102 WeakPolarHBondContact OG1-CG1 3.3Å; T89-V102 PolarHBondContact OG1-O 2.9Å
90	H	89.2	Confident	84	Confident	109 Å²	109	62.3 Å²	62.3	51%	0.505	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	156	-176.6	62.3	-74.8	0	0	0	111.6	F101 V102	H90-F101 CarbonylContact O-C 3.09Å; H90-F101 VanDerWaalsContact O-CA 3.27Å; H90-F101 WeakPolarHBondContact O-CA 3.41Å; H90-V102 PolarHBondContact O-N 2.94Å
91	Q	91.9	Very high	85.6	Confident	68 Å²	68	58.6 Å²	58.6	32%	0.318	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.4	175.6	-163.2	175.1	-43.2	0	0	109.5	G93 E94 I100 F101	Q91-G93 WeakPolarHBondContact CG-O 3.49Å; Q91-G93 PolarHBondContact NE2-O 2.91Å; Q91-E94 PolarHBondContact NE2-OE2 3.12Å; Q91-I100 CarbonylContact C-O 3.49Å; Q91-I100 WeakPolarHBondContact CA-O 3.47Å; Q91-I100 VanDerWaalsContact CG-O 3.29Å; Q91-I100 WeakPolarHBondContact CG-O 3.36Å; Q91-F101 VanDerWaalsContact CA-CD1 3.44Å; Q91-F101 HydrophobicContact CB-CD1 3.76Å; Q91-F101 HydrophobicContact CB-CE1 3.53Å; Q91-F101 HydrophobicContact CB-CZ 4.39Å; Q91-F101 HydrophobicContact CG-CD1 4.16Å; Q91-F101 HydrophobicContact CG-CE1 3.77Å; Q91-F101 HydrophobicContact CG-CZ 4.16Å
92	I	91.8	Very high	86.3	Confident	80 Å²	80	54.4 Å²	54.4	41%	0.41	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	-8.7	176.1	55.9	168.6	0	0	0	113	I100 V102 A113 L164	I92-I100 HydrophobicContact CD1-CG2 3.86Å; I92-I100 HydrophobicContact CG1-CB 4.15Å; I92-I100 HydrophobicContact CG1-CG2 3.7Å; I92-I100 PolarHBondContact N-O 3.46Å; I92-V102 HydrophobicContact CD1-CG2 3.98Å; I92-V102 HydrophobicContact CG1-CG2 4.41Å; I92-V102 HydrophobicContact CG2-CG2 3.55Å; I92-A113 HydrophobicContact CD1-CB 4.49Å; I92-L164 HydrophobicContact CD1-CD1 3.73Å
93	G	87.6	Confident	86.8	Confident	25 Å²	25	50.8 Å²	50.8	26%	0.258	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	162.2	177.5	0	0	0	0	0	113	Q91 I100	Q91-G93 WeakPolarHBondContact CG-O 3.49Å; Q91-G93 PolarHBondContact NE2-O 2.91Å; G93-I100 PolarHBondContact N-O 3.38Å; G93-I100 PolarHBondContact O-N 3.09Å
94	E	85.5	Confident	87.2	Confident	134 Å²	134	54 Å²	54	63%	0.626	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.1	175.9	-169.6	154.2	175.3	0	0	109.2	Q91 K99	Q91-E94 PolarHBondContact NE2-OE2 3.12Å; E94-K99 HydrophobicContact CG-CG 4.25Å; E94-K99 WeakPolarHBondContact OE1-CE 3.39Å
95	G	74.2	Confident	87.5	Confident	42 Å²	42	52 Å²	52	43%	0.433	27%	0.274	S	S	.	.			trans	-110.4	175.5	170.1	0	0	0	0	0	110.6	F97 A98	G95-F97 PolarHBondContact O-N 3.48Å; G95-F97 VanDerWaalsContact O-N 3.12Å; G95-A98 WeakPolarHBondContact CA-O 3.39Å; G95-A98 PolarHBondContact N-O 3.15Å
96	T	70.9	Confident	87.3	Confident	127 Å²	127	52.5 Å²	52.5	78%	0.779	28%	0.276	S	S	*	.	S	Bend	trans	-57.4	-31.8	-176.5	-48.1	0	0	0	0	113.9
97	F	72.5	Confident	86.8	Confident	127 Å²	127	53.6 Å²	53.6	56%	0.557	29%	0.285	S	S	*	.	S	Bend	trans	-127.3	0	-174.8	-52.5	-70.7	0	0	0	113.4	G95 E117	G95-F97 PolarHBondContact O-N 3.48Å; G95-F97 VanDerWaalsContact O-N 3.12Å; F97-E117 WeakPolarHBondContact O-CG 3.41Å
98	A	85.3	Confident	86.2	Confident	11 Å²	11	54 Å²	54	9%	0.091	29%	0.286	C	S	.	.			trans	-149.1	148.4	-172.4	0	0	0	0	0	111.9	G95 K115 I116 E117	G95-A98 WeakPolarHBondContact CA-O 3.39Å; G95-A98 PolarHBondContact N-O 3.15Å; A98-K115 HydrophobicContact CB-CD 4.28Å; A98-K115 HydrophobicContact CB-CG 3.8Å; A98-I116 CarbonylContact C-O 3.56Å; A98-I116 WeakPolarHBondContact CA-O 3.45Å; A98-I116 WeakPolarHBondContact CB-O 3.33Å; A98-E117 HydrophobicContact CB-CB 4.43Å
99	K	89.6	Confident	85.8	Confident	58 Å²	58	58 Å²	58	25%	0.252	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.1	170.8	-67.4	-175.2	175.3	-161.8	0	109.6	E94 F101 I116	E94-K99 HydrophobicContact CG-CG 4.25Å; E94-K99 WeakPolarHBondContact OE1-CE 3.39Å; K99-F101 HydrophobicContact CB-CD2 4.34Å; K99-F101 HydrophobicContact CB-CE2 3.4Å; K99-F101 VanDerWaalsContact CB-CE2 3.4Å; K99-F101 HydrophobicContact CB-CZ 3.72Å; K99-F101 HydrophobicContact CD-CZ 4.17Å; K99-I116 PolarHBondContact N-O 2.95Å; K99-I116 PolarHBondContact O-N 2.81Å
100	I	92.7	Very high	85.7	Confident	30 Å²	30	61.5 Å²	61.5	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.9	-180	-45.9	-63.3	0	0	0	108.7	Q91 I92 G93 A113 V114 K115	Q91-I100 CarbonylContact C-O 3.49Å; Q91-I100 WeakPolarHBondContact CA-O 3.47Å; Q91-I100 VanDerWaalsContact CG-O 3.29Å; Q91-I100 WeakPolarHBondContact CG-O 3.36Å; I92-I100 HydrophobicContact CD1-CG2 3.86Å; I92-I100 HydrophobicContact CG1-CB 4.15Å; I92-I100 HydrophobicContact CG1-CG2 3.7Å; I92-I100 PolarHBondContact N-O 3.46Å; G93-I100 PolarHBondContact N-O 3.38Å; G93-I100 PolarHBondContact O-N 3.09Å; I100-A113 HydrophobicContact CG2-CB 4.29Å; I100-V114 WeakPolarHBondContact CA-O 3.37Å; I100-K115 HydrophobicContact CD1-CB 3.53Å; I100-K115 HydrophobicContact CD1-CD 3.49Å; I100-K115 VanDerWaalsContact CD1-CD 3.49Å; I100-K115 HydrophobicContact CD1-CG 3.37Å
101	F	94.2	Very high	85.8	Confident	14 Å²	14	61.2 Å²	61.2	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	158	178.8	-59.4	-90.4	0	0	0	111.3	I78 I88 H90 Q91 K99 A113 V114 I116	I78-F101 HydrophobicContact CD1-CD1 3.96Å; I78-F101 HydrophobicContact CD1-CE1 3.23Å; I78-F101 HydrophobicContact CD1-CZ 3.94Å; I88-F101 HydrophobicContact CG2-CB 3.46Å; I88-F101 VanDerWaalsContact CG2-CB 3.46Å; I88-F101 HydrophobicContact CG2-CD1 3.95Å; I88-F101 HydrophobicContact CG2-CD2 4.33Å; I88-F101 HydrophobicContact CG2-CG 3.65Å; H90-F101 CarbonylContact O-C 3.09Å; H90-F101 VanDerWaalsContact O-CA 3.27Å; H90-F101 WeakPolarHBondContact O-CA 3.41Å; Q91-F101 VanDerWaalsContact CA-CD1 3.44Å; Q91-F101 HydrophobicContact CB-CD1 3.76Å; Q91-F101 HydrophobicContact CB-CE1 3.53Å; Q91-F101 HydrophobicContact CB-CZ 4.39Å; Q91-F101 HydrophobicContact CG-CD1 4.16Å; Q91-F101 HydrophobicContact CG-CE1 3.77Å; Q91-F101 HydrophobicContact CG-CZ 4.16Å; K99-F101 HydrophobicContact CB-CD2 4.34Å; K99-F101 HydrophobicContact CB-CE2 3.4Å; K99-F101 VanDerWaalsContact CB-CE2 3.4Å; K99-F101 HydrophobicContact CB-CZ 3.72Å; K99-F101 HydrophobicContact CD-CZ 4.17Å; F101-A113 CarbonylContact O-C 3.11Å; F101-A113 WeakPolarHBondContact O-CA 3.44Å; F101-V114 PolarHBondContact N-O 3.49Å; F101-V114 PolarHBondContact O-N 3.39Å; F101-I116 HydrophobicContact CD2-CD1 3.59Å; F101-I116 HydrophobicContact CD2-CG1 4.1Å; F101-I116 HydrophobicContact CE2-CB 4.44Å; F101-I116 HydrophobicContact CE2-CD1 3.77Å; F101-I116 HydrophobicContact CE2-CG1 4.33Å
102	V	94.3	Very high	86	Confident	10 Å²	10	59.1 Å²	59.1	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.3	161.7	172.4	0	0	0	0	109	T89 H90 I92 Y111 Y112 L164	T89-V102 PolarHBondContact N-O 3.03Å; T89-V102 WeakPolarHBondContact OG1-CB 3.44Å; T89-V102 WeakPolarHBondContact OG1-CG1 3.3Å; T89-V102 PolarHBondContact OG1-O 2.9Å; H90-V102 PolarHBondContact O-N 2.94Å; I92-V102 HydrophobicContact CD1-CG2 3.98Å; I92-V102 HydrophobicContact CG1-CG2 4.41Å; I92-V102 HydrophobicContact CG2-CG2 3.55Å; V102-Y111 HydrophobicContact CG1-CD1 3.65Å; V102-Y111 HydrophobicContact CG1-CE1 4.39Å; V102-Y112 WeakPolarHBondContact CA-O 3.38Å; V102-L164 HydrophobicContact CG1-CD2 4.44Å; V102-L164 HydrophobicContact CG2-CD1 4.03Å; V102-L164 HydrophobicContact CG2-CD2 4.33Å
103	G	93.5	Very high	86.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.6	174.2	0	0	0	0	0	111.7	M87 Y111 Y112	M87-G103 CarbonylContact O-C 3.53Å; M87-G103 WeakPolarHBondContact O-CA 3.22Å; G103-Y111 CarbonylContact O-C 3.58Å; G103-Y111 WeakPolarHBondContact O-CA 3.39Å; G103-Y112 PolarHBondContact N-O 3.21Å; G103-Y112 PolarHBondContact O-N 3.48Å
104	R	92.4	Very high	86.5	Confident	77 Å²	77	54.4 Å²	54.4	29%	0.291	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.8	171.8	-176.1	179.2	175.8	-178.9	3.5	109.4	M87 L106 D109 Y111	M87-R104 HydrophobicContact CB-CB 4.49Å; M87-R104 HydrophobicContact CE-CB 4.16Å; M87-R104 PolarHBondContact N-O 3.34Å; M87-R104 PolarHBondContact O-N 3.49Å; R104-L106 PolarHBondContact O-N 3.47Å; R104-D109 IonicContact CZ-OD1 2.68Å; R104-D109 IonicContact CZ-OD2 3.23Å; R104-D109 IonicContact NE-OD1 2.81Å; R104-D109 PolarHBondContact NE-OD1 2.85Å; R104-D109 IonicContact NH2-OD1 3.85Å; R104-D109 PolarHBondContact NH2-OD1 3.44Å; R104-D109 IonicContact NH2-OD2 3.71Å; R104-D109 PolarHBondContact NH2-OD2 2.96Å; R104-Y111 HydrophobicContact CB-CD1 4.06Å; R104-Y111 HydrophobicContact CB-CE1 3.87Å; R104-Y111 HydrophobicContact CG-CD1 4.49Å; R104-Y111 HydrophobicContact CG-CE1 4.14Å
105	S	88.5	Confident	86.8	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.028	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	114.7	173.4	-166.2	0	0	0	0	109.8	W86 F108 D109 Q110	W86-S105 VanDerWaalsContact CZ3-CB 3.5Å; S105-F108 PolarHBondContact O-N 2.77Å; S105-F108 WeakPolarHBondContact OG-CD2 3.23Å; S105-D109 WeakPolarHBondContact O-CA 3.42Å; S105-D109 PolarHBondContact O-N 3.03Å; S105-Q110 PolarHBondContact N-O 3.11Å
106	L	79.7	Confident	87.6	Confident	95 Å²	95	48.5 Å²	48.5	50%	0.497	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-37	179.9	-67.5	-176.5	0	0	0	114.3	M82 D85 M87 R104	M82-L106 HydrophobicContact CE-CD1 3.39Å; M82-L106 HydrophobicContact CE-CG 4.1Å; M82-L106 HydrophobicContact SD-CD1 4.31Å; D85-L106 PolarHBondContact O-N 3.43Å; M87-L106 HydrophobicContact CB-CD2 4.23Å; R104-L106 PolarHBondContact O-N 3.47Å
107	P	77.6	Confident	88.2	Confident	36 Å²	36	43.2 Å²	43.2	23%	0.234	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-27.3	-179.6	-19.1	32.7	0	0	0	114.1	D85 Y452	D85-P107 HydrophobicContact CB-CG 4.32Å; P107-Y452 PolarHBondContact O-OH 3.37Å
108	F	77.8	Confident	88.4	Confident	54 Å²	54	41.2 Å²	41.2	24%	0.237	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-10.7	-170.1	-58.7	-89.5	0	0	0	114.2	S105 Q110 L435 E438 Y452	S105-F108 PolarHBondContact O-N 2.77Å; S105-F108 WeakPolarHBondContact OG-CD2 3.23Å; F108-Q110 HydrophobicContact CB-CB 4.33Å; F108-Q110 PolarHBondContact O-N 3.4Å; F108-L435 HydrophobicContact CE1-CD2 3.83Å; F108-L435 HydrophobicContact CZ-CD2 3.64Å; F108-E438 VanDerWaalsContact CD1-OE2 3.22Å; F108-E438 WeakPolarHBondContact CD1-OE2 3.24Å; F108-E438 WeakPolarHBondContact CE1-OE2 3.48Å; F108-Y452 AromaticContact CD1-CE2 3.8Å; F108-Y452 HydrophobicContact CD1-CE2 3.8Å; F108-Y452 AromaticContact CD1-CZ 3.69Å; F108-Y452 WeakPolarHBondContact CD1-OH 3.13Å; F108-Y452 HydrophobicContact CE1-CE1 4.29Å; F108-Y452 AromaticContact CE1-CE2 3.92Å; F108-Y452 HydrophobicContact CE1-CE2 3.92Å; F108-Y452 AromaticContact CE1-CZ 3.4Å; F108-Y452 VanDerWaalsContact CE1-CZ 3.4Å; F108-Y452 WeakPolarHBondContact CE1-OH 3.45Å; F108-Y452 AromaticContact CZ-CZ 3.99Å; F108-Y452 WeakPolarHBondContact CZ-OH 3.31Å
109	D	83.2	Confident	87.5	Confident	86 Å²	86	46.2 Å²	46.2	46%	0.46	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	36.2	-174.7	-159.5	3	0	0	0	114	R104 S105	R104-D109 IonicContact CZ-OD1 2.68Å; R104-D109 IonicContact CZ-OD2 3.23Å; R104-D109 IonicContact NE-OD1 2.81Å; R104-D109 PolarHBondContact NE-OD1 2.85Å; R104-D109 IonicContact NH2-OD1 3.85Å; R104-D109 PolarHBondContact NH2-OD1 3.44Å; R104-D109 IonicContact NH2-OD2 3.71Å; R104-D109 PolarHBondContact NH2-OD2 2.96Å; S105-D109 WeakPolarHBondContact O-CA 3.42Å; S105-D109 PolarHBondContact O-N 3.03Å
110	Q	87.1	Confident	86	Confident	105 Å²	105	50.7 Å²	50.7	49%	0.491	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.7	-177.1	-172.4	69.2	42.1	0	0	110.4	S105 F108 Y112	S105-Q110 PolarHBondContact N-O 3.11Å; F108-Q110 HydrophobicContact CB-CB 4.33Å; F108-Q110 PolarHBondContact O-N 3.4Å; Q110-Y112 HydrophobicContact CB-CD2 4.45Å; Q110-Y112 HydrophobicContact CB-CE2 3.63Å; Q110-Y112 HydrophobicContact CG-CD2 4.4Å; Q110-Y112 HydrophobicContact CG-CE2 3.66Å; Q110-Y112 VanDerWaalsContact O-CD2 3.26Å; Q110-Y112 WeakPolarHBondContact O-CD2 3.49Å; Q110-Y112 WeakPolarHBondContact O-CE2 3.41Å
111	Y	91.9	Very high	84.1	Confident	102 Å²	102	53.4 Å²	53.4	40%	0.4	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	142.2	179.2	-67.3	-86.5	0	0	0	112.3	V102 G103 R104	V102-Y111 HydrophobicContact CG1-CD1 3.65Å; V102-Y111 HydrophobicContact CG1-CE1 4.39Å; G103-Y111 CarbonylContact O-C 3.58Å; G103-Y111 WeakPolarHBondContact O-CA 3.39Å; R104-Y111 HydrophobicContact CB-CD1 4.06Å; R104-Y111 HydrophobicContact CB-CE1 3.87Å; R104-Y111 HydrophobicContact CG-CD1 4.49Å; R104-Y111 HydrophobicContact CG-CE1 4.14Å
112	Y	95.1	Very high	82.1	Confident	25 Å²	25	58.4 Å²	58.4	10%	0.098	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	161.6	-176	-66.7	-89	0	0	0	110.7	W86 V102 G103 Q110 V149 V161 M162	W86-Y112 HydrophobicContact CE3-CD2 4.43Å; W86-Y112 HydrophobicContact CH2-CD2 4.08Å; W86-Y112 HydrophobicContact CH2-CE2 4.14Å; W86-Y112 HydrophobicContact CH2-CG 4.45Å; W86-Y112 AromaticContact CZ3-CD2 3.42Å; W86-Y112 HydrophobicContact CZ3-CD2 3.42Å; W86-Y112 VanDerWaalsContact CZ3-CD2 3.42Å; W86-Y112 AromaticContact CZ3-CE2 3.81Å; W86-Y112 HydrophobicContact CZ3-CE2 3.81Å; W86-Y112 AromaticContact CZ3-CG 3.96Å; W86-Y112 HydrophobicContact CZ3-CG 3.96Å; V102-Y112 WeakPolarHBondContact CA-O 3.38Å; G103-Y112 PolarHBondContact N-O 3.21Å; G103-Y112 PolarHBondContact O-N 3.48Å; Q110-Y112 HydrophobicContact CB-CD2 4.45Å; Q110-Y112 HydrophobicContact CB-CE2 3.63Å; Q110-Y112 HydrophobicContact CG-CD2 4.4Å; Q110-Y112 HydrophobicContact CG-CE2 3.66Å; Q110-Y112 VanDerWaalsContact O-CD2 3.26Å; Q110-Y112 WeakPolarHBondContact O-CD2 3.49Å; Q110-Y112 WeakPolarHBondContact O-CE2 3.41Å; Y112-V149 HydrophobicContact CD1-CG1 4.48Å; Y112-V149 HydrophobicContact CD1-CG2 3.84Å; Y112-V149 HydrophobicContact CE1-CB 4.45Å; Y112-V149 HydrophobicContact CE1-CG1 3.95Å; Y112-V149 HydrophobicContact CE1-CG2 3.86Å; Y112-V161 HydrophobicContact CD1-CG1 4.18Å; Y112-V161 HydrophobicContact CG-CG1 3.79Å; Y112-M162 WeakPolarHBondContact CB-O 3.23Å; Y112-M162 WeakPolarHBondContact CD1-O 3.36Å
113	A	96	Very high	80.2	Confident	5 Å²	5	63.5 Å²	63.5	4%	0.041	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.9	166	0	0	0	0	0	109.7	I92 I100 F101 V161 M162 L164	I92-A113 HydrophobicContact CD1-CB 4.49Å; I100-A113 HydrophobicContact CG2-CB 4.29Å; F101-A113 CarbonylContact O-C 3.11Å; F101-A113 WeakPolarHBondContact O-CA 3.44Å; A113-V161 WeakPolarHBondContact O-CA 3.41Å; A113-M162 HydrophobicContact CB-CE 4.03Å; A113-M162 HydrophobicContact CB-CG 3.96Å; A113-M162 PolarHBondContact N-O 3.21Å; A113-M162 PolarHBondContact O-N 3.41Å; A113-L164 HydrophobicContact CB-CD1 4.07Å
114	V	94.2	Very high	78.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	112.1	178.4	-172.7	0	0	0	0	108.6	I88 I100 F101 I116 F159 F160 V161	I88-V114 HydrophobicContact CD1-CB 3.94Å; I88-V114 HydrophobicContact CD1-CG1 3.8Å; I88-V114 HydrophobicContact CD1-CG2 3.71Å; I100-V114 WeakPolarHBondContact CA-O 3.37Å; F101-V114 PolarHBondContact N-O 3.49Å; F101-V114 PolarHBondContact O-N 3.39Å; V114-I116 HydrophobicContact CG1-CD1 4.31Å; V114-I116 HydrophobicContact CG1-CG1 3.9Å; V114-F159 HydrophobicContact CG1-CB 4.44Å; V114-F159 HydrophobicContact CG1-CD2 3.9Å; V114-F160 WeakPolarHBondContact CA-O 3.49Å; V114-V161 HydrophobicContact CG1-CG2 4.29Å; V114-V161 HydrophobicContact CG2-CG1 4.22Å; V114-V161 HydrophobicContact CG2-CG2 4.09Å
115	K	92.6	Very high	77.6	Confident	28 Å²	28	65 Å²	65	12%	0.122	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.4	175.4	-176.8	159.9	-173.2	-173.3	0	108.8	A98 I100 E129 F159 F160	A98-K115 HydrophobicContact CB-CD 4.28Å; A98-K115 HydrophobicContact CB-CG 3.8Å; I100-K115 HydrophobicContact CD1-CB 3.53Å; I100-K115 HydrophobicContact CD1-CD 3.49Å; I100-K115 VanDerWaalsContact CD1-CD 3.49Å; I100-K115 HydrophobicContact CD1-CG 3.37Å; K115-E129 WeakPolarHBondContact CE-OE2 3.46Å; K115-E129 IonicContact NZ-OE1 2.69Å; K115-E129 PolarHBondContact NZ-OE1 3.08Å; K115-E129 IonicContact NZ-OE2 3.67Å; K115-E129 PolarHBondContact NZ-OE2 3.02Å; K115-F159 WeakPolarHBondContact O-CA 3.49Å; K115-F159 VanDerWaalsContact O-CB 3.3Å; K115-F159 WeakPolarHBondContact O-CB 3.4Å; K115-F160 HydrophobicContact CB-CD1 4.04Å; K115-F160 HydrophobicContact CB-CE1 3.68Å; K115-F160 HydrophobicContact CB-CE2 4.39Å; K115-F160 HydrophobicContact CB-CZ 3.86Å; K115-F160 HydrophobicContact CD-CE1 3.55Å; K115-F160 HydrophobicContact CD-CZ 3.65Å; K115-F160 HydrophobicContact CG-CD1 4.45Å; K115-F160 HydrophobicContact CG-CE1 3.82Å; K115-F160 HydrophobicContact CG-CZ 4.22Å; K115-F160 PolarHBondContact N-O 3.4Å; K115-F160 PolarHBondContact O-N 2.93Å
116	I	89.5	Confident	77.2	Confident	24 Å²	24	65 Å²	65	12%	0.123	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.6	-177.3	-53.6	176.1	0	0	0	108.7	L83 A98 K99 F101 V114 F159	L83-I116 HydrophobicContact CD1-CD1 3.56Å; L83-I116 HydrophobicContact CD1-CG1 4.17Å; A98-I116 CarbonylContact C-O 3.56Å; A98-I116 WeakPolarHBondContact CA-O 3.45Å; A98-I116 WeakPolarHBondContact CB-O 3.33Å; K99-I116 PolarHBondContact N-O 2.95Å; K99-I116 PolarHBondContact O-N 2.81Å; F101-I116 HydrophobicContact CD2-CD1 3.59Å; F101-I116 HydrophobicContact CD2-CG1 4.1Å; F101-I116 HydrophobicContact CE2-CB 4.44Å; F101-I116 HydrophobicContact CE2-CD1 3.77Å; F101-I116 HydrophobicContact CE2-CG1 4.33Å; V114-I116 HydrophobicContact CG1-CD1 4.31Å; V114-I116 HydrophobicContact CG1-CG1 3.9Å; I116-F159 HydrophobicContact CB-CB 4.46Å; I116-F159 HydrophobicContact CG1-CB 4.03Å
117	E	85.6	Confident	77.3	Confident	16 Å²	16	61.6 Å²	61.6	8%	0.075	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.9	172.4	174.6	170.5	-153.2	0	0	108.5	F97 A98 I126 L157 N158	F97-E117 WeakPolarHBondContact O-CG 3.41Å; A98-E117 HydrophobicContact CB-CB 4.43Å; E117-I126 HydrophobicContact CB-CD1 4.18Å; E117-I126 WeakPolarHBondContact OE2-CB 3.34Å; E117-I126 WeakPolarHBondContact OE2-CG2 3.48Å; E117-I126 PolarHBondContact OE2-N 3.46Å; E117-L157 WeakPolarHBondContact O-CA 3.49Å; E117-N158 PolarHBondContact N-O 3.49Å; E117-N158 PolarHBondContact O-N 3.15Å
118	V	75.8	Confident	77.7	Confident	85 Å²	85	62.5 Å²	62.5	52%	0.515	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.7	171.2	-177.2	0	0	0	0	107.7	L120	V118-L120 VanDerWaalsContact C-N 3.29Å; V118-L120 HydrophobicContact CB-CG 4.41Å; V118-L120 HydrophobicContact CG1-CD2 4.14Å; V118-L120 HydrophobicContact CG1-CG 4.23Å; V118-L120 PolarHBondContact O-N 3.5Å
119	R	67	Low	78.3	Confident	116 Å²	116	60.3 Å²	60.3	44%	0.438	31%	0.308	S	S	.	.			trans	-76.3	81.5	-175.4	-159.3	177.4	-161.7	175.2	4	110.9	D156	R119-D156 PolarHBondContact N-O 3.23Å; R119-D156 VanDerWaalsContact N-O 3.11Å
120	L	57.2	Low	78.5	Confident	152 Å²	152	56.4 Å²	56.4	80%	0.796	29%	0.287	S	S	*	.			trans	-90.6	-22.8	179.3	-64.3	174.8	0	0	0	113	V118	V118-L120 VanDerWaalsContact C-N 3.29Å; V118-L120 HydrophobicContact CB-CG 4.41Å; V118-L120 HydrophobicContact CG1-CD2 4.14Å; V118-L120 HydrophobicContact CG1-CG 4.23Å; V118-L120 PolarHBondContact O-N 3.5Å
121	T	53.8	Low	78.5	Confident	88 Å²	88	52.4 Å²	52.4	54%	0.54	27%	0.27	S	S	.	.	S	Bend	trans	-141.6	171.3	-179.2	70.9	0	0	0	0	111.7	M123	T121-M123 PolarHBondContact O-N 3.04Å; T121-M123 PolarHBondContact OG1-N 3.22Å
122	S	52.1	Low	78.5	Confident	118 Å²	118	47.7 Å²	47.7	83%	0.825	25%	0.252	S	S	*	.	S	Bend	trans	-77.4	4.8	176.6	63.5	0	0	0	0	114.6
123	M	53.8	Low	78.3	Confident	117 Å²	117	46.6 Å²	46.6	58%	0.576	25%	0.247	S	C	*	.			trans	-91.6	113.7	178.4	-66	-156.3	-160.3	0	0	110.8	T121 F125	T121-M123 PolarHBondContact O-N 3.04Å; T121-M123 PolarHBondContact OG1-N 3.22Å; M123-F125 HydrophobicContact CB-CD2 3.95Å; M123-F125 HydrophobicContact CB-CE2 3.56Å; M123-F125 HydrophobicContact CB-CZ 4.24Å; M123-F125 HydrophobicContact CG-CE2 4.29Å; M123-F125 PolarHBondContact O-N 2.91Å; M123-F125 HydrophobicContact SD-CE2 3.83Å; M123-F125 HydrophobicContact SD-CZ 3.67Å
124	D	63.3	Low	77.9	Confident	51 Å²	51	49.9 Å²	49.9	27%	0.273	26%	0.259	S	S	.	.			trans	-88.7	73.5	179.3	-70.8	-15	0	0	0	110.8	I126 D127 K153	D124-I126 VanDerWaalsContact C-N 3.34Å; D124-D127 HydrophobicContact CB-CB 4.02Å; D124-D127 PolarHBondContact O-N 2.93Å; D124-K153 IonicContact OD2-NZ 3.92Å; D124-K153 PolarHBondContact OD2-NZ 3.47Å
125	F	68.9	Low	77.6	Confident	59 Å²	59	51.9 Å²	51.9	26%	0.259	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-36.4	178.9	-73.1	-78.1	0	0	0	112.7	M123 D127 H128 E129	M123-F125 HydrophobicContact CB-CD2 3.95Å; M123-F125 HydrophobicContact CB-CE2 3.56Å; M123-F125 HydrophobicContact CB-CZ 4.24Å; M123-F125 HydrophobicContact CG-CE2 4.29Å; M123-F125 PolarHBondContact O-N 2.91Å; M123-F125 HydrophobicContact SD-CE2 3.83Å; M123-F125 HydrophobicContact SD-CZ 3.67Å; F125-D127 VanDerWaalsContact C-N 3.27Å; F125-D127 PolarHBondContact O-N 3.11Å; F125-H128 PolarHBondContact O-N 2.84Å; F125-E129 PolarHBondContact O-N 3.29Å
126	I	79.3	Confident	77.4	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-33.3	177.4	-161.1	165.8	0	0	0	113.3	E117 D124 E129 V130 F151 N158 F160	E117-I126 HydrophobicContact CB-CD1 4.18Å; E117-I126 WeakPolarHBondContact OE2-CB 3.34Å; E117-I126 WeakPolarHBondContact OE2-CG2 3.48Å; E117-I126 PolarHBondContact OE2-N 3.46Å; D124-I126 VanDerWaalsContact C-N 3.34Å; I126-E129 PolarHBondContact O-N 3.08Å; I126-V130 HydrophobicContact CG1-CG2 4.49Å; I126-V130 WeakPolarHBondContact O-CB 3.35Å; I126-V130 VanDerWaalsContact O-CG2 3.27Å; I126-V130 WeakPolarHBondContact O-CG2 3.49Å; I126-V130 PolarHBondContact O-N 2.83Å; I126-F151 HydrophobicContact CD1-CE2 4.44Å; I126-F151 HydrophobicContact CG1-CE2 4.25Å; I126-F151 HydrophobicContact CG2-CE2 4.17Å; I126-N158 HydrophobicContact CD1-CB 3.97Å; I126-N158 HydrophobicContact CG2-CB 3.7Å; I126-F160 HydrophobicContact CD1-CD1 3.71Å; I126-F160 HydrophobicContact CD1-CE1 4.27Å; I126-F160 HydrophobicContact CG1-CD1 3.43Å; I126-F160 VanDerWaalsContact CG1-CD1 3.43Å; I126-F160 HydrophobicContact CG1-CE1 3.77Å
127	D	82.4	Confident	77.2	Confident	24 Å²	24	50.4 Å²	50.4	13%	0.128	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-45.5	177.5	-89.9	16.5	0	0	0	112	D124 F125 E129 T131 F151 K153	D124-D127 HydrophobicContact CB-CB 4.02Å; D124-D127 PolarHBondContact O-N 2.93Å; F125-D127 VanDerWaalsContact C-N 3.27Å; F125-D127 PolarHBondContact O-N 3.11Å; D127-E129 VanDerWaalsContact C-N 3.33Å; D127-T131 WeakPolarHBondContact O-CB 3.32Å; D127-T131 PolarHBondContact O-N 3.25Å; D127-T131 PolarHBondContact O-OG1 3.49Å; D127-F151 WeakPolarHBondContact OD1-CZ 3.47Å; D127-K153 WeakPolarHBondContact OD1-CE 3.48Å; D127-K153 IonicContact OD1-NZ 3.86Å; D127-K153 PolarHBondContact OD1-NZ 2.94Å; D127-K153 WeakPolarHBondContact OD2-CE 3.18Å; D127-K153 IonicContact OD2-NZ 2.64Å; D127-K153 PolarHBondContact OD2-NZ 2.88Å
128	H	84.9	Confident	76.9	Confident	55 Å²	55	57.1 Å²	57.1	26%	0.255	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-46	179.4	176.7	72.6	0	0	0	110.1	F125 T131 V132 T237	F125-H128 PolarHBondContact O-N 2.84Å; H128-T131 PolarHBondContact O-N 3.38Å; H128-V132 WeakPolarHBondContact O-CG2 3.49Å; H128-V132 PolarHBondContact O-N 3.14Å; H128-T237 PolarHBondContact CE1-O 2.84Å; H128-T237 PolarHBondContact NE2-O 3.25Å
129	E	90	Very high	76.9	Confident	8 Å²	8	56.4 Å²	56.4	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-51.7	177.6	-174	172.9	-170.3	0	0	111.9	K115 F125 I126 D127 T131 V132 M133 F160 F234	K115-E129 WeakPolarHBondContact CE-OE2 3.46Å; K115-E129 IonicContact NZ-OE1 2.69Å; K115-E129 PolarHBondContact NZ-OE1 3.08Å; K115-E129 IonicContact NZ-OE2 3.67Å; K115-E129 PolarHBondContact NZ-OE2 3.02Å; F125-E129 PolarHBondContact O-N 3.29Å; I126-E129 PolarHBondContact O-N 3.08Å; D127-E129 VanDerWaalsContact C-N 3.33Å; E129-T131 VanDerWaalsContact C-N 3.3Å; E129-T131 PolarHBondContact O-N 3.21Å; E129-V132 PolarHBondContact O-N 3.41Å; E129-M133 HydrophobicContact CG-SD 4.27Å; E129-M133 WeakPolarHBondContact O-CG 3.35Å; E129-M133 PolarHBondContact O-N 3.31Å; E129-F160 HydrophobicContact CG-CE1 4.43Å; E129-F160 HydrophobicContact CG-CZ 4.23Å; E129-F234 HydrophobicContact CG-CB 3.98Å
130	V	88.8	Confident	77.6	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-40.5	177.9	169.6	0	0	0	0	111.5	I126 M133 R134 F151 F160	I126-V130 HydrophobicContact CG1-CG2 4.49Å; I126-V130 WeakPolarHBondContact O-CB 3.35Å; I126-V130 VanDerWaalsContact O-CG2 3.27Å; I126-V130 WeakPolarHBondContact O-CG2 3.49Å; I126-V130 PolarHBondContact O-N 2.83Å; V130-M133 PolarHBondContact O-N 3.05Å; V130-R134 WeakPolarHBondContact O-CB 3.47Å; V130-R134 VanDerWaalsContact O-CG 3.32Å; V130-R134 WeakPolarHBondContact O-CG 3.24Å; V130-R134 PolarHBondContact O-N 3.08Å; V130-F151 HydrophobicContact CG1-CB 3.97Å; V130-F151 HydrophobicContact CG1-CD1 4.19Å; V130-F151 HydrophobicContact CG1-CG 3.98Å; V130-F151 HydrophobicContact CG2-CB 4.39Å; V130-F151 HydrophobicContact CG2-CD2 3.88Å; V130-F151 HydrophobicContact CG2-CE2 4.38Å; V130-F151 HydrophobicContact CG2-CG 4.12Å; V130-F160 HydrophobicContact CG2-CB 3.67Å; V130-F160 HydrophobicContact CG2-CD1 3.57Å; V130-F160 HydrophobicContact CG2-CD2 4.28Å; V130-F160 HydrophobicContact CG2-CE1 4.17Å; V130-F160 HydrophobicContact CG2-CG 3.62Å
131	T	87.3	Confident	79	Confident	22 Å²	22	52.4 Å²	52.4	14%	0.135	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-46.5	179	-61.6	0	0	0	0	111	D127 H128 E129 R134 L135	D127-T131 WeakPolarHBondContact O-CB 3.32Å; D127-T131 PolarHBondContact O-N 3.25Å; D127-T131 PolarHBondContact O-OG1 3.49Å; H128-T131 PolarHBondContact O-N 3.38Å; E129-T131 VanDerWaalsContact C-N 3.3Å; E129-T131 PolarHBondContact O-N 3.21Å; T131-R134 PolarHBondContact O-N 3.15Å; T131-L135 HydrophobicContact CG2-CD1 3.88Å; T131-L135 HydrophobicContact CG2-CG 4.5Å; T131-L135 WeakPolarHBondContact O-CB 3.36Å; T131-L135 VanDerWaalsContact O-CG 3.32Å; T131-L135 WeakPolarHBondContact O-CG 3.42Å; T131-L135 PolarHBondContact O-N 2.85Å
132	V	90.3	Very high	80.6	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-48.9	177	168.2	0	0	0	0	111	H128 E129 R134 L135 L136 F205 F234 T237	H128-V132 WeakPolarHBondContact O-CG2 3.49Å; H128-V132 PolarHBondContact O-N 3.14Å; E129-V132 PolarHBondContact O-N 3.41Å; V132-R134 VanDerWaalsContact C-N 3.3Å; V132-R134 PolarHBondContact O-N 3.02Å; V132-L135 PolarHBondContact O-N 3.06Å; V132-L135 VanDerWaalsContact O-N 3.16Å; V132-L136 HydrophobicContact CG1-CD1 3.8Å; V132-L136 HydrophobicContact CG1-CG 4.23Å; V132-L136 WeakPolarHBondContact O-CG 3.48Å; V132-L136 PolarHBondContact O-N 3.31Å; V132-F205 HydrophobicContact CG2-CD1 4.42Å; V132-F205 HydrophobicContact CG2-CE1 4.2Å; V132-F234 HydrophobicContact CB-CB 4.12Å; V132-F234 HydrophobicContact CG1-CB 3.8Å; V132-F234 HydrophobicContact CG1-CD1 3.82Å; V132-F234 HydrophobicContact CG1-CG 3.99Å; V132-T237 HydrophobicContact CB-CG2 4.36Å; V132-T237 HydrophobicContact CG1-CG2 3.5Å; V132-T237 VanDerWaalsContact CG1-CG2 3.5Å; V132-T237 HydrophobicContact CG2-CG2 3.91Å
133	M	91.5	Very high	82.3	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-55.4	-47	179.1	-70.8	177	74.9	0	0	111.3	E129 V130 L135 L136 S137 P146 C148 F160 M162 F234	E129-M133 HydrophobicContact CG-SD 4.27Å; E129-M133 WeakPolarHBondContact O-CG 3.35Å; E129-M133 PolarHBondContact O-N 3.31Å; V130-M133 PolarHBondContact O-N 3.05Å; M133-L135 PolarHBondContact O-N 3.17Å; M133-L136 PolarHBondContact O-N 3.28Å; M133-S137 PolarHBondContact O-N 2.72Å; M133-S137 PolarHBondContact O-OG 3.11Å; M133-S137 VanDerWaalsContact O-OG 3.13Å; M133-P146 HydrophobicContact CE-CB 4.41Å; M133-P146 HydrophobicContact CE-CG 3.97Å; M133-P146 WeakPolarHBondContact CE-O 3.11Å; M133-C148 HydrophobicContact CB-CB 4.28Å; M133-C148 HydrophobicContact CE-CB 4.04Å; M133-C148 HydrophobicContact SD-CB 4.41Å; M133-F160 HydrophobicContact CE-CE2 4.36Å; M133-F160 HydrophobicContact SD-CE2 3.87Å; M133-F160 HydrophobicContact SD-CZ 4.21Å; M133-M162 HydrophobicContact CE-CB 4.16Å; M133-M162 HydrophobicContact CE-SD 4.15Å; M133-F234 HydrophobicContact CG-CD2 3.33Å; M133-F234 HydrophobicContact CG-CE2 3.68Å; M133-F234 HydrophobicContact CG-CG 4.1Å; M133-F234 HydrophobicContact SD-CD2 4.01Å; M133-F234 HydrophobicContact SD-CE2 4.34Å
134	R	88.1	Confident	84.2	Confident	74 Å²	74	39.7 Å²	39.7	28%	0.279	20%	0.197	S	C	.	.	H	α-helix	trans	-64.5	-39.2	178.3	-73.3	176.2	175.2	178.2	-1.2	113.1	V130 T131 V132 S137 Y138 F421	V130-R134 WeakPolarHBondContact O-CB 3.47Å; V130-R134 VanDerWaalsContact O-CG 3.32Å; V130-R134 WeakPolarHBondContact O-CG 3.24Å; V130-R134 PolarHBondContact O-N 3.08Å; T131-R134 PolarHBondContact O-N 3.15Å; V132-R134 VanDerWaalsContact C-N 3.3Å; V132-R134 PolarHBondContact O-N 3.02Å; R134-S137 PolarHBondContact O-N 3.01Å; R134-Y138 WeakPolarHBondContact O-CB 3.29Å; R134-Y138 PolarHBondContact O-N 3.31Å; R134-F421 HydrophobicContact CB-CE1 4.19Å; R134-F421 HydrophobicContact CB-CZ 4.21Å
135	L	87.4	Confident	85.7	Confident	43 Å²	43	37.8 Å²	37.8	23%	0.225	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-37.4	177	-76.1	170.9	0	0	0	112.1	T131 V132 M133 Y138 F205 P416 F421	T131-L135 HydrophobicContact CG2-CD1 3.88Å; T131-L135 HydrophobicContact CG2-CG 4.5Å; T131-L135 WeakPolarHBondContact O-CB 3.36Å; T131-L135 VanDerWaalsContact O-CG 3.32Å; T131-L135 WeakPolarHBondContact O-CG 3.42Å; T131-L135 PolarHBondContact O-N 2.85Å; V132-L135 PolarHBondContact O-N 3.06Å; V132-L135 VanDerWaalsContact O-N 3.16Å; M133-L135 PolarHBondContact O-N 3.17Å; L135-Y138 PolarHBondContact O-N 3.06Å; L135-F205 HydrophobicContact CB-CE2 4.16Å; L135-F205 HydrophobicContact CB-CZ 4.15Å; L135-F205 HydrophobicContact CD1-CZ 3.81Å; L135-P416 HydrophobicContact CD1-CB 4.28Å; L135-P416 HydrophobicContact CD1-CG 4.18Å; L135-F421 HydrophobicContact CD2-CE2 3.6Å; L135-F421 HydrophobicContact CD2-CZ 3.91Å; L135-F421 HydrophobicContact CG-CE2 3.93Å; L135-F421 HydrophobicContact CG-CZ 4.31Å
136	L	88.7	Confident	87	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-40.9	175.6	-71	175.5	0	0	0	111.6	V132 M133 Y138 L142 I145 M200 K203 F205 F234	V132-L136 HydrophobicContact CG1-CD1 3.8Å; V132-L136 HydrophobicContact CG1-CG 4.23Å; V132-L136 WeakPolarHBondContact O-CG 3.48Å; V132-L136 PolarHBondContact O-N 3.31Å; M133-L136 PolarHBondContact O-N 3.28Å; L136-Y138 VanDerWaalsContact C-N 3.26Å; L136-Y138 PolarHBondContact O-N 3.2Å; L136-L142 HydrophobicContact CB-CD1 4.23Å; L136-L142 WeakPolarHBondContact O-CD1 3.31Å; L136-L142 WeakPolarHBondContact O-CG 3.41Å; L136-I145 HydrophobicContact CD1-CD1 4.38Å; L136-M200 HydrophobicContact CD1-CE 4.44Å; L136-M200 HydrophobicContact CD1-CG 4.24Å; L136-M200 HydrophobicContact CD2-CB 4.4Å; L136-M200 HydrophobicContact CD2-CG 3.92Å; L136-K203 HydrophobicContact CD2-CB 3.76Å; L136-K203 HydrophobicContact CD2-CG 4.22Å; L136-F205 HydrophobicContact CD2-CB 4.33Å; L136-F205 HydrophobicContact CD2-CD2 3.78Å; L136-F205 HydrophobicContact CD2-CG 4.33Å; L136-F205 HydrophobicContact CG-CD2 4.47Å; L136-F234 HydrophobicContact CD1-CD1 3.99Å; L136-F234 HydrophobicContact CD1-CE1 3.68Å; L136-F234 HydrophobicContact CD1-CZ 4.41Å
137	S	85.1	Confident	87.5	Confident	20 Å²	20	37.1 Å²	37.1	14%	0.14	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	7.2	178.2	-52.7	0	0	0	0	114.9	M133 R134 P139 N140	M133-S137 PolarHBondContact O-N 2.72Å; M133-S137 PolarHBondContact O-OG 3.11Å; M133-S137 VanDerWaalsContact O-OG 3.13Å; R134-S137 PolarHBondContact O-N 3.01Å; S137-P139 CarbonylContact O-C 3.58Å; S137-N140 CarbonylContact C-O 3.57Å; S137-N140 WeakPolarHBondContact CA-O 3.3Å; S137-N140 CarbonylContact O-C 3.5Å; S137-N140 PolarHBondContact O-N 3.32Å
138	Y	79.8	Confident	87.9	Confident	157 Å²	157	36.8 Å²	36.8	62%	0.616	18%	0.183	S	C	*	.	S	Bend	trans	-105.5	137.1	177.5	-178.5	-92.4	0	0	0	111.7	R134 L135 L136 N140 K203	R134-Y138 WeakPolarHBondContact O-CB 3.29Å; R134-Y138 PolarHBondContact O-N 3.31Å; L135-Y138 PolarHBondContact O-N 3.06Å; L136-Y138 VanDerWaalsContact C-N 3.26Å; L136-Y138 PolarHBondContact O-N 3.2Å; Y138-N140 VanDerWaalsContact C-N 3.34Å; Y138-K203 PolarHBondContact O-NZ 2.9Å
139	P	76.3	Confident	88.1	Confident	71 Å²	71	35.2 Å²	35.2	46%	0.461	18%	0.177	S	C	.	.	S	Bend	cis	-78.3	-14	-6.1	33	-35.9	0	0	0	113.8	S137	S137-P139 CarbonylContact O-C 3.58Å
140	N	81.3	Confident	88	Confident	116 Å²	116	38.3 Å²	38.3	62%	0.62	19%	0.191	S	C	*	.	S	Bend	trans	-120.1	147.5	-176.5	-58.6	-39.8	0	0	0	110.4	S137 Y138	S137-N140 CarbonylContact C-O 3.57Å; S137-N140 WeakPolarHBondContact CA-O 3.3Å; S137-N140 CarbonylContact O-C 3.5Å; S137-N140 PolarHBondContact O-N 3.32Å; Y138-N140 VanDerWaalsContact C-N 3.34Å
141	E	85.2	Confident	88	Confident	67 Å²	67	40.3 Å²	40.3	31%	0.313	20%	0.199	S	C	.	.			trans	-60.8	146.8	173.7	-64.9	179	-163.7	0	0	110.9	K147 Y437	E141-K147 VanDerWaalsContact OE1-CD 3.3Å; E141-K147 WeakPolarHBondContact OE1-CD 2.9Å; E141-K147 WeakPolarHBondContact OE1-CE 3.41Å; E141-K147 IonicContact OE1-NZ 2.65Å; E141-K147 PolarHBondContact OE1-NZ 3.08Å; E141-Y437 WeakPolarHBondContact OE1-CE1 2.84Å
142	L	87.4	Confident	87.9	Confident	21 Å²	21	40.5 Å²	40.5	11%	0.11	20%	0.202	C	C	.	.			trans	-105.8	134.5	175.1	-60.6	-176.6	0	0	0	109.1	L136 H144 I145 L199	L136-L142 HydrophobicContact CB-CD1 4.23Å; L136-L142 WeakPolarHBondContact O-CD1 3.31Å; L136-L142 WeakPolarHBondContact O-CG 3.41Å; L142-H144 VanDerWaalsContact C-N 3.27Å; L142-H144 PolarHBondContact O-N 3.38Å; L142-I145 HydrophobicContact CB-CB 4.13Å; L142-I145 HydrophobicContact CB-CG1 3.83Å; L142-I145 HydrophobicContact CD1-CG1 4.16Å; L142-I145 PolarHBondContact O-N 2.89Å; L142-L199 HydrophobicContact CD1-CB 4.38Å; L142-L199 HydrophobicContact CD2-CD1 4.22Å
143	P	88.1	Confident	87.5	Confident	35 Å²	35	44.4 Å²	44.4	23%	0.227	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.1	-169.3	18.8	-27.4	0	0	0	113.7	Y195 H230 F381 W385	P143-Y195 HydrophobicContact CG-CE1 4.02Å; P143-H230 PolarHBondContact O-CD2 2.83Å; P143-H230 PolarHBondContact O-NE2 2.87Å; P143-F381 HydrophobicContact CB-CE1 4.39Å; P143-W385 HydrophobicContact CB-CH2 3.72Å; P143-W385 HydrophobicContact CB-CZ3 3.83Å; P143-W385 HydrophobicContact CG-CE3 4.44Å; P143-W385 HydrophobicContact CG-CH2 3.9Å; P143-W385 HydrophobicContact CG-CZ3 3.45Å; P143-W385 VanDerWaalsContact CG-CZ3 3.45Å
144	H	95.2	Very high	86.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	13.3	-178.4	-57.2	-82	0	0	0	113.5	L142 Q192 Y195 A196 I228 V229 H230 V231 W385	L142-H144 VanDerWaalsContact C-N 3.27Å; L142-H144 PolarHBondContact O-N 3.38Å; H144-Q192 PolarHBondContact CE1-OE1 3.43Å; H144-Y195 AromaticContact CD2-CD1 3.38Å; H144-Y195 WeakPolarHBondContact CD2-CD1 3.33Å; H144-Y195 AromaticContact CD2-CE1 3.8Å; H144-Y195 AromaticContact NE2-CD1 3.37Å; H144-Y195 WeakPolarHBondContact NE2-CD1 3.25Å; H144-Y195 AromaticContact NE2-CE1 3.88Å; H144-A196 HydrophobicContact CB-CB 3.47Å; H144-A196 VanDerWaalsContact CB-CB 3.47Å; H144-I228 WeakPolarHBondContact ND1-CG2 3.45Å; H144-V229 WeakPolarHBondContact CB-O 3.43Å; H144-V229 PolarHBondContact ND1-O 2.93Å; H144-H230 CarbonylContact O-C 3.5Å; H144-H230 VanDerWaalsContact O-CA 3.27Å; H144-H230 WeakPolarHBondContact O-CA 3.5Å; H144-V231 PolarHBondContact O-N 3.08Å; H144-W385 AromaticContact NE2-CD2 3.73Å; H144-W385 AromaticContact NE2-CE2 3.92Å; H144-W385 AromaticContact NE2-CE3 3.69Å; H144-W385 AromaticContact NE2-CH2 3.83Å; H144-W385 AromaticContact NE2-CZ3 3.72Å
145	I	94.8	Very high	86.2	Confident	11 Å²	11	52.8 Å²	52.8	6%	0.056	26%	0.258	C	S	.	.	S	Bend	trans	-123.5	121.1	-179.2	-55	-65.1	0	0	0	107.9	L136 L142 V231 F234	L136-I145 HydrophobicContact CD1-CD1 4.38Å; L142-I145 HydrophobicContact CB-CB 4.13Å; L142-I145 HydrophobicContact CB-CG1 3.83Å; L142-I145 HydrophobicContact CD1-CG1 4.16Å; L142-I145 PolarHBondContact O-N 2.89Å; I145-V231 HydrophobicContact CD1-CB 4.21Å; I145-F234 HydrophobicContact CD1-CE1 3.93Å; I145-F234 HydrophobicContact CD1-CZ 3.67Å; I145-F234 HydrophobicContact CG2-CE2 4.23Å; I145-F234 HydrophobicContact CG2-CZ 3.79Å
146	P	94.7	Very high	85.7	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.013	28%	0.275	C	S	.	.			trans	-62.9	142.3	178.2	25.7	-32	0	0	0	110.4	M133 C148 M162 L165 V231 I232	M133-P146 HydrophobicContact CE-CB 4.41Å; M133-P146 HydrophobicContact CE-CG 3.97Å; M133-P146 WeakPolarHBondContact CE-O 3.11Å; P146-C148 PolarHBondContact O-N 3.37Å; P146-M162 HydrophobicContact CG-SD 4.41Å; P146-L165 HydrophobicContact CB-CD1 4.17Å; P146-L165 HydrophobicContact CG-CD1 4.31Å; P146-V231 WeakPolarHBondContact CD-O 3.29Å; P146-I232 HydrophobicContact CG-CG2 4.09Å
147	K	90.8	Very high	85.4	Confident	46 Å²	46	57.3 Å²	57.3	20%	0.2	28%	0.282	C	S	.	.			trans	-79.5	124.5	-179.2	-177.7	-177.8	-175.9	166.4	0	109.7	E141 V149 M162 T163	E141-K147 VanDerWaalsContact OE1-CD 3.3Å; E141-K147 WeakPolarHBondContact OE1-CD 2.9Å; E141-K147 WeakPolarHBondContact OE1-CE 3.41Å; E141-K147 IonicContact OE1-NZ 2.65Å; E141-K147 PolarHBondContact OE1-NZ 3.08Å; K147-V149 HydrophobicContact CB-CG1 4.49Å; K147-V149 HydrophobicContact CD-CG1 3.95Å; K147-V149 HydrophobicContact CG-CG1 3.99Å; K147-V149 PolarHBondContact O-N 3.05Å; K147-M162 CarbonylContact O-C 3.52Å; K147-M162 WeakPolarHBondContact O-CA 3.42Å; K147-M162 WeakPolarHBondContact O-CB 3.3Å; K147-T163 PolarHBondContact N-OG1 3.46Å; K147-T163 PolarHBondContact O-N 3.38Å
148	C	91.2	Very high	85.4	Confident	17 Å²	17	56.5 Å²	56.5	12%	0.115	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	112.1	164.5	179	0	0	0	0	109.1	M133 P146	M133-C148 HydrophobicContact CB-CB 4.28Å; M133-C148 HydrophobicContact CE-CB 4.04Å; M133-C148 HydrophobicContact SD-CB 4.41Å; P146-C148 PolarHBondContact O-N 3.37Å
149	V	89.2	Confident	85.9	Confident	22 Å²	22	49.1 Å²	49.1	13%	0.133	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-25.2	-177.2	-60.9	0	0	0	0	113	W86 Y112 K147 V161 M434	W86-V149 HydrophobicContact CH2-CG2 4Å; W86-V149 HydrophobicContact CZ2-CG2 4.45Å; Y112-V149 HydrophobicContact CD1-CG1 4.48Å; Y112-V149 HydrophobicContact CD1-CG2 3.84Å; Y112-V149 HydrophobicContact CE1-CB 4.45Å; Y112-V149 HydrophobicContact CE1-CG1 3.95Å; Y112-V149 HydrophobicContact CE1-CG2 3.86Å; K147-V149 HydrophobicContact CB-CG1 4.49Å; K147-V149 HydrophobicContact CD-CG1 3.95Å; K147-V149 HydrophobicContact CG-CG1 3.99Å; K147-V149 PolarHBondContact O-N 3.05Å; V149-V161 HydrophobicContact CG2-CB 3.84Å; V149-V161 HydrophobicContact CG2-CG1 3.69Å; V149-V161 WeakPolarHBondContact CG2-O 3.29Å; V149-V161 PolarHBondContact N-O 2.93Å; V149-M434 WeakPolarHBondContact O-CE 3.35Å
150	F	87.9	Confident	86.6	Confident	72 Å²	72	45.7 Å²	45.7	32%	0.316	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	148.9	-180	-176.6	-96.3	0	0	0	111.1	W86 S152 F159 F160 V161	W86-F150 HydrophobicContact CZ2-CB 3.72Å; W86-F150 HydrophobicContact CZ2-CG 4.17Å; W86-F150 AromaticContact NE1-CD1 3.51Å; W86-F150 AromaticContact NE1-CE1 3.91Å; W86-F150 AromaticContact NE1-CG 3.69Å; F150-S152 VanDerWaalsContact CE1-CB 3.47Å; F150-F159 AromaticContact CD1-CE2 3.75Å; F150-F159 HydrophobicContact CD1-CE2 3.75Å; F150-F159 HydrophobicContact CD1-CZ 4.17Å; F150-F159 HydrophobicContact CE1-CE1 4.44Å; F150-F159 AromaticContact CE1-CE2 3.63Å; F150-F159 HydrophobicContact CE1-CE2 3.63Å; F150-F159 AromaticContact CE1-CZ 3.55Å; F150-F159 HydrophobicContact CE1-CZ 3.55Å; F150-F160 CarbonylContact O-C 3.55Å; F150-F160 WeakPolarHBondContact O-CA 3.49Å; F150-F160 WeakPolarHBondContact O-CB 3.38Å; F150-V161 HydrophobicContact CB-CB 4Å; F150-V161 HydrophobicContact CB-CG2 4.08Å; F150-V161 HydrophobicContact CD1-CG2 4.14Å; F150-V161 PolarHBondContact N-O 2.95Å; F150-V161 PolarHBondContact O-N 3.11Å
151	F	87.7	Confident	87.1	Confident	45 Å²	45	40.2 Å²	40.2	20%	0.197	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.1	172.2	170.8	-120.3	0	0	0	109.3	I126 D127 V130 K153 F159 F160	I126-F151 HydrophobicContact CD1-CE2 4.44Å; I126-F151 HydrophobicContact CG1-CE2 4.25Å; I126-F151 HydrophobicContact CG2-CE2 4.17Å; D127-F151 WeakPolarHBondContact OD1-CZ 3.47Å; V130-F151 HydrophobicContact CG1-CB 3.97Å; V130-F151 HydrophobicContact CG1-CD1 4.19Å; V130-F151 HydrophobicContact CG1-CG 3.98Å; V130-F151 HydrophobicContact CG2-CB 4.39Å; V130-F151 HydrophobicContact CG2-CD2 3.88Å; V130-F151 HydrophobicContact CG2-CE2 4.38Å; V130-F151 HydrophobicContact CG2-CG 4.12Å; F151-K153 HydrophobicContact CE1-CG 3.89Å; F151-K153 HydrophobicContact CE2-CG 4.29Å; F151-K153 HydrophobicContact CZ-CD 4.26Å; F151-K153 HydrophobicContact CZ-CG 3.44Å; F151-K153 VanDerWaalsContact CZ-CG 3.44Å; F151-F159 VanDerWaalsContact CD2-O 3.25Å; F151-F159 WeakPolarHBondContact CD2-O 3.38Å; F151-F160 HydrophobicContact CB-CB 4.11Å; F151-F160 HydrophobicContact CD2-CB 3.88Å; F151-F160 HydrophobicContact CG-CB 4.47Å
152	S	85.1	Confident	87.6	Confident	26 Å²	26	38 Å²	38	18%	0.182	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	134.1	176.6	174.8	0	0	0	0	110.8	F150 F159	F150-S152 VanDerWaalsContact CE1-CB 3.47Å; S152-F159 PolarHBondContact N-O 3.48Å; S152-F159 PolarHBondContact O-N 3.32Å
153	K	83.1	Confident	87.9	Confident	86 Å²	86	38 Å²	38	37%	0.374	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.5	163.8	-67.1	-164.1	173.7	-170.7	0	109.9	D124 D127 F151 N158	D124-K153 IonicContact OD2-NZ 3.92Å; D124-K153 PolarHBondContact OD2-NZ 3.47Å; D127-K153 WeakPolarHBondContact OD1-CE 3.48Å; D127-K153 IonicContact OD1-NZ 3.86Å; D127-K153 PolarHBondContact OD1-NZ 2.94Å; D127-K153 WeakPolarHBondContact OD2-CE 3.18Å; D127-K153 IonicContact OD2-NZ 2.64Å; D127-K153 PolarHBondContact OD2-NZ 2.88Å; F151-K153 HydrophobicContact CE1-CG 3.89Å; F151-K153 HydrophobicContact CE2-CG 4.29Å; F151-K153 HydrophobicContact CZ-CD 4.26Å; F151-K153 HydrophobicContact CZ-CG 3.44Å; F151-K153 VanDerWaalsContact CZ-CG 3.44Å; K153-N158 WeakPolarHBondContact CA-OD1 3.35Å; K153-N158 WeakPolarHBondContact CB-OD1 3.49Å; K153-N158 WeakPolarHBondContact CG-OD1 3.36Å
154	Q	78.4	Confident	88.3	Confident	81 Å²	81	38 Å²	38	38%	0.379	19%	0.185	S	C	.	.			trans	-120.3	176.2	171.4	-55.4	-173.7	-8.2	0	0	109.6	D156 L157	Q154-D156 VanDerWaalsContact C-N 3.33Å; Q154-D156 PolarHBondContact O-N 3.32Å; Q154-L157 CarbonylContact C-O 3.59Å; Q154-L157 WeakPolarHBondContact CA-O 3.43Å; Q154-L157 HydrophobicContact CB-CG 4.4Å; Q154-L157 VanDerWaalsContact CB-O 3.29Å; Q154-L157 WeakPolarHBondContact CB-O 3.45Å; Q154-L157 HydrophobicContact CG-CD1 4.47Å; Q154-L157 PolarHBondContact N-O 2.95Å
155	K	73	Confident	88.4	Confident	170 Å²	170	39 Å²	39	74%	0.739	19%	0.19	S	C	*	.	S	Bend	trans	-58.8	-47.7	-177.6	-171.2	-172.6	174.1	-170.6	0	111.2
156	D	76.3	Confident	88.5	Confident	108 Å²	108	39.7 Å²	39.7	58%	0.578	20%	0.2	S	C	*	.	S	Bend	trans	-110.3	-13.7	-167.4	-50	-49.2	0	0	0	113.3	R119 Q154	R119-D156 PolarHBondContact N-O 3.23Å; R119-D156 VanDerWaalsContact N-O 3.11Å; Q154-D156 VanDerWaalsContact C-N 3.33Å; Q154-D156 PolarHBondContact O-N 3.32Å
157	L	82.4	Confident	88.6	Confident	30 Å²	30	43.5 Å²	43.5	16%	0.157	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	150.3	179.1	68.8	90	0	0	0	111.7	L83 E117 Q154 F159	L83-L157 HydrophobicContact CD2-CD1 4.48Å; L83-L157 HydrophobicContact CD2-CD2 4.17Å; E117-L157 WeakPolarHBondContact O-CA 3.49Å; Q154-L157 CarbonylContact C-O 3.59Å; Q154-L157 WeakPolarHBondContact CA-O 3.43Å; Q154-L157 HydrophobicContact CB-CG 4.4Å; Q154-L157 VanDerWaalsContact CB-O 3.29Å; Q154-L157 WeakPolarHBondContact CB-O 3.45Å; Q154-L157 HydrophobicContact CG-CD1 4.47Å; Q154-L157 PolarHBondContact N-O 2.95Å; L157-F159 HydrophobicContact CD1-CB 4.41Å; L157-F159 HydrophobicContact CD1-CD1 3.55Å; L157-F159 HydrophobicContact CD1-CE1 4.27Å; L157-F159 HydrophobicContact CD1-CG 4.4Å
158	N	85.4	Confident	88.9	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	143.3	166.2	-64.4	-35.3	0	0	0	108.5	E117 I126 K153	E117-N158 PolarHBondContact N-O 3.49Å; E117-N158 PolarHBondContact O-N 3.15Å; I126-N158 HydrophobicContact CD1-CB 3.97Å; I126-N158 HydrophobicContact CG2-CB 3.7Å; K153-N158 WeakPolarHBondContact CA-OD1 3.35Å; K153-N158 WeakPolarHBondContact CB-OD1 3.49Å; K153-N158 WeakPolarHBondContact CG-OD1 3.36Å
159	F	89.6	Confident	89.3	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	150.7	172.3	75	-81	0	0	0	112.4	L83 W86 V114 K115 I116 F150 F151 S152 L157 V161	L83-F159 HydrophobicContact CB-CE1 4.26Å; L83-F159 HydrophobicContact CB-CE2 4.3Å; L83-F159 HydrophobicContact CB-CZ 3.94Å; L83-F159 HydrophobicContact CD1-CD1 4.33Å; L83-F159 HydrophobicContact CD1-CD2 4.44Å; L83-F159 HydrophobicContact CD1-CG 4.27Å; W86-F159 AromaticContact CD1-CE2 3.89Å; V114-F159 HydrophobicContact CG1-CB 4.44Å; V114-F159 HydrophobicContact CG1-CD2 3.9Å; K115-F159 WeakPolarHBondContact O-CA 3.49Å; K115-F159 VanDerWaalsContact O-CB 3.3Å; K115-F159 WeakPolarHBondContact O-CB 3.4Å; I116-F159 HydrophobicContact CB-CB 4.46Å; I116-F159 HydrophobicContact CG1-CB 4.03Å; F150-F159 AromaticContact CD1-CE2 3.75Å; F150-F159 HydrophobicContact CD1-CE2 3.75Å; F150-F159 HydrophobicContact CD1-CZ 4.17Å; F150-F159 HydrophobicContact CE1-CE1 4.44Å; F150-F159 AromaticContact CE1-CE2 3.63Å; F150-F159 HydrophobicContact CE1-CE2 3.63Å; F150-F159 AromaticContact CE1-CZ 3.55Å; F150-F159 HydrophobicContact CE1-CZ 3.55Å; F151-F159 VanDerWaalsContact CD2-O 3.25Å; F151-F159 WeakPolarHBondContact CD2-O 3.38Å; S152-F159 PolarHBondContact N-O 3.48Å; S152-F159 PolarHBondContact O-N 3.32Å; L157-F159 HydrophobicContact CD1-CB 4.41Å; L157-F159 HydrophobicContact CD1-CD1 3.55Å; L157-F159 HydrophobicContact CD1-CE1 4.27Å; L157-F159 HydrophobicContact CD1-CG 4.4Å; F159-V161 HydrophobicContact CD2-CG2 4.12Å; F159-V161 HydrophobicContact CE2-CG2 4.08Å
160	F	91.4	Very high	89.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	159.6	164.4	72.1	-90.5	0	0	0	111	V114 K115 I126 E129 V130 M133 F150 F151 M162	V114-F160 WeakPolarHBondContact CA-O 3.49Å; K115-F160 HydrophobicContact CB-CD1 4.04Å; K115-F160 HydrophobicContact CB-CE1 3.68Å; K115-F160 HydrophobicContact CB-CE2 4.39Å; K115-F160 HydrophobicContact CB-CZ 3.86Å; K115-F160 HydrophobicContact CD-CE1 3.55Å; K115-F160 HydrophobicContact CD-CZ 3.65Å; K115-F160 HydrophobicContact CG-CD1 4.45Å; K115-F160 HydrophobicContact CG-CE1 3.82Å; K115-F160 HydrophobicContact CG-CZ 4.22Å; K115-F160 PolarHBondContact N-O 3.4Å; K115-F160 PolarHBondContact O-N 2.93Å; I126-F160 HydrophobicContact CD1-CD1 3.71Å; I126-F160 HydrophobicContact CD1-CE1 4.27Å; I126-F160 HydrophobicContact CG1-CD1 3.43Å; I126-F160 VanDerWaalsContact CG1-CD1 3.43Å; I126-F160 HydrophobicContact CG1-CE1 3.77Å; E129-F160 HydrophobicContact CG-CE1 4.43Å; E129-F160 HydrophobicContact CG-CZ 4.23Å; V130-F160 HydrophobicContact CG2-CB 3.67Å; V130-F160 HydrophobicContact CG2-CD1 3.57Å; V130-F160 HydrophobicContact CG2-CD2 4.28Å; V130-F160 HydrophobicContact CG2-CE1 4.17Å; V130-F160 HydrophobicContact CG2-CG 3.62Å; M133-F160 HydrophobicContact CE-CE2 4.36Å; M133-F160 HydrophobicContact SD-CE2 3.87Å; M133-F160 HydrophobicContact SD-CZ 4.21Å; F150-F160 CarbonylContact O-C 3.55Å; F150-F160 WeakPolarHBondContact O-CA 3.49Å; F150-F160 WeakPolarHBondContact O-CB 3.38Å; F151-F160 HydrophobicContact CB-CB 4.11Å; F151-F160 HydrophobicContact CD2-CB 3.88Å; F151-F160 HydrophobicContact CG-CB 4.47Å; F160-M162 HydrophobicContact CD2-CB 4.19Å; F160-M162 HydrophobicContact CD2-CG 4.41Å; F160-M162 HydrophobicContact CE2-CB 4.05Å; F160-M162 HydrophobicContact CE2-CE 4.27Å; F160-M162 HydrophobicContact CE2-CG 3.97Å; F160-M162 HydrophobicContact CE2-SD 3.56Å; F160-M162 VanDerWaalsContact CE2-SD 3.56Å; F160-M162 HydrophobicContact CZ-SD 4.21Å
161	V	92.6	Very high	90.1	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.8	179.2	-171.7	0	0	0	0	108.3	W86 Y112 A113 V114 V149 F150 F159	W86-V161 HydrophobicContact CD2-CG1 4.32Å; W86-V161 HydrophobicContact CD2-CG2 3.81Å; W86-V161 HydrophobicContact CE3-CG1 3.94Å; W86-V161 HydrophobicContact CE3-CG2 4.26Å; W86-V161 HydrophobicContact CG-CG2 4.16Å; W86-V161 HydrophobicContact CH2-CB 4.2Å; W86-V161 HydrophobicContact CH2-CG1 3.67Å; W86-V161 HydrophobicContact CH2-CG2 4.43Å; W86-V161 HydrophobicContact CZ2-CB 4.11Å; W86-V161 HydrophobicContact CZ2-CG1 4.08Å; W86-V161 HydrophobicContact CZ2-CG2 4Å; W86-V161 HydrophobicContact CZ3-CB 4.47Å; W86-V161 HydrophobicContact CZ3-CG1 3.61Å; Y112-V161 HydrophobicContact CD1-CG1 4.18Å; Y112-V161 HydrophobicContact CG-CG1 3.79Å; A113-V161 WeakPolarHBondContact O-CA 3.41Å; V114-V161 HydrophobicContact CG1-CG2 4.29Å; V114-V161 HydrophobicContact CG2-CG1 4.22Å; V114-V161 HydrophobicContact CG2-CG2 4.09Å; V149-V161 HydrophobicContact CG2-CB 3.84Å; V149-V161 HydrophobicContact CG2-CG1 3.69Å; V149-V161 WeakPolarHBondContact CG2-O 3.29Å; V149-V161 PolarHBondContact N-O 2.93Å; F150-V161 HydrophobicContact CB-CB 4Å; F150-V161 HydrophobicContact CB-CG2 4.08Å; F150-V161 HydrophobicContact CD1-CG2 4.14Å; F150-V161 PolarHBondContact N-O 2.95Å; F150-V161 PolarHBondContact O-N 3.11Å; F159-V161 HydrophobicContact CD2-CG2 4.12Å; F159-V161 HydrophobicContact CE2-CG2 4.08Å
162	M	94.8	Very high	90.6	Very high	21 Å²	21	43.6 Å²	43.6	10%	0.103	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	168.3	-178.5	64.1	178.8	167.4	0	0	112	Y112 A113 M133 P146 K147 F160 L164	Y112-M162 WeakPolarHBondContact CB-O 3.23Å; Y112-M162 WeakPolarHBondContact CD1-O 3.36Å; A113-M162 HydrophobicContact CB-CE 4.03Å; A113-M162 HydrophobicContact CB-CG 3.96Å; A113-M162 PolarHBondContact N-O 3.21Å; A113-M162 PolarHBondContact O-N 3.41Å; M133-M162 HydrophobicContact CE-CB 4.16Å; M133-M162 HydrophobicContact CE-SD 4.15Å; P146-M162 HydrophobicContact CG-SD 4.41Å; K147-M162 CarbonylContact O-C 3.52Å; K147-M162 WeakPolarHBondContact O-CA 3.42Å; K147-M162 WeakPolarHBondContact O-CB 3.3Å; F160-M162 HydrophobicContact CD2-CB 4.19Å; F160-M162 HydrophobicContact CD2-CG 4.41Å; F160-M162 HydrophobicContact CE2-CB 4.05Å; F160-M162 HydrophobicContact CE2-CE 4.27Å; F160-M162 HydrophobicContact CE2-CG 3.97Å; F160-M162 HydrophobicContact CE2-SD 3.56Å; F160-M162 VanDerWaalsContact CE2-SD 3.56Å; F160-M162 HydrophobicContact CZ-SD 4.21Å; M162-L164 PolarHBondContact O-N 3.44Å
163	T	94.8	Very high	91.2	Very high	21 Å²	21	43.1 Å²	43.1	13%	0.129	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-43.9	126.8	170.7	-54.5	0	0	0	0	111	K147 L165	K147-T163 PolarHBondContact N-OG1 3.46Å; K147-T163 PolarHBondContact O-N 3.38Å; T163-L165 HydrophobicContact CG2-CD2 4.11Å
164	L	96.1	Very high	91.8	Very high	36 Å²	36	42.6 Å²	42.6	19%	0.188	21%	0.211	C	C	.	.			trans	-72.9	129.8	170.3	-176	60.5	0	0	0	108.8	I92 V102 A113 M162	I92-L164 HydrophobicContact CD1-CD1 3.73Å; V102-L164 HydrophobicContact CG1-CD2 4.44Å; V102-L164 HydrophobicContact CG2-CD1 4.03Å; V102-L164 HydrophobicContact CG2-CD2 4.33Å; A113-L164 HydrophobicContact CB-CD1 4.07Å; M162-L164 PolarHBondContact O-N 3.44Å
165	L	97	Very high	92.7	Very high	22 Å²	22	45.2 Å²	45.2	12%	0.115	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	168.1	179.8	-63.7	175.1	0	0	0	110.1	P146 T163 L216 H230 I232	P146-L165 HydrophobicContact CB-CD1 4.17Å; P146-L165 HydrophobicContact CG-CD1 4.31Å; T163-L165 HydrophobicContact CG2-CD2 4.11Å; L165-L216 HydrophobicContact CB-CB 4.06Å; L165-L216 HydrophobicContact CB-CD2 3.91Å; L165-L216 HydrophobicContact CD1-CB 4.02Å; L165-L216 HydrophobicContact CD1-CD2 4.28Å; L165-H230 HydrophobicContact CD1-CB 3.67Å; L165-H230 HydrophobicContact CD2-CB 4.14Å; L165-I232 HydrophobicContact CD1-CG2 3.64Å
166	G	96.6	Very high	93.7	Very high	25 Å²	25	37.5 Å²	37.5	26%	0.258	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-152.6	174.6	0	0	0	0	0	112.2	L216 M217	G166-L216 WeakPolarHBondContact O-CD2 3.41Å; G166-M217 WeakPolarHBondContact CA-O 3.34Å; G166-M217 PolarHBondContact N-O 2.95Å
167	E	96.5	Very high	94.4	Very high	82 Å²	82	37.1 Å²	37.1	38%	0.383	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	152.7	-176.3	-63.9	-172	-102	0	0	113	L172 K175 L216 M217	E167-L172 HydrophobicContact CB-CD1 4.35Å; E167-L172 HydrophobicContact CB-CD2 3.98Å; E167-L172 HydrophobicContact CB-CG 3.85Å; E167-K175 IonicContact OE1-NZ 3.73Å; E167-K175 PolarHBondContact OE1-NZ 3.01Å; E167-K175 WeakPolarHBondContact OE2-CE 3.28Å; E167-K175 IonicContact OE2-NZ 2.68Å; E167-K175 PolarHBondContact OE2-NZ 2.99Å; E167-L216 WeakPolarHBondContact O-CA 3.4Å; E167-M217 PolarHBondContact O-N 3.29Å
168	N	98	Very high	94.8	Very high	28 Å²	28	42.2 Å²	42.2	15%	0.15	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	157.1	173.2	68.2	67.3	0	0	0	111.4	R170 D171 L172 E213 L215 L216	N168-R170 PolarHBondContact O-N 3.43Å; N168-R170 WeakPolarHBondContact OD1-CA 3.03Å; N168-R170 VanDerWaalsContact OD1-CB 3.22Å; N168-R170 WeakPolarHBondContact OD1-CB 3.06Å; N168-R170 PolarHBondContact OD1-N 3.4Å; N168-R170 VanDerWaalsContact OD1-N 3.08Å; N168-D171 PolarHBondContact ND2-OD2 2.93Å; N168-D171 PolarHBondContact O-N 2.86Å; N168-D171 PolarHBondContact OD1-N 3.21Å; N168-D171 PolarHBondContact OD1-OD2 3.41Å; N168-L172 WeakPolarHBondContact O-CG 3.4Å; N168-L172 PolarHBondContact O-N 2.97Å; N168-E213 WeakPolarHBondContact CB-O 2.76Å; N168-L215 CarbonylContact C-O 3.59Å; N168-L215 VanDerWaalsContact CA-O 3.24Å; N168-L215 WeakPolarHBondContact CA-O 3.27Å; N168-L216 HydrophobicContact CB-CD1 3.57Å; N168-L216 HydrophobicContact CB-CG 3.87Å
169	L	98.6	Very high	95.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-25.1	-176.7	-64.1	-173.6	0	0	0	113	L172 K173 F181 L189 I193 P212 L215 M217 V229 L292	L169-L172 HydrophobicContact CD2-CD1 4.2Å; L169-K173 WeakPolarHBondContact O-CB 3.44Å; L169-K173 PolarHBondContact O-N 3.35Å; L169-F181 HydrophobicContact CB-CE2 4.34Å; L169-F181 HydrophobicContact CD2-CE2 4.25Å; L169-L189 HydrophobicContact CD1-CD1 4.11Å; L169-L189 HydrophobicContact CD2-CD1 3.88Å; L169-L189 HydrophobicContact CD2-CD2 4.13Å; L169-I193 HydrophobicContact CD1-CD1 4.27Å; L169-P212 HydrophobicContact CB-CB 4.22Å; L169-P212 PolarHBondContact N-O 3.06Å; L169-P212 VanDerWaalsContact N-O 3.12Å; L169-L215 HydrophobicContact CB-CB 4.49Å; L169-L215 HydrophobicContact CD1-CB 3.73Å; L169-L215 HydrophobicContact CD1-CD1 4.03Å; L169-L215 HydrophobicContact CG-CB 3.88Å; L169-L215 WeakPolarHBondContact CG-O 3.43Å; L169-L215 PolarHBondContact N-O 2.91Å; L169-M217 HydrophobicContact CD2-CG 4.21Å; L169-M217 HydrophobicContact CD2-SD 3.94Å; L169-V229 HydrophobicContact CD1-CG2 4.15Å; L169-V229 HydrophobicContact CG-CG2 4.42Å; L169-L292 HydrophobicContact CB-CD2 4.07Å; L169-L292 HydrophobicContact CD1-CD1 3.89Å
170	R	97.6	Very high	95.7	Very high	109 Å²	109	52.3 Å²	52.3	41%	0.411	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-51.1	174.4	-179.5	-176.5	172.5	-84.3	5	110.5	N168 K173 L174 P212 E213	N168-R170 PolarHBondContact O-N 3.43Å; N168-R170 WeakPolarHBondContact OD1-CA 3.03Å; N168-R170 VanDerWaalsContact OD1-CB 3.22Å; N168-R170 WeakPolarHBondContact OD1-CB 3.06Å; N168-R170 PolarHBondContact OD1-N 3.4Å; N168-R170 VanDerWaalsContact OD1-N 3.08Å; R170-K173 WeakPolarHBondContact O-CB 3.28Å; R170-K173 PolarHBondContact O-N 3.24Å; R170-L174 WeakPolarHBondContact O-CG 2.72Å; R170-L174 PolarHBondContact O-N 3.03Å; R170-P212 HydrophobicContact CB-CB 3.83Å; R170-P212 PolarHBondContact N-O 3.41Å; R170-E213 HydrophobicContact CB-CG 4.12Å; R170-E213 VanDerWaalsContact CD-CG 3.48Å; R170-E213 WeakPolarHBondContact CD-OE1 3.17Å; R170-E213 HydrophobicContact CG-CG 4.47Å; R170-E213 IonicContact NE-OE1 2.88Å
171	D	97.4	Very high	95.9	Very high	52 Å²	52	52.5 Å²	52.5	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-71.9	-36.8	-174.5	-63.4	-21.1	0	0	0	110.7	N168 K173 L174 K175	N168-D171 PolarHBondContact ND2-OD2 2.93Å; N168-D171 PolarHBondContact O-N 2.86Å; N168-D171 PolarHBondContact OD1-N 3.21Å; N168-D171 PolarHBondContact OD1-OD2 3.41Å; D171-K173 PolarHBondContact O-N 3.45Å; D171-L174 PolarHBondContact O-N 2.92Å; D171-K175 WeakPolarHBondContact O-CG 3.44Å; D171-K175 PolarHBondContact O-N 3.09Å
172	L	97.8	Very high	96.1	Very high	14 Å²	14	58.2 Å²	58.2	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-45.7	169.3	-70.2	171.5	0	0	0	112	E167 N168 L169 L174 K175 C176 F181 M217 F367	E167-L172 HydrophobicContact CB-CD1 4.35Å; E167-L172 HydrophobicContact CB-CD2 3.98Å; E167-L172 HydrophobicContact CB-CG 3.85Å; N168-L172 WeakPolarHBondContact O-CG 3.4Å; N168-L172 PolarHBondContact O-N 2.97Å; L169-L172 HydrophobicContact CD2-CD1 4.2Å; L172-L174 VanDerWaalsContact C-N 3.28Å; L172-L174 PolarHBondContact O-N 3.03Å; L172-K175 PolarHBondContact O-N 2.91Å; L172-K175 VanDerWaalsContact O-N 3.13Å; L172-C176 PolarHBondContact O-N 2.94Å; L172-C176 PolarHBondContact O-SG 3.33Å; L172-F181 HydrophobicContact CB-CE1 4.3Å; L172-F181 HydrophobicContact CB-CZ 3.94Å; L172-M217 HydrophobicContact CD1-CB 4.43Å; L172-M217 HydrophobicContact CD1-CG 3.54Å; L172-F367 HydrophobicContact CB-CB 4.24Å; L172-F367 HydrophobicContact CB-CD1 4.22Å; L172-F367 HydrophobicContact CB-CG 4.17Å; L172-F367 HydrophobicContact CD1-CD1 4.35Å; L172-F367 HydrophobicContact CD1-CD2 4.16Å; L172-F367 HydrophobicContact CD1-CE1 4.3Å; L172-F367 HydrophobicContact CD1-CE2 4.14Å; L172-F367 HydrophobicContact CD1-CG 4.27Å; L172-F367 HydrophobicContact CD1-CZ 4.2Å; L172-F367 HydrophobicContact CD2-CB 4.16Å; L172-F367 HydrophobicContact CD2-CD2 4Å; L172-F367 HydrophobicContact CD2-CG 4.1Å; L172-F367 HydrophobicContact CG-CG 4.41Å
173	K	97.6	Very high	96.2	Very high	16 Å²	16	62.7 Å²	62.7	7%	0.07	30%	0.303	C	S	.	.	H	α-helix	trans	-58.9	-39.5	175.5	174.8	-167.8	170.3	-169.8	0	111.9	L169 R170 D171 K175 C176 R179 F181 D291 L292 D294	L169-K173 WeakPolarHBondContact O-CB 3.44Å; L169-K173 PolarHBondContact O-N 3.35Å; R170-K173 WeakPolarHBondContact O-CB 3.28Å; R170-K173 PolarHBondContact O-N 3.24Å; D171-K173 PolarHBondContact O-N 3.45Å; K173-K175 PolarHBondContact O-N 2.91Å; K173-C176 PolarHBondContact O-N 2.96Å; K173-R179 WeakPolarHBondContact CE-O 3.38Å; K173-R179 VanDerWaalsContact CG-O 3.24Å; K173-R179 WeakPolarHBondContact CG-O 3.48Å; K173-R179 CarbonylContact O-C 3.57Å; K173-R179 VanDerWaalsContact O-CA 3.25Å; K173-R179 WeakPolarHBondContact O-CA 3.47Å; K173-F181 HydrophobicContact CB-CD1 4.34Å; K173-F181 HydrophobicContact CB-CE1 3.77Å; K173-F181 HydrophobicContact CB-CZ 3.85Å; K173-D291 WeakPolarHBondContact CE-O 3.48Å; K173-D291 PolarHBondContact NZ-O 2.87Å; K173-D291 IonicContact NZ-OD1 2.68Å; K173-D291 PolarHBondContact NZ-OD1 2.69Å; K173-D291 IonicContact NZ-OD2 3.12Å; K173-D291 PolarHBondContact NZ-OD2 2.72Å; K173-L292 HydrophobicContact CD-CD2 4.44Å; K173-D294 PolarHBondContact NZ-O 2.83Å
174	L	96.8	Very high	96.2	Very high	75 Å²	75	61.8 Å²	61.8	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-65.1	-24.7	179.2	-71.5	175.8	0	0	0	113.3	R170 D171 L172 R179	R170-L174 WeakPolarHBondContact O-CG 2.72Å; R170-L174 PolarHBondContact O-N 3.03Å; D171-L174 PolarHBondContact O-N 2.92Å; L172-L174 VanDerWaalsContact C-N 3.28Å; L172-L174 PolarHBondContact O-N 3.03Å; L174-R179 HydrophobicContact CD2-CG 4.41Å
175	K	95.6	Very high	96.3	Very high	136 Å²	136	60.2 Å²	60.2	59%	0.591	29%	0.29	S	S	*	.	H	α-helix	trans	-83	-19.9	176	-63.5	177.1	-172.2	-172.2	0	113.4	E167 D171 L172 K173	E167-K175 IonicContact OE1-NZ 3.73Å; E167-K175 PolarHBondContact OE1-NZ 3.01Å; E167-K175 WeakPolarHBondContact OE2-CE 3.28Å; E167-K175 IonicContact OE2-NZ 2.68Å; E167-K175 PolarHBondContact OE2-NZ 2.99Å; D171-K175 WeakPolarHBondContact O-CG 3.44Å; D171-K175 PolarHBondContact O-N 3.09Å; L172-K175 PolarHBondContact O-N 2.91Å; L172-K175 VanDerWaalsContact O-N 3.13Å; K173-K175 PolarHBondContact O-N 2.91Å
176	C	95.7	Very high	96.3	Very high	9 Å²	9	59.1 Å²	59.1	6%	0.061	29%	0.285	C	S	.	.	S	Bend	trans	-75.1	154.5	179.4	-67.4	0	0	0	0	112.9	L172 K173 R179 R180 F181 T366	L172-C176 PolarHBondContact O-N 2.94Å; L172-C176 PolarHBondContact O-SG 3.33Å; K173-C176 PolarHBondContact O-N 2.96Å; C176-R179 WeakPolarHBondContact O-CA 3.3Å; C176-R179 PolarHBondContact O-N 2.91Å; C176-R180 WeakPolarHBondContact CB-O 3.29Å; C176-F181 HydrophobicContact CB-CD1 4.48Å; C176-T366 HydrophobicContact CB-CG2 4.09Å
177	P	89.6	Confident	96.3	Very high	100 Å²	100	58 Å²	58	65%	0.649	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-51.1	140.6	168.7	-25.6	34.8	0	0	0	111.9	R179 R180	P177-R179 PolarHBondContact O-N 3.41Å; P177-R180 PolarHBondContact O-N 3.23Å
178	D	92.2	Very high	96.3	Very high	137 Å²	137	54.5 Å²	54.5	73%	0.733	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	54.9	9.2	-175.6	-61	-43.2	0	0	0	116	R180	D178-R180 HydrophobicContact CB-CG 4.33Å; D178-R180 WeakPolarHBondContact O-CG 3.46Å
179	R	95.7	Very high	96.3	Very high	139 Å²	139	53.1 Å²	53.1	53%	0.525	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	56.2	48.6	-172.2	-53.7	177.1	-178.5	-175.8	1.1	111.9	K173 L174 C176 P177	K173-R179 WeakPolarHBondContact CE-O 3.38Å; K173-R179 VanDerWaalsContact CG-O 3.24Å; K173-R179 WeakPolarHBondContact CG-O 3.48Å; K173-R179 CarbonylContact O-C 3.57Å; K173-R179 VanDerWaalsContact O-CA 3.25Å; K173-R179 WeakPolarHBondContact O-CA 3.47Å; L174-R179 HydrophobicContact CD2-CG 4.41Å; C176-R179 WeakPolarHBondContact O-CA 3.3Å; C176-R179 PolarHBondContact O-N 2.91Å; P177-R179 PolarHBondContact O-N 3.41Å
180	R	96.3	Very high	96.3	Very high	77 Å²	77	53.1 Å²	53.1	29%	0.291	25%	0.249	S	C	.	.			trans	-142.3	153.7	-176.2	-63.2	165.8	-173.1	-104.7	-1.5	111.4	C176 P177 D178 N293 D294	C176-R180 WeakPolarHBondContact CB-O 3.29Å; P177-R180 PolarHBondContact O-N 3.23Å; D178-R180 HydrophobicContact CB-CG 4.33Å; D178-R180 WeakPolarHBondContact O-CG 3.46Å; R180-N293 WeakPolarHBondContact CD-O 3.14Å; R180-N293 VanDerWaalsContact CG-O 3.27Å; R180-N293 WeakPolarHBondContact CG-O 3.33Å; R180-N293 PolarHBondContact NH1-O 3.16Å; R180-N293 VanDerWaalsContact NH1-O 3.09Å; R180-D294 IonicContact CZ-OD1 3.26Å; R180-D294 IonicContact CZ-OD2 3.21Å; R180-D294 IonicContact NH1-OD1 3.65Å; R180-D294 PolarHBondContact NH1-OD1 3.01Å; R180-D294 IonicContact NH1-OD2 2.73Å; R180-D294 PolarHBondContact NH1-OD2 3.35Å; R180-D294 IonicContact NH2-OD1 3.62Å; R180-D294 PolarHBondContact NH2-OD1 3.49Å; R180-D294 IonicContact NH2-OD2 2.9Å; R180-D294 PolarHBondContact NH2-OD2 3.32Å
181	F	97.7	Very high	96.2	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.018	23%	0.231	C	C	.	.			trans	-93.1	141.8	164.6	-65.9	-17.2	0	0	0	110.6	L169 L172 K173 C176 T185 W186 L189 L292 F367	L169-F181 HydrophobicContact CB-CE2 4.34Å; L169-F181 HydrophobicContact CD2-CE2 4.25Å; L172-F181 HydrophobicContact CB-CE1 4.3Å; L172-F181 HydrophobicContact CB-CZ 3.94Å; K173-F181 HydrophobicContact CB-CD1 4.34Å; K173-F181 HydrophobicContact CB-CE1 3.77Å; K173-F181 HydrophobicContact CB-CZ 3.85Å; C176-F181 HydrophobicContact CB-CD1 4.48Å; F181-T185 HydrophobicContact CB-CG2 3.79Å; F181-T185 HydrophobicContact CD1-CG2 4.33Å; F181-T185 HydrophobicContact CD2-CG2 3.93Å; F181-T185 HydrophobicContact CG-CG2 3.78Å; F181-W186 HydrophobicContact CB-CB 4.13Å; F181-L189 HydrophobicContact CD2-CD1 3.77Å; F181-L189 HydrophobicContact CE2-CD1 3.65Å; F181-L292 HydrophobicContact CD2-CB 3.84Å; F181-L292 HydrophobicContact CD2-CD1 4.05Å; F181-L292 HydrophobicContact CD2-CD2 3.87Å; F181-L292 HydrophobicContact CD2-CG 4.1Å; F181-L292 HydrophobicContact CE2-CB 4.48Å; F181-L292 HydrophobicContact CE2-CD1 4.16Å; F181-L292 HydrophobicContact CE2-CD2 3.62Å; F181-L292 HydrophobicContact CE2-CG 4.27Å; F181-L292 HydrophobicContact CZ-CD2 4.47Å; F181-L292 PolarHBondContact N-O 3.45Å; F181-F367 HydrophobicContact CD1-CD1 4.29Å; F181-F367 AromaticContact CE1-CD1 3.63Å; F181-F367 HydrophobicContact CE1-CD1 3.63Å; F181-F367 HydrophobicContact CE1-CE1 4.39Å; F181-F367 HydrophobicContact CE2-CD1 4.41Å; F181-F367 HydrophobicContact CE2-CE1 4.41Å; F181-F367 AromaticContact CZ-CD1 3.72Å; F181-F367 HydrophobicContact CZ-CD1 3.72Å; F181-F367 HydrophobicContact CZ-CE1 4.09Å
182	L	96.1	Very high	96.2	Very high	120 Å²	120	46.1 Å²	46.1	63%	0.628	22%	0.219	S	C	*	.			trans	-66	158	170.9	-61.8	178.8	0	0	0	110.6	G184 T185 W186 T366	L182-G184 VanDerWaalsContact C-N 3.3Å; L182-G184 PolarHBondContact O-N 2.93Å; L182-T185 WeakPolarHBondContact O-CA 3.4Å; L182-T185 WeakPolarHBondContact O-CB 3.26Å; L182-T185 PolarHBondContact O-N 2.86Å; L182-W186 VanDerWaalsContact O-CD1 3.26Å; L182-W186 PolarHBondContact O-N 2.96Å; L182-T366 WeakPolarHBondContact CB-OG1 3.44Å; L182-T366 HydrophobicContact CD1-CG2 4.4Å; L182-T366 HydrophobicContact CG-CG2 3.93Å; L182-T366 PolarHBondContact N-OG1 2.85Å
183	R	95.9	Very high	96.3	Very high	114 Å²	114	45.5 Å²	45.5	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-49.8	-48.3	-176.7	-175	-178.1	-64.4	173.9	3.5	113.4	T185 W186 S187 I353	R183-T185 VanDerWaalsContact C-N 3.3Å; R183-T185 PolarHBondContact O-N 3.37Å; R183-W186 HydrophobicContact CG-CZ2 4.19Å; R183-S187 VanDerWaalsContact O-CB 3.28Å; R183-S187 WeakPolarHBondContact O-CB 3.39Å; R183-S187 PolarHBondContact O-N 3.49Å; R183-S187 VanDerWaalsContact O-N 3.09Å; R183-S187 PolarHBondContact O-OG 3.39Å; R183-I353 HydrophobicContact CG-CG2 3.5Å
184	G	95.8	Very high	96.3	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-68.4	-28.9	-179.4	0	0	0	0	0	113.4	L182 S187 R188 S357 D359	L182-G184 VanDerWaalsContact C-N 3.3Å; L182-G184 PolarHBondContact O-N 2.93Å; G184-S187 WeakPolarHBondContact CA-OG 3.46Å; G184-S187 PolarHBondContact O-OG 3.09Å; G184-R188 WeakPolarHBondContact O-CB 3.31Å; G184-R188 VanDerWaalsContact O-CG 3.26Å; G184-R188 WeakPolarHBondContact O-CG 3.32Å; G184-R188 PolarHBondContact O-N 3.47Å; G184-R188 PolarHBondContact O-NE 2.87Å; G184-S357 WeakPolarHBondContact CA-OG 3.41Å; G184-S357 PolarHBondContact N-OG 3.24Å; G184-D359 VanDerWaalsContact C-OD2 3.3Å; G184-D359 WeakPolarHBondContact CA-OD2 3.27Å
185	T	97.2	Very high	96.3	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-71.4	-55.6	174.8	-66.1	0	0	0	0	112.1	F181 L182 R183 S187 R188 L189 Y365 T366 F367	F181-T185 HydrophobicContact CB-CG2 3.79Å; F181-T185 HydrophobicContact CD1-CG2 4.33Å; F181-T185 HydrophobicContact CD2-CG2 3.93Å; F181-T185 HydrophobicContact CG-CG2 3.78Å; L182-T185 WeakPolarHBondContact O-CA 3.4Å; L182-T185 WeakPolarHBondContact O-CB 3.26Å; L182-T185 PolarHBondContact O-N 2.86Å; R183-T185 VanDerWaalsContact C-N 3.3Å; R183-T185 PolarHBondContact O-N 3.37Å; T185-S187 VanDerWaalsContact C-N 3.31Å; T185-S187 PolarHBondContact O-N 3.22Å; T185-R188 PolarHBondContact O-N 2.86Å; T185-L189 HydrophobicContact CG2-CD1 4.02Å; T185-L189 WeakPolarHBondContact O-CG 3.08Å; T185-L189 PolarHBondContact O-N 3.38Å; T185-Y365 HydrophobicContact CG2-CD1 3.75Å; T185-Y365 HydrophobicContact CG2-CG 4.37Å; T185-T366 VanDerWaalsContact CB-OG1 3.25Å; T185-T366 WeakPolarHBondContact CB-OG1 3.48Å; T185-T366 PolarHBondContact OG1-N 2.9Å; T185-T366 PolarHBondContact OG1-OG1 3.22Å; T185-F367 HydrophobicContact CG2-CD1 4.37Å; T185-F367 HydrophobicContact CG2-CE1 4.09Å
186	W	97.8	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.1	-29.9	-176	69.2	-111.1	0	0	0	112.6	F181 L182 R183 G190 L289 L292 N293 M321 P322 M325 L350 I353	F181-W186 HydrophobicContact CB-CB 4.13Å; L182-W186 VanDerWaalsContact O-CD1 3.26Å; L182-W186 PolarHBondContact O-N 2.96Å; R183-W186 HydrophobicContact CG-CZ2 4.19Å; W186-G190 PolarHBondContact O-N 3.39Å; W186-L289 HydrophobicContact CE3-CB 4.2Å; W186-L289 HydrophobicContact CE3-CD1 4.41Å; W186-L289 HydrophobicContact CE3-CD2 4.24Å; W186-L289 HydrophobicContact CZ3-CB 4.45Å; W186-L289 HydrophobicContact CZ3-CD1 4.33Å; W186-L292 HydrophobicContact CB-CB 3.91Å; W186-N293 HydrophobicContact CG-CB 4.47Å; W186-N293 PolarHBondContact NE1-OD1 2.94Å; W186-M321 HydrophobicContact CE3-CE 4.37Å; W186-M321 HydrophobicContact CH2-CE 3.45Å; W186-M321 VanDerWaalsContact CH2-CE 3.45Å; W186-M321 HydrophobicContact CZ2-CE 3.65Å; W186-M321 HydrophobicContact CZ3-CE 3.85Å; W186-P322 HydrophobicContact CH2-CG 4.36Å; W186-P322 HydrophobicContact CZ2-CG 4.17Å; W186-M325 HydrophobicContact CH2-SD 4.49Å; W186-L350 HydrophobicContact CZ3-CD2 4Å; W186-I353 HydrophobicContact CH2-CD1 3.91Å; W186-I353 HydrophobicContact CH2-CG2 3.7Å; W186-I353 HydrophobicContact CZ2-CG2 3.91Å; W186-I353 HydrophobicContact CZ3-CG2 4.39Å
187	S	97.1	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-43.1	176.2	55.9	0	0	0	0	112.1	R183 G184 T185 G190 I191	R183-S187 VanDerWaalsContact O-CB 3.28Å; R183-S187 WeakPolarHBondContact O-CB 3.39Å; R183-S187 PolarHBondContact O-N 3.49Å; R183-S187 VanDerWaalsContact O-N 3.09Å; R183-S187 PolarHBondContact O-OG 3.39Å; G184-S187 WeakPolarHBondContact CA-OG 3.46Å; G184-S187 PolarHBondContact O-OG 3.09Å; T185-S187 VanDerWaalsContact C-N 3.31Å; T185-S187 PolarHBondContact O-N 3.22Å; S187-G190 PolarHBondContact O-N 3.45Å; S187-I191 WeakPolarHBondContact O-CG1 3.24Å; S187-I191 PolarHBondContact O-N 3.19Å
188	R	96	Very high	96.9	Very high	9 Å²	9	30.5 Å²	30.5	3%	0.034	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-45.2	173.7	-75.9	-177.3	-70.5	142.1	-13.2	112.5	G184 T185 G190 I191 Q192 Q354 D359 T360 S363 K364 Y365	G184-R188 WeakPolarHBondContact O-CB 3.31Å; G184-R188 VanDerWaalsContact O-CG 3.26Å; G184-R188 WeakPolarHBondContact O-CG 3.32Å; G184-R188 PolarHBondContact O-N 3.47Å; G184-R188 PolarHBondContact O-NE 2.87Å; T185-R188 PolarHBondContact O-N 2.86Å; R188-G190 VanDerWaalsContact C-N 3.28Å; R188-G190 PolarHBondContact O-N 2.88Å; R188-I191 PolarHBondContact O-N 2.92Å; R188-Q192 PolarHBondContact O-N 3Å; R188-Q354 HydrophobicContact CG-CG 3.94Å; R188-D359 IonicContact CZ-OD2 2.86Å; R188-D359 IonicContact NE-OD2 3.86Å; R188-D359 IonicContact NH2-OD2 2.69Å; R188-D359 PolarHBondContact NH2-OD2 2.82Å; R188-T360 VanDerWaalsContact CD-O 3.3Å; R188-T360 WeakPolarHBondContact CD-O 3.5Å; R188-S363 PolarHBondContact NH1-O 3.19Å; R188-S363 PolarHBondContact NH2-O 3.47Å; R188-K364 PolarHBondContact NH2-O 2.94Å; R188-Y365 HydrophobicContact CB-CE1 4Å
189	L	97.7	Very high	97	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.1	-42.1	171.9	-71	171	0	0	0	111	L169 F181 T185 I191 Q192 I193 M217 V229 L292 Y365 F367	L169-L189 HydrophobicContact CD1-CD1 4.11Å; L169-L189 HydrophobicContact CD2-CD1 3.88Å; L169-L189 HydrophobicContact CD2-CD2 4.13Å; F181-L189 HydrophobicContact CD2-CD1 3.77Å; F181-L189 HydrophobicContact CE2-CD1 3.65Å; T185-L189 HydrophobicContact CG2-CD1 4.02Å; T185-L189 WeakPolarHBondContact O-CG 3.08Å; T185-L189 PolarHBondContact O-N 3.38Å; L189-I191 VanDerWaalsContact C-N 3.33Å; L189-I191 PolarHBondContact O-N 3.32Å; L189-Q192 PolarHBondContact O-N 3.36Å; L189-I193 HydrophobicContact CB-CD1 4.43Å; L189-I193 WeakPolarHBondContact O-CD1 3.23Å; L189-I193 WeakPolarHBondContact O-CG1 3.15Å; L189-I193 PolarHBondContact O-N 2.87Å; L189-M217 HydrophobicContact CD2-SD 3.83Å; L189-V229 HydrophobicContact CD2-CB 4.18Å; L189-L292 HydrophobicContact CD1-CD1 4.34Å; L189-Y365 HydrophobicContact CD2-CE1 4.45Å; L189-Y365 HydrophobicContact CG-CE1 4.29Å; L189-F367 HydrophobicContact CD1-CE1 4.3Å
190	G	98	Very high	97	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.7	-40.3	176.5	0	0	0	0	0	113.6	W186 S187 R188 L194	W186-G190 PolarHBondContact O-N 3.39Å; S187-G190 PolarHBondContact O-N 3.45Å; R188-G190 VanDerWaalsContact C-N 3.28Å; R188-G190 PolarHBondContact O-N 2.88Å; G190-L194 WeakPolarHBondContact O-CB 3.37Å; G190-L194 PolarHBondContact O-N 2.89Å
191	I	97.3	Very high	96.9	Very high	7 Å²	7	15 Å²	15	4%	0.036	7%	0.07	C	C	.	.	H	α-helix	trans	-62.3	-47.4	175.3	-69.1	166.2	0	0	0	110.5	S187 R188 L189 L194 Y195 F347 L350 K351 W385 F393	S187-I191 WeakPolarHBondContact O-CG1 3.24Å; S187-I191 PolarHBondContact O-N 3.19Å; R188-I191 PolarHBondContact O-N 2.92Å; L189-I191 VanDerWaalsContact C-N 3.33Å; L189-I191 PolarHBondContact O-N 3.32Å; I191-L194 PolarHBondContact O-N 3.37Å; I191-Y195 PolarHBondContact O-N 3.11Å; I191-F347 HydrophobicContact CD1-CE2 4.42Å; I191-F347 HydrophobicContact CG1-CD2 4.3Å; I191-F347 HydrophobicContact CG1-CE2 4.46Å; I191-F347 HydrophobicContact CG2-CD2 3.95Å; I191-F347 HydrophobicContact CG2-CE2 3.86Å; I191-L350 HydrophobicContact CD1-CB 4.31Å; I191-L350 HydrophobicContact CG1-CB 3.7Å; I191-L350 HydrophobicContact CG1-CD1 4.32Å; I191-K351 HydrophobicContact CD1-CB 4.48Å; I191-K351 HydrophobicContact CD1-CD 4.09Å; I191-W385 WeakPolarHBondContact CG2-O 3.11Å; I191-F393 HydrophobicContact CG2-CZ 4.48Å
192	Q	97	Very high	96.7	Very high	7 Å²	7	15.6 Å²	15.6	3%	0.033	7%	0.073	C	C	.	.	H	α-helix	trans	-63.3	-44.2	178.5	-65.7	-167.1	34.6	0	0	112.3	H144 R188 L189 L194 Y195 A196 R227 V229 Y365	H144-Q192 PolarHBondContact CE1-OE1 3.43Å; R188-Q192 PolarHBondContact O-N 3Å; L189-Q192 PolarHBondContact O-N 3.36Å; Q192-L194 VanDerWaalsContact C-N 3.35Å; Q192-L194 PolarHBondContact O-N 3.46Å; Q192-Y195 WeakPolarHBondContact O-CB 3.07Å; Q192-Y195 PolarHBondContact O-N 3.37Å; Q192-A196 PolarHBondContact O-N 3.33Å; Q192-R227 PolarHBondContact NE2-O 3.37Å; Q192-V229 HydrophobicContact CB-CG1 3.47Å; Q192-V229 VanDerWaalsContact CB-CG1 3.47Å; Q192-V229 HydrophobicContact CG-CG1 4.44Å; Q192-Y365 PolarHBondContact NE2-OH 2.82Å
193	I	98.4	Very high	96.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.9	-40.1	178.5	-58.2	155.6	0	0	0	110.4	L169 L189 Y195 A196 L197 L215 V229 L285	L169-I193 HydrophobicContact CD1-CD1 4.27Å; L189-I193 HydrophobicContact CB-CD1 4.43Å; L189-I193 WeakPolarHBondContact O-CD1 3.23Å; L189-I193 WeakPolarHBondContact O-CG1 3.15Å; L189-I193 PolarHBondContact O-N 2.87Å; I193-Y195 VanDerWaalsContact C-N 3.29Å; I193-Y195 PolarHBondContact O-N 3.35Å; I193-A196 PolarHBondContact O-N 3.47Å; I193-L197 HydrophobicContact CG2-CD1 4.2Å; I193-L197 HydrophobicContact CG2-CG 4.37Å; I193-L197 WeakPolarHBondContact O-CB 3.21Å; I193-L197 WeakPolarHBondContact O-CG 3.44Å; I193-L197 PolarHBondContact O-N 3.34Å; I193-L215 HydrophobicContact CD1-CD1 3.65Å; I193-L215 HydrophobicContact CG1-CD1 4.16Å; I193-L215 HydrophobicContact CG1-CD2 4.1Å; I193-L215 HydrophobicContact CG2-CD1 4.49Å; I193-L215 HydrophobicContact CG2-CD2 4.16Å; I193-V229 HydrophobicContact CG1-CG1 3.82Å; I193-V229 HydrophobicContact CG1-CG2 4.34Å; I193-L285 HydrophobicContact CB-CD1 3.88Å; I193-L285 HydrophobicContact CD1-CD1 4.22Å; I193-L285 HydrophobicContact CG2-CD1 3.69Å
194	L	98.4	Very high	96.3	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-60.4	-40.8	175	-177	67.3	0	0	0	111.4	G190 I191 Q192 K198 L282 L285 Y343 M346 F347 L350 F393	G190-L194 WeakPolarHBondContact O-CB 3.37Å; G190-L194 PolarHBondContact O-N 2.89Å; I191-L194 PolarHBondContact O-N 3.37Å; Q192-L194 VanDerWaalsContact C-N 3.35Å; Q192-L194 PolarHBondContact O-N 3.46Å; L194-K198 WeakPolarHBondContact O-CB 3.3Å; L194-K198 PolarHBondContact O-N 3.2Å; L194-L282 HydrophobicContact CD1-CD2 3.62Å; L194-L285 HydrophobicContact CB-CD2 4Å; L194-L285 HydrophobicContact CD1-CD2 3.94Å; L194-Y343 HydrophobicContact CD1-CD1 3.84Å; L194-M346 HydrophobicContact CD1-CB 4.22Å; L194-M346 HydrophobicContact CD1-SD 4.07Å; L194-M346 HydrophobicContact CD2-CB 3.74Å; L194-F347 HydrophobicContact CD2-CB 4.03Å; L194-L350 HydrophobicContact CD2-CD1 4.19Å; L194-F393 HydrophobicContact CB-CE1 4.28Å; L194-F393 HydrophobicContact CD2-CD1 4.17Å; L194-F393 HydrophobicContact CD2-CE1 3.92Å; L194-F393 HydrophobicContact CG-CD1 4.23Å; L194-F393 HydrophobicContact CG-CE1 3.81Å
195	Y	97.3	Very high	96.2	Very high	15 Å²	15	8.4 Å²	8.4	6%	0.059	4%	0.039	C	C	.	.	H	α-helix	trans	-63.6	-49.2	175.6	179.3	-94.5	0	0	0	111.6	P143 H144 I191 Q192 I193 L197 K198 L199 E384 W385 F392 F393	P143-Y195 HydrophobicContact CG-CE1 4.02Å; H144-Y195 AromaticContact CD2-CD1 3.38Å; H144-Y195 WeakPolarHBondContact CD2-CD1 3.33Å; H144-Y195 AromaticContact CD2-CE1 3.8Å; H144-Y195 AromaticContact NE2-CD1 3.37Å; H144-Y195 WeakPolarHBondContact NE2-CD1 3.25Å; H144-Y195 AromaticContact NE2-CE1 3.88Å; I191-Y195 PolarHBondContact O-N 3.11Å; Q192-Y195 WeakPolarHBondContact O-CB 3.07Å; Q192-Y195 PolarHBondContact O-N 3.37Å; I193-Y195 VanDerWaalsContact C-N 3.29Å; I193-Y195 PolarHBondContact O-N 3.35Å; Y195-L197 VanDerWaalsContact C-N 3.32Å; Y195-L197 PolarHBondContact O-N 2.82Å; Y195-K198 PolarHBondContact O-N 2.88Å; Y195-L199 HydrophobicContact CD1-CD1 3.76Å; Y195-L199 HydrophobicContact CD1-CG 4.38Å; Y195-L199 HydrophobicContact CE1-CD1 3.18Å; Y195-L199 HydrophobicContact CE1-CG 4.02Å; Y195-L199 PolarHBondContact O-N 2.9Å; Y195-E384 HydrophobicContact CE2-CB 4.24Å; Y195-W385 HydrophobicContact CD1-CB 4.15Å; Y195-W385 HydrophobicContact CD1-CD2 4.3Å; Y195-W385 AromaticContact CD1-CE3 3.76Å; Y195-W385 HydrophobicContact CD1-CE3 3.76Å; Y195-W385 HydrophobicContact CD1-CZ3 4.44Å; Y195-W385 HydrophobicContact CD2-CB 3.51Å; Y195-W385 HydrophobicContact CD2-CE3 4.49Å; Y195-W385 HydrophobicContact CE1-CD2 4.36Å; Y195-W385 AromaticContact CE1-CE3 3.41Å; Y195-W385 HydrophobicContact CE1-CE3 3.41Å; Y195-W385 VanDerWaalsContact CE1-CE3 3.41Å; Y195-W385 AromaticContact CE1-CZ3 3.85Å; Y195-W385 HydrophobicContact CE1-CZ3 3.85Å; Y195-W385 HydrophobicContact CE2-CB 4.11Å; Y195-W385 HydrophobicContact CE2-CE3 4.22Å; Y195-W385 HydrophobicContact CG-CB 3.55Å; Y195-W385 HydrophobicContact CG-CE3 4.3Å; Y195-W385 HydrophobicContact CG-CG 4.34Å; Y195-W385 AromaticContact CZ-CE3 3.69Å; Y195-F392 AromaticContact CD2-CD1 3.36Å; Y195-F392 HydrophobicContact CD2-CD1 3.36Å; Y195-F392 AromaticContact CD2-CE1 3.06Å; Y195-F392 HydrophobicContact CD2-CE1 3.06Å; Y195-F392 HydrophobicContact CD2-CE2 4.41Å; Y195-F392 HydrophobicContact CD2-CG 4.16Å; Y195-F392 AromaticContact CD2-CZ 3.68Å; Y195-F392 HydrophobicContact CD2-CZ 3.68Å; Y195-F392 AromaticContact CE2-CD1 3.46Å; Y195-F392 HydrophobicContact CE2-CD1 3.46Å; Y195-F392 VanDerWaalsContact CE2-CD1 3.46Å; Y195-F392 AromaticContact CE2-CD2 3.9Å; Y195-F392 HydrophobicContact CE2-CD2 3.9Å; Y195-F392 AromaticContact CE2-CE1 3.2Å; Y195-F392 HydrophobicContact CE2-CE1 3.2Å; Y195-F392 AromaticContact CE2-CE2 3.69Å; Y195-F392 HydrophobicContact CE2-CE2 3.69Å; Y195-F392 AromaticContact CE2-CG 3.81Å; Y195-F392 HydrophobicContact CE2-CG 3.81Å; Y195-F392 AromaticContact CE2-CZ 3.34Å; Y195-F392 HydrophobicContact CE2-CZ 3.34Å; Y195-F392 HydrophobicContact CG-CE1 4.05Å; Y195-F393 HydrophobicContact CD2-CE1 4.48Å; Y195-F393 HydrophobicContact CD2-CZ 4.18Å
196	A	97.1	Very high	96.1	Very high	4 Å²	4	8.4 Å²	8.4	3%	0.033	4%	0.039	C	C	.	.	H	α-helix	trans	-56.2	-46.1	176.1	0	0	0	0	0	112	H144 Q192 I193 L199 M200 V231	H144-A196 HydrophobicContact CB-CB 3.47Å; H144-A196 VanDerWaalsContact CB-CB 3.47Å; Q192-A196 PolarHBondContact O-N 3.33Å; I193-A196 PolarHBondContact O-N 3.47Å; A196-L199 PolarHBondContact O-N 2.72Å; A196-M200 WeakPolarHBondContact O-CB 3.34Å; A196-M200 PolarHBondContact O-N 3.37Å; A196-V231 HydrophobicContact CB-CG2 3.86Å
197	L	98.2	Very high	96	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-64.3	-43.7	176.7	-74.4	179.8	0	0	0	112	I193 Y195 M200 H201 I210 D281 L282 L285	I193-L197 HydrophobicContact CG2-CD1 4.2Å; I193-L197 HydrophobicContact CG2-CG 4.37Å; I193-L197 WeakPolarHBondContact O-CB 3.21Å; I193-L197 WeakPolarHBondContact O-CG 3.44Å; I193-L197 PolarHBondContact O-N 3.34Å; Y195-L197 VanDerWaalsContact C-N 3.32Å; Y195-L197 PolarHBondContact O-N 2.82Å; L197-M200 PolarHBondContact O-N 2.92Å; L197-H201 VanDerWaalsContact O-CB 3.27Å; L197-H201 WeakPolarHBondContact O-CB 3.28Å; L197-H201 PolarHBondContact O-N 2.77Å; L197-H201 PolarHBondContact O-ND1 3.26Å; L197-I210 HydrophobicContact CD1-CG1 4.41Å; L197-I210 HydrophobicContact CD2-CD1 3.71Å; L197-I210 HydrophobicContact CD2-CG1 3.88Å; L197-D281 HydrophobicContact CD1-CB 4.29Å; L197-D281 HydrophobicContact CD2-CB 4.02Å; L197-L282 HydrophobicContact CD1-CD2 4.04Å; L197-L285 HydrophobicContact CD1-CB 4.14Å; L197-L285 HydrophobicContact CD1-CD2 4.29Å
198	K	96.9	Very high	96	Very high	1 Å²	1	10.5 Å²	10.5	0%	0.004	5%	0.047	C	C	.	.	H	α-helix	trans	-58.7	-50	176.8	177.5	171.2	176.9	-68.8	0	111.1	L194 Y195 M200 H201 E202 R340 Y343 F392 F393 I395	L194-K198 WeakPolarHBondContact O-CB 3.3Å; L194-K198 PolarHBondContact O-N 3.2Å; Y195-K198 PolarHBondContact O-N 2.88Å; K198-M200 VanDerWaalsContact C-N 3.34Å; K198-M200 PolarHBondContact O-N 2.73Å; K198-H201 WeakPolarHBondContact O-CB 3.14Å; K198-H201 PolarHBondContact O-N 3.48Å; K198-E202 WeakPolarHBondContact CE-OE1 3.48Å; K198-E202 HydrophobicContact CG-CG 4.47Å; K198-E202 IonicContact NZ-OE1 3.98Å; K198-E202 PolarHBondContact NZ-OE1 3.44Å; K198-E202 IonicContact NZ-OE2 2.9Å; K198-E202 PolarHBondContact NZ-OE2 2.99Å; K198-E202 WeakPolarHBondContact O-CG 3.22Å; K198-E202 PolarHBondContact O-N 2.93Å; K198-R340 VanDerWaalsContact CE-NH2 3.3Å; K198-Y343 HydrophobicContact CB-CD1 3.84Å; K198-Y343 HydrophobicContact CB-CE1 4.06Å; K198-Y343 HydrophobicContact CB-CG 4.27Å; K198-Y343 HydrophobicContact CD-CD1 4.5Å; K198-Y343 HydrophobicContact CD-CD2 4.36Å; K198-Y343 HydrophobicContact CD-CG 4.08Å; K198-Y343 HydrophobicContact CG-CD1 4.3Å; K198-Y343 HydrophobicContact CG-CD2 4.43Å; K198-Y343 HydrophobicContact CG-CG 4.25Å; K198-F392 HydrophobicContact CB-CE1 4.23Å; K198-F392 HydrophobicContact CD-CD1 4.04Å; K198-F392 HydrophobicContact CD-CE1 3.51Å; K198-F392 HydrophobicContact CD-CZ 4.07Å; K198-F392 WeakPolarHBondContact CE-O 3.44Å; K198-F392 HydrophobicContact CG-CE1 3.99Å; K198-F392 HydrophobicContact CG-CZ 4.24Å; K198-F392 PolarHBondContact NZ-O 3.31Å; K198-F393 HydrophobicContact CD-CB 4.46Å; K198-F393 HydrophobicContact CD-CD1 3.92Å; K198-I395 WeakPolarHBondContact CE-O 3.42Å; K198-I395 PolarHBondContact NZ-O 2.83Å
199	L	94.9	Very high	96	Very high	25 Å²	25	10.5 Å²	10.5	13%	0.131	5%	0.047	C	C	.	.	H	α-helix	trans	-56.5	-47.8	177.4	-76	175.5	0	0	0	111.9	L142 Y195 A196 H201 E202 K203 F392	L142-L199 HydrophobicContact CD1-CB 4.38Å; L142-L199 HydrophobicContact CD2-CD1 4.22Å; Y195-L199 HydrophobicContact CD1-CD1 3.76Å; Y195-L199 HydrophobicContact CD1-CG 4.38Å; Y195-L199 HydrophobicContact CE1-CD1 3.18Å; Y195-L199 HydrophobicContact CE1-CG 4.02Å; Y195-L199 PolarHBondContact O-N 2.9Å; A196-L199 PolarHBondContact O-N 2.72Å; L199-H201 VanDerWaalsContact C-N 3.34Å; L199-H201 PolarHBondContact O-N 3.4Å; L199-E202 PolarHBondContact O-N 3.38Å; L199-K203 WeakPolarHBondContact O-CG 3.46Å; L199-K203 PolarHBondContact O-N 3.49Å; L199-F392 HydrophobicContact CD2-CE2 3.94Å; L199-F392 HydrophobicContact CD2-CZ 3.63Å; L199-F392 HydrophobicContact CG-CZ 3.87Å
200	M	95.6	Very high	96	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.01	5%	0.047	C	C	.	.	H	α-helix	trans	-61.7	-43.5	178.9	-175.5	178.6	176.4	0	0	111.9	L136 A196 L197 K198 E202 K203 G204 F205 I206 H207 F234 T237	L136-M200 HydrophobicContact CD1-CE 4.44Å; L136-M200 HydrophobicContact CD1-CG 4.24Å; L136-M200 HydrophobicContact CD2-CB 4.4Å; L136-M200 HydrophobicContact CD2-CG 3.92Å; A196-M200 WeakPolarHBondContact O-CB 3.34Å; A196-M200 PolarHBondContact O-N 3.37Å; L197-M200 PolarHBondContact O-N 2.92Å; K198-M200 VanDerWaalsContact C-N 3.34Å; K198-M200 PolarHBondContact O-N 2.73Å; M200-E202 VanDerWaalsContact C-N 3.33Å; M200-E202 PolarHBondContact O-N 2.85Å; M200-K203 PolarHBondContact O-N 3.33Å; M200-G204 PolarHBondContact O-N 3.16Å; M200-F205 CarbonylContact C-O 3.56Å; M200-F205 HydrophobicContact CE-CB 3.74Å; M200-F205 HydrophobicContact CG-CB 3.89Å; M200-F205 PolarHBondContact O-N 3.48Å; M200-F205 VanDerWaalsContact O-O 3.1Å; M200-I206 VanDerWaalsContact CE-C 3.49Å; M200-H207 HydrophobicContact CE-CB 3.9Å; M200-H207 HydrophobicContact SD-CB 3.92Å; M200-F234 HydrophobicContact CE-CD1 4.29Å; M200-F234 HydrophobicContact CE-CE1 4.49Å; M200-F234 HydrophobicContact SD-CE1 4.49Å; M200-T237 HydrophobicContact CE-CG2 3.35Å; M200-T237 WeakPolarHBondContact CE-OG1 3.45Å
201	H	95.6	Very high	96	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-61.7	-40.8	175.5	-67.3	143.6	0	0	0	111.7	L197 K198 L199 K203 G204 F205 W240 R278 D281 Y343	L197-H201 VanDerWaalsContact O-CB 3.27Å; L197-H201 WeakPolarHBondContact O-CB 3.28Å; L197-H201 PolarHBondContact O-N 2.77Å; L197-H201 PolarHBondContact O-ND1 3.26Å; K198-H201 WeakPolarHBondContact O-CB 3.14Å; K198-H201 PolarHBondContact O-N 3.48Å; L199-H201 VanDerWaalsContact C-N 3.34Å; L199-H201 PolarHBondContact O-N 3.4Å; H201-K203 VanDerWaalsContact C-N 3.35Å; H201-G204 WeakPolarHBondContact O-CA 3.49Å; H201-G204 PolarHBondContact O-N 3.28Å; H201-F205 VanDerWaalsContact CA-O 3.31Å; H201-F205 WeakPolarHBondContact CA-O 3.4Å; H201-F205 PolarHBondContact CD2-O 2.88Å; H201-F205 VanDerWaalsContact CD2-O 3.24Å; H201-F205 PolarHBondContact N-O 2.83Å; H201-W240 VanDerWaalsContact O-CE2 3.26Å; H201-W240 WeakPolarHBondContact O-CZ2 3.44Å; H201-W240 PolarHBondContact O-NE1 3.44Å; H201-R278 HydrophobicContact CB-CG 3.99Å; H201-R278 PolarHBondContact CE1-O 3.38Å; H201-D281 IonicContact CD2-OD2 3.88Å; H201-D281 IonicContact NE2-OD2 2.67Å; H201-D281 PolarHBondContact NE2-OD2 2.92Å; H201-D281 VanDerWaalsContact NE2-OD2 3.11Å; H201-Y343 AromaticContact ND1-CE1 3.61Å; H201-Y343 AromaticContact ND1-CZ 3.58Å; H201-Y343 PolarHBondContact ND1-OH 3Å
202	E	92.1	Very high	96.1	Very high	17 Å²	17	11.4 Å²	11.4	8%	0.079	5%	0.051	C	C	.	.	H	α-helix	trans	-73	-27.6	179.2	-73	174.6	158.6	0	0	113.1	K198 L199 M200 G204 R340 V398	K198-E202 WeakPolarHBondContact CE-OE1 3.48Å; K198-E202 HydrophobicContact CG-CG 4.47Å; K198-E202 IonicContact NZ-OE1 3.98Å; K198-E202 PolarHBondContact NZ-OE1 3.44Å; K198-E202 IonicContact NZ-OE2 2.9Å; K198-E202 PolarHBondContact NZ-OE2 2.99Å; K198-E202 WeakPolarHBondContact O-CG 3.22Å; K198-E202 PolarHBondContact O-N 2.93Å; L199-E202 PolarHBondContact O-N 3.38Å; M200-E202 VanDerWaalsContact C-N 3.33Å; M200-E202 PolarHBondContact O-N 2.85Å; E202-G204 PolarHBondContact O-N 3.48Å; E202-R340 IonicContact OE1-NH2 3.89Å; E202-V398 HydrophobicContact CB-CG2 4.22Å; E202-V398 HydrophobicContact CG-CG2 4.27Å; E202-V398 VanDerWaalsContact O-CG2 3.31Å; E202-V398 WeakPolarHBondContact O-CG2 3.36Å
203	K	91.2	Very high	96.1	Very high	73 Å²	73	14.1 Å²	14.1	32%	0.317	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.5	165.3	-68	-75	-175.4	175.7	0	113.6	L136 Y138 L199 M200 H201 F205	L136-K203 HydrophobicContact CD2-CB 3.76Å; L136-K203 HydrophobicContact CD2-CG 4.22Å; Y138-K203 PolarHBondContact O-NZ 2.9Å; L199-K203 WeakPolarHBondContact O-CG 3.46Å; L199-K203 PolarHBondContact O-N 3.49Å; M200-K203 PolarHBondContact O-N 3.33Å; H201-K203 VanDerWaalsContact C-N 3.35Å; K203-F205 HydrophobicContact CB-CD2 4.28Å; K203-F205 WeakPolarHBondContact O-CD2 3.31Å; K203-F205 WeakPolarHBondContact O-CE2 3.38Å
204	G	91.8	Very high	96.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	15.9	175.3	0	0	0	0	0	114.9	M200 H201 E202 Q239 W240 A241	M200-G204 PolarHBondContact O-N 3.16Å; H201-G204 WeakPolarHBondContact O-CA 3.49Å; H201-G204 PolarHBondContact O-N 3.28Å; E202-G204 PolarHBondContact O-N 3.48Å; G204-Q239 CarbonylContact O-C 3.35Å; G204-Q239 VanDerWaalsContact O-CA 3.32Å; G204-Q239 WeakPolarHBondContact O-CA 3.32Å; G204-Q239 WeakPolarHBondContact O-CG 3.47Å; G204-W240 VanDerWaalsContact C-NE1 3.31Å; G204-W240 PolarHBondContact O-N 2.83Å; G204-A241 WeakPolarHBondContact CA-O 3.46Å; G204-A241 PolarHBondContact O-N 3.33Å
205	F	93.8	Very high	96.1	Very high	11 Å²	11	14.6 Å²	14.6	5%	0.048	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148	-179	-66.1	-85.1	0	0	0	113	V132 L135 L136 M200 H201 K203 T237 R238 Q239	V132-F205 HydrophobicContact CG2-CD1 4.42Å; V132-F205 HydrophobicContact CG2-CE1 4.2Å; L135-F205 HydrophobicContact CB-CE2 4.16Å; L135-F205 HydrophobicContact CB-CZ 4.15Å; L135-F205 HydrophobicContact CD1-CZ 3.81Å; L136-F205 HydrophobicContact CD2-CB 4.33Å; L136-F205 HydrophobicContact CD2-CD2 3.78Å; L136-F205 HydrophobicContact CD2-CG 4.33Å; L136-F205 HydrophobicContact CG-CD2 4.47Å; M200-F205 CarbonylContact C-O 3.56Å; M200-F205 HydrophobicContact CE-CB 3.74Å; M200-F205 HydrophobicContact CG-CB 3.89Å; M200-F205 PolarHBondContact O-N 3.48Å; M200-F205 VanDerWaalsContact O-O 3.1Å; H201-F205 VanDerWaalsContact CA-O 3.31Å; H201-F205 WeakPolarHBondContact CA-O 3.4Å; H201-F205 PolarHBondContact CD2-O 2.88Å; H201-F205 VanDerWaalsContact CD2-O 3.24Å; H201-F205 PolarHBondContact N-O 2.83Å; K203-F205 HydrophobicContact CB-CD2 4.28Å; K203-F205 WeakPolarHBondContact O-CD2 3.31Å; K203-F205 WeakPolarHBondContact O-CE2 3.38Å; F205-T237 HydrophobicContact CB-CG2 3.91Å; F205-T237 HydrophobicContact CD1-CG2 3.76Å; F205-T237 HydrophobicContact CG-CG2 4.21Å; F205-R238 CarbonylContact C-O 3.58Å; F205-R238 WeakPolarHBondContact CA-O 3.43Å; F205-Q239 HydrophobicContact CD1-CB 4.04Å; F205-Q239 HydrophobicContact CD1-CG 4.44Å; F205-Q239 HydrophobicContact CE1-CB 3.79Å; F205-Q239 HydrophobicContact CE1-CG 4.08Å; F205-Q239 HydrophobicContact CZ-CB 4.48Å; F205-Q239 HydrophobicContact CZ-CG 4.31Å
206	I	95.3	Very high	96.1	Very high	4 Å²	4	15.1 Å²	15.1	2%	0.021	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.1	168.1	52.4	170.6	0	0	0	108.8	M200 R208 T237 R238 W240 L276 R278 D281	M200-I206 VanDerWaalsContact CE-C 3.49Å; I206-R208 HydrophobicContact CB-CG 4.37Å; I206-R208 HydrophobicContact CD1-CG 3.78Å; I206-R208 HydrophobicContact CG1-CG 3.9Å; I206-T237 CarbonylContact O-C 3.49Å; I206-T237 VanDerWaalsContact O-CA 3.3Å; I206-T237 WeakPolarHBondContact O-CA 3.27Å; I206-T237 WeakPolarHBondContact O-CG2 3.32Å; I206-R238 HydrophobicContact CD1-CB 4.48Å; I206-R238 HydrophobicContact CG1-CB 4.09Å; I206-R238 VanDerWaalsContact CG1-O 3.29Å; I206-R238 WeakPolarHBondContact CG1-O 3.21Å; I206-R238 PolarHBondContact N-O 3.36Å; I206-R238 PolarHBondContact O-N 3.24Å; I206-W240 HydrophobicContact CG2-CB 4.31Å; I206-W240 HydrophobicContact CG2-CG 4.19Å; I206-L276 HydrophobicContact CD1-CB 4.21Å; I206-L276 VanDerWaalsContact CD1-O 3.26Å; I206-L276 WeakPolarHBondContact CD1-O 3.34Å; I206-R278 HydrophobicContact CG2-CG 4.09Å; I206-D281 VanDerWaalsContact CA-OD2 3.29Å; I206-D281 WeakPolarHBondContact CA-OD2 3.48Å; I206-D281 WeakPolarHBondContact CB-OD2 3.32Å
207	H	97.1	Very high	96.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.07	C	C	.	.			trans	-74.2	-49	-174.5	-166.4	-92.3	0	0	0	112.4	M200 D209 I210 V231 I232 D233 F234 L236 T237 D281	M200-H207 HydrophobicContact CE-CB 3.9Å; M200-H207 HydrophobicContact SD-CB 3.92Å; H207-D209 PolarHBondContact CE1-O 3.44Å; H207-D209 VanDerWaalsContact ND1-C 3.3Å; H207-D209 PolarHBondContact ND1-N 2.86Å; H207-D209 PolarHBondContact ND1-O 3.11Å; H207-D209 PolarHBondContact O-N 3.06Å; H207-I210 HydrophobicContact CB-CD1 3.73Å; H207-I210 HydrophobicContact CB-CG1 4Å; H207-V231 VanDerWaalsContact CD2-CG1 3.46Å; H207-V231 WeakPolarHBondContact CD2-CG1 3.41Å; H207-V231 WeakPolarHBondContact NE2-CG1 3.36Å; H207-I232 PolarHBondContact CE1-O 2.86Å; H207-I232 VanDerWaalsContact CE1-O 3.32Å; H207-I232 PolarHBondContact NE2-O 3.41Å; H207-D233 PolarHBondContact CE1-O 2.68Å; H207-D233 PolarHBondContact NE2-O 3.47Å; H207-F234 AromaticContact CD2-CD1 3.99Å; H207-L236 CarbonylContact O-C 3.49Å; H207-T237 WeakPolarHBondContact O-CA 3.47Å; H207-T237 PolarHBondContact O-N 3.5Å; H207-D281 PolarHBondContact N-OD2 2.77Å
208	R	95.6	Very high	96	Very high	43 Å²	43	15.4 Å²	15.4	16%	0.162	7%	0.072	C	C	.	.	S	Bend	trans	69	3	-178.8	-50.3	-170	-64.2	158.6	-2	116.6	I206 L236 L276 D281	I206-R208 HydrophobicContact CB-CG 4.37Å; I206-R208 HydrophobicContact CD1-CG 3.78Å; I206-R208 HydrophobicContact CG1-CG 3.9Å; R208-L236 PolarHBondContact NE-O 2.83Å; R208-L236 PolarHBondContact NH2-O 2.79Å; R208-L276 HydrophobicContact CB-CD1 4.28Å; R208-L276 HydrophobicContact CG-CD1 4.22Å; R208-D281 VanDerWaalsContact CA-OD1 3.31Å; R208-D281 WeakPolarHBondContact CA-OD1 3.33Å; R208-D281 PolarHBondContact N-OD1 3.11Å
209	D	96.6	Very high	95.8	Very high	9 Å²	9	15.8 Å²	15.8	5%	0.048	8%	0.075	C	C	.	.			trans	-145.7	48.2	176.9	-156.9	39.6	0	0	0	113.3	H207 K211 N214 L236 G261 S262	H207-D209 PolarHBondContact CE1-O 3.44Å; H207-D209 VanDerWaalsContact ND1-C 3.3Å; H207-D209 PolarHBondContact ND1-N 2.86Å; H207-D209 PolarHBondContact ND1-O 3.11Å; H207-D209 PolarHBondContact O-N 3.06Å; D209-K211 IonicContact OD1-NZ 2.59Å; D209-K211 IonicContact OD2-NZ 2.95Å; D209-K211 PolarHBondContact OD2-NZ 3.35Å; D209-N214 PolarHBondContact O-ND2 3.15Å; D209-N214 PolarHBondContact OD2-ND2 3.37Å; D209-L236 HydrophobicContact CB-CB 4.44Å; D209-L236 HydrophobicContact CB-CD1 3.93Å; D209-G261 WeakPolarHBondContact OD1-CA 3.08Å; D209-S262 PolarHBondContact OD1-N 3.13Å
210	I	98.5	Very high	95.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.106	C	C	.	.			trans	-75.7	124.2	174.6	-59	-63.8	0	0	0	109.4	L197 H207 L215 V231 F265 D281 S284	L197-I210 HydrophobicContact CD1-CG1 4.41Å; L197-I210 HydrophobicContact CD2-CD1 3.71Å; L197-I210 HydrophobicContact CD2-CG1 3.88Å; H207-I210 HydrophobicContact CB-CD1 3.73Å; H207-I210 HydrophobicContact CB-CG1 4Å; I210-L215 HydrophobicContact CG2-CD1 4.36Å; I210-V231 HydrophobicContact CD1-CG1 3.88Å; I210-F265 WeakPolarHBondContact O-CB 3.46Å; I210-D281 HydrophobicContact CG1-CB 4.44Å; I210-S284 WeakPolarHBondContact O-CB 3.31Å
211	K	98.1	Very high	95	Very high	26 Å²	26	25.3 Å²	25.3	11%	0.113	14%	0.139	C	C	.	.	S	Bend	trans	-165.4	160.1	-179.4	62.4	-169.3	-170.1	-144.4	0	109.8	D209 E213 N214 L215 S262 F265	D209-K211 IonicContact OD1-NZ 2.59Å; D209-K211 IonicContact OD2-NZ 2.95Å; D209-K211 PolarHBondContact OD2-NZ 3.35Å; K211-E213 WeakPolarHBondContact CB-OE2 3.32Å; K211-E213 HydrophobicContact CD-CB 4.47Å; K211-E213 WeakPolarHBondContact CD-OE2 3.03Å; K211-E213 HydrophobicContact CG-CB 4.24Å; K211-E213 VanDerWaalsContact CG-OE2 3.25Å; K211-E213 WeakPolarHBondContact CG-OE2 3.46Å; K211-E213 PolarHBondContact O-N 2.84Å; K211-E213 VanDerWaalsContact O-N 3.09Å; K211-N214 WeakPolarHBondContact CE-ND2 2.94Å; K211-N214 HydrophobicContact CG-CB 4.12Å; K211-N214 PolarHBondContact O-N 3.05Å; K211-L215 WeakPolarHBondContact O-CG 3.32Å; K211-S262 WeakPolarHBondContact CD-OG 3.09Å; K211-S262 PolarHBondContact NZ-OG 3.28Å; K211-F265 HydrophobicContact CB-CB 4.15Å; K211-F265 HydrophobicContact CB-CD1 4.38Å; K211-F265 HydrophobicContact CB-CD2 3.38Å; K211-F265 HydrophobicContact CB-CE2 3.8Å; K211-F265 HydrophobicContact CB-CG 3.72Å; K211-F265 HydrophobicContact CB-CZ 4.46Å; K211-F265 HydrophobicContact CD-CD2 4.39Å
212	P	98.4	Very high	94.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-52	-32.4	179.7	-28.7	36.2	0	0	0	115.1	L169 R170 N214 L215 F265 T288 L292	L169-P212 HydrophobicContact CB-CB 4.22Å; L169-P212 PolarHBondContact N-O 3.06Å; L169-P212 VanDerWaalsContact N-O 3.12Å; R170-P212 HydrophobicContact CB-CB 3.83Å; R170-P212 PolarHBondContact N-O 3.41Å; P212-N214 VanDerWaalsContact C-N 3.35Å; P212-N214 PolarHBondContact O-N 3.38Å; P212-L215 PolarHBondContact O-N 3.32Å; P212-F265 VanDerWaalsContact CD-CE1 3.48Å; P212-F265 HydrophobicContact CG-CE1 4.05Å; P212-F265 HydrophobicContact CG-CZ 3.95Å; P212-T288 HydrophobicContact CG-CG2 4.06Å; P212-L292 HydrophobicContact CB-CD2 4.33Å; P212-L292 HydrophobicContact CG-CD2 4.19Å
213	E	97.1	Very high	94.4	Very high	63 Å²	63	31.8 Å²	31.8	29%	0.294	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-70.1	-27.9	179	-59.1	90.7	155.1	0	0	113.8	N168 R170 K211 L216	N168-E213 WeakPolarHBondContact CB-O 2.76Å; R170-E213 HydrophobicContact CB-CG 4.12Å; R170-E213 VanDerWaalsContact CD-CG 3.48Å; R170-E213 WeakPolarHBondContact CD-OE1 3.17Å; R170-E213 HydrophobicContact CG-CG 4.47Å; R170-E213 IonicContact NE-OE1 2.88Å; K211-E213 WeakPolarHBondContact CB-OE2 3.32Å; K211-E213 HydrophobicContact CD-CB 4.47Å; K211-E213 WeakPolarHBondContact CD-OE2 3.03Å; K211-E213 HydrophobicContact CG-CB 4.24Å; K211-E213 VanDerWaalsContact CG-OE2 3.25Å; K211-E213 WeakPolarHBondContact CG-OE2 3.46Å; K211-E213 PolarHBondContact O-N 2.84Å; K211-E213 VanDerWaalsContact O-N 3.09Å; E213-L216 WeakPolarHBondContact O-CD1 3.21Å
214	N	97.9	Very high	94.1	Very high	11 Å²	11	34.9 Å²	34.9	6%	0.059	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-98.7	13.3	-179.5	-71.5	-8.1	0	0	0	112.4	D209 K211 P212 I232	D209-N214 PolarHBondContact O-ND2 3.15Å; D209-N214 PolarHBondContact OD2-ND2 3.37Å; K211-N214 WeakPolarHBondContact CE-ND2 2.94Å; K211-N214 HydrophobicContact CG-CB 4.12Å; K211-N214 PolarHBondContact O-N 3.05Å; P212-N214 VanDerWaalsContact C-N 3.35Å; P212-N214 PolarHBondContact O-N 3.38Å; N214-I232 HydrophobicContact CB-CG1 4.21Å; N214-I232 PolarHBondContact O-N 3.13Å
215	L	98.7	Very high	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	106.7	179.4	-65.9	171.4	0	0	0	107.9	N168 L169 I193 I210 K211 P212 V229 H230 V231 T288	N168-L215 CarbonylContact C-O 3.59Å; N168-L215 VanDerWaalsContact CA-O 3.24Å; N168-L215 WeakPolarHBondContact CA-O 3.27Å; L169-L215 HydrophobicContact CB-CB 4.49Å; L169-L215 HydrophobicContact CD1-CB 3.73Å; L169-L215 HydrophobicContact CD1-CD1 4.03Å; L169-L215 HydrophobicContact CG-CB 3.88Å; L169-L215 WeakPolarHBondContact CG-O 3.43Å; L169-L215 PolarHBondContact N-O 2.91Å; I193-L215 HydrophobicContact CD1-CD1 3.65Å; I193-L215 HydrophobicContact CG1-CD1 4.16Å; I193-L215 HydrophobicContact CG1-CD2 4.1Å; I193-L215 HydrophobicContact CG2-CD1 4.49Å; I193-L215 HydrophobicContact CG2-CD2 4.16Å; I210-L215 HydrophobicContact CG2-CD1 4.36Å; K211-L215 WeakPolarHBondContact O-CG 3.32Å; P212-L215 PolarHBondContact O-N 3.32Å; L215-V229 HydrophobicContact CB-CG2 3.92Å; L215-V229 HydrophobicContact CD2-CG2 4.34Å; L215-H230 WeakPolarHBondContact CA-O 3.27Å; L215-V231 HydrophobicContact CD2-CG2 3.92Å; L215-T288 HydrophobicContact CD1-CG2 3.79Å
216	L	98.3	Very high	94	Very high	25 Å²	25	39.3 Å²	39.3	13%	0.131	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.1	-174.1	-80.1	64.8	0	0	0	110.8	L165 G166 E167 N168 E213 V229 H230 I232	L165-L216 HydrophobicContact CB-CB 4.06Å; L165-L216 HydrophobicContact CB-CD2 3.91Å; L165-L216 HydrophobicContact CD1-CB 4.02Å; L165-L216 HydrophobicContact CD1-CD2 4.28Å; G166-L216 WeakPolarHBondContact O-CD2 3.41Å; E167-L216 WeakPolarHBondContact O-CA 3.4Å; N168-L216 HydrophobicContact CB-CD1 3.57Å; N168-L216 HydrophobicContact CB-CG 3.87Å; E213-L216 WeakPolarHBondContact O-CD1 3.21Å; L216-V229 CarbonylContact O-C 3.48Å; L216-V229 WeakPolarHBondContact O-CA 3.2Å; L216-H230 PolarHBondContact N-O 2.87Å; L216-H230 PolarHBondContact O-N 2.91Å; L216-I232 HydrophobicContact CD1-CD1 3.4Å; L216-I232 VanDerWaalsContact CD1-CD1 3.4Å; L216-I232 HydrophobicContact CD1-CG1 3.78Å; L216-I232 HydrophobicContact CD1-CG2 4.38Å; L216-I232 HydrophobicContact CD2-CD1 4.01Å; L216-I232 HydrophobicContact CG-CD1 4.36Å
217	M	97.6	Very high	93.8	Very high	7 Å²	7	40 Å²	40	3%	0.034	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	157	167.3	-61	-55.3	-62.3	0	0	109.9	G166 E167 L169 L172 L189 S226 R227 V229 Y365 F367	G166-M217 WeakPolarHBondContact CA-O 3.34Å; G166-M217 PolarHBondContact N-O 2.95Å; E167-M217 PolarHBondContact O-N 3.29Å; L169-M217 HydrophobicContact CD2-CG 4.21Å; L169-M217 HydrophobicContact CD2-SD 3.94Å; L172-M217 HydrophobicContact CD1-CB 4.43Å; L172-M217 HydrophobicContact CD1-CG 3.54Å; L189-M217 HydrophobicContact CD2-SD 3.83Å; M217-S226 WeakPolarHBondContact CE-O 3.04Å; M217-R227 VanDerWaalsContact CE-C 3.42Å; M217-V229 HydrophobicContact SD-CB 4.08Å; M217-V229 HydrophobicContact SD-CG2 4.48Å; M217-Y365 HydrophobicContact CE-CE2 4.06Å; M217-F367 HydrophobicContact CE-CZ 4.23Å; M217-F367 HydrophobicContact CG-CE2 4.33Å; M217-F367 HydrophobicContact CG-CZ 4.1Å; M217-F367 HydrophobicContact SD-CZ 4.15Å
218	G	95.4	Very high	93.7	Very high	4 Å²	4	40.5 Å²	40.5	4%	0.041	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	156.8	165.7	0	0	0	0	0	111.4	R225 I228	G218-R225 VanDerWaalsContact CA-O 3.26Å; G218-R225 WeakPolarHBondContact CA-O 3.26Å; G218-R225 PolarHBondContact N-O 2.9Å; G218-I228 PolarHBondContact N-O 3.05Å
219	A	92.7	Very high	93.8	Very high	10 Å²	10	38.5 Å²	38.5	8%	0.083	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-60.1	144.9	178.3	0	0	0	0	0	110.6	D221 D222 S226	A219-D221 VanDerWaalsContact CB-OD1 3.22Å; A219-D221 WeakPolarHBondContact CB-OD1 3.48Å; A219-D221 PolarHBondContact O-N 2.81Å; A219-D222 HydrophobicContact CB-CB 4.32Å; A219-D222 WeakPolarHBondContact O-CA 3.47Å; A219-D222 WeakPolarHBondContact O-CB 3.39Å; A219-D222 PolarHBondContact O-N 3.21Å; A219-S226 WeakPolarHBondContact O-CB 3.37Å
220	A	87.4	Confident	93.9	Very high	93 Å²	93	38.1 Å²	38.1	77%	0.769	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.1	-173.5	0	0	0	0	0	113.1	D222	A220-D222 VanDerWaalsContact C-N 3.35Å
221	D	85.8	Confident	93.9	Very high	134 Å²	134	38.2 Å²	38.2	72%	0.717	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.2	175.5	61.7	-26.9	0	0	0	113.4	A219 R223	A219-D221 VanDerWaalsContact CB-OD1 3.22Å; A219-D221 WeakPolarHBondContact CB-OD1 3.48Å; A219-D221 PolarHBondContact O-N 2.81Å; D221-R223 PolarHBondContact O-N 2.6Å
222	D	89.1	Confident	93.8	Very high	34 Å²	34	38.5 Å²	38.5	18%	0.182	20%	0.196	C	C	.	.			trans	-85.9	85.9	169.8	-170.7	-20.7	0	0	0	109.7	A219 A220 K224 R225 S226	A219-D222 HydrophobicContact CB-CB 4.32Å; A219-D222 WeakPolarHBondContact O-CA 3.47Å; A219-D222 WeakPolarHBondContact O-CB 3.39Å; A219-D222 PolarHBondContact O-N 3.21Å; A220-D222 VanDerWaalsContact C-N 3.35Å; D222-K224 PolarHBondContact O-N 2.84Å; D222-K224 VanDerWaalsContact O-N 3.13Å; D222-K224 PolarHBondContact OD1-N 3.24Å; D222-R225 HydrophobicContact CB-CB 4.31Å; D222-R225 PolarHBondContact O-N 3.39Å; D222-R225 PolarHBondContact OD1-N 2.84Å; D222-R225 IonicContact OD1-NH1 2.99Å; D222-R225 VanDerWaalsContact OD2-CD 3.25Å; D222-R225 WeakPolarHBondContact OD2-CD 3.48Å; D222-R225 WeakPolarHBondContact OD2-CG 3.43Å; D222-R225 IonicContact OD2-CZ 3.12Å; D222-R225 IonicContact OD2-NE 2.85Å; D222-R225 IonicContact OD2-NH1 2.7Å; D222-R225 PolarHBondContact OD2-NH1 3.44Å; D222-S226 VanDerWaalsContact O-CB 3.3Å; D222-S226 WeakPolarHBondContact O-CB 3.47Å; D222-S226 PolarHBondContact O-N 3.35Å; D222-S226 PolarHBondContact O-OG 3.04Å
223	R	85.4	Confident	93.5	Very high	119 Å²	119	40.9 Å²	40.9	45%	0.449	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-35.8	-179.4	-65.2	-174.3	175.9	-149.1	-11.9	113.1	D221 S226 D376 E379 R380	D221-R223 PolarHBondContact O-N 2.6Å; R223-S226 PolarHBondContact O-OG 3.23Å; R223-D376 IonicContact CZ-OD1 3.67Å; R223-D376 IonicContact NE-OD1 2.72Å; R223-D376 IonicContact NH1-OD1 2.7Å; R223-D376 PolarHBondContact NH1-OD1 3.39Å; R223-D376 IonicContact NH2-OD1 3.65Å; R223-D376 PolarHBondContact NH2-OD1 3.44Å; R223-E379 WeakPolarHBondContact CD-OE2 3.33Å; R223-E379 IonicContact CZ-OE2 3.5Å; R223-E379 IonicContact NE-OE2 3.31Å; R223-E379 IonicContact NH1-OE1 3.75Å; R223-E379 IonicContact NH1-OE2 2.75Å; R223-E379 PolarHBondContact NH1-OE2 3.47Å; R223-R380 WeakPolarHBondContact O-CG 3.3Å; R223-R380 PolarHBondContact O-NH1 3.08Å
224	K	86.4	Confident	93.3	Very high	138 Å²	138	37.9 Å²	37.9	60%	0.6	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-33.6	-179	-65.1	-176.2	177.5	-175.9	0	112.7	D222	D222-K224 PolarHBondContact O-N 2.84Å; D222-K224 VanDerWaalsContact O-N 3.13Å; D222-K224 PolarHBondContact OD1-N 3.24Å
225	R	91.1	Very high	92.9	Very high	87 Å²	87	38 Å²	38	33%	0.328	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-14.1	-171.8	-62.9	-172.5	-174	85.3	0.9	115	G218 D222 R227 I228	G218-R225 VanDerWaalsContact CA-O 3.26Å; G218-R225 WeakPolarHBondContact CA-O 3.26Å; G218-R225 PolarHBondContact N-O 2.9Å; D222-R225 HydrophobicContact CB-CB 4.31Å; D222-R225 PolarHBondContact O-N 3.39Å; D222-R225 PolarHBondContact OD1-N 2.84Å; D222-R225 IonicContact OD1-NH1 2.99Å; D222-R225 VanDerWaalsContact OD2-CD 3.25Å; D222-R225 WeakPolarHBondContact OD2-CD 3.48Å; D222-R225 WeakPolarHBondContact OD2-CG 3.43Å; D222-R225 IonicContact OD2-CZ 3.12Å; D222-R225 IonicContact OD2-NE 2.85Å; D222-R225 IonicContact OD2-NH1 2.7Å; D222-R225 PolarHBondContact OD2-NH1 3.44Å; R225-R227 PolarHBondContact O-N 3.49Å; R225-I228 WeakPolarHBondContact O-CA 3.35Å; R225-I228 WeakPolarHBondContact O-CB 3.49Å; R225-I228 PolarHBondContact O-N 2.98Å
226	S	91.4	Very high	92.4	Very high	17 Å²	17	39.6 Å²	39.6	12%	0.119	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.4	-172.3	32	0	0	0	0	114.7	M217 A219 D222 R223 R380	M217-S226 WeakPolarHBondContact CE-O 3.04Å; A219-S226 WeakPolarHBondContact O-CB 3.37Å; D222-S226 VanDerWaalsContact O-CB 3.3Å; D222-S226 WeakPolarHBondContact O-CB 3.47Å; D222-S226 PolarHBondContact O-N 3.35Å; D222-S226 PolarHBondContact O-OG 3.04Å; R223-S226 PolarHBondContact O-OG 3.23Å; S226-R380 PolarHBondContact OG-NH1 3.23Å; S226-R380 PolarHBondContact OG-NH2 2.88Å
227	R	92.2	Very high	92.2	Very high	20 Å²	20	38.5 Å²	38.5	8%	0.075	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	10.4	174.5	-76	-174.6	65.3	-170.9	7.9	114.9	Q192 M217 R225 P361 T362 S363 Y365 E368 L372 R380	Q192-R227 PolarHBondContact NE2-O 3.37Å; M217-R227 VanDerWaalsContact CE-C 3.42Å; R225-R227 PolarHBondContact O-N 3.49Å; R227-P361 PolarHBondContact NH2-O 3.07Å; R227-T362 PolarHBondContact NH1-O 2.85Å; R227-T362 PolarHBondContact NH2-O 2.92Å; R227-S363 PolarHBondContact NH2-O 3.4Å; R227-Y365 HydrophobicContact CB-CE2 4.12Å; R227-Y365 HydrophobicContact CG-CD2 4.36Å; R227-Y365 HydrophobicContact CG-CE2 4.01Å; R227-E368 WeakPolarHBondContact CD-OE1 3.4Å; R227-E368 WeakPolarHBondContact CG-OE1 3.46Å; R227-E368 IonicContact NE-OE1 3.61Å; R227-L372 HydrophobicContact CG-CD1 4.5Å; R227-R380 VanDerWaalsContact CG-NH1 3.34Å
228	I	94.5	Very high	91.8	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.046	21%	0.211	C	C	.	.			trans	-103.7	125.4	176.5	-60.3	-178	0	0	0	109	H144 G218 R225 H230 F381 W385	H144-I228 WeakPolarHBondContact ND1-CG2 3.45Å; G218-I228 PolarHBondContact N-O 3.05Å; R225-I228 WeakPolarHBondContact O-CA 3.35Å; R225-I228 WeakPolarHBondContact O-CB 3.49Å; R225-I228 PolarHBondContact O-N 2.98Å; I228-H230 PolarHBondContact O-CE1 2.69Å; I228-H230 VanDerWaalsContact O-CE1 3.3Å; I228-H230 PolarHBondContact O-ND1 3.46Å; I228-F381 HydrophobicContact CD1-CB 3.99Å; I228-F381 HydrophobicContact CD1-CD1 4.17Å; I228-F381 HydrophobicContact CD1-CG 4.42Å; I228-W385 HydrophobicContact CD1-CH2 4.34Å; I228-W385 HydrophobicContact CD1-CZ2 4.24Å; I228-W385 HydrophobicContact CG1-CZ2 4.44Å
229	V	97.1	Very high	91.5	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136	170.3	68.1	0	0	0	0	110.1	H144 L169 L189 Q192 I193 L215 L216 M217	H144-V229 WeakPolarHBondContact CB-O 3.43Å; H144-V229 PolarHBondContact ND1-O 2.93Å; L169-V229 HydrophobicContact CD1-CG2 4.15Å; L169-V229 HydrophobicContact CG-CG2 4.42Å; L189-V229 HydrophobicContact CD2-CB 4.18Å; Q192-V229 HydrophobicContact CB-CG1 3.47Å; Q192-V229 VanDerWaalsContact CB-CG1 3.47Å; Q192-V229 HydrophobicContact CG-CG1 4.44Å; I193-V229 HydrophobicContact CG1-CG1 3.82Å; I193-V229 HydrophobicContact CG1-CG2 4.34Å; L215-V229 HydrophobicContact CB-CG2 3.92Å; L215-V229 HydrophobicContact CD2-CG2 4.34Å; L216-V229 CarbonylContact O-C 3.48Å; L216-V229 WeakPolarHBondContact O-CA 3.2Å; M217-V229 HydrophobicContact SD-CB 4.08Å; M217-V229 HydrophobicContact SD-CG2 4.48Å
230	H	97.9	Very high	91.4	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138	-178.9	-62.5	70.1	0	0	0	109.7	P143 H144 L165 L215 L216 I228	P143-H230 PolarHBondContact O-CD2 2.83Å; P143-H230 PolarHBondContact O-NE2 2.87Å; H144-H230 CarbonylContact O-C 3.5Å; H144-H230 VanDerWaalsContact O-CA 3.27Å; H144-H230 WeakPolarHBondContact O-CA 3.5Å; L165-H230 HydrophobicContact CD1-CB 3.67Å; L165-H230 HydrophobicContact CD2-CB 4.14Å; L215-H230 WeakPolarHBondContact CA-O 3.27Å; L216-H230 PolarHBondContact N-O 2.87Å; L216-H230 PolarHBondContact O-N 2.91Å; I228-H230 PolarHBondContact O-CE1 2.69Å; I228-H230 VanDerWaalsContact O-CE1 3.3Å; I228-H230 PolarHBondContact O-ND1 3.46Å
231	V	98.3	Very high	91.4	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	129.1	173.1	-174.2	0	0	0	0	108.5	H144 I145 P146 A196 H207 I210 L215 F234	H144-V231 PolarHBondContact O-N 3.08Å; I145-V231 HydrophobicContact CD1-CB 4.21Å; P146-V231 WeakPolarHBondContact CD-O 3.29Å; A196-V231 HydrophobicContact CB-CG2 3.86Å; H207-V231 VanDerWaalsContact CD2-CG1 3.46Å; H207-V231 WeakPolarHBondContact CD2-CG1 3.41Å; H207-V231 WeakPolarHBondContact NE2-CG1 3.36Å; I210-V231 HydrophobicContact CD1-CG1 3.88Å; L215-V231 HydrophobicContact CD2-CG2 3.92Å; V231-F234 VanDerWaalsContact O-CZ 3.26Å; V231-F234 WeakPolarHBondContact O-CZ 3.3Å
232	I	96.1	Very high	91.3	Very high	31 Å²	31	33.7 Å²	33.7	16%	0.159	15%	0.151	C	C	.	.			trans	-124.4	174.8	178.3	71.5	161.3	0	0	0	111.7	P146 L165 H207 N214 L216	P146-I232 HydrophobicContact CG-CG2 4.09Å; L165-I232 HydrophobicContact CD1-CG2 3.64Å; H207-I232 PolarHBondContact CE1-O 2.86Å; H207-I232 VanDerWaalsContact CE1-O 3.32Å; H207-I232 PolarHBondContact NE2-O 3.41Å; N214-I232 HydrophobicContact CB-CG1 4.21Å; N214-I232 PolarHBondContact O-N 3.13Å; L216-I232 HydrophobicContact CD1-CD1 3.4Å; L216-I232 VanDerWaalsContact CD1-CD1 3.4Å; L216-I232 HydrophobicContact CD1-CG1 3.78Å; L216-I232 HydrophobicContact CD1-CG2 4.38Å; L216-I232 HydrophobicContact CD2-CD1 4.01Å; L216-I232 HydrophobicContact CG-CD1 4.36Å
233	D	92.8	Very high	91	Very high	50 Å²	50	35.3 Å²	35.3	27%	0.267	17%	0.165	S	C	.	.			trans	64.6	74	177.7	-165.7	2.5	0	0	0	114	H207 G235	H207-D233 PolarHBondContact CE1-O 2.68Å; H207-D233 PolarHBondContact NE2-O 3.47Å; D233-G235 PolarHBondContact O-N 3.1Å; D233-G235 PolarHBondContact OD1-N 3.1Å
234	F	93	Very high	90.8	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-83.8	8.5	178.7	-54.4	-87.1	0	0	0	113.3	E129 V132 M133 L136 I145 M200 H207 V231 L236 T237	E129-F234 HydrophobicContact CG-CB 3.98Å; V132-F234 HydrophobicContact CB-CB 4.12Å; V132-F234 HydrophobicContact CG1-CB 3.8Å; V132-F234 HydrophobicContact CG1-CD1 3.82Å; V132-F234 HydrophobicContact CG1-CG 3.99Å; M133-F234 HydrophobicContact CG-CD2 3.33Å; M133-F234 HydrophobicContact CG-CE2 3.68Å; M133-F234 HydrophobicContact CG-CG 4.1Å; M133-F234 HydrophobicContact SD-CD2 4.01Å; M133-F234 HydrophobicContact SD-CE2 4.34Å; L136-F234 HydrophobicContact CD1-CD1 3.99Å; L136-F234 HydrophobicContact CD1-CE1 3.68Å; L136-F234 HydrophobicContact CD1-CZ 4.41Å; I145-F234 HydrophobicContact CD1-CE1 3.93Å; I145-F234 HydrophobicContact CD1-CZ 3.67Å; I145-F234 HydrophobicContact CG2-CE2 4.23Å; I145-F234 HydrophobicContact CG2-CZ 3.79Å; M200-F234 HydrophobicContact CE-CD1 4.29Å; M200-F234 HydrophobicContact CE-CE1 4.49Å; M200-F234 HydrophobicContact SD-CE1 4.49Å; H207-F234 AromaticContact CD2-CD1 3.99Å; V231-F234 VanDerWaalsContact O-CZ 3.26Å; V231-F234 WeakPolarHBondContact O-CZ 3.3Å; F234-L236 PolarHBondContact O-N 2.96Å; F234-L236 VanDerWaalsContact O-N 3.16Å; F234-T237 WeakPolarHBondContact CD1-OG1 3.14Å; F234-T237 VanDerWaalsContact O-CB 3.28Å; F234-T237 WeakPolarHBondContact O-CB 3.29Å; F234-T237 PolarHBondContact O-N 3.47Å
235	G	88.9	Confident	90.5	Very high	13 Å²	13	34.4 Å²	34.4	13%	0.134	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-59.7	-29.1	-178.7	0	0	0	0	0	113.3	D233	D233-G235 PolarHBondContact O-N 3.1Å; D233-G235 PolarHBondContact OD1-N 3.1Å
236	L	89.9	Confident	89.9	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.178	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-97	-1.9	174.8	-64.4	-176.3	0	0	0	113.9	H207 R208 D209 F234 R260	H207-L236 CarbonylContact O-C 3.49Å; R208-L236 PolarHBondContact NE-O 2.83Å; R208-L236 PolarHBondContact NH2-O 2.79Å; D209-L236 HydrophobicContact CB-CB 4.44Å; D209-L236 HydrophobicContact CB-CD1 3.93Å; F234-L236 PolarHBondContact O-N 2.96Å; F234-L236 VanDerWaalsContact O-N 3.16Å; L236-R260 HydrophobicContact CD1-CB 4.34Å; L236-R260 HydrophobicContact CD2-CB 4.06Å; L236-R260 HydrophobicContact CD2-CG 4.43Å
237	T	93.1	Very high	89.4	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	20%	0.204	C	C	.	.			trans	-60.6	146.9	-178.3	-72.3	0	0	0	0	111.8	H128 V132 M200 F205 I206 H207 F234	H128-T237 PolarHBondContact CE1-O 2.84Å; H128-T237 PolarHBondContact NE2-O 3.25Å; V132-T237 HydrophobicContact CB-CG2 4.36Å; V132-T237 HydrophobicContact CG1-CG2 3.5Å; V132-T237 VanDerWaalsContact CG1-CG2 3.5Å; V132-T237 HydrophobicContact CG2-CG2 3.91Å; M200-T237 HydrophobicContact CE-CG2 3.35Å; M200-T237 WeakPolarHBondContact CE-OG1 3.45Å; F205-T237 HydrophobicContact CB-CG2 3.91Å; F205-T237 HydrophobicContact CD1-CG2 3.76Å; F205-T237 HydrophobicContact CG-CG2 4.21Å; I206-T237 CarbonylContact O-C 3.49Å; I206-T237 VanDerWaalsContact O-CA 3.3Å; I206-T237 WeakPolarHBondContact O-CA 3.27Å; I206-T237 WeakPolarHBondContact O-CG2 3.32Å; H207-T237 WeakPolarHBondContact O-CA 3.47Å; H207-T237 PolarHBondContact O-N 3.5Å; F234-T237 WeakPolarHBondContact CD1-OG1 3.14Å; F234-T237 VanDerWaalsContact O-CB 3.28Å; F234-T237 WeakPolarHBondContact O-CB 3.29Å; F234-T237 PolarHBondContact O-N 3.47Å
238	R	89.8	Confident	89	Confident	66 Å²	66	42.8 Å²	42.8	25%	0.249	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.1	176.2	-167.2	62	-180	-179.4	2.8	112.5	F205 I206 W240 W413	F205-R238 CarbonylContact C-O 3.58Å; F205-R238 WeakPolarHBondContact CA-O 3.43Å; I206-R238 HydrophobicContact CD1-CB 4.48Å; I206-R238 HydrophobicContact CG1-CB 4.09Å; I206-R238 VanDerWaalsContact CG1-O 3.29Å; I206-R238 WeakPolarHBondContact CG1-O 3.21Å; I206-R238 PolarHBondContact N-O 3.36Å; I206-R238 PolarHBondContact O-N 3.24Å; R238-W240 PolarHBondContact O-N 3.29Å; R238-W413 VanDerWaalsContact NH2-CH2 3.31Å
239	Q	89.1	Confident	88.5	Confident	30 Å²	30	45 Å²	45	14%	0.14	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	122.6	168.8	-163.3	176	31.6	0	0	110.5	G204 F205 A241 R251	G204-Q239 CarbonylContact O-C 3.35Å; G204-Q239 VanDerWaalsContact O-CA 3.32Å; G204-Q239 WeakPolarHBondContact O-CA 3.32Å; G204-Q239 WeakPolarHBondContact O-CG 3.47Å; F205-Q239 HydrophobicContact CD1-CB 4.04Å; F205-Q239 HydrophobicContact CD1-CG 4.44Å; F205-Q239 HydrophobicContact CE1-CB 3.79Å; F205-Q239 HydrophobicContact CE1-CG 4.08Å; F205-Q239 HydrophobicContact CZ-CB 4.48Å; F205-Q239 HydrophobicContact CZ-CG 4.31Å; Q239-A241 WeakPolarHBondContact CG-O 3.32Å; Q239-A241 PolarHBondContact NE2-O 3.29Å; Q239-R251 VanDerWaalsContact O-CD 3.29Å; Q239-R251 WeakPolarHBondContact O-CD 3.44Å
240	W	88.9	Confident	87.8	Confident	13 Å²	13	44.9 Å²	44.9	5%	0.049	22%	0.219	C	C	.	.			trans	-102.7	-27.5	175.2	78	-91.5	0	0	0	112.2	H201 G204 I206 R238 R251 R278 V398 I400	H201-W240 VanDerWaalsContact O-CE2 3.26Å; H201-W240 WeakPolarHBondContact O-CZ2 3.44Å; H201-W240 PolarHBondContact O-NE1 3.44Å; G204-W240 VanDerWaalsContact C-NE1 3.31Å; G204-W240 PolarHBondContact O-N 2.83Å; I206-W240 HydrophobicContact CG2-CB 4.31Å; I206-W240 HydrophobicContact CG2-CG 4.19Å; R238-W240 PolarHBondContact O-N 3.29Å; W240-R251 VanDerWaalsContact O-CB 3.32Å; W240-R251 WeakPolarHBondContact O-CB 3.39Å; W240-R251 PolarHBondContact O-N 3.36Å; W240-R278 HydrophobicContact CD2-CG 4.25Å; W240-R278 VanDerWaalsContact CH2-NH1 3.29Å; W240-R278 HydrophobicContact CZ2-CG 4.32Å; W240-V398 HydrophobicContact CH2-CB 4.27Å; W240-V398 HydrophobicContact CH2-CG1 3.41Å; W240-V398 VanDerWaalsContact CH2-CG1 3.41Å; W240-V398 HydrophobicContact CZ2-CB 4.44Å; W240-V398 HydrophobicContact CZ2-CG1 3.83Å; W240-V398 HydrophobicContact CZ2-CG2 4.39Å; W240-V398 HydrophobicContact CZ3-CG1 4.38Å; W240-I400 HydrophobicContact CH2-CB 4.18Å; W240-I400 HydrophobicContact CH2-CD1 4.33Å; W240-I400 HydrophobicContact CZ3-CB 4.01Å; W240-I400 HydrophobicContact CZ3-CD1 4.08Å; W240-I400 HydrophobicContact CZ3-CG2 3.95Å
241	A	88.1	Confident	86.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	158.5	174.7	0	0	0	0	0	111.5	G204 Q239 Y249 V398 I400	G204-A241 WeakPolarHBondContact CA-O 3.46Å; G204-A241 PolarHBondContact O-N 3.33Å; Q239-A241 WeakPolarHBondContact CG-O 3.32Å; Q239-A241 PolarHBondContact NE2-O 3.29Å; A241-Y249 CarbonylContact C-O 3.56Å; A241-Y249 WeakPolarHBondContact CA-O 3.16Å; A241-Y249 WeakPolarHBondContact CB-O 3.3Å; A241-V398 HydrophobicContact CB-CG1 4.42Å; A241-I400 HydrophobicContact CB-CD1 3.81Å
242	W	84.5	Confident	85.9	Confident	39 Å²	39	47.7 Å²	47.7	15%	0.148	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.8	173.1	75	98	0	0	0	110.5	F248 Y249 W413	W242-F248 CarbonylContact O-C 3.58Å; W242-F248 VanDerWaalsContact O-CA 3.31Å; W242-F248 WeakPolarHBondContact O-CA 3.37Å; W242-Y249 VanDerWaalsContact CZ2-CB 3.48Å; W242-Y249 HydrophobicContact CZ2-CG 4.14Å; W242-Y249 WeakPolarHBondContact CZ3-O 3.46Å; W242-Y249 PolarHBondContact N-O 3.42Å; W242-Y249 PolarHBondContact O-N 2.89Å; W242-W413 AromaticContact CE3-CD1 3.96Å; W242-W413 HydrophobicContact CH2-CB 4.45Å; W242-W413 AromaticContact CZ3-CD1 3.93Å
243	S	82	Confident	84.6	Confident	68 Å²	68	50.3 Å²	50.3	48%	0.476	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.3	174.5	-174.4	0	0	0	0	110.4	A247	S243-A247 CarbonylContact C-O 3.59Å; S243-A247 WeakPolarHBondContact CA-O 3.41Å
244	K	80.8	Confident	83.4	Confident	76 Å²	76	54.9 Å²	54.9	33%	0.33	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.9	170.1	176.3	177.7	173.5	179	0	107.6	K246 A247 Y249 E412	K244-K246 VanDerWaalsContact C-N 3.27Å; K244-K246 PolarHBondContact O-N 2.95Å; K244-A247 PolarHBondContact N-O 3.35Å; K244-A247 PolarHBondContact O-N 3.27Å; K244-Y249 HydrophobicContact CB-CD2 4.15Å; K244-Y249 HydrophobicContact CB-CE2 3.89Å; K244-E412 IonicContact NZ-OE2 2.63Å; K244-E412 PolarHBondContact NZ-OE2 2.72Å
245	E	80	Confident	82.2	Confident	162 Å²	162	61.2 Å²	61.2	76%	0.757	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.6	179.4	-64.9	164.5	-153.3	0	0	113.5	A247	E245-A247 PolarHBondContact O-N 2.68Å; E245-A247 VanDerWaalsContact O-N 3.14Å
246	K	78.4	Confident	81.5	Confident	209 Å²	209	69.2 Å²	69.2	91%	0.909	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	8.4	-176.8	-53.4	178.8	178.1	178.8	0	115.2	K244	K244-K246 VanDerWaalsContact C-N 3.27Å; K244-K246 PolarHBondContact O-N 2.95Å
247	A	81.5	Confident	81	Confident	38 Å²	38	69.8 Å²	69.8	31%	0.314	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	142.8	172.1	0	0	0	0	0	110.7	S243 K244 E245 Y249	S243-A247 CarbonylContact C-O 3.59Å; S243-A247 WeakPolarHBondContact CA-O 3.41Å; K244-A247 PolarHBondContact N-O 3.35Å; K244-A247 PolarHBondContact O-N 3.27Å; E245-A247 PolarHBondContact O-N 2.68Å; E245-A247 VanDerWaalsContact O-N 3.14Å; A247-Y249 HydrophobicContact CB-CE2 3.97Å; A247-Y249 WeakPolarHBondContact O-CE2 3.22Å
248	F	84.5	Confident	80.6	Confident	53 Å²	53	77.2 Å²	77.2	23%	0.232	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	142	174.6	-77.7	-94.1	0	0	0	111.8	W242 V398 I400	W242-F248 CarbonylContact O-C 3.58Å; W242-F248 VanDerWaalsContact O-CA 3.31Å; W242-F248 WeakPolarHBondContact O-CA 3.37Å; F248-V398 HydrophobicContact CB-CG1 3.73Å; F248-V398 HydrophobicContact CD1-CB 4.49Å; F248-V398 HydrophobicContact CD1-CG1 3.87Å; F248-V398 HydrophobicContact CD1-CG2 4.2Å; F248-V398 HydrophobicContact CD2-CB 4.43Å; F248-V398 HydrophobicContact CD2-CG1 4.35Å; F248-V398 HydrophobicContact CD2-CG2 4.47Å; F248-V398 HydrophobicContact CE1-CG2 4.06Å; F248-V398 HydrophobicContact CE2-CG2 4.34Å; F248-V398 HydrophobicContact CG-CB 4.3Å; F248-V398 HydrophobicContact CG-CG1 3.75Å; F248-V398 HydrophobicContact CG-CG2 4.4Å; F248-V398 HydrophobicContact CZ-CG2 4.12Å; F248-I400 HydrophobicContact CB-CD1 3.77Å; F248-I400 HydrophobicContact CB-CG1 4.28Å
249	Y	83.2	Confident	80.4	Confident	54 Å²	54	76.8 Å²	76.8	21%	0.212	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.1	178.3	-60.6	-82.5	0	0	0	110.6	A241 W242 K244 A247 L409	A241-Y249 CarbonylContact C-O 3.56Å; A241-Y249 WeakPolarHBondContact CA-O 3.16Å; A241-Y249 WeakPolarHBondContact CB-O 3.3Å; W242-Y249 VanDerWaalsContact CZ2-CB 3.48Å; W242-Y249 HydrophobicContact CZ2-CG 4.14Å; W242-Y249 WeakPolarHBondContact CZ3-O 3.46Å; W242-Y249 PolarHBondContact N-O 3.42Å; W242-Y249 PolarHBondContact O-N 2.89Å; K244-Y249 HydrophobicContact CB-CD2 4.15Å; K244-Y249 HydrophobicContact CB-CE2 3.89Å; A247-Y249 HydrophobicContact CB-CE2 3.97Å; A247-Y249 WeakPolarHBondContact O-CE2 3.22Å; Y249-L409 HydrophobicContact CE1-CD1 4.11Å
250	A	83	Confident	80.2	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	139.4	179.8	0	0	0	0	0	111	L338 I400	A250-L338 HydrophobicContact CB-CD2 4.38Å; A250-I400 HydrophobicContact CB-CD1 4.05Å; A250-I400 HydrophobicContact CB-CG2 3.8Å
251	R	79.8	Confident	80.1	Confident	17 Å²	17	80.8 Å²	80.8	6%	0.064	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-66.7	130.4	171.7	-169.8	169.2	-171.8	-116.4	-10.1	110.4	Q239 W240 L253 K275 W413	Q239-R251 VanDerWaalsContact O-CD 3.29Å; Q239-R251 WeakPolarHBondContact O-CD 3.44Å; W240-R251 VanDerWaalsContact O-CB 3.32Å; W240-R251 WeakPolarHBondContact O-CB 3.39Å; W240-R251 PolarHBondContact O-N 3.36Å; R251-L253 PolarHBondContact O-N 3.48Å; R251-K275 PolarHBondContact O-NZ 2.87Å; R251-W413 VanDerWaalsContact NE-CZ2 3.26Å
252	P	75.9	Confident	80.3	Confident	46 Å²	46	82.3 Å²	82.3	30%	0.299	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-52.3	139.7	-179.8	-27.4	33.1	0	0	0	113.2	K275 A410	P252-K275 PolarHBondContact O-NZ 3.02Å; P252-A410 HydrophobicContact CG-CB 3.51Å
253	L	68.9	Low	80.8	Confident	86 Å²	86	83 Å²	83	45%	0.45	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-70.1	137.9	176.3	-61.3	178.3	0	0	0	109.9	R251 K275 L338	R251-L253 PolarHBondContact O-N 3.48Å; L253-K275 HydrophobicContact CB-CD 4.5Å; L253-K275 HydrophobicContact CD2-CD 3.81Å; L253-L338 HydrophobicContact CD1-CD1 3.91Å; L253-L338 HydrophobicContact CD1-CG 4.18Å; L253-L338 HydrophobicContact CD2-CD1 4.31Å; L253-L338 HydrophobicContact CD2-CD2 3.97Å; L253-L338 HydrophobicContact CD2-CG 4.04Å; L253-L338 HydrophobicContact CG-CD1 4.1Å; L253-L338 HydrophobicContact CG-CG 4.35Å
254	R	68.9	Low	81.4	Confident	147 Å²	147	81.3 Å²	81.3	56%	0.555	39%	0.394	S	S	*	.			trans	-106	148.8	173.3	-68.1	-176.1	178.5	178.7	-5.6	108.4	V257	R254-V257 HydrophobicContact CB-CG1 4.48Å
255	T	66.2	Low	82.2	Confident	133 Å²	133	78.1 Å²	78.1	82%	0.816	38%	0.38	S	S	*	.	S	Bend	trans	-76	-36.5	-176.7	44.2	0	0	0	0	113.6
256	K	75.6	Confident	82.9	Confident	182 Å²	182	70.6 Å²	70.6	79%	0.791	35%	0.345	S	S	*	.			trans	-136.5	143	174.4	-71	-171.2	177	-177.4	0	111.9	G273	K256-G273 CarbonylContact C-O 3.53Å; K256-G273 WeakPolarHBondContact CA-O 3.17Å
257	V	79.3	Confident	83.6	Confident	46 Å²	46	60.7 Å²	60.7	28%	0.279	30%	0.302	S	S	.	.			trans	-134.2	147	171.8	-64.3	0	0	0	0	110.1	R254 G273 Y274	R254-V257 HydrophobicContact CB-CG1 4.48Å; V257-G273 WeakPolarHBondContact CG2-O 3.28Å; V257-G273 PolarHBondContact N-O 2.81Å; V257-G273 WeakPolarHBondContact O-CA 3.42Å; V257-Y274 WeakPolarHBondContact CG2-O 3.46Å
258	Q	83.6	Confident	84.1	Confident	157 Å²	157	59.1 Å²	59.1	73%	0.734	29%	0.289	S	S	*	.			trans	-66.2	139.5	171.9	-170.4	-178.4	23.2	0	0	109.8	R260	Q258-R260 PolarHBondContact O-N 3.48Å
259	F	86.7	Confident	84.3	Confident	56 Å²	56	57.9 Å²	57.9	25%	0.246	29%	0.285	C	S	.	.			trans	-57.9	135.1	173.7	179.6	-92.2	0	0	0	111.3	G261 L263 T266 A270 H271 H304	F259-G261 WeakPolarHBondContact CE1-O 3.3Å; F259-G261 WeakPolarHBondContact CZ-O 3.49Å; F259-L263 HydrophobicContact CE1-CD2 4.01Å; F259-L263 HydrophobicContact CE2-CD2 4.4Å; F259-L263 HydrophobicContact CZ-CD2 3.7Å; F259-L263 HydrophobicContact CZ-CG 4.38Å; F259-T266 HydrophobicContact CE2-CG2 3.62Å; F259-T266 HydrophobicContact CZ-CG2 3.88Å; F259-A270 HydrophobicContact CD2-CB 4.24Å; F259-A270 WeakPolarHBondContact CD2-O 3.15Å; F259-A270 HydrophobicContact CE2-CB 4.11Å; F259-H271 AromaticContact CE2-ND1 3.91Å; F259-H304 AromaticContact CD1-CE1 3.73Å; F259-H304 AromaticContact CD2-CE1 3.59Å; F259-H304 AromaticContact CD2-ND1 3.79Å; F259-H304 AromaticContact CE1-CE1 3.92Å; F259-H304 AromaticContact CE2-CE1 3.76Å; F259-H304 AromaticContact CE2-ND1 3.98Å; F259-H304 AromaticContact CG-CE1 3.58Å; F259-H304 AromaticContact CZ-CE1 3.94Å
260	R	84.3	Confident	84.7	Confident	108 Å²	108	55.5 Å²	55.5	41%	0.408	28%	0.277	S	S	.	.			trans	-145.5	154.4	169	-61.1	-169.3	-178.6	-162	-4	108.6	L236 Q258	L236-R260 HydrophobicContact CD1-CB 4.34Å; L236-R260 HydrophobicContact CD2-CB 4.06Å; L236-R260 HydrophobicContact CD2-CG 4.43Å; Q258-R260 PolarHBondContact O-N 3.48Å
261	G	87.7	Confident	85.1	Confident	20 Å²	20	56.1 Å²	56.1	21%	0.206	28%	0.279	C	S	.	.	S	Bend	trans	102	175.4	178.7	0	0	0	0	0	113.6	D209 F259	D209-G261 WeakPolarHBondContact OD1-CA 3.08Å; F259-G261 WeakPolarHBondContact CE1-O 3.3Å; F259-G261 WeakPolarHBondContact CZ-O 3.49Å
262	S	92.3	Very high	85.3	Confident	31 Å²	31	58.2 Å²	58.2	22%	0.217	29%	0.292	C	S	.	.			trans	-77.4	125.2	-176.3	-78.9	0	0	0	0	113.5	D209 K211 N264 F265 T266	D209-S262 PolarHBondContact OD1-N 3.13Å; K211-S262 WeakPolarHBondContact CD-OG 3.09Å; K211-S262 PolarHBondContact NZ-OG 3.28Å; S262-N264 VanDerWaalsContact C-N 3.27Å; S262-N264 PolarHBondContact O-N 2.81Å; S262-N264 VanDerWaalsContact O-N 3.15Å; S262-F265 PolarHBondContact O-N 3.44Å; S262-F265 VanDerWaalsContact O-N 3.1Å; S262-T266 WeakPolarHBondContact O-CB 3.49Å; S262-T266 WeakPolarHBondContact O-CG2 3.38Å; S262-T266 PolarHBondContact O-N 3.18Å
263	L	94.1	Very high	85.8	Confident	54 Å²	54	56.8 Å²	56.8	28%	0.283	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-41.5	-177.7	-74	173.1	0	0	0	113.6	F259 H271 L307 K311	F259-L263 HydrophobicContact CE1-CD2 4.01Å; F259-L263 HydrophobicContact CE2-CD2 4.4Å; F259-L263 HydrophobicContact CZ-CD2 3.7Å; F259-L263 HydrophobicContact CZ-CG 4.38Å; L263-H271 PolarHBondContact O-NE2 2.99Å; L263-L307 HydrophobicContact CB-CD1 4.2Å; L263-L307 HydrophobicContact CD2-CD1 4.09Å; L263-K311 PolarHBondContact O-NZ 2.97Å
264	N	95.1	Very high	86.5	Confident	33 Å²	33	58.7 Å²	58.7	18%	0.176	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-33.4	-176.2	-71.2	-24.9	0	0	0	113.1	S262 L296 W298 H299 K311	S262-N264 VanDerWaalsContact C-N 3.27Å; S262-N264 PolarHBondContact O-N 2.81Å; S262-N264 VanDerWaalsContact O-N 3.15Å; N264-L296 HydrophobicContact CB-CD1 3.98Å; N264-W298 PolarHBondContact O-NE1 2.94Å; N264-H299 PolarHBondContact ND2-ND1 3.29Å; N264-K311 WeakPolarHBondContact O-CE 3.27Å; N264-K311 PolarHBondContact O-NZ 2.76Å
265	F	96.7	Very high	87.1	Confident	9 Å²	9	53.3 Å²	53.3	4%	0.039	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-16	-166.6	-57.7	-76.6	0	0	0	114	I210 K211 P212 S262 S284 F287 D291 L296	I210-F265 WeakPolarHBondContact O-CB 3.46Å; K211-F265 HydrophobicContact CB-CB 4.15Å; K211-F265 HydrophobicContact CB-CD1 4.38Å; K211-F265 HydrophobicContact CB-CD2 3.38Å; K211-F265 HydrophobicContact CB-CE2 3.8Å; K211-F265 HydrophobicContact CB-CG 3.72Å; K211-F265 HydrophobicContact CB-CZ 4.46Å; K211-F265 HydrophobicContact CD-CD2 4.39Å; P212-F265 VanDerWaalsContact CD-CE1 3.48Å; P212-F265 HydrophobicContact CG-CE1 4.05Å; P212-F265 HydrophobicContact CG-CZ 3.95Å; S262-F265 PolarHBondContact O-N 3.44Å; S262-F265 VanDerWaalsContact O-N 3.1Å; F265-S284 WeakPolarHBondContact O-CA 3.39Å; F265-S284 VanDerWaalsContact O-CB 3.23Å; F265-S284 WeakPolarHBondContact O-CB 3.31Å; F265-S284 PolarHBondContact O-OG 3.49Å; F265-F287 HydrophobicContact CD1-CB 4.27Å; F265-F287 WeakPolarHBondContact O-CD2 3.49Å; F265-D291 HydrophobicContact CE1-CB 3.88Å; F265-D291 HydrophobicContact CZ-CB 4.46Å; F265-L296 HydrophobicContact CD1-CD1 3.99Å; F265-L296 HydrophobicContact CE1-CD1 3.73Å; F265-L296 HydrophobicContact CZ-CD1 4.3Å
266	T	94.9	Very high	88.2	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.025	23%	0.233	C	C	.	.	S	Bend	trans	-71.4	158.6	179	-161.8	0	0	0	0	112.5	F259 S262 A270 H271 F287 K311	F259-T266 HydrophobicContact CE2-CG2 3.62Å; F259-T266 HydrophobicContact CZ-CG2 3.88Å; S262-T266 WeakPolarHBondContact O-CB 3.49Å; S262-T266 WeakPolarHBondContact O-CG2 3.38Å; S262-T266 PolarHBondContact O-N 3.18Å; T266-A270 HydrophobicContact CG2-CB 3.91Å; T266-A270 WeakPolarHBondContact OG1-CB 3.31Å; T266-H271 WeakPolarHBondContact CG2-NE2 3.39Å; T266-F287 WeakPolarHBondContact O-CE2 3.46Å; T266-K311 WeakPolarHBondContact O-CE 3.37Å; T266-K311 PolarHBondContact O-NZ 3.02Å
267	S	93.8	Very high	88.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.			trans	-73	165.1	180	75	0	0	0	0	112.7	N269 A270 H271 D280	S267-N269 PolarHBondContact O-N 3.4Å; S267-N269 WeakPolarHBondContact OG-CB 3.34Å; S267-N269 PolarHBondContact OG-N 3.42Å; S267-A270 WeakPolarHBondContact O-CB 3.1Å; S267-A270 PolarHBondContact O-N 2.65Å; S267-A270 VanDerWaalsContact O-N 3.12Å; S267-A270 PolarHBondContact OG-N 3.12Å; S267-H271 PolarHBondContact O-CD2 2.84Å; S267-H271 VanDerWaalsContact O-CD2 3.31Å; S267-D280 VanDerWaalsContact CB-OD1 3.27Å; S267-D280 WeakPolarHBondContact CB-OD1 3.26Å; S267-D280 PolarHBondContact OG-OD1 3.36Å
268	S	91.3	Very high	89.6	Confident	5 Å²	5	37.6 Å²	37.6	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-29.7	171.1	-57.2	0	0	0	0	112.6	A270 H271 L272 A308 K311	S268-A270 VanDerWaalsContact C-N 3.28Å; S268-A270 PolarHBondContact O-N 2.82Å; S268-H271 PolarHBondContact O-N 2.7Å; S268-L272 VanDerWaalsContact O-CG 3.29Å; S268-L272 WeakPolarHBondContact O-CG 3.43Å; S268-L272 PolarHBondContact O-N 2.87Å; S268-L272 VanDerWaalsContact O-N 3.1Å; S268-A308 PolarHBondContact OG-O 3.38Å; S268-K311 VanDerWaalsContact OG-CB 3.23Å; S268-K311 WeakPolarHBondContact OG-CB 3.31Å
269	N	89.9	Confident	90.1	Very high	27 Å²	27	31.3 Å²	31.3	14%	0.144	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-37.3	176.6	-64.8	-33	0	0	0	111.9	S267 L272 G273 Y274 L276 K279 D280	S267-N269 PolarHBondContact O-N 3.4Å; S267-N269 WeakPolarHBondContact OG-CB 3.34Å; S267-N269 PolarHBondContact OG-N 3.42Å; N269-L272 PolarHBondContact O-N 2.94Å; N269-G273 PolarHBondContact O-N 3.31Å; N269-Y274 HydrophobicContact CB-CD2 4.32Å; N269-Y274 PolarHBondContact O-N 2.86Å; N269-L276 HydrophobicContact CB-CD2 3.99Å; N269-K279 WeakPolarHBondContact ND2-CE 3.43Å; N269-D280 WeakPolarHBondContact CB-OD1 3.29Å; N269-D280 PolarHBondContact ND2-OD1 3.31Å
270	A	91.4	Very high	90.5	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-46.1	177.4	0	0	0	0	0	111.4	F259 T266 S267 S268 L272 G273 L276	F259-A270 HydrophobicContact CD2-CB 4.24Å; F259-A270 WeakPolarHBondContact CD2-O 3.15Å; F259-A270 HydrophobicContact CE2-CB 4.11Å; T266-A270 HydrophobicContact CG2-CB 3.91Å; T266-A270 WeakPolarHBondContact OG1-CB 3.31Å; S267-A270 WeakPolarHBondContact O-CB 3.1Å; S267-A270 PolarHBondContact O-N 2.65Å; S267-A270 VanDerWaalsContact O-N 3.12Å; S267-A270 PolarHBondContact OG-N 3.12Å; S268-A270 VanDerWaalsContact C-N 3.28Å; S268-A270 PolarHBondContact O-N 2.82Å; A270-L272 PolarHBondContact O-N 2.84Å; A270-G273 PolarHBondContact O-N 2.84Å; A270-L276 HydrophobicContact CB-CD1 4.04Å; A270-L276 HydrophobicContact CB-CD2 3.8Å; A270-L276 HydrophobicContact CB-CG 4.49Å
271	H	89.9	Confident	91.2	Very high	12 Å²	12	23.7 Å²	23.7	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-35.1	176.8	-68.3	-71.1	0	0	0	112.8	F259 L263 T266 S267 S268 G273 H304 L307 A308 K311	F259-H271 AromaticContact CE2-ND1 3.91Å; L263-H271 PolarHBondContact O-NE2 2.99Å; T266-H271 WeakPolarHBondContact CG2-NE2 3.39Å; S267-H271 PolarHBondContact O-CD2 2.84Å; S267-H271 VanDerWaalsContact O-CD2 3.31Å; S268-H271 PolarHBondContact O-N 2.7Å; H271-G273 VanDerWaalsContact C-N 3.26Å; H271-G273 PolarHBondContact O-N 3.12Å; H271-H304 HydrophobicContact CB-CB 4.2Å; H271-H304 WeakPolarHBondContact CB-O 3.22Å; H271-H304 AromaticContact CG-ND1 3.97Å; H271-H304 AromaticContact ND1-CE1 3.92Å; H271-H304 AromaticContact ND1-CG 3.72Å; H271-H304 AromaticContact ND1-ND1 3.11Å; H271-H304 PolarHBondContact ND1-ND1 2.97Å; H271-H304 VanDerWaalsContact ND1-ND1 3.11Å; H271-L307 VanDerWaalsContact CE1-CD1 3.4Å; H271-L307 WeakPolarHBondContact CE1-CD1 3.39Å; H271-A308 HydrophobicContact CB-CB 3.95Å; H271-K311 PolarHBondContact NE2-NZ 3.41Å
272	L	85.9	Confident	91.7	Very high	62 Å²	62	22.7 Å²	22.7	33%	0.325	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-0.1	178.6	-62.7	170.8	0	0	0	113.3	S268 N269 A270 Y274 M305 A308 M312	S268-L272 VanDerWaalsContact O-CG 3.29Å; S268-L272 WeakPolarHBondContact O-CG 3.43Å; S268-L272 PolarHBondContact O-N 2.87Å; S268-L272 VanDerWaalsContact O-N 3.1Å; N269-L272 PolarHBondContact O-N 2.94Å; A270-L272 PolarHBondContact O-N 2.84Å; L272-Y274 HydrophobicContact CB-CD2 3.72Å; L272-Y274 HydrophobicContact CB-CE2 3.68Å; L272-Y274 HydrophobicContact CB-CG 4.33Å; L272-Y274 HydrophobicContact CD1-CD2 4.14Å; L272-Y274 HydrophobicContact CD1-CE2 3.63Å; L272-Y274 HydrophobicContact CG-CE2 4.29Å; L272-Y274 PolarHBondContact O-N 2.78Å; L272-M305 HydrophobicContact CD2-CE 3.72Å; L272-M305 HydrophobicContact CD2-SD 3.92Å; L272-A308 HydrophobicContact CD2-CB 4.3Å; L272-A308 HydrophobicContact CG-CB 4.24Å; L272-M312 HydrophobicContact CD1-CE 4Å
273	G	85.3	Confident	91.9	Very high	15 Å²	15	21.8 Å²	21.8	16%	0.155	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	20.7	-179.4	0	0	0	0	0	113.8	K256 V257 N269 A270 H271	K256-G273 CarbonylContact C-O 3.53Å; K256-G273 WeakPolarHBondContact CA-O 3.17Å; V257-G273 WeakPolarHBondContact CG2-O 3.28Å; V257-G273 PolarHBondContact N-O 2.81Å; V257-G273 WeakPolarHBondContact O-CA 3.42Å; N269-G273 PolarHBondContact O-N 3.31Å; A270-G273 PolarHBondContact O-N 2.84Å; H271-G273 VanDerWaalsContact C-N 3.26Å; H271-G273 PolarHBondContact O-N 3.12Å
274	Y	84.4	Confident	92.1	Very high	126 Å²	126	19.3 Å²	19.3	49%	0.494	10%	0.096	S	C	.	.	P	Polyproline II helix	trans	-77.4	152.4	172.5	-63.6	-41.8	0	0	0	111	V257 N269 L272 L276	V257-Y274 WeakPolarHBondContact CG2-O 3.46Å; N269-Y274 HydrophobicContact CB-CD2 4.32Å; N269-Y274 PolarHBondContact O-N 2.86Å; L272-Y274 HydrophobicContact CB-CD2 3.72Å; L272-Y274 HydrophobicContact CB-CE2 3.68Å; L272-Y274 HydrophobicContact CB-CG 4.33Å; L272-Y274 HydrophobicContact CD1-CD2 4.14Å; L272-Y274 HydrophobicContact CD1-CE2 3.63Å; L272-Y274 HydrophobicContact CG-CE2 4.29Å; L272-Y274 PolarHBondContact O-N 2.78Å; Y274-L276 PolarHBondContact O-N 2.77Å
275	K	81.6	Confident	92.3	Very high	34 Å²	34	17.8 Å²	17.8	15%	0.148	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-65.1	127.8	175.6	-176.5	-178	170.9	-168.8	0	109.9	R251 P252 L253	R251-K275 PolarHBondContact O-NZ 2.87Å; P252-K275 PolarHBondContact O-NZ 3.02Å; L253-K275 HydrophobicContact CB-CD 4.5Å; L253-K275 HydrophobicContact CD2-CD 3.81Å
276	L	87.9	Confident	92.3	Very high	18 Å²	18	17.3 Å²	17.3	9%	0.094	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-77.8	143.3	176.5	-51.8	-174.3	0	0	0	111.5	I206 R208 N269 A270 Y274 D280	I206-L276 HydrophobicContact CD1-CB 4.21Å; I206-L276 VanDerWaalsContact CD1-O 3.26Å; I206-L276 WeakPolarHBondContact CD1-O 3.34Å; R208-L276 HydrophobicContact CB-CD1 4.28Å; R208-L276 HydrophobicContact CG-CD1 4.22Å; N269-L276 HydrophobicContact CB-CD2 3.99Å; A270-L276 HydrophobicContact CB-CD1 4.04Å; A270-L276 HydrophobicContact CB-CD2 3.8Å; A270-L276 HydrophobicContact CB-CG 4.49Å; Y274-L276 PolarHBondContact O-N 2.77Å; L276-D280 VanDerWaalsContact CA-OD2 3.31Å; L276-D280 WeakPolarHBondContact CA-OD2 3.33Å; L276-D280 HydrophobicContact CB-CB 4.03Å; L276-D280 HydrophobicContact CD2-CB 4.01Å; L276-D280 HydrophobicContact CG-CB 4.44Å
277	G	89.6	Confident	92.5	Very high	8 Å²	8	17.1 Å²	17.1	8%	0.082	9%	0.085	C	C	.	.			trans	-130.5	-169	172.3	0	0	0	0	0	111.1	K279 D280	G277-K279 PolarHBondContact O-N 2.83Å; G277-D280 PolarHBondContact N-OD2 2.82Å; G277-D280 WeakPolarHBondContact O-CB 3.34Å; G277-D280 PolarHBondContact O-N 2.81Å
278	R	94.8	Very high	92.7	Very high	6 Å²	6	17.1 Å²	17.1	2%	0.023	9%	0.085	C	C	.	.	H	α-helix	trans	-56.6	-37.2	-175.8	-62.4	174.3	-77.9	-172.1	-5.3	113.3	H201 I206 W240 D280 D281 L282 L338 Q339 P341 I400	H201-R278 HydrophobicContact CB-CG 3.99Å; H201-R278 PolarHBondContact CE1-O 3.38Å; I206-R278 HydrophobicContact CG2-CG 4.09Å; W240-R278 HydrophobicContact CD2-CG 4.25Å; W240-R278 VanDerWaalsContact CH2-NH1 3.29Å; W240-R278 HydrophobicContact CZ2-CG 4.32Å; R278-D280 PolarHBondContact O-N 2.92Å; R278-D281 PolarHBondContact O-N 2.59Å; R278-L282 PolarHBondContact O-N 2.67Å; R278-L338 PolarHBondContact NH2-O 3.31Å; R278-Q339 PolarHBondContact NH2-O 3.03Å; R278-P341 HydrophobicContact CB-CG 4.05Å; R278-I400 PolarHBondContact NH2-O 3.46Å
279	K	94.5	Very high	93	Very high	24 Å²	24	16.9 Å²	16.9	10%	0.104	8%	0.083	C	C	.	.	H	α-helix	trans	-63.3	-26.7	178.8	72.9	174.7	-170.4	160.3	0	112.9	N269 G277 L282 W283 L332 C335 P341	N269-K279 WeakPolarHBondContact ND2-CE 3.43Å; G277-K279 PolarHBondContact O-N 2.83Å; K279-L282 CarbonylContact O-C 3.21Å; K279-L282 PolarHBondContact O-N 2.85Å; K279-W283 PolarHBondContact O-N 3.29Å; K279-L332 HydrophobicContact CB-CD2 4.37Å; K279-C335 HydrophobicContact CD-CB 4.18Å; K279-C335 WeakPolarHBondContact CD-O 3.42Å; K279-C335 WeakPolarHBondContact CE-O 3.48Å; K279-C335 PolarHBondContact NZ-O 3.48Å; K279-P341 HydrophobicContact CB-CG 4.25Å
280	D	95.3	Very high	93.4	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-74.4	-33.2	-177.2	-60.7	-73.3	0	0	0	111.7	S267 N269 L276 G277 R278 L282 W283 S284	S267-D280 VanDerWaalsContact CB-OD1 3.27Å; S267-D280 WeakPolarHBondContact CB-OD1 3.26Å; S267-D280 PolarHBondContact OG-OD1 3.36Å; N269-D280 WeakPolarHBondContact CB-OD1 3.29Å; N269-D280 PolarHBondContact ND2-OD1 3.31Å; L276-D280 VanDerWaalsContact CA-OD2 3.31Å; L276-D280 WeakPolarHBondContact CA-OD2 3.33Å; L276-D280 HydrophobicContact CB-CB 4.03Å; L276-D280 HydrophobicContact CD2-CB 4.01Å; L276-D280 HydrophobicContact CG-CB 4.44Å; G277-D280 PolarHBondContact N-OD2 2.82Å; G277-D280 WeakPolarHBondContact O-CB 3.34Å; G277-D280 PolarHBondContact O-N 2.81Å; R278-D280 PolarHBondContact O-N 2.92Å; D280-L282 VanDerWaalsContact C-N 3.26Å; D280-L282 PolarHBondContact O-N 3.25Å; D280-W283 WeakPolarHBondContact O-CB 3.43Å; D280-W283 PolarHBondContact O-N 2.82Å; D280-S284 PolarHBondContact O-N 3.23Å; D280-S284 VanDerWaalsContact O-N 3.09Å; D280-S284 PolarHBondContact O-OG 3.06Å
281	D	98.1	Very high	93.7	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-66.1	-31.7	168.3	-72.6	-17.7	0	0	0	111.6	L197 H201 I206 H207 R208 I210 R278 S284 L285	L197-D281 HydrophobicContact CD1-CB 4.29Å; L197-D281 HydrophobicContact CD2-CB 4.02Å; H201-D281 IonicContact CD2-OD2 3.88Å; H201-D281 IonicContact NE2-OD2 2.67Å; H201-D281 PolarHBondContact NE2-OD2 2.92Å; H201-D281 VanDerWaalsContact NE2-OD2 3.11Å; I206-D281 VanDerWaalsContact CA-OD2 3.29Å; I206-D281 WeakPolarHBondContact CA-OD2 3.48Å; I206-D281 WeakPolarHBondContact CB-OD2 3.32Å; H207-D281 PolarHBondContact N-OD2 2.77Å; R208-D281 VanDerWaalsContact CA-OD1 3.31Å; R208-D281 WeakPolarHBondContact CA-OD1 3.33Å; R208-D281 PolarHBondContact N-OD1 3.11Å; I210-D281 HydrophobicContact CG1-CB 4.44Å; R278-D281 PolarHBondContact O-N 2.59Å; D281-S284 CarbonylContact O-C 3.54Å; D281-S284 WeakPolarHBondContact O-CB 3.42Å; D281-S284 PolarHBondContact O-N 3.47Å; D281-L285 PolarHBondContact O-N 3.03Å
282	L	98.3	Very high	94	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-77.8	-28.7	177.1	-61.2	173.4	0	0	0	113	L194 L197 R278 K279 D280 S284 L285 L286 L332 P341 Y343 M346	L194-L282 HydrophobicContact CD1-CD2 3.62Å; L197-L282 HydrophobicContact CD1-CD2 4.04Å; R278-L282 PolarHBondContact O-N 2.67Å; K279-L282 CarbonylContact O-C 3.21Å; K279-L282 PolarHBondContact O-N 2.85Å; D280-L282 VanDerWaalsContact C-N 3.26Å; D280-L282 PolarHBondContact O-N 3.25Å; L282-S284 VanDerWaalsContact C-N 3.32Å; L282-L285 HydrophobicContact CD2-CD2 4.17Å; L282-L285 PolarHBondContact O-N 3.16Å; L282-L286 PolarHBondContact O-N 3.34Å; L282-L332 HydrophobicContact CB-CD2 3.73Å; L282-P341 HydrophobicContact CD1-CB 3.21Å; L282-P341 HydrophobicContact CD1-CG 3.46Å; L282-P341 VanDerWaalsContact CD1-CG 3.46Å; L282-Y343 HydrophobicContact CD1-CD1 4.35Å; L282-Y343 HydrophobicContact CD1-CE1 3.84Å; L282-Y343 HydrophobicContact CD2-CD1 4.44Å; L282-Y343 HydrophobicContact CD2-CE1 4.11Å; L282-Y343 HydrophobicContact CG-CE1 4.43Å; L282-M346 HydrophobicContact CD1-CE 3.83Å; L282-M346 HydrophobicContact CD1-SD 3.79Å; L282-M346 HydrophobicContact CD2-SD 4.23Å; L282-M346 HydrophobicContact CG-SD 4.43Å
283	W	97.3	Very high	94.5	Very high	11 Å²	11	13.8 Å²	13.8	4%	0.042	7%	0.067	C	C	.	.	H	α-helix	trans	-60.1	-46	163.2	-83.8	107.1	0	0	0	110.7	K279 D280 L285 L286 F287 M314 F329 L332 L333	K279-W283 PolarHBondContact O-N 3.29Å; D280-W283 WeakPolarHBondContact O-CB 3.43Å; D280-W283 PolarHBondContact O-N 2.82Å; W283-L285 VanDerWaalsContact C-N 3.33Å; W283-L285 PolarHBondContact O-N 2.73Å; W283-L286 HydrophobicContact CE3-CD2 4.31Å; W283-L286 HydrophobicContact CZ3-CD2 4.25Å; W283-L286 WeakPolarHBondContact O-CB 3.41Å; W283-L286 PolarHBondContact O-N 3.35Å; W283-F287 HydrophobicContact CB-CE2 4.39Å; W283-F287 HydrophobicContact CD2-CZ 4.38Å; W283-F287 AromaticContact CE3-CE1 3.77Å; W283-F287 HydrophobicContact CE3-CE1 3.77Å; W283-F287 HydrophobicContact CE3-CE2 4.18Å; W283-F287 AromaticContact CE3-CZ 3.41Å; W283-F287 HydrophobicContact CE3-CZ 3.41Å; W283-F287 VanDerWaalsContact CE3-CZ 3.41Å; W283-F287 HydrophobicContact CZ3-CE1 4.06Å; W283-F287 AromaticContact CZ3-CZ 3.91Å; W283-F287 HydrophobicContact CZ3-CZ 3.91Å; W283-F287 WeakPolarHBondContact O-CD2 3.31Å; W283-F287 WeakPolarHBondContact O-CG 3.29Å; W283-F287 PolarHBondContact O-N 3.34Å; W283-M314 HydrophobicContact CZ3-CG 4.42Å; W283-F329 AromaticContact CH2-CD2 3.41Å; W283-F329 HydrophobicContact CH2-CD2 3.41Å; W283-F329 VanDerWaalsContact CH2-CD2 3.41Å; W283-F329 AromaticContact CH2-CE2 3.28Å; W283-F329 HydrophobicContact CH2-CE2 3.28Å; W283-F329 HydrophobicContact CH2-CZ 4.37Å; W283-F329 AromaticContact CZ3-CD2 3.47Å; W283-F329 HydrophobicContact CZ3-CD2 3.47Å; W283-F329 VanDerWaalsContact CZ3-CD2 3.47Å; W283-F329 AromaticContact CZ3-CE2 3.54Å; W283-F329 HydrophobicContact CZ3-CE2 3.54Å; W283-L332 HydrophobicContact CD2-CB 4.09Å; W283-L332 HydrophobicContact CD2-CD1 3.76Å; W283-L332 VanDerWaalsContact CE2-CB 3.48Å; W283-L332 HydrophobicContact CE3-CD1 4Å; W283-L332 HydrophobicContact CG-CD1 3.99Å; W283-L332 HydrophobicContact CH2-CB 4.17Å; W283-L332 HydrophobicContact CZ2-CB 3.52Å; W283-L333 HydrophobicContact CH2-CD2 3.89Å; W283-L333 HydrophobicContact CH2-CG 4.18Å; W283-L333 HydrophobicContact CZ2-CD2 3.92Å; W283-L333 HydrophobicContact CZ2-CG 4.25Å
284	S	98.2	Very high	94.9	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-63.9	-36.9	176.2	-63.3	0	0	0	0	113.2	I210 F265 D280 D281 L282 T288	I210-S284 WeakPolarHBondContact O-CB 3.31Å; F265-S284 WeakPolarHBondContact O-CA 3.39Å; F265-S284 VanDerWaalsContact O-CB 3.23Å; F265-S284 WeakPolarHBondContact O-CB 3.31Å; F265-S284 PolarHBondContact O-OG 3.49Å; D280-S284 PolarHBondContact O-N 3.23Å; D280-S284 VanDerWaalsContact O-N 3.09Å; D280-S284 PolarHBondContact O-OG 3.06Å; D281-S284 CarbonylContact O-C 3.54Å; D281-S284 WeakPolarHBondContact O-CB 3.42Å; D281-S284 PolarHBondContact O-N 3.47Å; L282-S284 VanDerWaalsContact C-N 3.32Å; S284-T288 VanDerWaalsContact O-CB 3.25Å; S284-T288 WeakPolarHBondContact O-CB 3.46Å; S284-T288 PolarHBondContact O-N 2.9Å; S284-T288 PolarHBondContact O-OG1 3.45Å
285	L	98.7	Very high	95.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.3	-50.4	169.6	175.3	57.5	0	0	0	111	I193 L194 L197 D281 L282 W283 F287 T288 L289 F328	I193-L285 HydrophobicContact CB-CD1 3.88Å; I193-L285 HydrophobicContact CD1-CD1 4.22Å; I193-L285 HydrophobicContact CG2-CD1 3.69Å; L194-L285 HydrophobicContact CB-CD2 4Å; L194-L285 HydrophobicContact CD1-CD2 3.94Å; L197-L285 HydrophobicContact CD1-CB 4.14Å; L197-L285 HydrophobicContact CD1-CD2 4.29Å; D281-L285 PolarHBondContact O-N 3.03Å; L282-L285 HydrophobicContact CD2-CD2 4.17Å; L282-L285 PolarHBondContact O-N 3.16Å; W283-L285 VanDerWaalsContact C-N 3.33Å; W283-L285 PolarHBondContact O-N 2.73Å; L285-F287 VanDerWaalsContact C-N 3.33Å; L285-F287 PolarHBondContact O-N 2.97Å; L285-T288 CarbonylContact O-C 3.39Å; L285-T288 WeakPolarHBondContact O-CA 3.47Å; L285-T288 WeakPolarHBondContact O-CB 3.26Å; L285-T288 PolarHBondContact O-N 3.48Å; L285-T288 VanDerWaalsContact O-N 3.1Å; L285-L289 HydrophobicContact CD1-CD1 4.16Å; L285-L289 HydrophobicContact CD1-CD2 4.08Å; L285-L289 HydrophobicContact CD1-CG 3.92Å; L285-L289 HydrophobicContact CG-CD1 4.28Å; L285-L289 HydrophobicContact CG-CG 4.4Å; L285-L289 WeakPolarHBondContact O-CG 3.2Å; L285-L289 PolarHBondContact O-N 3.26Å; L285-F328 HydrophobicContact CD2-CZ 4.34Å
286	L	98.1	Very high	95.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-55.4	-48	178.9	176.6	61.6	0	0	0	111.7	L282 W283 T288 L289 V290 M314 L318 M325 F329 L332	L282-L286 PolarHBondContact O-N 3.34Å; W283-L286 HydrophobicContact CE3-CD2 4.31Å; W283-L286 HydrophobicContact CZ3-CD2 4.25Å; W283-L286 WeakPolarHBondContact O-CB 3.41Å; W283-L286 PolarHBondContact O-N 3.35Å; L286-T288 VanDerWaalsContact C-N 3.34Å; L286-T288 PolarHBondContact O-N 3.45Å; L286-L289 PolarHBondContact O-N 3.16Å; L286-V290 WeakPolarHBondContact O-CG2 3.39Å; L286-V290 PolarHBondContact O-N 2.95Å; L286-M314 HydrophobicContact CD2-CE 4.3Å; L286-M314 HydrophobicContact CG-CE 4.46Å; L286-L318 HydrophobicContact CD1-CD2 4.41Å; L286-M325 HydrophobicContact CD1-CE 3.32Å; L286-F329 HydrophobicContact CD2-CB 4.07Å; L286-F329 HydrophobicContact CD2-CD2 4.21Å; L286-L332 HydrophobicContact CB-CD1 4.34Å; L286-L332 HydrophobicContact CD2-CD1 4.09Å
287	F	97.8	Very high	95.8	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.9	-35.6	177.8	-57.9	-27.2	0	0	0	112.4	F265 T266 W283 L285 V290 D291 L296 W298 K311 M314	F265-F287 HydrophobicContact CD1-CB 4.27Å; F265-F287 WeakPolarHBondContact O-CD2 3.49Å; T266-F287 WeakPolarHBondContact O-CE2 3.46Å; W283-F287 HydrophobicContact CB-CE2 4.39Å; W283-F287 HydrophobicContact CD2-CZ 4.38Å; W283-F287 AromaticContact CE3-CE1 3.77Å; W283-F287 HydrophobicContact CE3-CE1 3.77Å; W283-F287 HydrophobicContact CE3-CE2 4.18Å; W283-F287 AromaticContact CE3-CZ 3.41Å; W283-F287 HydrophobicContact CE3-CZ 3.41Å; W283-F287 VanDerWaalsContact CE3-CZ 3.41Å; W283-F287 HydrophobicContact CZ3-CE1 4.06Å; W283-F287 AromaticContact CZ3-CZ 3.91Å; W283-F287 HydrophobicContact CZ3-CZ 3.91Å; W283-F287 WeakPolarHBondContact O-CD2 3.31Å; W283-F287 WeakPolarHBondContact O-CG 3.29Å; W283-F287 PolarHBondContact O-N 3.34Å; L285-F287 VanDerWaalsContact C-N 3.33Å; L285-F287 PolarHBondContact O-N 2.97Å; F287-V290 PolarHBondContact O-N 3.44Å; F287-D291 WeakPolarHBondContact O-CB 3.43Å; F287-D291 PolarHBondContact O-N 3.49Å; F287-L296 HydrophobicContact CB-CD2 4.13Å; F287-W298 AromaticContact CD1-CH2 3.81Å; F287-W298 HydrophobicContact CD1-CH2 3.81Å; F287-W298 AromaticContact CD1-CZ2 3.76Å; F287-W298 HydrophobicContact CD1-CZ2 3.76Å; F287-W298 HydrophobicContact CD2-CZ2 4.26Å; F287-W298 AromaticContact CE1-CH2 3.77Å; F287-W298 HydrophobicContact CE1-CH2 3.77Å; F287-W298 AromaticContact CE1-CZ2 3.97Å; F287-W298 HydrophobicContact CE1-CZ2 3.97Å; F287-W298 HydrophobicContact CE2-CZ2 4.45Å; F287-W298 HydrophobicContact CG-CH2 4.45Å; F287-W298 AromaticContact CG-CZ2 3.93Å; F287-W298 HydrophobicContact CG-CZ2 3.93Å; F287-W298 HydrophobicContact CZ-CH2 4.35Å; F287-W298 HydrophobicContact CZ-CZ2 4.3Å; F287-K311 HydrophobicContact CE1-CG 4.49Å; F287-K311 HydrophobicContact CE2-CB 4.4Å; F287-K311 HydrophobicContact CE2-CD 3.73Å; F287-K311 HydrophobicContact CE2-CG 3.95Å; F287-K311 HydrophobicContact CZ-CB 3.87Å; F287-K311 HydrophobicContact CZ-CD 4.04Å; F287-K311 HydrophobicContact CZ-CG 3.75Å; F287-M314 HydrophobicContact CD1-CE 3.82Å; F287-M314 HydrophobicContact CD1-SD 4.17Å; F287-M314 HydrophobicContact CE1-CE 3.64Å; F287-M314 HydrophobicContact CE1-CG 4.39Å; F287-M314 HydrophobicContact CE1-SD 3.52Å; F287-M314 VanDerWaalsContact CE1-SD 3.52Å; F287-M314 HydrophobicContact CZ-SD 4.45Å
288	T	98.4	Very high	96	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.5	-47.3	171.7	-63.7	0	0	0	0	110.4	P212 L215 S284 L285 L286 V290 D291 L292	P212-T288 HydrophobicContact CG-CG2 4.06Å; L215-T288 HydrophobicContact CD1-CG2 3.79Å; S284-T288 VanDerWaalsContact O-CB 3.25Å; S284-T288 WeakPolarHBondContact O-CB 3.46Å; S284-T288 PolarHBondContact O-N 2.9Å; S284-T288 PolarHBondContact O-OG1 3.45Å; L285-T288 CarbonylContact O-C 3.39Å; L285-T288 WeakPolarHBondContact O-CA 3.47Å; L285-T288 WeakPolarHBondContact O-CB 3.26Å; L285-T288 PolarHBondContact O-N 3.48Å; L285-T288 VanDerWaalsContact O-N 3.1Å; L286-T288 VanDerWaalsContact C-N 3.34Å; L286-T288 PolarHBondContact O-N 3.45Å; T288-V290 PolarHBondContact O-N 3.15Å; T288-D291 CarbonylContact O-C 3.52Å; T288-D291 PolarHBondContact O-N 3.39Å; T288-D291 VanDerWaalsContact O-N 3.16Å; T288-L292 HydrophobicContact CG2-CD1 4.21Å; T288-L292 HydrophobicContact CG2-CG 4.3Å; T288-L292 VanDerWaalsContact O-CG 3.32Å; T288-L292 WeakPolarHBondContact O-CG 3.44Å; T288-L292 PolarHBondContact O-N 3.17Å
289	L	98.4	Very high	95.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-39.4	179.6	-61.5	-178.4	0	0	0	113	W186 L285 L286 D291 L292 N293 M321 M325 L350	W186-L289 HydrophobicContact CE3-CB 4.2Å; W186-L289 HydrophobicContact CE3-CD1 4.41Å; W186-L289 HydrophobicContact CE3-CD2 4.24Å; W186-L289 HydrophobicContact CZ3-CB 4.45Å; W186-L289 HydrophobicContact CZ3-CD1 4.33Å; L285-L289 HydrophobicContact CD1-CD1 4.16Å; L285-L289 HydrophobicContact CD1-CD2 4.08Å; L285-L289 HydrophobicContact CD1-CG 3.92Å; L285-L289 HydrophobicContact CG-CD1 4.28Å; L285-L289 HydrophobicContact CG-CG 4.4Å; L285-L289 WeakPolarHBondContact O-CG 3.2Å; L285-L289 PolarHBondContact O-N 3.26Å; L286-L289 PolarHBondContact O-N 3.16Å; L289-D291 VanDerWaalsContact C-N 3.29Å; L289-D291 PolarHBondContact O-N 2.85Å; L289-L292 HydrophobicContact CD2-CD1 4.46Å; L289-L292 PolarHBondContact O-N 3.34Å; L289-N293 WeakPolarHBondContact O-CB 2.96Å; L289-N293 PolarHBondContact O-N 3.13Å; L289-M321 HydrophobicContact CB-CE 4.42Å; L289-M325 HydrophobicContact CD1-CE 4.44Å; L289-L350 HydrophobicContact CD1-CD2 3.67Å
290	V	97.2	Very high	95.4	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.024	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-42.4	172.6	173.9	0	0	0	0	110.5	L286 F287 T288 N293 D294 L296 M314 A317 M321	L286-V290 WeakPolarHBondContact O-CG2 3.39Å; L286-V290 PolarHBondContact O-N 2.95Å; F287-V290 PolarHBondContact O-N 3.44Å; T288-V290 PolarHBondContact O-N 3.15Å; V290-N293 PolarHBondContact O-N 2.68Å; V290-D294 PolarHBondContact O-N 3.49Å; V290-L296 HydrophobicContact CB-CD2 4.05Å; V290-L296 HydrophobicContact CG1-CD2 3.86Å; V290-M314 HydrophobicContact CG2-CE 4.35Å; V290-A317 HydrophobicContact CG1-CB 4.3Å; V290-M321 HydrophobicContact CG2-CE 4.39Å; V290-M321 HydrophobicContact CG2-CG 3.97Å; V290-M321 HydrophobicContact CG2-SD 4.2Å
291	D	97.3	Very high	95.2	Very high	13 Å²	13	24.8 Å²	24.8	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-69.1	-36.1	174.9	-166.5	78.8	0	0	0	112.1	K173 F265 F287 T288 L289 N293 D294 L296	K173-D291 WeakPolarHBondContact CE-O 3.48Å; K173-D291 PolarHBondContact NZ-O 2.87Å; K173-D291 IonicContact NZ-OD1 2.68Å; K173-D291 PolarHBondContact NZ-OD1 2.69Å; K173-D291 IonicContact NZ-OD2 3.12Å; K173-D291 PolarHBondContact NZ-OD2 2.72Å; F265-D291 HydrophobicContact CE1-CB 3.88Å; F265-D291 HydrophobicContact CZ-CB 4.46Å; F287-D291 WeakPolarHBondContact O-CB 3.43Å; F287-D291 PolarHBondContact O-N 3.49Å; T288-D291 CarbonylContact O-C 3.52Å; T288-D291 PolarHBondContact O-N 3.39Å; T288-D291 VanDerWaalsContact O-N 3.16Å; L289-D291 VanDerWaalsContact C-N 3.29Å; L289-D291 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-N 2.93Å; D291-D294 CarbonylContact C-O 3.51Å; D291-D294 WeakPolarHBondContact CA-O 3.22Å; D291-D294 CarbonylContact O-C 3.54Å; D291-D294 PolarHBondContact O-N 3.04Å; D291-L296 HydrophobicContact CB-CD1 4.39Å; D291-L296 HydrophobicContact CB-CG 4.09Å
292	L	97.8	Very high	95	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-32.8	176.2	-66.4	-177.5	0	0	0	111.8	L169 K173 F181 W186 L189 P212 T288 L289	L169-L292 HydrophobicContact CB-CD2 4.07Å; L169-L292 HydrophobicContact CD1-CD1 3.89Å; K173-L292 HydrophobicContact CD-CD2 4.44Å; F181-L292 HydrophobicContact CD2-CB 3.84Å; F181-L292 HydrophobicContact CD2-CD1 4.05Å; F181-L292 HydrophobicContact CD2-CD2 3.87Å; F181-L292 HydrophobicContact CD2-CG 4.1Å; F181-L292 HydrophobicContact CE2-CB 4.48Å; F181-L292 HydrophobicContact CE2-CD1 4.16Å; F181-L292 HydrophobicContact CE2-CD2 3.62Å; F181-L292 HydrophobicContact CE2-CG 4.27Å; F181-L292 HydrophobicContact CZ-CD2 4.47Å; F181-L292 PolarHBondContact N-O 3.45Å; W186-L292 HydrophobicContact CB-CB 3.91Å; L189-L292 HydrophobicContact CD1-CD1 4.34Å; P212-L292 HydrophobicContact CB-CD2 4.33Å; P212-L292 HydrophobicContact CG-CD2 4.19Å; T288-L292 HydrophobicContact CG2-CD1 4.21Å; T288-L292 HydrophobicContact CG2-CG 4.3Å; T288-L292 VanDerWaalsContact O-CG 3.32Å; T288-L292 WeakPolarHBondContact O-CG 3.44Å; T288-L292 PolarHBondContact O-N 3.17Å; L289-L292 HydrophobicContact CD2-CD1 4.46Å; L289-L292 PolarHBondContact O-N 3.34Å
293	N	96.1	Very high	94.8	Very high	24 Å²	24	36.7 Å²	36.7	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-79.4	-32.9	175.8	-177.4	78.5	0	0	0	113.7	R180 W186 L289 V290 D291 K320 M321	R180-N293 WeakPolarHBondContact CD-O 3.14Å; R180-N293 VanDerWaalsContact CG-O 3.27Å; R180-N293 WeakPolarHBondContact CG-O 3.33Å; R180-N293 PolarHBondContact NH1-O 3.16Å; R180-N293 VanDerWaalsContact NH1-O 3.09Å; W186-N293 HydrophobicContact CG-CB 4.47Å; W186-N293 PolarHBondContact NE1-OD1 2.94Å; L289-N293 WeakPolarHBondContact O-CB 2.96Å; L289-N293 PolarHBondContact O-N 3.13Å; V290-N293 PolarHBondContact O-N 2.68Å; D291-N293 PolarHBondContact O-N 2.93Å; N293-K320 PolarHBondContact ND2-O 3.46Å; N293-M321 HydrophobicContact CB-CE 4.37Å; N293-M321 HydrophobicContact CB-SD 3.67Å; N293-M321 PolarHBondContact ND2-SD 3.04Å; N293-M321 VanDerWaalsContact ND2-SD 3.39Å
294	D	92.5	Very high	94.4	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.053	20%	0.202	C	C	.	.	S	Bend	trans	-157.2	-141.2	-177.7	-161	-20.2	0	0	0	112.6	K173 R180 V290 D291 K320	K173-D294 PolarHBondContact NZ-O 2.83Å; R180-D294 IonicContact CZ-OD1 3.26Å; R180-D294 IonicContact CZ-OD2 3.21Å; R180-D294 IonicContact NH1-OD1 3.65Å; R180-D294 PolarHBondContact NH1-OD1 3.01Å; R180-D294 IonicContact NH1-OD2 2.73Å; R180-D294 PolarHBondContact NH1-OD2 3.35Å; R180-D294 IonicContact NH2-OD1 3.62Å; R180-D294 PolarHBondContact NH2-OD1 3.49Å; R180-D294 IonicContact NH2-OD2 2.9Å; R180-D294 PolarHBondContact NH2-OD2 3.32Å; V290-D294 PolarHBondContact O-N 3.49Å; D291-D294 CarbonylContact C-O 3.51Å; D291-D294 WeakPolarHBondContact CA-O 3.22Å; D291-D294 CarbonylContact O-C 3.54Å; D291-D294 PolarHBondContact O-N 3.04Å; D294-K320 HydrophobicContact CB-CD 4.48Å; D294-K320 WeakPolarHBondContact OD2-CD 3.34Å; D294-K320 WeakPolarHBondContact OD2-CE 3.27Å; D294-K320 IonicContact OD2-NZ 3.11Å; D294-K320 PolarHBondContact OD2-NZ 3.18Å
295	R	89.9	Confident	94	Very high	159 Å²	159	43.9 Å²	43.9	60%	0.6	23%	0.225	S	C	*	.			trans	-117.1	142.7	174.5	-60.4	-177.3	-174.2	179.1	3.5	107.4
296	L	92.9	Very high	93.6	Very high	4 Å²	4	48 Å²	48	2%	0.021	25%	0.246	C	C	.	.			trans	-63.5	136.8	169.9	-66.7	171.2	0	0	0	110.4	N264 F265 F287 V290 D291 W298 H299	N264-L296 HydrophobicContact CB-CD1 3.98Å; F265-L296 HydrophobicContact CD1-CD1 3.99Å; F265-L296 HydrophobicContact CE1-CD1 3.73Å; F265-L296 HydrophobicContact CZ-CD1 4.3Å; F287-L296 HydrophobicContact CB-CD2 4.13Å; V290-L296 HydrophobicContact CB-CD2 4.05Å; V290-L296 HydrophobicContact CG1-CD2 3.86Å; D291-L296 HydrophobicContact CB-CD1 4.39Å; D291-L296 HydrophobicContact CB-CG 4.09Å; L296-W298 HydrophobicContact CB-CZ2 4.45Å; L296-W298 HydrophobicContact CD1-CZ2 4.41Å; L296-W298 HydrophobicContact CD2-CH2 4.17Å; L296-W298 HydrophobicContact CD2-CZ2 3.67Å; L296-W298 HydrophobicContact CG-CZ2 4.4Å; L296-W298 PolarHBondContact O-N 3.22Å; L296-H299 WeakPolarHBondContact O-CB 3.48Å; L296-H299 PolarHBondContact O-N 3.26Å
297	P	91.1	Very high	93.2	Very high	67 Å²	67	48 Å²	48	44%	0.435	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.4	-176.6	26.4	-32.4	0	0	0	113.4	V316 A317	P297-V316 HydrophobicContact CB-CG1 4.13Å; P297-A317 HydrophobicContact CG-CB 3.88Å
298	W	93.3	Very high	92.7	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.011	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	17.6	177.8	55.5	75.4	0	0	0	113.4	N264 F287 L296 G300 V301 L307 Q310 K311 M314 A317	N264-W298 PolarHBondContact O-NE1 2.94Å; F287-W298 AromaticContact CD1-CH2 3.81Å; F287-W298 HydrophobicContact CD1-CH2 3.81Å; F287-W298 AromaticContact CD1-CZ2 3.76Å; F287-W298 HydrophobicContact CD1-CZ2 3.76Å; F287-W298 HydrophobicContact CD2-CZ2 4.26Å; F287-W298 AromaticContact CE1-CH2 3.77Å; F287-W298 HydrophobicContact CE1-CH2 3.77Å; F287-W298 AromaticContact CE1-CZ2 3.97Å; F287-W298 HydrophobicContact CE1-CZ2 3.97Å; F287-W298 HydrophobicContact CE2-CZ2 4.45Å; F287-W298 HydrophobicContact CG-CH2 4.45Å; F287-W298 AromaticContact CG-CZ2 3.93Å; F287-W298 HydrophobicContact CG-CZ2 3.93Å; F287-W298 HydrophobicContact CZ-CH2 4.35Å; F287-W298 HydrophobicContact CZ-CZ2 4.3Å; L296-W298 HydrophobicContact CB-CZ2 4.45Å; L296-W298 HydrophobicContact CD1-CZ2 4.41Å; L296-W298 HydrophobicContact CD2-CH2 4.17Å; L296-W298 HydrophobicContact CD2-CZ2 3.67Å; L296-W298 HydrophobicContact CG-CZ2 4.4Å; L296-W298 PolarHBondContact O-N 3.22Å; W298-G300 PolarHBondContact O-N 3.38Å; W298-V301 HydrophobicContact CB-CG2 4.2Å; W298-V301 WeakPolarHBondContact O-CB 3.25Å; W298-V301 WeakPolarHBondContact O-CG2 3.43Å; W298-V301 PolarHBondContact O-N 2.93Å; W298-V301 VanDerWaalsContact O-N 3.1Å; W298-L307 HydrophobicContact CB-CD2 3.79Å; W298-L307 HydrophobicContact CG-CD2 3.76Å; W298-Q310 HydrophobicContact CE3-CB 4.13Å; W298-K311 HydrophobicContact CD2-CG 4.17Å; W298-K311 HydrophobicContact CE3-CG 4.29Å; W298-K311 HydrophobicContact CH2-CG 3.93Å; W298-K311 HydrophobicContact CZ2-CD 4.46Å; W298-K311 HydrophobicContact CZ2-CG 3.72Å; W298-K311 HydrophobicContact CZ3-CG 4.19Å; W298-M314 HydrophobicContact CH2-CE 4.13Å; W298-M314 HydrophobicContact CH2-SD 3.32Å; W298-M314 WeakPolarHBondContact CH2-SD 3.45Å; W298-M314 HydrophobicContact CZ3-SD 3.59Å; W298-M314 VanDerWaalsContact CZ3-SD 3.59Å; W298-A317 HydrophobicContact CH2-CB 4.34Å; W298-A317 HydrophobicContact CZ3-CB 4.17Å
299	H	88.8	Confident	92.2	Very high	123 Å²	123	57.9 Å²	57.9	57%	0.569	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	126.6	177.1	-156.2	83.9	0	0	0	110.3	N264 L296	N264-H299 PolarHBondContact ND2-ND1 3.29Å; L296-H299 WeakPolarHBondContact O-CB 3.48Å; L296-H299 PolarHBondContact O-N 3.26Å
300	G	87.9	Confident	91.8	Very high	60 Å²	60	61.3 Å²	61.3	62%	0.619	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-8.2	-178.8	0	0	0	0	0	115.5	W298	W298-G300 PolarHBondContact O-N 3.38Å
301	V	92.1	Very high	91.4	Very high	38 Å²	38	61.1 Å²	61.1	23%	0.23	30%	0.299	C	S	.	.			trans	-73.5	129.3	171.9	-176.8	0	0	0	0	109.1	W298 I306 L307	W298-V301 HydrophobicContact CB-CG2 4.2Å; W298-V301 WeakPolarHBondContact O-CB 3.25Å; W298-V301 WeakPolarHBondContact O-CG2 3.43Å; W298-V301 PolarHBondContact O-N 2.93Å; W298-V301 VanDerWaalsContact O-N 3.1Å; V301-I306 HydrophobicContact CG1-CB 4.1Å; V301-I306 HydrophobicContact CG1-CG2 3.82Å; V301-L307 HydrophobicContact CB-CD2 3.88Å; V301-L307 HydrophobicContact CB-CG 4.17Å; V301-L307 HydrophobicContact CG1-CD2 4.1Å; V301-L307 HydrophobicContact CG1-CG 3.88Å
302	K	92.4	Very high	90.7	Very high	170 Å²	170	65 Å²	65	74%	0.739	32%	0.318	S	S	*	.			trans	-106.9	-19.6	179.8	-62.4	-177.1	-178.5	179	0	113.7	H304	K302-H304 PolarHBondContact O-N 3.14Å
303	D	94.2	Very high	89.9	Confident	81 Å²	81	70.6 Å²	70.6	43%	0.433	35%	0.348	S	S	.	.			trans	-72.9	123.4	-178.9	-175.1	-76.1	0	0	0	111.2	M305 I306 L307	D303-M305 PolarHBondContact O-N 3.24Å; D303-M305 WeakPolarHBondContact OD1-CA 3.4Å; D303-M305 WeakPolarHBondContact OD1-CB 3.37Å; D303-M305 PolarHBondContact OD1-N 3.38Å; D303-I306 HydrophobicContact CB-CB 4.07Å; D303-I306 HydrophobicContact CB-CD1 3.84Å; D303-I306 HydrophobicContact CB-CG1 3.96Å; D303-I306 WeakPolarHBondContact OD1-CG1 3.45Å; D303-I306 PolarHBondContact OD1-N 2.81Å; D303-L307 WeakPolarHBondContact O-CB 3.49Å; D303-L307 VanDerWaalsContact O-CG 3.31Å; D303-L307 WeakPolarHBondContact O-CG 3.44Å; D303-L307 PolarHBondContact O-N 2.85Å
304	H	89.8	Confident	89	Confident	64 Å²	64	69.6 Å²	69.6	30%	0.296	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-35.7	-176	-76.6	-101.5	0	0	0	113.2	F259 H271 K302 A308	F259-H304 AromaticContact CD1-CE1 3.73Å; F259-H304 AromaticContact CD2-CE1 3.59Å; F259-H304 AromaticContact CD2-ND1 3.79Å; F259-H304 AromaticContact CE1-CE1 3.92Å; F259-H304 AromaticContact CE2-CE1 3.76Å; F259-H304 AromaticContact CE2-ND1 3.98Å; F259-H304 AromaticContact CG-CE1 3.58Å; F259-H304 AromaticContact CZ-CE1 3.94Å; H271-H304 HydrophobicContact CB-CB 4.2Å; H271-H304 WeakPolarHBondContact CB-O 3.22Å; H271-H304 AromaticContact CG-ND1 3.97Å; H271-H304 AromaticContact ND1-CE1 3.92Å; H271-H304 AromaticContact ND1-CG 3.72Å; H271-H304 AromaticContact ND1-ND1 3.11Å; H271-H304 PolarHBondContact ND1-ND1 2.97Å; H271-H304 VanDerWaalsContact ND1-ND1 3.11Å; K302-H304 PolarHBondContact O-N 3.14Å; H304-A308 VanDerWaalsContact O-CB 3.32Å; H304-A308 WeakPolarHBondContact O-CB 3.43Å; H304-A308 PolarHBondContact O-N 2.83Å
305	M	88.9	Confident	88	Confident	101 Å²	101	71.1 Å²	71.1	50%	0.498	36%	0.361	S	S	.	.	H	α-helix	trans	-76.4	-39.2	-177.8	-63.8	-58.2	87.9	0	0	111.3	L272 D303 A308 R309	L272-M305 HydrophobicContact CD2-CE 3.72Å; L272-M305 HydrophobicContact CD2-SD 3.92Å; D303-M305 PolarHBondContact O-N 3.24Å; D303-M305 WeakPolarHBondContact OD1-CA 3.4Å; D303-M305 WeakPolarHBondContact OD1-CB 3.37Å; D303-M305 PolarHBondContact OD1-N 3.38Å; M305-A308 PolarHBondContact O-N 3Å; M305-R309 WeakPolarHBondContact O-CB 3.37Å; M305-R309 PolarHBondContact O-N 2.83Å
306	I	89.9	Confident	87.2	Confident	87 Å²	87	67.9 Å²	67.9	45%	0.446	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-47.7	172.7	-61.4	178.4	0	0	0	109.9	V301 D303 A308 R309 Q310	V301-I306 HydrophobicContact CG1-CB 4.1Å; V301-I306 HydrophobicContact CG1-CG2 3.82Å; D303-I306 HydrophobicContact CB-CB 4.07Å; D303-I306 HydrophobicContact CB-CD1 3.84Å; D303-I306 HydrophobicContact CB-CG1 3.96Å; D303-I306 WeakPolarHBondContact OD1-CG1 3.45Å; D303-I306 PolarHBondContact OD1-N 2.81Å; I306-A308 PolarHBondContact O-N 3.5Å; I306-R309 PolarHBondContact O-N 2.82Å; I306-Q310 HydrophobicContact CG2-CG 4.34Å; I306-Q310 WeakPolarHBondContact O-CB 3.49Å; I306-Q310 WeakPolarHBondContact O-CG 3.4Å; I306-Q310 PolarHBondContact O-N 2.99Å
307	L	89.9	Confident	86.4	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59	-47.2	176.6	-77.6	171.1	0	0	0	112.1	L263 H271 W298 V301 D303 R309 Q310 K311	L263-L307 HydrophobicContact CB-CD1 4.2Å; L263-L307 HydrophobicContact CD2-CD1 4.09Å; H271-L307 VanDerWaalsContact CE1-CD1 3.4Å; H271-L307 WeakPolarHBondContact CE1-CD1 3.39Å; W298-L307 HydrophobicContact CB-CD2 3.79Å; W298-L307 HydrophobicContact CG-CD2 3.76Å; V301-L307 HydrophobicContact CB-CD2 3.88Å; V301-L307 HydrophobicContact CB-CG 4.17Å; V301-L307 HydrophobicContact CG1-CD2 4.1Å; V301-L307 HydrophobicContact CG1-CG 3.88Å; D303-L307 WeakPolarHBondContact O-CB 3.49Å; D303-L307 VanDerWaalsContact O-CG 3.31Å; D303-L307 WeakPolarHBondContact O-CG 3.44Å; D303-L307 PolarHBondContact O-N 2.85Å; L307-R309 VanDerWaalsContact C-N 3.3Å; L307-R309 PolarHBondContact O-N 3.2Å; L307-Q310 PolarHBondContact O-N 3.31Å; L307-K311 VanDerWaalsContact O-CB 3.31Å; L307-K311 WeakPolarHBondContact O-CB 3.31Å; L307-K311 VanDerWaalsContact O-CG 3.28Å; L307-K311 WeakPolarHBondContact O-CG 3.22Å; L307-K311 PolarHBondContact O-N 2.89Å
308	A	88.4	Confident	86.1	Confident	4 Å²	4	65.6 Å²	65.6	3%	0.033	34%	0.343	C	S	.	.	H	α-helix	trans	-58	-43	179.1	0	0	0	0	0	111.9	S268 H271 L272 H304 M305 I306 M312	S268-A308 PolarHBondContact OG-O 3.38Å; H271-A308 HydrophobicContact CB-CB 3.95Å; L272-A308 HydrophobicContact CD2-CB 4.3Å; L272-A308 HydrophobicContact CG-CB 4.24Å; H304-A308 VanDerWaalsContact O-CB 3.32Å; H304-A308 WeakPolarHBondContact O-CB 3.43Å; H304-A308 PolarHBondContact O-N 2.83Å; M305-A308 PolarHBondContact O-N 3Å; I306-A308 PolarHBondContact O-N 3.5Å; A308-M312 WeakPolarHBondContact O-CG 3.41Å; A308-M312 PolarHBondContact O-N 3.35Å; A308-M312 VanDerWaalsContact O-N 3.15Å
309	R	87.6	Confident	85.7	Confident	203 Å²	203	72.2 Å²	72.2	77%	0.766	38%	0.376	S	S	*	.	H	α-helix	trans	-68.5	-45.1	178.7	-173.7	177.9	-177.1	173.2	1.1	112.3	M305 I306 L307 K311 M312 N313	M305-R309 WeakPolarHBondContact O-CB 3.37Å; M305-R309 PolarHBondContact O-N 2.83Å; I306-R309 PolarHBondContact O-N 2.82Å; L307-R309 VanDerWaalsContact C-N 3.3Å; L307-R309 PolarHBondContact O-N 3.2Å; R309-K311 VanDerWaalsContact C-N 3.34Å; R309-K311 PolarHBondContact O-N 3.39Å; R309-M312 PolarHBondContact O-N 3.31Å; R309-N313 PolarHBondContact O-N 2.78Å; R309-N313 VanDerWaalsContact O-N 3.14Å
310	Q	88.8	Confident	85.6	Confident	72 Å²	72	72.6 Å²	72.6	34%	0.336	38%	0.376	S	S	.	.	H	α-helix	trans	-62.8	-41.4	178.1	-74.8	178.7	-27.4	0	0	111.6	W298 I306 L307 M312 N313	W298-Q310 HydrophobicContact CE3-CB 4.13Å; I306-Q310 HydrophobicContact CG2-CG 4.34Å; I306-Q310 WeakPolarHBondContact O-CB 3.49Å; I306-Q310 WeakPolarHBondContact O-CG 3.4Å; I306-Q310 PolarHBondContact O-N 2.99Å; L307-Q310 PolarHBondContact O-N 3.31Å; Q310-M312 VanDerWaalsContact C-N 3.31Å; Q310-M312 PolarHBondContact O-N 3.04Å; Q310-N313 CarbonylContact O-C 3.35Å; Q310-N313 PolarHBondContact O-N 2.85Å
311	K	88.8	Confident	85.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-69.1	-24.2	177.1	-74.4	173.1	177.9	-177.2	0	114.3	L263 N264 T266 S268 H271 F287 W298 L307 R309 M314	L263-K311 PolarHBondContact O-NZ 2.97Å; N264-K311 WeakPolarHBondContact O-CE 3.27Å; N264-K311 PolarHBondContact O-NZ 2.76Å; T266-K311 WeakPolarHBondContact O-CE 3.37Å; T266-K311 PolarHBondContact O-NZ 3.02Å; S268-K311 VanDerWaalsContact OG-CB 3.23Å; S268-K311 WeakPolarHBondContact OG-CB 3.31Å; H271-K311 PolarHBondContact NE2-NZ 3.41Å; F287-K311 HydrophobicContact CE1-CG 4.49Å; F287-K311 HydrophobicContact CE2-CB 4.4Å; F287-K311 HydrophobicContact CE2-CD 3.73Å; F287-K311 HydrophobicContact CE2-CG 3.95Å; F287-K311 HydrophobicContact CZ-CB 3.87Å; F287-K311 HydrophobicContact CZ-CD 4.04Å; F287-K311 HydrophobicContact CZ-CG 3.75Å; W298-K311 HydrophobicContact CD2-CG 4.17Å; W298-K311 HydrophobicContact CE3-CG 4.29Å; W298-K311 HydrophobicContact CH2-CG 3.93Å; W298-K311 HydrophobicContact CZ2-CD 4.46Å; W298-K311 HydrophobicContact CZ2-CG 3.72Å; W298-K311 HydrophobicContact CZ3-CG 4.19Å; L307-K311 VanDerWaalsContact O-CB 3.31Å; L307-K311 WeakPolarHBondContact O-CB 3.31Å; L307-K311 VanDerWaalsContact O-CG 3.28Å; L307-K311 WeakPolarHBondContact O-CG 3.22Å; L307-K311 PolarHBondContact O-N 2.89Å; R309-K311 VanDerWaalsContact C-N 3.34Å; R309-K311 PolarHBondContact O-N 3.39Å; K311-M314 VanDerWaalsContact O-CG 3.3Å; K311-M314 WeakPolarHBondContact O-CG 3.27Å
312	M	82.7	Confident	86	Confident	94 Å²	94	69.5 Å²	69.5	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-80.2	-19.8	169.9	-73.7	-179.9	175.7	0	0	112.3	L272 A308 R309 Q310	L272-M312 HydrophobicContact CD1-CE 4Å; A308-M312 WeakPolarHBondContact O-CG 3.41Å; A308-M312 PolarHBondContact O-N 3.35Å; A308-M312 VanDerWaalsContact O-N 3.15Å; R309-M312 PolarHBondContact O-N 3.31Å; Q310-M312 VanDerWaalsContact C-N 3.31Å; Q310-M312 PolarHBondContact O-N 3.04Å
313	N	82.1	Confident	86	Confident	119 Å²	119	69.1 Å²	69.1	64%	0.636	34%	0.344	S	S	*	.			trans	-110.7	66.5	178.3	-169.1	1.1	0	0	0	110.7	R309 Q310 G315	R309-N313 PolarHBondContact O-N 2.78Å; R309-N313 VanDerWaalsContact O-N 3.14Å; Q310-N313 CarbonylContact O-C 3.35Å; Q310-N313 PolarHBondContact O-N 2.85Å; N313-G315 PolarHBondContact O-N 3.24Å; N313-G315 VanDerWaalsContact O-N 3.1Å
314	M	76	Confident	86	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.01	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	0.6	-172.6	-80.3	-66	-76.8	0	0	115.7	W283 L286 F287 V290 W298 K311 V316 A317 L318 F329	W283-M314 HydrophobicContact CZ3-CG 4.42Å; L286-M314 HydrophobicContact CD2-CE 4.3Å; L286-M314 HydrophobicContact CG-CE 4.46Å; F287-M314 HydrophobicContact CD1-CE 3.82Å; F287-M314 HydrophobicContact CD1-SD 4.17Å; F287-M314 HydrophobicContact CE1-CE 3.64Å; F287-M314 HydrophobicContact CE1-CG 4.39Å; F287-M314 HydrophobicContact CE1-SD 3.52Å; F287-M314 VanDerWaalsContact CE1-SD 3.52Å; F287-M314 HydrophobicContact CZ-SD 4.45Å; V290-M314 HydrophobicContact CG2-CE 4.35Å; W298-M314 HydrophobicContact CH2-CE 4.13Å; W298-M314 HydrophobicContact CH2-SD 3.32Å; W298-M314 WeakPolarHBondContact CH2-SD 3.45Å; W298-M314 HydrophobicContact CZ3-SD 3.59Å; W298-M314 VanDerWaalsContact CZ3-SD 3.59Å; K311-M314 VanDerWaalsContact O-CG 3.3Å; K311-M314 WeakPolarHBondContact O-CG 3.27Å; M314-V316 VanDerWaalsContact C-N 3.26Å; M314-V316 PolarHBondContact O-N 3.42Å; M314-V316 VanDerWaalsContact O-N 3.14Å; M314-A317 HydrophobicContact CE-CB 3.45Å; M314-A317 VanDerWaalsContact CE-CB 3.45Å; M314-A317 PolarHBondContact O-N 3.37Å; M314-A317 HydrophobicContact SD-CB 3.68Å; M314-L318 HydrophobicContact CB-CD1 3.92Å; M314-L318 HydrophobicContact CB-CG 4.09Å; M314-L318 HydrophobicContact CE-CD2 4.24Å; M314-L318 HydrophobicContact CE-CG 4.27Å; M314-L318 PolarHBondContact O-N 2.9Å; M314-F329 HydrophobicContact CB-CD1 4.44Å; M314-F329 HydrophobicContact CB-CD2 3.7Å; M314-F329 HydrophobicContact CB-CE1 4.17Å; M314-F329 HydrophobicContact CB-CE2 3.37Å; M314-F329 HydrophobicContact CB-CG 4.22Å; M314-F329 HydrophobicContact CB-CZ 3.64Å; M314-F329 HydrophobicContact CG-CD2 3.48Å; M314-F329 VanDerWaalsContact CG-CD2 3.48Å; M314-F329 HydrophobicContact CG-CE2 3.11Å; M314-F329 HydrophobicContact CG-CG 4.43Å; M314-F329 HydrophobicContact CG-CZ 3.86Å
315	G	72.6	Confident	86.3	Confident	42 Å²	42	65.6 Å²	65.6	43%	0.433	33%	0.329	S	S	.	.	H	α-helix	trans	-48.6	-48.8	-174.7	0	0	0	0	0	112.3	N313 A317 L318 M319	N313-G315 PolarHBondContact O-N 3.24Å; N313-G315 VanDerWaalsContact O-N 3.1Å; G315-A317 PolarHBondContact O-N 2.75Å; G315-L318 PolarHBondContact O-N 3.34Å; G315-M319 VanDerWaalsContact O-CG 3.3Å; G315-M319 WeakPolarHBondContact O-CG 3.48Å; G315-M319 PolarHBondContact O-N 3.31Å; G315-M319 VanDerWaalsContact O-N 3.11Å
316	V	72.3	Confident	86.4	Confident	91 Å²	91	64.6 Å²	64.6	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-65.2	-39.8	179.8	-179	0	0	0	0	113.2	P297 M314 M319	P297-V316 HydrophobicContact CB-CG1 4.13Å; M314-V316 VanDerWaalsContact C-N 3.26Å; M314-V316 PolarHBondContact O-N 3.42Å; M314-V316 VanDerWaalsContact O-N 3.14Å; V316-M319 HydrophobicContact CB-CE 4.07Å; V316-M319 HydrophobicContact CG1-CE 3.89Å; V316-M319 HydrophobicContact CG2-CE 4.14Å
317	A	77.3	Confident	86.7	Confident	7 Å²	7	67.8 Å²	67.8	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-69.7	-34.6	-179.8	0	0	0	0	0	112	V290 P297 W298 M314 G315	V290-A317 HydrophobicContact CG1-CB 4.3Å; P297-A317 HydrophobicContact CG-CB 3.88Å; W298-A317 HydrophobicContact CH2-CB 4.34Å; W298-A317 HydrophobicContact CZ3-CB 4.17Å; M314-A317 HydrophobicContact CE-CB 3.45Å; M314-A317 VanDerWaalsContact CE-CB 3.45Å; M314-A317 PolarHBondContact O-N 3.37Å; M314-A317 HydrophobicContact SD-CB 3.68Å; G315-A317 PolarHBondContact O-N 2.75Å
318	L	85.3	Confident	86.9	Confident	16 Å²	16	67.8 Å²	67.8	8%	0.084	33%	0.33	C	S	.	.	H	α-helix	trans	-84.1	-17.3	-178.6	-65.2	176.5	0	0	0	113.6	L286 M314 G315 K320 M321 M325 E326 F329	L286-L318 HydrophobicContact CD1-CD2 4.41Å; M314-L318 HydrophobicContact CB-CD1 3.92Å; M314-L318 HydrophobicContact CB-CG 4.09Å; M314-L318 HydrophobicContact CE-CD2 4.24Å; M314-L318 HydrophobicContact CE-CG 4.27Å; M314-L318 PolarHBondContact O-N 2.9Å; G315-L318 PolarHBondContact O-N 3.34Å; L318-K320 PolarHBondContact O-N 2.7Å; L318-M321 HydrophobicContact CD2-CB 4.45Å; L318-M321 HydrophobicContact CD2-CG 4.35Å; L318-M321 WeakPolarHBondContact O-CB 3.43Å; L318-M321 PolarHBondContact O-N 2.7Å; L318-M325 HydrophobicContact CD2-CB 4.18Å; L318-E326 HydrophobicContact CD1-CG 4.5Å; L318-F329 HydrophobicContact CD1-CB 3.79Å; L318-F329 HydrophobicContact CD1-CD1 4.08Å; L318-F329 HydrophobicContact CD1-CG 3.91Å
319	M	84.5	Confident	87.1	Confident	142 Å²	142	68.7 Å²	68.7	70%	0.7	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.1	177.9	-79.2	-164.2	-73.1	0	0	113.9	G315 V316	G315-M319 VanDerWaalsContact O-CG 3.3Å; G315-M319 WeakPolarHBondContact O-CG 3.48Å; G315-M319 PolarHBondContact O-N 3.31Å; G315-M319 VanDerWaalsContact O-N 3.11Å; V316-M319 HydrophobicContact CB-CE 4.07Å; V316-M319 HydrophobicContact CG1-CE 3.89Å; V316-M319 HydrophobicContact CG2-CE 4.14Å
320	K	86.1	Confident	87.3	Confident	131 Å²	131	63.7 Å²	63.7	57%	0.57	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	4.8	-180	-59.4	-171.6	-175.8	-173.1	0	113.7	N293 D294 L318	N293-K320 PolarHBondContact ND2-O 3.46Å; D294-K320 HydrophobicContact CB-CD 4.48Å; D294-K320 WeakPolarHBondContact OD2-CD 3.34Å; D294-K320 WeakPolarHBondContact OD2-CE 3.27Å; D294-K320 IonicContact OD2-NZ 3.11Å; D294-K320 PolarHBondContact OD2-NZ 3.18Å; L318-K320 PolarHBondContact O-N 2.7Å
321	M	93.5	Very high	87.6	Confident	15 Å²	15	61.4 Å²	61.4	7%	0.074	31%	0.308	C	S	.	.	S	Bend	trans	-104.4	157	176.9	-60.7	-61	-74.6	0	0	109.8	W186 L289 V290 N293 L318 K323 M325	W186-M321 HydrophobicContact CE3-CE 4.37Å; W186-M321 HydrophobicContact CH2-CE 3.45Å; W186-M321 VanDerWaalsContact CH2-CE 3.45Å; W186-M321 HydrophobicContact CZ2-CE 3.65Å; W186-M321 HydrophobicContact CZ3-CE 3.85Å; L289-M321 HydrophobicContact CB-CE 4.42Å; V290-M321 HydrophobicContact CG2-CE 4.39Å; V290-M321 HydrophobicContact CG2-CG 3.97Å; V290-M321 HydrophobicContact CG2-SD 4.2Å; N293-M321 HydrophobicContact CB-CE 4.37Å; N293-M321 HydrophobicContact CB-SD 3.67Å; N293-M321 PolarHBondContact ND2-SD 3.04Å; N293-M321 VanDerWaalsContact ND2-SD 3.39Å; L318-M321 HydrophobicContact CD2-CB 4.45Å; L318-M321 HydrophobicContact CD2-CG 4.35Å; L318-M321 WeakPolarHBondContact O-CB 3.43Å; L318-M321 PolarHBondContact O-N 2.7Å; M321-K323 PolarHBondContact O-N 3.33Å; M321-M325 HydrophobicContact CB-CB 4.22Å; M321-M325 HydrophobicContact CB-CG 4.12Å; M321-M325 HydrophobicContact CE-CE 4.45Å; M321-M325 HydrophobicContact CE-CG 4.35Å
322	P	94.5	Very high	87.7	Confident	19 Å²	19	61.4 Å²	61.4	12%	0.123	31%	0.308	C	S	.	.			trans	-55.5	138.1	169.7	-25.2	35.5	0	0	0	111.3	W186 T324 M325 I353	W186-P322 HydrophobicContact CH2-CG 4.36Å; W186-P322 HydrophobicContact CZ2-CG 4.17Å; P322-T324 PolarHBondContact O-N 3.32Å; P322-M325 VanDerWaalsContact O-CB 3.29Å; P322-M325 WeakPolarHBondContact O-CB 3.44Å; P322-M325 WeakPolarHBondContact O-CG 3.25Å; P322-M325 PolarHBondContact O-N 3.29Å; P322-I353 HydrophobicContact CB-CD1 4.01Å; P322-I353 HydrophobicContact CB-CG1 3.96Å; P322-I353 HydrophobicContact CG-CD1 4.03Å; P322-I353 HydrophobicContact CG-CG1 4.02Å; P322-I353 HydrophobicContact CG-CG2 3.96Å
323	K	93.2	Very high	87.9	Confident	162 Å²	162	61 Å²	61	70%	0.704	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.6	-176.1	-169.2	174.9	-178.2	177.4	0	113.6	M321 M325 E326	M321-K323 PolarHBondContact O-N 3.33Å; K323-M325 PolarHBondContact O-N 3.1Å; K323-M325 VanDerWaalsContact O-N 3.09Å; K323-E326 WeakPolarHBondContact CE-OE2 3.47Å; K323-E326 WeakPolarHBondContact CG-OE2 3.42Å; K323-E326 VanDerWaalsContact O-CB 3.31Å; K323-E326 WeakPolarHBondContact O-CB 3.41Å; K323-E326 WeakPolarHBondContact O-CG 3.29Å; K323-E326 PolarHBondContact O-N 2.94Å
324	T	94.3	Very high	88.2	Confident	69 Å²	69	62.3 Å²	62.3	42%	0.423	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.2	175.3	50.2	0	0	0	0	113.9	P322 E326 R327	P322-T324 PolarHBondContact O-N 3.32Å; T324-E326 VanDerWaalsContact C-N 3.26Å; T324-E326 PolarHBondContact O-N 3.47Å; T324-R327 PolarHBondContact O-N 3.3Å
325	M	94.8	Very high	88.6	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-69.2	-19.4	174.1	-67	-61.7	-64.3	0	0	113.5	W186 L286 L289 L318 M321 P322 K323 R327 F328 F329 I349 L350 I353	W186-M325 HydrophobicContact CH2-SD 4.49Å; L286-M325 HydrophobicContact CD1-CE 3.32Å; L289-M325 HydrophobicContact CD1-CE 4.44Å; L318-M325 HydrophobicContact CD2-CB 4.18Å; M321-M325 HydrophobicContact CB-CB 4.22Å; M321-M325 HydrophobicContact CB-CG 4.12Å; M321-M325 HydrophobicContact CE-CE 4.45Å; M321-M325 HydrophobicContact CE-CG 4.35Å; P322-M325 VanDerWaalsContact O-CB 3.29Å; P322-M325 WeakPolarHBondContact O-CB 3.44Å; P322-M325 WeakPolarHBondContact O-CG 3.25Å; P322-M325 PolarHBondContact O-N 3.29Å; K323-M325 PolarHBondContact O-N 3.1Å; K323-M325 VanDerWaalsContact O-N 3.09Å; M325-R327 VanDerWaalsContact C-N 3.27Å; M325-R327 PolarHBondContact O-N 3.41Å; M325-F328 HydrophobicContact CE-CB 4.35Å; M325-F328 HydrophobicContact CE-CD1 3.84Å; M325-F328 HydrophobicContact CE-CE1 4.49Å; M325-F328 HydrophobicContact CE-CG 4.31Å; M325-F328 VanDerWaalsContact O-CB 3.31Å; M325-F328 WeakPolarHBondContact O-CB 3.23Å; M325-F328 PolarHBondContact O-N 3.02Å; M325-F328 VanDerWaalsContact O-N 3.12Å; M325-F328 HydrophobicContact SD-CD1 4.35Å; M325-F329 PolarHBondContact O-N 3.11Å; M325-F329 VanDerWaalsContact O-N 3.1Å; M325-I349 HydrophobicContact SD-CG2 3.81Å; M325-L350 HydrophobicContact SD-CD2 4.4Å; M325-I353 HydrophobicContact CG-CD1 3.83Å; M325-I353 HydrophobicContact SD-CD1 3.6Å; M325-I353 VanDerWaalsContact SD-CD1 3.6Å
326	E	92.8	Very high	89.1	Confident	81 Å²	81	69.5 Å²	69.5	38%	0.379	32%	0.323	S	S	.	.	H	α-helix	trans	-57.2	-43.8	173.2	-68.8	174.9	172.4	0	0	110.5	L318 K323 T324 F328 F329 E330	L318-E326 HydrophobicContact CD1-CG 4.5Å; K323-E326 WeakPolarHBondContact CE-OE2 3.47Å; K323-E326 WeakPolarHBondContact CG-OE2 3.42Å; K323-E326 VanDerWaalsContact O-CB 3.31Å; K323-E326 WeakPolarHBondContact O-CB 3.41Å; K323-E326 WeakPolarHBondContact O-CG 3.29Å; K323-E326 PolarHBondContact O-N 2.94Å; T324-E326 VanDerWaalsContact C-N 3.26Å; T324-E326 PolarHBondContact O-N 3.47Å; E326-F328 VanDerWaalsContact C-N 3.29Å; E326-F328 PolarHBondContact O-N 3.32Å; E326-F329 WeakPolarHBondContact O-CB 3.41Å; E326-F329 PolarHBondContact O-N 2.96Å; E326-F329 VanDerWaalsContact O-N 3.11Å; E326-E330 VanDerWaalsContact O-CG 3.3Å; E326-E330 WeakPolarHBondContact O-CG 3.37Å; E326-E330 PolarHBondContact O-N 3.15Å
327	R	94.6	Very high	89.1	Confident	153 Å²	153	67 Å²	67	58%	0.577	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-33	176.8	-173.3	177.3	179.5	177.1	2.8	113.2	T324 M325 H331 M345 I349	T324-R327 PolarHBondContact O-N 3.3Å; M325-R327 VanDerWaalsContact C-N 3.27Å; M325-R327 PolarHBondContact O-N 3.41Å; R327-H331 WeakPolarHBondContact O-CB 3.38Å; R327-H331 PolarHBondContact O-N 2.85Å; R327-H331 VanDerWaalsContact O-N 3.17Å; R327-M345 HydrophobicContact CG-SD 3.87Å; R327-M345 PolarHBondContact NE-SD 2.85Å; R327-I349 HydrophobicContact CB-CD1 4.05Å; R327-I349 HydrophobicContact CG-CD1 4.23Å
328	F	95.3	Very high	89.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-52.4	173	-164.1	141.5	0	0	0	109	L285 M325 E326 H331 L332 M346 I349	L285-F328 HydrophobicContact CD2-CZ 4.34Å; M325-F328 HydrophobicContact CE-CB 4.35Å; M325-F328 HydrophobicContact CE-CD1 3.84Å; M325-F328 HydrophobicContact CE-CE1 4.49Å; M325-F328 HydrophobicContact CE-CG 4.31Å; M325-F328 VanDerWaalsContact O-CB 3.31Å; M325-F328 WeakPolarHBondContact O-CB 3.23Å; M325-F328 PolarHBondContact O-N 3.02Å; M325-F328 VanDerWaalsContact O-N 3.12Å; M325-F328 HydrophobicContact SD-CD1 4.35Å; E326-F328 VanDerWaalsContact C-N 3.29Å; E326-F328 PolarHBondContact O-N 3.32Å; F328-H331 PolarHBondContact O-N 3.01Å; F328-L332 HydrophobicContact CD2-CD1 3.86Å; F328-L332 HydrophobicContact CD2-CG 4.02Å; F328-L332 HydrophobicContact CE2-CD1 3.78Å; F328-L332 HydrophobicContact CE2-CD2 4.34Å; F328-L332 HydrophobicContact CE2-CG 4.08Å; F328-L332 PolarHBondContact O-N 2.72Å; F328-M346 HydrophobicContact CD1-CB 4.21Å; F328-M346 HydrophobicContact CD1-CG 4.03Å; F328-M346 HydrophobicContact CD2-CE 3.97Å; F328-M346 HydrophobicContact CD2-CG 4.1Å; F328-M346 HydrophobicContact CD2-SD 4.23Å; F328-M346 HydrophobicContact CE1-CB 3.83Å; F328-M346 HydrophobicContact CE1-CG 3.81Å; F328-M346 HydrophobicContact CE1-SD 4.16Å; F328-M346 HydrophobicContact CE2-CE 3.56Å; F328-M346 HydrophobicContact CE2-CG 3.85Å; F328-M346 HydrophobicContact CE2-SD 3.48Å; F328-M346 WeakPolarHBondContact CE2-SD 3.38Å; F328-M346 HydrophobicContact CG-CG 4.17Å; F328-M346 HydrophobicContact CZ-CB 4.08Å; F328-M346 HydrophobicContact CZ-CE 4.19Å; F328-M346 HydrophobicContact CZ-CG 3.71Å; F328-M346 HydrophobicContact CZ-SD 3.45Å; F328-M346 WeakPolarHBondContact CZ-SD 3.4Å; F328-I349 HydrophobicContact CB-CD1 4.19Å
329	F	92.7	Very high	89.3	Confident	24 Å²	24	69.7 Å²	69.7	11%	0.105	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-48.5	-179.8	168	-104.4	0	0	0	112.8	W283 L286 M314 L318 M325 E326 H331 L332 L333	W283-F329 AromaticContact CH2-CD2 3.41Å; W283-F329 HydrophobicContact CH2-CD2 3.41Å; W283-F329 VanDerWaalsContact CH2-CD2 3.41Å; W283-F329 AromaticContact CH2-CE2 3.28Å; W283-F329 HydrophobicContact CH2-CE2 3.28Å; W283-F329 HydrophobicContact CH2-CZ 4.37Å; W283-F329 AromaticContact CZ3-CD2 3.47Å; W283-F329 HydrophobicContact CZ3-CD2 3.47Å; W283-F329 VanDerWaalsContact CZ3-CD2 3.47Å; W283-F329 AromaticContact CZ3-CE2 3.54Å; W283-F329 HydrophobicContact CZ3-CE2 3.54Å; L286-F329 HydrophobicContact CD2-CB 4.07Å; L286-F329 HydrophobicContact CD2-CD2 4.21Å; M314-F329 HydrophobicContact CB-CD1 4.44Å; M314-F329 HydrophobicContact CB-CD2 3.7Å; M314-F329 HydrophobicContact CB-CE1 4.17Å; M314-F329 HydrophobicContact CB-CE2 3.37Å; M314-F329 HydrophobicContact CB-CG 4.22Å; M314-F329 HydrophobicContact CB-CZ 3.64Å; M314-F329 HydrophobicContact CG-CD2 3.48Å; M314-F329 VanDerWaalsContact CG-CD2 3.48Å; M314-F329 HydrophobicContact CG-CE2 3.11Å; M314-F329 HydrophobicContact CG-CG 4.43Å; M314-F329 HydrophobicContact CG-CZ 3.86Å; L318-F329 HydrophobicContact CD1-CB 3.79Å; L318-F329 HydrophobicContact CD1-CD1 4.08Å; L318-F329 HydrophobicContact CD1-CG 3.91Å; M325-F329 PolarHBondContact O-N 3.11Å; M325-F329 VanDerWaalsContact O-N 3.1Å; E326-F329 WeakPolarHBondContact O-CB 3.41Å; E326-F329 PolarHBondContact O-N 2.96Å; E326-F329 VanDerWaalsContact O-N 3.11Å; F329-H331 VanDerWaalsContact C-N 3.32Å; F329-H331 PolarHBondContact O-N 3.1Å; F329-L332 WeakPolarHBondContact O-CB 3.26Å; F329-L332 PolarHBondContact O-N 3.05Å; F329-L333 HydrophobicContact CD1-CD1 4.1Å; F329-L333 HydrophobicContact CE1-CD1 3.42Å; F329-L333 VanDerWaalsContact CE1-CD1 3.42Å; F329-L333 HydrophobicContact CE1-CG 4.17Å; F329-L333 HydrophobicContact CE2-CD1 4.25Å; F329-L333 HydrophobicContact CE2-CD2 4.27Å; F329-L333 HydrophobicContact CE2-CG 4.17Å; F329-L333 HydrophobicContact CZ-CD1 3.5Å; F329-L333 HydrophobicContact CZ-CD2 4.1Å; F329-L333 HydrophobicContact CZ-CG 3.92Å; F329-L333 PolarHBondContact O-N 3Å; F329-L333 VanDerWaalsContact O-N 3.08Å
330	E	91.4	Very high	89.7	Confident	97 Å²	97	64.4 Å²	64.4	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-55.4	-46.7	177.4	-73.1	167	176.4	0	0	111.5	E326 L332 L333 E334	E326-E330 VanDerWaalsContact O-CG 3.3Å; E326-E330 WeakPolarHBondContact O-CG 3.37Å; E326-E330 PolarHBondContact O-N 3.15Å; E330-L332 VanDerWaalsContact C-N 3.28Å; E330-L332 PolarHBondContact O-N 3.5Å; E330-L333 WeakPolarHBondContact O-CB 3.4Å; E330-L333 PolarHBondContact O-N 2.79Å; E330-L333 VanDerWaalsContact O-N 3.12Å; E330-E334 WeakPolarHBondContact O-CG 3.47Å; E330-E334 PolarHBondContact O-N 3.42Å; E330-E334 VanDerWaalsContact O-N 3.07Å
331	H	94.4	Very high	90.1	Very high	24 Å²	24	58.1 Å²	58.1	11%	0.111	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-39	176.8	178	72.5	0	0	0	112.5	R327 F328 F329 L333 E334 C335 N342 M345 M346	R327-H331 WeakPolarHBondContact O-CB 3.38Å; R327-H331 PolarHBondContact O-N 2.85Å; R327-H331 VanDerWaalsContact O-N 3.17Å; F328-H331 PolarHBondContact O-N 3.01Å; F329-H331 VanDerWaalsContact C-N 3.32Å; F329-H331 PolarHBondContact O-N 3.1Å; H331-L333 VanDerWaalsContact C-N 3.34Å; H331-E334 PolarHBondContact O-N 2.92Å; H331-C335 WeakPolarHBondContact O-CB 3.3Å; H331-C335 PolarHBondContact O-N 2.76Å; H331-N342 PolarHBondContact CE1-N 2.78Å; H331-N342 PolarHBondContact NE2-N 2.94Å; H331-M345 HydrophobicContact CB-CE 3.57Å; H331-M345 HydrophobicContact CB-SD 4.34Å; H331-M346 VanDerWaalsContact CD2-CE 3.44Å; H331-M346 WeakPolarHBondContact CD2-CE 3.42Å
332	L	91.9	Very high	90.3	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.7	-30	178.3	-68.2	-179.8	0	0	0	113.3	K279 L282 W283 L286 F328 F329 E330 M346	K279-L332 HydrophobicContact CB-CD2 4.37Å; L282-L332 HydrophobicContact CB-CD2 3.73Å; W283-L332 HydrophobicContact CD2-CB 4.09Å; W283-L332 HydrophobicContact CD2-CD1 3.76Å; W283-L332 VanDerWaalsContact CE2-CB 3.48Å; W283-L332 HydrophobicContact CE3-CD1 4Å; W283-L332 HydrophobicContact CG-CD1 3.99Å; W283-L332 HydrophobicContact CH2-CB 4.17Å; W283-L332 HydrophobicContact CZ2-CB 3.52Å; L286-L332 HydrophobicContact CB-CD1 4.34Å; L286-L332 HydrophobicContact CD2-CD1 4.09Å; F328-L332 HydrophobicContact CD2-CD1 3.86Å; F328-L332 HydrophobicContact CD2-CG 4.02Å; F328-L332 HydrophobicContact CE2-CD1 3.78Å; F328-L332 HydrophobicContact CE2-CD2 4.34Å; F328-L332 HydrophobicContact CE2-CG 4.08Å; F328-L332 PolarHBondContact O-N 2.72Å; F329-L332 WeakPolarHBondContact O-CB 3.26Å; F329-L332 PolarHBondContact O-N 3.05Å; E330-L332 VanDerWaalsContact C-N 3.28Å; E330-L332 PolarHBondContact O-N 3.5Å; L332-M346 HydrophobicContact CD2-CE 3.74Å; L332-M346 HydrophobicContact CG-CE 4.34Å
333	L	87.3	Confident	90.4	Very high	86 Å²	86	59.7 Å²	59.7	45%	0.45	28%	0.276	S	S	.	.	H	α-helix	trans	-66.6	-46	172.6	-71.9	176.3	0	0	0	111	W283 F329 E330 H331	W283-L333 HydrophobicContact CH2-CD2 3.89Å; W283-L333 HydrophobicContact CH2-CG 4.18Å; W283-L333 HydrophobicContact CZ2-CD2 3.92Å; W283-L333 HydrophobicContact CZ2-CG 4.25Å; F329-L333 HydrophobicContact CD1-CD1 4.1Å; F329-L333 HydrophobicContact CE1-CD1 3.42Å; F329-L333 VanDerWaalsContact CE1-CD1 3.42Å; F329-L333 HydrophobicContact CE1-CG 4.17Å; F329-L333 HydrophobicContact CE2-CD1 4.25Å; F329-L333 HydrophobicContact CE2-CD2 4.27Å; F329-L333 HydrophobicContact CE2-CG 4.17Å; F329-L333 HydrophobicContact CZ-CD1 3.5Å; F329-L333 HydrophobicContact CZ-CD2 4.1Å; F329-L333 HydrophobicContact CZ-CG 3.92Å; F329-L333 PolarHBondContact O-N 3Å; F329-L333 VanDerWaalsContact O-N 3.08Å; E330-L333 WeakPolarHBondContact O-CB 3.4Å; E330-L333 PolarHBondContact O-N 2.79Å; E330-L333 VanDerWaalsContact O-N 3.12Å; H331-L333 VanDerWaalsContact C-N 3.34Å
334	E	86.8	Confident	90.6	Very high	147 Å²	147	54.5 Å²	54.5	69%	0.687	25%	0.254	S	S	*	.	H	α-helix	trans	-75.2	-30.3	-177.2	-66.7	176	176.8	0	0	113.1	E330 H331 R336	E330-E334 WeakPolarHBondContact O-CG 3.47Å; E330-E334 PolarHBondContact O-N 3.42Å; E330-E334 VanDerWaalsContact O-N 3.07Å; H331-E334 PolarHBondContact O-N 2.92Å; E334-R336 PolarHBondContact O-N 3.11Å
335	C	85.6	Confident	90.8	Very high	1 Å²	1	52 Å²	52	1%	0.007	24%	0.238	C	C	.	.			trans	-63.5	123.4	-174.4	-173.5	0	0	0	0	111.3	K279 H331	K279-C335 HydrophobicContact CD-CB 4.18Å; K279-C335 WeakPolarHBondContact CD-O 3.42Å; K279-C335 WeakPolarHBondContact CE-O 3.48Å; K279-C335 PolarHBondContact NZ-O 3.48Å; H331-C335 WeakPolarHBondContact O-CB 3.3Å; H331-C335 PolarHBondContact O-N 2.76Å
336	R	82.2	Confident	91	Very high	193 Å²	193	52 Å²	52	73%	0.728	24%	0.238	S	C	*	.			trans	-75.8	161.2	177	-62.4	-179.2	-180	171.7	0	111.4	E334 L338 Q339	E334-R336 PolarHBondContact O-N 3.11Å; R336-L338 PolarHBondContact O-N 3.45Å; R336-L338 VanDerWaalsContact O-N 3.08Å; R336-Q339 HydrophobicContact CB-CB 4.09Å; R336-Q339 VanDerWaalsContact N-OE1 3.09Å; R336-Q339 PolarHBondContact O-N 3.43Å; R336-Q339 VanDerWaalsContact O-N 3.09Å
337	A	72.8	Confident	91.2	Very high	39 Å²	39	48.1 Å²	48.1	32%	0.322	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.6	-173.8	0	0	0	0	0	115.2
338	L	80.7	Confident	91.3	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.052	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-6.6	179	-67.4	174.4	0	0	0	113.9	A250 L253 R278 R336 P403 C406	A250-L338 HydrophobicContact CB-CD2 4.38Å; L253-L338 HydrophobicContact CD1-CD1 3.91Å; L253-L338 HydrophobicContact CD1-CG 4.18Å; L253-L338 HydrophobicContact CD2-CD1 4.31Å; L253-L338 HydrophobicContact CD2-CD2 3.97Å; L253-L338 HydrophobicContact CD2-CG 4.04Å; L253-L338 HydrophobicContact CG-CD1 4.1Å; L253-L338 HydrophobicContact CG-CG 4.35Å; R278-L338 PolarHBondContact NH2-O 3.31Å; R336-L338 PolarHBondContact O-N 3.45Å; R336-L338 VanDerWaalsContact O-N 3.08Å; L338-P403 HydrophobicContact CD1-CB 3.99Å; L338-P403 HydrophobicContact CD1-CG 4.09Å; L338-C406 WeakPolarHBondContact CD1-SG 3.35Å
339	Q	86.7	Confident	91.5	Very high	70 Å²	70	44.9 Å²	44.9	33%	0.327	21%	0.214	S	C	.	.	S	Bend	trans	-66.1	139.1	176.4	-177.9	176.4	-4.1	0	0	109	R278 R336 P341	R278-Q339 PolarHBondContact NH2-O 3.03Å; R336-Q339 HydrophobicContact CB-CB 4.09Å; R336-Q339 VanDerWaalsContact N-OE1 3.09Å; R336-Q339 PolarHBondContact O-N 3.43Å; R336-Q339 VanDerWaalsContact O-N 3.09Å; Q339-P341 VanDerWaalsContact O-CD 3.3Å; Q339-P341 WeakPolarHBondContact O-CD 3.47Å
340	R	92.3	Very high	91.7	Very high	30 Å²	30	43.8 Å²	43.8	11%	0.113	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-68.5	123.3	171.4	-178.3	175.8	177.9	-78	4.5	108.5	K198 E202 Y343 F393 I395 D396 N401	K198-R340 VanDerWaalsContact CE-NH2 3.3Å; E202-R340 IonicContact OE1-NH2 3.89Å; R340-Y343 HydrophobicContact CG-CD2 4.35Å; R340-Y343 HydrophobicContact CG-CE2 3.91Å; R340-F393 PolarHBondContact NH2-O 3.25Å; R340-I395 PolarHBondContact NH2-O 3.27Å; R340-D396 WeakPolarHBondContact CD-OD1 3.41Å; R340-D396 WeakPolarHBondContact CD-OD2 3.45Å; R340-D396 IonicContact NE-OD1 3.21Å; R340-N401 WeakPolarHBondContact CB-OD1 3.39Å; R340-N401 PolarHBondContact N-OD1 2.88Å
341	P	95.5	Very high	91.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-59.5	148.8	170.6	-22.9	35	0	0	0	111.2	R278 K279 L282 Q339 Y343 M346	R278-P341 HydrophobicContact CB-CG 4.05Å; K279-P341 HydrophobicContact CB-CG 4.25Å; L282-P341 HydrophobicContact CD1-CB 3.21Å; L282-P341 HydrophobicContact CD1-CG 3.46Å; L282-P341 VanDerWaalsContact CD1-CG 3.46Å; Q339-P341 VanDerWaalsContact O-CD 3.3Å; Q339-P341 WeakPolarHBondContact O-CD 3.47Å; P341-Y343 VanDerWaalsContact C-N 3.3Å; P341-Y343 HydrophobicContact CB-CE2 4.22Å; P341-Y343 HydrophobicContact CG-CE2 4.41Å; P341-Y343 WeakPolarHBondContact O-CD2 3.42Å; P341-Y343 WeakPolarHBondContact O-CE2 3.32Å; P341-Y343 PolarHBondContact O-N 3.08Å; P341-M346 HydrophobicContact CB-CE 4.2Å
342	N	96.5	Very high	91.9	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	20%	0.204	S	C	.	.			trans	-81.1	78.9	177.3	-168.2	-20.5	0	0	0	110.4	H331 H344 M345 M346	H331-N342 PolarHBondContact CE1-N 2.78Å; H331-N342 PolarHBondContact NE2-N 2.94Å; N342-H344 PolarHBondContact O-N 3.32Å; N342-H344 PolarHBondContact OD1-N 3.47Å; N342-M345 HydrophobicContact CB-CB 4.02Å; N342-M345 VanDerWaalsContact CG-CB 3.43Å; N342-M345 PolarHBondContact O-N 3.23Å; N342-M345 WeakPolarHBondContact OD1-CB 3.44Å; N342-M345 PolarHBondContact OD1-N 3.46Å; N342-M346 WeakPolarHBondContact O-CG 3.48Å; N342-M346 PolarHBondContact O-N 2.88Å
343	Y	97.8	Very high	92	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-36.3	179.1	-58.8	-90.4	0	0	0	112.3	L194 K198 H201 L282 R340 P341 M346 F347	L194-Y343 HydrophobicContact CD1-CD1 3.84Å; K198-Y343 HydrophobicContact CB-CD1 3.84Å; K198-Y343 HydrophobicContact CB-CE1 4.06Å; K198-Y343 HydrophobicContact CB-CG 4.27Å; K198-Y343 HydrophobicContact CD-CD1 4.5Å; K198-Y343 HydrophobicContact CD-CD2 4.36Å; K198-Y343 HydrophobicContact CD-CG 4.08Å; K198-Y343 HydrophobicContact CG-CD1 4.3Å; K198-Y343 HydrophobicContact CG-CD2 4.43Å; K198-Y343 HydrophobicContact CG-CG 4.25Å; H201-Y343 AromaticContact ND1-CE1 3.61Å; H201-Y343 AromaticContact ND1-CZ 3.58Å; H201-Y343 PolarHBondContact ND1-OH 3Å; L282-Y343 HydrophobicContact CD1-CD1 4.35Å; L282-Y343 HydrophobicContact CD1-CE1 3.84Å; L282-Y343 HydrophobicContact CD2-CD1 4.44Å; L282-Y343 HydrophobicContact CD2-CE1 4.11Å; L282-Y343 HydrophobicContact CG-CE1 4.43Å; R340-Y343 HydrophobicContact CG-CD2 4.35Å; R340-Y343 HydrophobicContact CG-CE2 3.91Å; P341-Y343 VanDerWaalsContact C-N 3.3Å; P341-Y343 HydrophobicContact CB-CE2 4.22Å; P341-Y343 HydrophobicContact CG-CE2 4.41Å; P341-Y343 WeakPolarHBondContact O-CD2 3.42Å; P341-Y343 WeakPolarHBondContact O-CE2 3.32Å; P341-Y343 PolarHBondContact O-N 3.08Å; Y343-M346 PolarHBondContact O-N 3.22Å; Y343-F347 WeakPolarHBondContact O-CB 3.48Å; Y343-F347 PolarHBondContact O-N 3.41Å
344	H	97.4	Very high	92.4	Very high	53 Å²	53	37 Å²	37	25%	0.245	18%	0.184	C	C	.	.	H	α-helix	trans	-65.3	-42.5	179.8	-175.6	75.2	0	0	0	112.3	N342 M346 F347 N348 T389 G390 F393 A394	N342-H344 PolarHBondContact O-N 3.32Å; N342-H344 PolarHBondContact OD1-N 3.47Å; H344-M346 VanDerWaalsContact C-N 3.33Å; H344-M346 PolarHBondContact O-N 2.85Å; H344-F347 PolarHBondContact O-N 3.01Å; H344-N348 PolarHBondContact CD2-ND2 2.99Å; H344-N348 PolarHBondContact NE2-ND2 3.11Å; H344-N348 PolarHBondContact O-N 3.18Å; H344-N348 PolarHBondContact O-ND2 3.21Å; H344-T389 PolarHBondContact CE1-O 2.76Å; H344-G390 PolarHBondContact CE1-O 2.81Å; H344-G390 PolarHBondContact ND1-O 3.4Å; H344-F393 HydrophobicContact CB-CB 4.03Å; H344-A394 HydrophobicContact CB-CB 4.13Å
345	M	97.9	Very high	92.6	Very high	17 Å²	17	33.6 Å²	33.6	8%	0.084	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-43.9	172.5	-178.8	-155.8	71	0	0	111.5	R327 H331 N342 N348 I349	R327-M345 HydrophobicContact CG-SD 3.87Å; R327-M345 PolarHBondContact NE-SD 2.85Å; H331-M345 HydrophobicContact CB-CE 3.57Å; H331-M345 HydrophobicContact CB-SD 4.34Å; N342-M345 HydrophobicContact CB-CB 4.02Å; N342-M345 VanDerWaalsContact CG-CB 3.43Å; N342-M345 PolarHBondContact O-N 3.23Å; N342-M345 WeakPolarHBondContact OD1-CB 3.44Å; N342-M345 PolarHBondContact OD1-N 3.46Å; M345-N348 PolarHBondContact O-N 3.45Å; M345-I349 HydrophobicContact CE-CD1 4.13Å; M345-I349 HydrophobicContact CG-CD1 4.14Å; M345-I349 WeakPolarHBondContact O-CG1 3.49Å; M345-I349 PolarHBondContact O-N 2.81Å
346	M	98.3	Very high	93	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-41.6	178.2	-65.3	172.8	-176	0	0	111.7	L194 L282 F328 H331 L332 P341 N342 Y343 H344 I349 L350	L194-M346 HydrophobicContact CD1-CB 4.22Å; L194-M346 HydrophobicContact CD1-SD 4.07Å; L194-M346 HydrophobicContact CD2-CB 3.74Å; L282-M346 HydrophobicContact CD1-CE 3.83Å; L282-M346 HydrophobicContact CD1-SD 3.79Å; L282-M346 HydrophobicContact CD2-SD 4.23Å; L282-M346 HydrophobicContact CG-SD 4.43Å; F328-M346 HydrophobicContact CD1-CB 4.21Å; F328-M346 HydrophobicContact CD1-CG 4.03Å; F328-M346 HydrophobicContact CD2-CE 3.97Å; F328-M346 HydrophobicContact CD2-CG 4.1Å; F328-M346 HydrophobicContact CD2-SD 4.23Å; F328-M346 HydrophobicContact CE1-CB 3.83Å; F328-M346 HydrophobicContact CE1-CG 3.81Å; F328-M346 HydrophobicContact CE1-SD 4.16Å; F328-M346 HydrophobicContact CE2-CE 3.56Å; F328-M346 HydrophobicContact CE2-CG 3.85Å; F328-M346 HydrophobicContact CE2-SD 3.48Å; F328-M346 WeakPolarHBondContact CE2-SD 3.38Å; F328-M346 HydrophobicContact CG-CG 4.17Å; F328-M346 HydrophobicContact CZ-CB 4.08Å; F328-M346 HydrophobicContact CZ-CE 4.19Å; F328-M346 HydrophobicContact CZ-CG 3.71Å; F328-M346 HydrophobicContact CZ-SD 3.45Å; F328-M346 WeakPolarHBondContact CZ-SD 3.4Å; H331-M346 VanDerWaalsContact CD2-CE 3.44Å; H331-M346 WeakPolarHBondContact CD2-CE 3.42Å; L332-M346 HydrophobicContact CD2-CE 3.74Å; L332-M346 HydrophobicContact CG-CE 4.34Å; P341-M346 HydrophobicContact CB-CE 4.2Å; N342-M346 WeakPolarHBondContact O-CG 3.48Å; N342-M346 PolarHBondContact O-N 2.88Å; Y343-M346 PolarHBondContact O-N 3.22Å; H344-M346 VanDerWaalsContact C-N 3.33Å; H344-M346 PolarHBondContact O-N 2.85Å; M346-I349 PolarHBondContact O-N 3.36Å; M346-L350 WeakPolarHBondContact O-CG 3.37Å; M346-L350 PolarHBondContact O-N 3.22Å
347	F	97.9	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-50.8	173.1	168.3	-97.7	0	0	0	111.1	I191 L194 Y343 H344 I349 L350 K351 E387 F393	I191-F347 HydrophobicContact CD1-CE2 4.42Å; I191-F347 HydrophobicContact CG1-CD2 4.3Å; I191-F347 HydrophobicContact CG1-CE2 4.46Å; I191-F347 HydrophobicContact CG2-CD2 3.95Å; I191-F347 HydrophobicContact CG2-CE2 3.86Å; L194-F347 HydrophobicContact CD2-CB 4.03Å; Y343-F347 WeakPolarHBondContact O-CB 3.48Å; Y343-F347 PolarHBondContact O-N 3.41Å; H344-F347 PolarHBondContact O-N 3.01Å; F347-I349 VanDerWaalsContact C-N 3.28Å; F347-I349 PolarHBondContact O-N 3.47Å; F347-L350 PolarHBondContact O-N 2.82Å; F347-L350 VanDerWaalsContact O-N 3.1Å; F347-K351 HydrophobicContact CE1-CB 4.28Å; F347-K351 HydrophobicContact CE1-CG 4.42Å; F347-K351 HydrophobicContact CE2-CD 4.36Å; F347-K351 HydrophobicContact CZ-CB 4.19Å; F347-K351 HydrophobicContact CZ-CD 4Å; F347-K351 HydrophobicContact CZ-CG 4.14Å; F347-K351 VanDerWaalsContact O-CB 3.32Å; F347-K351 WeakPolarHBondContact O-CB 3.42Å; F347-K351 PolarHBondContact O-N 3.09Å; F347-E387 WeakPolarHBondContact CZ-O 3.41Å; F347-F393 HydrophobicContact CB-CB 4.24Å; F347-F393 HydrophobicContact CB-CD1 4.28Å; F347-F393 HydrophobicContact CB-CD2 3.62Å; F347-F393 HydrophobicContact CB-CE2 3.96Å; F347-F393 HydrophobicContact CB-CG 3.79Å; F347-F393 HydrophobicContact CB-CZ 4.4Å; F347-F393 HydrophobicContact CD1-CD2 4.07Å; F347-F393 HydrophobicContact CD1-CE2 4.44Å; F347-F393 AromaticContact CD2-CD2 3.54Å; F347-F393 HydrophobicContact CD2-CD2 3.54Å; F347-F393 AromaticContact CD2-CE2 3.12Å; F347-F393 HydrophobicContact CD2-CE2 3.12Å; F347-F393 HydrophobicContact CD2-CG 4.48Å; F347-F393 AromaticContact CD2-CZ 3.77Å; F347-F393 HydrophobicContact CD2-CZ 3.77Å; F347-F393 HydrophobicContact CE2-CD2 4.21Å; F347-F393 AromaticContact CE2-CE2 3.66Å; F347-F393 HydrophobicContact CE2-CE2 3.66Å; F347-F393 HydrophobicContact CE2-CZ 4.49Å; F347-F393 AromaticContact CG-CD2 3.44Å; F347-F393 HydrophobicContact CG-CD2 3.44Å; F347-F393 VanDerWaalsContact CG-CD2 3.44Å; F347-F393 AromaticContact CG-CE2 3.58Å; F347-F393 HydrophobicContact CG-CE2 3.58Å; F347-F393 HydrophobicContact CG-CG 4.15Å; F347-F393 HydrophobicContact CG-CZ 4.35Å
348	N	97.1	Very high	94.2	Very high	71 Å²	71	38.4 Å²	38.4	38%	0.38	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-36.3	-179.8	-71.2	-22.1	0	0	0	112.6	H344 M345 G352	H344-N348 PolarHBondContact CD2-ND2 2.99Å; H344-N348 PolarHBondContact NE2-ND2 3.11Å; H344-N348 PolarHBondContact O-N 3.18Å; H344-N348 PolarHBondContact O-ND2 3.21Å; M345-N348 PolarHBondContact O-N 3.45Å; N348-G352 PolarHBondContact O-N 3.47Å
349	I	97.6	Very high	94.6	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.077	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-51.4	173.1	-70.1	165	0	0	0	110.3	M325 R327 F328 M345 M346 F347 K351 G352 I353	M325-I349 HydrophobicContact SD-CG2 3.81Å; R327-I349 HydrophobicContact CB-CD1 4.05Å; R327-I349 HydrophobicContact CG-CD1 4.23Å; F328-I349 HydrophobicContact CB-CD1 4.19Å; M345-I349 HydrophobicContact CE-CD1 4.13Å; M345-I349 HydrophobicContact CG-CD1 4.14Å; M345-I349 WeakPolarHBondContact O-CG1 3.49Å; M345-I349 PolarHBondContact O-N 2.81Å; M346-I349 PolarHBondContact O-N 3.36Å; F347-I349 VanDerWaalsContact C-N 3.28Å; F347-I349 PolarHBondContact O-N 3.47Å; I349-K351 PolarHBondContact O-N 3.28Å; I349-G352 PolarHBondContact O-N 3.38Å; I349-I353 HydrophobicContact CG2-CD1 3.9Å; I349-I353 VanDerWaalsContact O-CG1 3.24Å; I349-I353 WeakPolarHBondContact O-CG1 3.41Å; I349-I353 PolarHBondContact O-N 3.32Å
350	L	97.1	Very high	94.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-38.9	-179.1	-66.3	170.9	0	0	0	112.1	W186 I191 L194 L289 M325 M346 F347 I353 Q354	W186-L350 HydrophobicContact CZ3-CD2 4Å; I191-L350 HydrophobicContact CD1-CB 4.31Å; I191-L350 HydrophobicContact CG1-CB 3.7Å; I191-L350 HydrophobicContact CG1-CD1 4.32Å; L194-L350 HydrophobicContact CD2-CD1 4.19Å; L289-L350 HydrophobicContact CD1-CD2 3.67Å; M325-L350 HydrophobicContact SD-CD2 4.4Å; M346-L350 WeakPolarHBondContact O-CG 3.37Å; M346-L350 PolarHBondContact O-N 3.22Å; F347-L350 PolarHBondContact O-N 2.82Å; F347-L350 VanDerWaalsContact O-N 3.1Å; L350-I353 PolarHBondContact O-N 2.58Å; L350-Q354 PolarHBondContact O-N 3.39Å
351	K	95	Very high	94.1	Very high	25 Å²	25	40.3 Å²	40.3	11%	0.109	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-44	176.7	-167.7	70.5	-177	177.8	0	111.5	I191 F347 I349 I353 Q354 S355	I191-K351 HydrophobicContact CD1-CB 4.48Å; I191-K351 HydrophobicContact CD1-CD 4.09Å; F347-K351 HydrophobicContact CE1-CB 4.28Å; F347-K351 HydrophobicContact CE1-CG 4.42Å; F347-K351 HydrophobicContact CE2-CD 4.36Å; F347-K351 HydrophobicContact CZ-CB 4.19Å; F347-K351 HydrophobicContact CZ-CD 4Å; F347-K351 HydrophobicContact CZ-CG 4.14Å; F347-K351 VanDerWaalsContact O-CB 3.32Å; F347-K351 WeakPolarHBondContact O-CB 3.42Å; F347-K351 PolarHBondContact O-N 3.09Å; I349-K351 PolarHBondContact O-N 3.28Å; K351-I353 VanDerWaalsContact C-N 3.29Å; K351-I353 PolarHBondContact O-N 3.46Å; K351-Q354 WeakPolarHBondContact O-CB 3.42Å; K351-Q354 PolarHBondContact O-N 2.84Å; K351-S355 PolarHBondContact O-N 3.25Å; K351-S355 PolarHBondContact O-OG 3.27Å
352	G	95.2	Very high	93.5	Very high	34 Å²	34	44 Å²	44	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-39.1	173.6	0	0	0	0	0	112.4	N348 I349 S355 L356	N348-G352 PolarHBondContact O-N 3.47Å; I349-G352 PolarHBondContact O-N 3.38Å; G352-S355 PolarHBondContact O-N 3.46Å; G352-L356 WeakPolarHBondContact O-CG 3.43Å; G352-L356 PolarHBondContact O-N 3.12Å; G352-L356 VanDerWaalsContact O-N 3.11Å
353	I	95.5	Very high	93.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-41.3	175.3	-68.1	167.3	0	0	0	111.5	R183 W186 P322 M325 I349 L350 K351 L356 S357	R183-I353 HydrophobicContact CG-CG2 3.5Å; W186-I353 HydrophobicContact CH2-CD1 3.91Å; W186-I353 HydrophobicContact CH2-CG2 3.7Å; W186-I353 HydrophobicContact CZ2-CG2 3.91Å; W186-I353 HydrophobicContact CZ3-CG2 4.39Å; P322-I353 HydrophobicContact CB-CD1 4.01Å; P322-I353 HydrophobicContact CB-CG1 3.96Å; P322-I353 HydrophobicContact CG-CD1 4.03Å; P322-I353 HydrophobicContact CG-CG1 4.02Å; P322-I353 HydrophobicContact CG-CG2 3.96Å; M325-I353 HydrophobicContact CG-CD1 3.83Å; M325-I353 HydrophobicContact SD-CD1 3.6Å; M325-I353 VanDerWaalsContact SD-CD1 3.6Å; I349-I353 HydrophobicContact CG2-CD1 3.9Å; I349-I353 VanDerWaalsContact O-CG1 3.24Å; I349-I353 WeakPolarHBondContact O-CG1 3.41Å; I349-I353 PolarHBondContact O-N 3.32Å; L350-I353 PolarHBondContact O-N 2.58Å; K351-I353 VanDerWaalsContact C-N 3.29Å; K351-I353 PolarHBondContact O-N 3.46Å; I353-L356 PolarHBondContact O-N 3.24Å; I353-S357 PolarHBondContact O-N 3.31Å
354	Q	93.8	Very high	93	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.023	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-49.5	173.3	179.2	-166.5	2.3	0	0	110.5	R188 L350 K351 L356 S357 D359	R188-Q354 HydrophobicContact CG-CG 3.94Å; L350-Q354 PolarHBondContact O-N 3.39Å; K351-Q354 WeakPolarHBondContact O-CB 3.42Å; K351-Q354 PolarHBondContact O-N 2.84Å; Q354-L356 VanDerWaalsContact C-N 3.27Å; Q354-L356 PolarHBondContact O-N 2.65Å; Q354-S357 PolarHBondContact O-N 2.94Å; Q354-S357 PolarHBondContact O-OG 3.3Å; Q354-D359 WeakPolarHBondContact CG-O 3.24Å; Q354-D359 PolarHBondContact NE2-O 2.94Å
355	S	92.4	Very high	92.9	Very high	77 Å²	77	43.5 Å²	43.5	54%	0.538	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-34.9	-179.3	-62.5	0	0	0	0	112.9	K351 G352 S357 E358	K351-S355 PolarHBondContact O-N 3.25Å; K351-S355 PolarHBondContact O-OG 3.27Å; G352-S355 PolarHBondContact O-N 3.46Å; S355-S357 PolarHBondContact O-N 2.7Å; S355-E358 PolarHBondContact O-N 3.03Å; S355-E358 VanDerWaalsContact O-N 3.14Å
356	L	92.8	Very high	92.8	Very high	120 Å²	120	44.2 Å²	44.2	63%	0.628	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.2	175.2	-70.9	172.5	0	0	0	114.2	G352 I353 Q354	G352-L356 WeakPolarHBondContact O-CG 3.43Å; G352-L356 PolarHBondContact O-N 3.12Å; G352-L356 VanDerWaalsContact O-N 3.11Å; I353-L356 PolarHBondContact O-N 3.24Å; Q354-L356 VanDerWaalsContact C-N 3.27Å; Q354-L356 PolarHBondContact O-N 2.65Å
357	S	90.9	Very high	92.6	Very high	33 Å²	33	46 Å²	46	23%	0.231	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3	172.7	49.2	0	0	0	0	113.6	G184 I353 Q354 S355 D359	G184-S357 WeakPolarHBondContact CA-OG 3.41Å; G184-S357 PolarHBondContact N-OG 3.24Å; I353-S357 PolarHBondContact O-N 3.31Å; Q354-S357 PolarHBondContact O-N 2.94Å; Q354-S357 PolarHBondContact O-OG 3.3Å; S355-S357 PolarHBondContact O-N 2.7Å; S357-D359 PolarHBondContact O-N 2.79Å
358	E	89.9	Confident	92.3	Very high	181 Å²	181	47.6 Å²	47.6	85%	0.846	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	9.5	-175.6	-57.4	178.4	-175	0	0	114	S355	S355-E358 PolarHBondContact O-N 3.03Å; S355-E358 VanDerWaalsContact O-N 3.14Å
359	D	89	Confident	91.8	Very high	41 Å²	41	52.8 Å²	52.8	22%	0.219	29%	0.289	C	S	.	.			trans	-80	128.7	178.9	-98.7	3.8	0	0	0	111.5	G184 R188 Q354 S357 S363	G184-D359 VanDerWaalsContact C-OD2 3.3Å; G184-D359 WeakPolarHBondContact CA-OD2 3.27Å; R188-D359 IonicContact CZ-OD2 2.86Å; R188-D359 IonicContact NE-OD2 3.86Å; R188-D359 IonicContact NH2-OD2 2.69Å; R188-D359 PolarHBondContact NH2-OD2 2.82Å; Q354-D359 WeakPolarHBondContact CG-O 3.24Å; Q354-D359 PolarHBondContact NE2-O 2.94Å; S357-D359 PolarHBondContact O-N 2.79Å; D359-S363 WeakPolarHBondContact CA-OG 3.36Å; D359-S363 WeakPolarHBondContact OD1-CB 3.4Å; D359-S363 PolarHBondContact OD1-OG 2.97Å
360	T	86.1	Confident	91.2	Very high	63 Å²	63	57.4 Å²	57.4	39%	0.387	32%	0.318	S	S	.	.			trans	-87.1	168	169.4	70.1	0	0	0	0	110.3	R188 T362 S363	R188-T360 VanDerWaalsContact CD-O 3.3Å; R188-T360 WeakPolarHBondContact CD-O 3.5Å; T360-T362 PolarHBondContact O-N 3.06Å; T360-T362 PolarHBondContact OG1-N 3.23Å; T360-T362 PolarHBondContact OG1-OG1 2.83Å; T360-S363 PolarHBondContact N-OG 3.18Å; T360-S363 WeakPolarHBondContact O-CB 3.31Å; T360-S363 PolarHBondContact O-N 3.24Å; T360-S363 VanDerWaalsContact O-N 3.16Å; T360-S363 PolarHBondContact OG1-N 3.42Å; T360-S363 PolarHBondContact OG1-OG 3.13Å
361	P	81.6	Confident	90.5	Very high	46 Å²	46	64.9 Å²	64.9	30%	0.299	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-30	169.8	-26.7	36.6	0	0	0	113	R227	R227-P361 PolarHBondContact NH2-O 3.07Å
362	T	84.6	Confident	90	Very high	76 Å²	76	65.9 Å²	65.9	47%	0.466	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-16.1	-179.9	56.8	0	0	0	0	113.8	R227 T360 L377	R227-T362 PolarHBondContact NH1-O 2.85Å; R227-T362 PolarHBondContact NH2-O 2.92Å; T360-T362 PolarHBondContact O-N 3.06Å; T360-T362 PolarHBondContact OG1-N 3.23Å; T360-T362 PolarHBondContact OG1-OG1 2.83Å; T362-L377 HydrophobicContact CG2-CD1 4.38Å; T362-L377 HydrophobicContact CG2-CD2 4.04Å
363	S	90.1	Very high	89.5	Confident	26 Å²	26	66.8 Å²	66.8	18%	0.182	36%	0.36	C	S	.	.	S	Bend	trans	-49	146	175.9	-73.5	0	0	0	0	112.5	R188 R227 D359 T360	R188-S363 PolarHBondContact NH1-O 3.19Å; R188-S363 PolarHBondContact NH2-O 3.47Å; R227-S363 PolarHBondContact NH2-O 3.4Å; D359-S363 WeakPolarHBondContact CA-OG 3.36Å; D359-S363 WeakPolarHBondContact OD1-CB 3.4Å; D359-S363 PolarHBondContact OD1-OG 2.97Å; T360-S363 PolarHBondContact N-OG 3.18Å; T360-S363 WeakPolarHBondContact O-CB 3.31Å; T360-S363 PolarHBondContact O-N 3.24Å; T360-S363 VanDerWaalsContact O-N 3.16Å; T360-S363 PolarHBondContact OG1-N 3.42Å; T360-S363 PolarHBondContact OG1-OG 3.13Å
364	K	92.6	Very high	88.9	Confident	76 Å²	76	74.3 Å²	74.3	33%	0.33	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-57.7	141.3	177.1	-164.6	-171.4	-160	-151.7	0	111.9	R188 E368 E369 V370 E371	R188-K364 PolarHBondContact NH2-O 2.94Å; K364-E368 VanDerWaalsContact CA-OE2 3.28Å; K364-E368 WeakPolarHBondContact CA-OE2 3.46Å; K364-E368 HydrophobicContact CD-CB 4.34Å; K364-E368 WeakPolarHBondContact CE-O 3.46Å; K364-E368 HydrophobicContact CG-CB 3.61Å; K364-E368 WeakPolarHBondContact CG-OE2 3.38Å; K364-E368 PolarHBondContact NZ-O 3.44Å; K364-E369 WeakPolarHBondContact CE-O 3.22Å; K364-E369 PolarHBondContact NZ-O 3.48Å; K364-V370 WeakPolarHBondContact CE-O 3.48Å; K364-E371 HydrophobicContact CD-CG 4.34Å
365	Y	94.9	Very high	88.4	Confident	8 Å²	8	79.4 Å²	79.4	3%	0.031	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-77.5	157.1	167.8	-70.5	-57.2	0	0	0	111.3	T185 R188 L189 Q192 M217 R227 F367 E368	T185-Y365 HydrophobicContact CG2-CD1 3.75Å; T185-Y365 HydrophobicContact CG2-CG 4.37Å; R188-Y365 HydrophobicContact CB-CE1 4Å; L189-Y365 HydrophobicContact CD2-CE1 4.45Å; L189-Y365 HydrophobicContact CG-CE1 4.29Å; Q192-Y365 PolarHBondContact NE2-OH 2.82Å; M217-Y365 HydrophobicContact CE-CE2 4.06Å; R227-Y365 HydrophobicContact CB-CE2 4.12Å; R227-Y365 HydrophobicContact CG-CD2 4.36Å; R227-Y365 HydrophobicContact CG-CE2 4.01Å; Y365-F367 HydrophobicContact CD1-CZ 4.46Å; Y365-F367 HydrophobicContact CD2-CE1 4.42Å; Y365-F367 HydrophobicContact CD2-CE2 4.01Å; Y365-F367 AromaticContact CD2-CZ 3.61Å; Y365-F367 HydrophobicContact CD2-CZ 3.61Å; Y365-F367 HydrophobicContact CE2-CZ 4.42Å; Y365-F367 HydrophobicContact CG-CE1 4Å; Y365-F367 HydrophobicContact CG-CE2 4.21Å; Y365-F367 AromaticContact CG-CZ 3.64Å; Y365-F367 HydrophobicContact CG-CZ 3.64Å; Y365-F367 PolarHBondContact O-N 2.7Å; Y365-F367 VanDerWaalsContact O-N 3.14Å; Y365-E368 WeakPolarHBondContact CD2-OE1 3.46Å; Y365-E368 PolarHBondContact N-OE2 3.06Å; Y365-E368 PolarHBondContact O-N 3.42Å
366	T	95.7	Very high	88	Confident	32 Å²	32	77.4 Å²	77.4	20%	0.196	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.8	-178.9	-52.1	0	0	0	0	112.6	C176 L182 T185	C176-T366 HydrophobicContact CB-CG2 4.09Å; L182-T366 WeakPolarHBondContact CB-OG1 3.44Å; L182-T366 HydrophobicContact CD1-CG2 4.4Å; L182-T366 HydrophobicContact CG-CG2 3.93Å; L182-T366 PolarHBondContact N-OG1 2.85Å; T185-T366 VanDerWaalsContact CB-OG1 3.25Å; T185-T366 WeakPolarHBondContact CB-OG1 3.48Å; T185-T366 PolarHBondContact OG1-N 2.9Å; T185-T366 PolarHBondContact OG1-OG1 3.22Å
367	F	95.1	Very high	87.4	Confident	38 Å²	38	73.9 Å²	73.9	17%	0.167	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.7	-179.5	54.2	-101.5	0	0	0	113.6	L172 F181 T185 L189 M217 Y365	L172-F367 HydrophobicContact CB-CB 4.24Å; L172-F367 HydrophobicContact CB-CD1 4.22Å; L172-F367 HydrophobicContact CB-CG 4.17Å; L172-F367 HydrophobicContact CD1-CD1 4.35Å; L172-F367 HydrophobicContact CD1-CD2 4.16Å; L172-F367 HydrophobicContact CD1-CE1 4.3Å; L172-F367 HydrophobicContact CD1-CE2 4.14Å; L172-F367 HydrophobicContact CD1-CG 4.27Å; L172-F367 HydrophobicContact CD1-CZ 4.2Å; L172-F367 HydrophobicContact CD2-CB 4.16Å; L172-F367 HydrophobicContact CD2-CD2 4Å; L172-F367 HydrophobicContact CD2-CG 4.1Å; L172-F367 HydrophobicContact CG-CG 4.41Å; F181-F367 HydrophobicContact CD1-CD1 4.29Å; F181-F367 AromaticContact CE1-CD1 3.63Å; F181-F367 HydrophobicContact CE1-CD1 3.63Å; F181-F367 HydrophobicContact CE1-CE1 4.39Å; F181-F367 HydrophobicContact CE2-CD1 4.41Å; F181-F367 HydrophobicContact CE2-CE1 4.41Å; F181-F367 AromaticContact CZ-CD1 3.72Å; F181-F367 HydrophobicContact CZ-CD1 3.72Å; F181-F367 HydrophobicContact CZ-CE1 4.09Å; T185-F367 HydrophobicContact CG2-CD1 4.37Å; T185-F367 HydrophobicContact CG2-CE1 4.09Å; L189-F367 HydrophobicContact CD1-CE1 4.3Å; M217-F367 HydrophobicContact CE-CZ 4.23Å; M217-F367 HydrophobicContact CG-CE2 4.33Å; M217-F367 HydrophobicContact CG-CZ 4.1Å; M217-F367 HydrophobicContact SD-CZ 4.15Å; Y365-F367 HydrophobicContact CD1-CZ 4.46Å; Y365-F367 HydrophobicContact CD2-CE1 4.42Å; Y365-F367 HydrophobicContact CD2-CE2 4.01Å; Y365-F367 AromaticContact CD2-CZ 3.61Å; Y365-F367 HydrophobicContact CD2-CZ 3.61Å; Y365-F367 HydrophobicContact CE2-CZ 4.42Å; Y365-F367 HydrophobicContact CG-CE1 4Å; Y365-F367 HydrophobicContact CG-CE2 4.21Å; Y365-F367 AromaticContact CG-CZ 3.64Å; Y365-F367 HydrophobicContact CG-CZ 3.64Å; Y365-F367 PolarHBondContact O-N 2.7Å; Y365-F367 VanDerWaalsContact O-N 3.14Å
368	E	92.4	Very high	87	Confident	32 Å²	32	80.1 Å²	80.1	15%	0.15	41%	0.413	C	S	.	.			trans	-81	137.1	174.3	-74.5	170.7	171.2	0	0	108.9	R227 K364 Y365	R227-E368 WeakPolarHBondContact CD-OE1 3.4Å; R227-E368 WeakPolarHBondContact CG-OE1 3.46Å; R227-E368 IonicContact NE-OE1 3.61Å; K364-E368 VanDerWaalsContact CA-OE2 3.28Å; K364-E368 WeakPolarHBondContact CA-OE2 3.46Å; K364-E368 HydrophobicContact CD-CB 4.34Å; K364-E368 WeakPolarHBondContact CE-O 3.46Å; K364-E368 HydrophobicContact CG-CB 3.61Å; K364-E368 WeakPolarHBondContact CG-OE2 3.38Å; K364-E368 PolarHBondContact NZ-O 3.44Å; Y365-E368 WeakPolarHBondContact CD2-OE1 3.46Å; Y365-E368 PolarHBondContact N-OE2 3.06Å; Y365-E368 PolarHBondContact O-N 3.42Å
369	E	86.2	Confident	86.5	Confident	181 Å²	181	76.3 Å²	76.3	85%	0.846	40%	0.395	S	S	*	.			trans	-93.5	-30.6	178	-67.1	-175	175.6	0	0	112.3	K364	K364-E369 WeakPolarHBondContact CE-O 3.22Å; K364-E369 PolarHBondContact NZ-O 3.48Å
370	V	83.9	Confident	86.1	Confident	111 Å²	111	76.1 Å²	76.1	67%	0.673	39%	0.391	S	S	*	.	S	Bend	trans	-115	142.5	-174.4	-169.7	0	0	0	0	109.9	K364	K364-V370 WeakPolarHBondContact CE-O 3.48Å
371	E	83.5	Confident	85.3	Confident	158 Å²	158	78.3 Å²	78.3	74%	0.738	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-76.5	140.4	168	-69.3	-169.4	167.9	0	0	110.1	K364	K364-E371 HydrophobicContact CD-CG 4.34Å
372	L	83.9	Confident	84.9	Confident	45 Å²	45	81 Å²	81	24%	0.236	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-76.9	140.1	178.7	-63.8	171.7	0	0	0	110.2	R227 D376 L377	R227-L372 HydrophobicContact CG-CD1 4.5Å; L372-D376 HydrophobicContact CB-CB 4.21Å; L372-D376 HydrophobicContact CD2-CB 4.23Å; L372-L377 HydrophobicContact CB-CD2 3.98Å; L372-L377 HydrophobicContact CB-CG 4Å; L372-L377 HydrophobicContact CD1-CD2 3.81Å
373	S	84.7	Confident	84.4	Confident	53 Å²	53	78.1 Å²	78.1	37%	0.371	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-66.3	163	168.8	66.4	0	0	0	0	110.8	D375 D376 L377	S373-D375 VanDerWaalsContact C-N 3.3Å; S373-D375 PolarHBondContact O-N 2.66Å; S373-D376 PolarHBondContact O-N 3.43Å; S373-D376 WeakPolarHBondContact OG-CB 3.19Å; S373-D376 VanDerWaalsContact OG-CG 3.28Å; S373-D376 PolarHBondContact OG-N 2.97Å; S373-D376 VanDerWaalsContact OG-N 3.12Å; S373-D376 PolarHBondContact OG-OD2 3.45Å; S373-L377 WeakPolarHBondContact O-CG 3.47Å; S373-L377 PolarHBondContact O-N 3.12Å
374	E	83.5	Confident	83.9	Confident	158 Å²	158	82.7 Å²	82.7	74%	0.738	42%	0.415	S	S	*	.	H	α-helix	trans	-57.3	-44.6	173.4	-67.7	-176.7	160.8	0	0	111.3	D376 L377 E378	E374-D376 VanDerWaalsContact C-N 3.32Å; E374-D376 PolarHBondContact O-N 3.09Å; E374-L377 WeakPolarHBondContact O-CA 3.3Å; E374-L377 WeakPolarHBondContact O-CB 2.89Å; E374-L377 PolarHBondContact O-N 2.84Å; E374-E378 PolarHBondContact O-N 3.24Å
375	D	83.3	Confident	83.4	Confident	112 Å²	112	79.3 Å²	79.3	60%	0.599	40%	0.4	S	S	*	.	H	α-helix	trans	-56.9	-43.4	175.1	-62.4	-20.3	0	0	0	112.2	S373 L377 E378 E379	S373-D375 VanDerWaalsContact C-N 3.3Å; S373-D375 PolarHBondContact O-N 2.66Å; D375-L377 VanDerWaalsContact C-N 3.26Å; D375-L377 PolarHBondContact O-N 2.99Å; D375-E378 PolarHBondContact O-N 2.89Å; D375-E379 PolarHBondContact O-N 3Å; D375-E379 VanDerWaalsContact O-N 3.17Å
376	D	82.8	Confident	82.7	Confident	35 Å²	35	81.6 Å²	81.6	19%	0.187	41%	0.411	C	S	.	.	H	α-helix	trans	-69.9	-24.5	178.4	-74.7	-24.6	0	0	0	112.3	R223 L372 S373 E374 R380	R223-D376 IonicContact CZ-OD1 3.67Å; R223-D376 IonicContact NE-OD1 2.72Å; R223-D376 IonicContact NH1-OD1 2.7Å; R223-D376 PolarHBondContact NH1-OD1 3.39Å; R223-D376 IonicContact NH2-OD1 3.65Å; R223-D376 PolarHBondContact NH2-OD1 3.44Å; L372-D376 HydrophobicContact CB-CB 4.21Å; L372-D376 HydrophobicContact CD2-CB 4.23Å; S373-D376 PolarHBondContact O-N 3.43Å; S373-D376 WeakPolarHBondContact OG-CB 3.19Å; S373-D376 VanDerWaalsContact OG-CG 3.28Å; S373-D376 PolarHBondContact OG-N 2.97Å; S373-D376 VanDerWaalsContact OG-N 3.12Å; S373-D376 PolarHBondContact OG-OD2 3.45Å; E374-D376 VanDerWaalsContact C-N 3.32Å; E374-D376 PolarHBondContact O-N 3.09Å; D376-R380 WeakPolarHBondContact O-CD 3.01Å; D376-R380 VanDerWaalsContact O-CG 3.23Å; D376-R380 WeakPolarHBondContact O-CG 3.07Å; D376-R380 PolarHBondContact O-NE 3.23Å
377	L	81.7	Confident	82.1	Confident	47 Å²	47	83.3 Å²	83.3	25%	0.246	42%	0.417	C	S	.	.	H	α-helix	trans	-76.9	-38.7	173.3	-70	171.8	0	0	0	111.5	T362 L372 S373 E374 D375 E379 R380	T362-L377 HydrophobicContact CG2-CD1 4.38Å; T362-L377 HydrophobicContact CG2-CD2 4.04Å; L372-L377 HydrophobicContact CB-CD2 3.98Å; L372-L377 HydrophobicContact CB-CG 4Å; L372-L377 HydrophobicContact CD1-CD2 3.81Å; S373-L377 WeakPolarHBondContact O-CG 3.47Å; S373-L377 PolarHBondContact O-N 3.12Å; E374-L377 WeakPolarHBondContact O-CA 3.3Å; E374-L377 WeakPolarHBondContact O-CB 2.89Å; E374-L377 PolarHBondContact O-N 2.84Å; D375-L377 VanDerWaalsContact C-N 3.26Å; D375-L377 PolarHBondContact O-N 2.99Å; L377-E379 VanDerWaalsContact C-N 3.33Å; L377-E379 PolarHBondContact O-N 2.94Å; L377-R380 WeakPolarHBondContact O-CB 3.38Å; L377-R380 PolarHBondContact O-N 3.06Å
378	E	80.9	Confident	81.4	Confident	163 Å²	163	86.7 Å²	86.7	76%	0.762	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-33.9	177.5	-71.6	-172.2	174.6	0	0	112.9	E374 D375 R380	E374-E378 PolarHBondContact O-N 3.24Å; D375-E378 PolarHBondContact O-N 2.89Å; E378-R380 PolarHBondContact O-N 2.9Å
379	E	80.5	Confident	81.1	Confident	101 Å²	101	88.3 Å²	88.3	47%	0.472	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.3	177.9	-71.2	-172.4	161.8	0	0	113.9	R223 D375 L377	R223-E379 WeakPolarHBondContact CD-OE2 3.33Å; R223-E379 IonicContact CZ-OE2 3.5Å; R223-E379 IonicContact NE-OE2 3.31Å; R223-E379 IonicContact NH1-OE1 3.75Å; R223-E379 IonicContact NH1-OE2 2.75Å; R223-E379 PolarHBondContact NH1-OE2 3.47Å; D375-E379 PolarHBondContact O-N 3Å; D375-E379 VanDerWaalsContact O-N 3.17Å; L377-E379 VanDerWaalsContact C-N 3.33Å; L377-E379 PolarHBondContact O-N 2.94Å
380	R	80.9	Confident	81.2	Confident	37 Å²	37	79.7 Å²	79.7	14%	0.14	41%	0.413	C	S	.	.	S	Bend	trans	-87.5	141.5	-177.4	-74.4	165.4	-169.2	-77.3	2.1	111.5	R223 S226 R227 D376 L377 E378 T382	R223-R380 WeakPolarHBondContact O-CG 3.3Å; R223-R380 PolarHBondContact O-NH1 3.08Å; S226-R380 PolarHBondContact OG-NH1 3.23Å; S226-R380 PolarHBondContact OG-NH2 2.88Å; R227-R380 VanDerWaalsContact CG-NH1 3.34Å; D376-R380 WeakPolarHBondContact O-CD 3.01Å; D376-R380 VanDerWaalsContact O-CG 3.23Å; D376-R380 WeakPolarHBondContact O-CG 3.07Å; D376-R380 PolarHBondContact O-NE 3.23Å; L377-R380 WeakPolarHBondContact O-CB 3.38Å; L377-R380 PolarHBondContact O-N 3.06Å; E378-R380 PolarHBondContact O-N 2.9Å; R380-T382 PolarHBondContact O-N 2.64Å
381	F	69.3	Low	81.5	Confident	109 Å²	109	80.4 Å²	80.4	48%	0.478	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-73	119.3	-179.1	-179.5	-81.8	0	0	0	110.6	P143 I228 G383 W385	P143-F381 HydrophobicContact CB-CE1 4.39Å; I228-F381 HydrophobicContact CD1-CB 3.99Å; I228-F381 HydrophobicContact CD1-CD1 4.17Å; I228-F381 HydrophobicContact CD1-CG 4.42Å; F381-G383 VanDerWaalsContact CE1-CA 3.49Å; F381-W385 AromaticContact CD1-CH2 3.26Å; F381-W385 HydrophobicContact CD1-CH2 3.26Å; F381-W385 AromaticContact CD1-CZ2 3.83Å; F381-W385 HydrophobicContact CD1-CZ2 3.83Å; F381-W385 HydrophobicContact CD1-CZ3 4.1Å; F381-W385 AromaticContact CE1-CH2 3.15Å; F381-W385 HydrophobicContact CE1-CH2 3.15Å; F381-W385 HydrophobicContact CE1-CZ2 4.08Å; F381-W385 AromaticContact CE1-CZ3 3.51Å; F381-W385 HydrophobicContact CE1-CZ3 3.51Å; F381-W385 HydrophobicContact CZ-CH2 4.44Å
382	T	71.4	Confident	81.9	Confident	104 Å²	104	73.9 Å²	73.9	64%	0.638	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-97.6	118.6	168.9	56.5	0	0	0	0	108.1	R380 E386	R380-T382 PolarHBondContact O-N 2.64Å; T382-E386 WeakPolarHBondContact CG2-OE2 3.37Å
383	G	74.8	Confident	82.5	Confident	14 Å²	14	71.8 Å²	71.8	14%	0.144	37%	0.367	C	S	.	.			trans	-109.4	174.8	179.8	0	0	0	0	0	113.3	F381 W385 E386	F381-G383 VanDerWaalsContact CE1-CA 3.49Å; G383-W385 VanDerWaalsContact CA-CZ3 3.47Å; G383-W385 PolarHBondContact O-N 3.24Å; G383-E386 PolarHBondContact O-N 3.31Å
384	E	79.8	Confident	82.9	Confident	122 Å²	122	71.9 Å²	71.9	57%	0.57	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-54.4	-24	178	-64.3	178.4	169.9	0	0	113.2	Y195 E386 E387 F392	Y195-E384 HydrophobicContact CE2-CB 4.24Å; E384-E386 PolarHBondContact O-N 3.21Å; E384-E387 WeakPolarHBondContact O-CB 3.3Å; E384-E387 PolarHBondContact O-N 3.1Å; E384-F392 VanDerWaalsContact OE2-CD2 3.3Å; E384-F392 WeakPolarHBondContact OE2-CD2 3.35Å
385	W	82.4	Confident	83.3	Confident	5 Å²	5	68.7 Å²	68.7	2%	0.019	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-68.5	-17.5	176.4	65.2	86.8	0	0	0	114.5	P143 H144 I191 Y195 I228 F381 G383 E387	P143-W385 HydrophobicContact CB-CH2 3.72Å; P143-W385 HydrophobicContact CB-CZ3 3.83Å; P143-W385 HydrophobicContact CG-CE3 4.44Å; P143-W385 HydrophobicContact CG-CH2 3.9Å; P143-W385 HydrophobicContact CG-CZ3 3.45Å; P143-W385 VanDerWaalsContact CG-CZ3 3.45Å; H144-W385 AromaticContact NE2-CD2 3.73Å; H144-W385 AromaticContact NE2-CE2 3.92Å; H144-W385 AromaticContact NE2-CE3 3.69Å; H144-W385 AromaticContact NE2-CH2 3.83Å; H144-W385 AromaticContact NE2-CZ3 3.72Å; I191-W385 WeakPolarHBondContact CG2-O 3.11Å; Y195-W385 HydrophobicContact CD1-CB 4.15Å; Y195-W385 HydrophobicContact CD1-CD2 4.3Å; Y195-W385 AromaticContact CD1-CE3 3.76Å; Y195-W385 HydrophobicContact CD1-CE3 3.76Å; Y195-W385 HydrophobicContact CD1-CZ3 4.44Å; Y195-W385 HydrophobicContact CD2-CB 3.51Å; Y195-W385 HydrophobicContact CD2-CE3 4.49Å; Y195-W385 HydrophobicContact CE1-CD2 4.36Å; Y195-W385 AromaticContact CE1-CE3 3.41Å; Y195-W385 HydrophobicContact CE1-CE3 3.41Å; Y195-W385 VanDerWaalsContact CE1-CE3 3.41Å; Y195-W385 AromaticContact CE1-CZ3 3.85Å; Y195-W385 HydrophobicContact CE1-CZ3 3.85Å; Y195-W385 HydrophobicContact CE2-CB 4.11Å; Y195-W385 HydrophobicContact CE2-CE3 4.22Å; Y195-W385 HydrophobicContact CG-CB 3.55Å; Y195-W385 HydrophobicContact CG-CE3 4.3Å; Y195-W385 HydrophobicContact CG-CG 4.34Å; Y195-W385 AromaticContact CZ-CE3 3.69Å; I228-W385 HydrophobicContact CD1-CH2 4.34Å; I228-W385 HydrophobicContact CD1-CZ2 4.24Å; I228-W385 HydrophobicContact CG1-CZ2 4.44Å; F381-W385 AromaticContact CD1-CH2 3.26Å; F381-W385 HydrophobicContact CD1-CH2 3.26Å; F381-W385 AromaticContact CD1-CZ2 3.83Å; F381-W385 HydrophobicContact CD1-CZ2 3.83Å; F381-W385 HydrophobicContact CD1-CZ3 4.1Å; F381-W385 AromaticContact CE1-CH2 3.15Å; F381-W385 HydrophobicContact CE1-CH2 3.15Å; F381-W385 HydrophobicContact CE1-CZ2 4.08Å; F381-W385 AromaticContact CE1-CZ3 3.51Å; F381-W385 HydrophobicContact CE1-CZ3 3.51Å; F381-W385 HydrophobicContact CZ-CH2 4.44Å; G383-W385 VanDerWaalsContact CA-CZ3 3.47Å; G383-W385 PolarHBondContact O-N 3.24Å; W385-E387 VanDerWaalsContact C-N 3.3Å
386	E	80.2	Confident	83.7	Confident	56 Å²	56	65 Å²	65	26%	0.262	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-85.9	-8.8	177.4	-56.1	-162.5	159.3	0	0	112.3	T382 G383 E384	T382-E386 WeakPolarHBondContact CG2-OE2 3.37Å; G383-E386 PolarHBondContact O-N 3.31Å; E384-E386 PolarHBondContact O-N 3.21Å
387	E	81.8	Confident	83.8	Confident	68 Å²	68	69.4 Å²	69.4	32%	0.318	36%	0.358	S	S	.	.			trans	-58.3	134.6	175.8	-166.7	-161.3	-179.9	0	0	111.2	F347 E384 W385 T389	F347-E387 WeakPolarHBondContact CZ-O 3.41Å; E384-E387 WeakPolarHBondContact O-CB 3.3Å; E384-E387 PolarHBondContact O-N 3.1Å; W385-E387 VanDerWaalsContact C-N 3.3Å; E387-T389 PolarHBondContact OE1-OG1 3.01Å; E387-T389 PolarHBondContact OE2-OG1 2.63Å
388	V	81.3	Confident	84.1	Confident	109 Å²	109	67.5 Å²	67.5	66%	0.661	35%	0.348	S	S	*	.	S	Bend	trans	-72.8	-29.8	-176.4	-179.4	0	0	0	0	112.6
389	T	85.5	Confident	84.4	Confident	66 Å²	66	66.2 Å²	66.2	41%	0.405	34%	0.34	S	S	.	.	S	Bend	trans	-75.6	-29.1	-173.8	75.1	0	0	0	0	112.2	H344 E387 E391	H344-T389 PolarHBondContact CE1-O 2.76Å; E387-T389 PolarHBondContact OE1-OG1 3.01Å; E387-T389 PolarHBondContact OE2-OG1 2.63Å; T389-E391 VanDerWaalsContact C-N 3.28Å; T389-E391 PolarHBondContact O-N 3.03Å; T389-E391 WeakPolarHBondContact OG1-CG 3.37Å; T389-E391 PolarHBondContact OG1-N 3.18Å; T389-E391 VanDerWaalsContact OG1-N 3.16Å
390	G	88.3	Confident	84.5	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.01	32%	0.318	C	S	.	.			trans	68.2	21.8	-174.2	0	0	0	0	0	114.5	H344 F392 F393	H344-G390 PolarHBondContact CE1-O 2.81Å; H344-G390 PolarHBondContact ND1-O 3.4Å; G390-F392 PolarHBondContact O-N 2.81Å; G390-F393 WeakPolarHBondContact O-CB 3.38Å; G390-F393 PolarHBondContact O-N 2.9Å
391	E	90.8	Very high	84.5	Confident	126 Å²	126	62.9 Å²	62.9	59%	0.589	33%	0.328	S	S	*	.	H	α-helix	trans	-53.2	-41.8	179.6	-83	-179.7	-165.5	0	0	111.8	T389 F393 A394 I395	T389-E391 VanDerWaalsContact C-N 3.28Å; T389-E391 PolarHBondContact O-N 3.03Å; T389-E391 WeakPolarHBondContact OG1-CG 3.37Å; T389-E391 PolarHBondContact OG1-N 3.18Å; T389-E391 VanDerWaalsContact OG1-N 3.16Å; E391-F393 PolarHBondContact O-N 3.25Å; E391-F393 VanDerWaalsContact O-N 3.14Å; E391-A394 WeakPolarHBondContact O-CB 3.44Å; E391-A394 PolarHBondContact O-N 3.09Å; E391-I395 PolarHBondContact O-N 2.68Å
392	F	92.8	Very high	84.6	Confident	21 Å²	21	60.4 Å²	60.4	9%	0.092	32%	0.32	C	S	.	.	H	α-helix	trans	-48.2	-43.4	173.2	171.4	-95.1	0	0	0	112.8	Y195 K198 L199 E384 G390 A394 I395	Y195-F392 AromaticContact CD2-CD1 3.36Å; Y195-F392 HydrophobicContact CD2-CD1 3.36Å; Y195-F392 AromaticContact CD2-CE1 3.06Å; Y195-F392 HydrophobicContact CD2-CE1 3.06Å; Y195-F392 HydrophobicContact CD2-CE2 4.41Å; Y195-F392 HydrophobicContact CD2-CG 4.16Å; Y195-F392 AromaticContact CD2-CZ 3.68Å; Y195-F392 HydrophobicContact CD2-CZ 3.68Å; Y195-F392 AromaticContact CE2-CD1 3.46Å; Y195-F392 HydrophobicContact CE2-CD1 3.46Å; Y195-F392 VanDerWaalsContact CE2-CD1 3.46Å; Y195-F392 AromaticContact CE2-CD2 3.9Å; Y195-F392 HydrophobicContact CE2-CD2 3.9Å; Y195-F392 AromaticContact CE2-CE1 3.2Å; Y195-F392 HydrophobicContact CE2-CE1 3.2Å; Y195-F392 AromaticContact CE2-CE2 3.69Å; Y195-F392 HydrophobicContact CE2-CE2 3.69Å; Y195-F392 AromaticContact CE2-CG 3.81Å; Y195-F392 HydrophobicContact CE2-CG 3.81Å; Y195-F392 AromaticContact CE2-CZ 3.34Å; Y195-F392 HydrophobicContact CE2-CZ 3.34Å; Y195-F392 HydrophobicContact CG-CE1 4.05Å; K198-F392 HydrophobicContact CB-CE1 4.23Å; K198-F392 HydrophobicContact CD-CD1 4.04Å; K198-F392 HydrophobicContact CD-CE1 3.51Å; K198-F392 HydrophobicContact CD-CZ 4.07Å; K198-F392 WeakPolarHBondContact CE-O 3.44Å; K198-F392 HydrophobicContact CG-CE1 3.99Å; K198-F392 HydrophobicContact CG-CZ 4.24Å; K198-F392 PolarHBondContact NZ-O 3.31Å; L199-F392 HydrophobicContact CD2-CE2 3.94Å; L199-F392 HydrophobicContact CD2-CZ 3.63Å; L199-F392 HydrophobicContact CG-CZ 3.87Å; E384-F392 VanDerWaalsContact OE2-CD2 3.3Å; E384-F392 WeakPolarHBondContact OE2-CD2 3.35Å; G390-F392 PolarHBondContact O-N 2.81Å; F392-A394 VanDerWaalsContact C-N 3.27Å; F392-A394 PolarHBondContact O-N 2.82Å; F392-I395 PolarHBondContact O-N 2.81Å
393	F	95.2	Very high	84	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-72.9	-20.5	-176.4	-65.5	-81.2	0	0	0	113.2	I191 L194 Y195 K198 R340 H344 F347 G390 E391	I191-F393 HydrophobicContact CG2-CZ 4.48Å; L194-F393 HydrophobicContact CB-CE1 4.28Å; L194-F393 HydrophobicContact CD2-CD1 4.17Å; L194-F393 HydrophobicContact CD2-CE1 3.92Å; L194-F393 HydrophobicContact CG-CD1 4.23Å; L194-F393 HydrophobicContact CG-CE1 3.81Å; Y195-F393 HydrophobicContact CD2-CE1 4.48Å; Y195-F393 HydrophobicContact CD2-CZ 4.18Å; K198-F393 HydrophobicContact CD-CB 4.46Å; K198-F393 HydrophobicContact CD-CD1 3.92Å; R340-F393 PolarHBondContact NH2-O 3.25Å; H344-F393 HydrophobicContact CB-CB 4.03Å; F347-F393 HydrophobicContact CB-CB 4.24Å; F347-F393 HydrophobicContact CB-CD1 4.28Å; F347-F393 HydrophobicContact CB-CD2 3.62Å; F347-F393 HydrophobicContact CB-CE2 3.96Å; F347-F393 HydrophobicContact CB-CG 3.79Å; F347-F393 HydrophobicContact CB-CZ 4.4Å; F347-F393 HydrophobicContact CD1-CD2 4.07Å; F347-F393 HydrophobicContact CD1-CE2 4.44Å; F347-F393 AromaticContact CD2-CD2 3.54Å; F347-F393 HydrophobicContact CD2-CD2 3.54Å; F347-F393 AromaticContact CD2-CE2 3.12Å; F347-F393 HydrophobicContact CD2-CE2 3.12Å; F347-F393 HydrophobicContact CD2-CG 4.48Å; F347-F393 AromaticContact CD2-CZ 3.77Å; F347-F393 HydrophobicContact CD2-CZ 3.77Å; F347-F393 HydrophobicContact CE2-CD2 4.21Å; F347-F393 AromaticContact CE2-CE2 3.66Å; F347-F393 HydrophobicContact CE2-CE2 3.66Å; F347-F393 HydrophobicContact CE2-CZ 4.49Å; F347-F393 AromaticContact CG-CD2 3.44Å; F347-F393 HydrophobicContact CG-CD2 3.44Å; F347-F393 VanDerWaalsContact CG-CD2 3.44Å; F347-F393 AromaticContact CG-CE2 3.58Å; F347-F393 HydrophobicContact CG-CE2 3.58Å; F347-F393 HydrophobicContact CG-CG 4.15Å; F347-F393 HydrophobicContact CG-CZ 4.35Å; G390-F393 WeakPolarHBondContact O-CB 3.38Å; G390-F393 PolarHBondContact O-N 2.9Å; E391-F393 PolarHBondContact O-N 3.25Å; E391-F393 VanDerWaalsContact O-N 3.14Å
394	A	93.4	Very high	83.2	Confident	55 Å²	55	66.9 Å²	66.9	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-78.9	-32.8	177.9	0	0	0	0	0	112.4	H344 E391 F392 D396	H344-A394 HydrophobicContact CB-CB 4.13Å; E391-A394 WeakPolarHBondContact O-CB 3.44Å; E391-A394 PolarHBondContact O-N 3.09Å; F392-A394 VanDerWaalsContact C-N 3.27Å; F392-A394 PolarHBondContact O-N 2.82Å; A394-D396 PolarHBondContact O-N 3.49Å
395	I	92.7	Very high	82	Confident	90 Å²	90	66.1 Å²	66.1	46%	0.462	34%	0.341	S	S	.	.			trans	-61.9	129.8	-176.3	-62	169.5	0	0	0	111.4	K198 R340 E391 F392 E397	K198-I395 WeakPolarHBondContact CE-O 3.42Å; K198-I395 PolarHBondContact NZ-O 2.83Å; R340-I395 PolarHBondContact NH2-O 3.27Å; E391-I395 PolarHBondContact O-N 2.68Å; F392-I395 PolarHBondContact O-N 2.81Å; I395-E397 HydrophobicContact CG2-CG 4.02Å
396	D	90.7	Very high	80.8	Confident	36 Å²	36	67.3 Å²	67.3	19%	0.193	35%	0.35	C	S	.	.			trans	-120	94.4	174.9	-179	13.4	0	0	0	110.7	R340 A394 V398 K399 N401	R340-D396 WeakPolarHBondContact CD-OD1 3.41Å; R340-D396 WeakPolarHBondContact CD-OD2 3.45Å; R340-D396 IonicContact NE-OD1 3.21Å; A394-D396 PolarHBondContact O-N 3.49Å; D396-V398 PolarHBondContact OD1-N 2.7Å; D396-K399 VanDerWaalsContact O-CG 3.3Å; D396-K399 WeakPolarHBondContact O-CG 3.49Å; D396-K399 PolarHBondContact OD1-N 3.27Å; D396-K399 WeakPolarHBondContact OD2-CA 3.23Å; D396-N401 PolarHBondContact OD2-ND2 2.97Å
397	E	86.1	Confident	79.4	Confident	127 Å²	127	65.5 Å²	65.5	59%	0.593	34%	0.343	S	S	*	.	S	Bend	trans	-75.7	-30.2	177.8	-61.2	-168.5	156.9	0	0	112.7	I395	I395-E397 HydrophobicContact CG2-CG 4.02Å
398	V	87.3	Confident	78	Confident	6 Å²	6	72.4 Å²	72.4	4%	0.036	37%	0.372	C	S	.	.	S	Bend	trans	-81.2	-33.8	-171.8	-178.6	0	0	0	0	111.8	E202 W240 A241 F248 D396 I400	E202-V398 HydrophobicContact CB-CG2 4.22Å; E202-V398 HydrophobicContact CG-CG2 4.27Å; E202-V398 VanDerWaalsContact O-CG2 3.31Å; E202-V398 WeakPolarHBondContact O-CG2 3.36Å; W240-V398 HydrophobicContact CH2-CB 4.27Å; W240-V398 HydrophobicContact CH2-CG1 3.41Å; W240-V398 VanDerWaalsContact CH2-CG1 3.41Å; W240-V398 HydrophobicContact CZ2-CB 4.44Å; W240-V398 HydrophobicContact CZ2-CG1 3.83Å; W240-V398 HydrophobicContact CZ2-CG2 4.39Å; W240-V398 HydrophobicContact CZ3-CG1 4.38Å; A241-V398 HydrophobicContact CB-CG1 4.42Å; F248-V398 HydrophobicContact CB-CG1 3.73Å; F248-V398 HydrophobicContact CD1-CB 4.49Å; F248-V398 HydrophobicContact CD1-CG1 3.87Å; F248-V398 HydrophobicContact CD1-CG2 4.2Å; F248-V398 HydrophobicContact CD2-CB 4.43Å; F248-V398 HydrophobicContact CD2-CG1 4.35Å; F248-V398 HydrophobicContact CD2-CG2 4.47Å; F248-V398 HydrophobicContact CE1-CG2 4.06Å; F248-V398 HydrophobicContact CE2-CG2 4.34Å; F248-V398 HydrophobicContact CG-CB 4.3Å; F248-V398 HydrophobicContact CG-CG1 3.75Å; F248-V398 HydrophobicContact CG-CG2 4.4Å; F248-V398 HydrophobicContact CZ-CG2 4.12Å; D396-V398 PolarHBondContact OD1-N 2.7Å; V398-I400 HydrophobicContact CG1-CB 4.11Å; V398-I400 HydrophobicContact CG1-CD1 3.67Å; V398-I400 HydrophobicContact CG1-CG1 3.88Å; V398-I400 PolarHBondContact O-N 3.37Å
399	K	87.2	Confident	76.5	Confident	136 Å²	136	69.8 Å²	69.8	59%	0.591	35%	0.354	S	S	*	.			trans	56.9	22.6	174.1	-56.1	-178.4	-179.1	178.2	0	114.9	D396 K405	D396-K399 VanDerWaalsContact O-CG 3.3Å; D396-K399 WeakPolarHBondContact O-CG 3.49Å; D396-K399 PolarHBondContact OD1-N 3.27Å; D396-K399 WeakPolarHBondContact OD2-CA 3.23Å; K399-K405 WeakPolarHBondContact O-CD 3.34Å; K399-K405 PolarHBondContact O-NZ 3.29Å
400	I	83	Confident	74.9	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.354	C	S	.	.			trans	-97.5	111.7	172.7	-64.1	168.9	0	0	0	108.6	W240 A241 F248 A250 R278 V398	W240-I400 HydrophobicContact CH2-CB 4.18Å; W240-I400 HydrophobicContact CH2-CD1 4.33Å; W240-I400 HydrophobicContact CZ3-CB 4.01Å; W240-I400 HydrophobicContact CZ3-CD1 4.08Å; W240-I400 HydrophobicContact CZ3-CG2 3.95Å; A241-I400 HydrophobicContact CB-CD1 3.81Å; F248-I400 HydrophobicContact CB-CD1 3.77Å; F248-I400 HydrophobicContact CB-CG1 4.28Å; A250-I400 HydrophobicContact CB-CD1 4.05Å; A250-I400 HydrophobicContact CB-CG2 3.8Å; R278-I400 PolarHBondContact NH2-O 3.46Å; V398-I400 HydrophobicContact CG1-CB 4.11Å; V398-I400 HydrophobicContact CG1-CD1 3.67Å; V398-I400 HydrophobicContact CG1-CG1 3.88Å; V398-I400 PolarHBondContact O-N 3.37Å
401	N	81.4	Confident	73.1	Confident	67 Å²	67	74.2 Å²	74.2	36%	0.358	39%	0.39	S	S	.	.			trans	-132.6	-7	-175.2	-69.7	-49	0	0	0	114.3	R340 D396	R340-N401 WeakPolarHBondContact CB-OD1 3.39Å; R340-N401 PolarHBondContact N-OD1 2.88Å; D396-N401 PolarHBondContact OD2-ND2 2.97Å
402	N	70.4	Confident	71.3	Confident	56 Å²	56	72.6 Å²	72.6	30%	0.299	38%	0.383	S	S	.	.	S	Bend	trans	-144.9	161.8	-179.6	67.7	20.6	0	0	0	112.1	E404 K405	N402-E404 VanDerWaalsContact C-N 3.28Å; N402-E404 PolarHBondContact O-N 3.37Å; N402-E404 PolarHBondContact OD1-N 3.17Å; N402-K405 PolarHBondContact O-N 2.88Å; N402-K405 WeakPolarHBondContact OD1-CG 3.35Å; N402-K405 PolarHBondContact OD1-N 3.2Å; N402-K405 VanDerWaalsContact OD1-N 3.11Å
403	P	60.3	Low	69.2	Low	81 Å²	81	74.5 Å²	74.5	53%	0.526	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-67.4	-21.9	176.8	-17.8	30.7	0	0	0	114.6	L338 K405 C406	L338-P403 HydrophobicContact CD1-CB 3.99Å; L338-P403 HydrophobicContact CD1-CG 4.09Å; P403-K405 PolarHBondContact O-N 2.84Å; P403-C406 WeakPolarHBondContact O-CB 3.48Å; P403-C406 PolarHBondContact O-N 2.9Å
404	E	57.5	Low	67.1	Low	174 Å²	174	82.1 Å²	82.1	81%	0.813	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-65.9	-25.4	178.4	-65.6	173.5	177.8	0	0	112.4	N402 C406	N402-E404 VanDerWaalsContact C-N 3.28Å; N402-E404 PolarHBondContact O-N 3.37Å; N402-E404 PolarHBondContact OD1-N 3.17Å; E404-C406 VanDerWaalsContact C-N 3.3Å
405	K	54.1	Low	64.8	Low	106 Å²	106	83.8 Å²	83.8	46%	0.461	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-82.8	1	169.5	-67.3	-175.1	-174.1	-167.1	0	113.8	K399 N402 P403 S407	K399-K405 WeakPolarHBondContact O-CD 3.34Å; K399-K405 PolarHBondContact O-NZ 3.29Å; N402-K405 PolarHBondContact O-N 2.88Å; N402-K405 WeakPolarHBondContact OD1-CG 3.35Å; N402-K405 PolarHBondContact OD1-N 3.2Å; N402-K405 VanDerWaalsContact OD1-N 3.11Å; P403-K405 PolarHBondContact O-N 2.84Å; K405-S407 PolarHBondContact O-N 3.43Å
406	C	56.7	Low	62.5	Low	30 Å²	30	81.8 Å²	81.8	20%	0.203	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-67	125	164.1	-71.2	0	0	0	0	108.3	L338 P403 E404	L338-C406 WeakPolarHBondContact CD1-SG 3.35Å; P403-C406 WeakPolarHBondContact O-CB 3.48Å; P403-C406 PolarHBondContact O-N 2.9Å; E404-C406 VanDerWaalsContact C-N 3.3Å
407	S	52.3	Low	60	Low	18 Å²	18	84.5 Å²	84.5	13%	0.126	43%	0.431	C	S	.	.			trans	-66.5	145.1	-168.8	85.1	0	0	0	0	112.2	K405 L409 A410	K405-S407 PolarHBondContact O-N 3.43Å; S407-L409 PolarHBondContact O-N 2.96Å; S407-L409 VanDerWaalsContact OG-CA 3.27Å; S407-L409 WeakPolarHBondContact OG-CA 3.25Å; S407-L409 VanDerWaalsContact OG-CB 3.3Å; S407-L409 WeakPolarHBondContact OG-CB 3.13Å; S407-L409 PolarHBondContact OG-N 3.24Å; S407-A410 PolarHBondContact OG-N 3.36Å
408	K	50.6	Low	57.9	Low	213 Å²	213	81.2 Å²	81.2	93%	0.926	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-10.5	157.1	-66	-177.4	179.8	179.6	0	112	A410	K408-A410 PolarHBondContact O-N 3.49Å
409	L	51.3	Low	55.3	Low	54 Å²	54	85.2 Å²	85.2	28%	0.283	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	23.2	178.2	-48.6	168.6	0	0	0	112.2	Y249 S407 S411 E412 W413	Y249-L409 HydrophobicContact CE1-CD1 4.11Å; S407-L409 PolarHBondContact O-N 2.96Å; S407-L409 VanDerWaalsContact OG-CA 3.27Å; S407-L409 WeakPolarHBondContact OG-CA 3.25Å; S407-L409 VanDerWaalsContact OG-CB 3.3Å; S407-L409 WeakPolarHBondContact OG-CB 3.13Å; S407-L409 PolarHBondContact OG-N 3.24Å; L409-S411 PolarHBondContact O-N 2.94Å; L409-S411 VanDerWaalsContact O-N 3.13Å; L409-E412 HydrophobicContact CB-CB 4.19Å; L409-E412 HydrophobicContact CB-CG 4.12Å; L409-E412 HydrophobicContact CD2-CG 4.33Å; L409-E412 WeakPolarHBondContact CD2-OE1 3.23Å; L409-E412 WeakPolarHBondContact O-CA 3.18Å; L409-E412 WeakPolarHBondContact O-CB 3.2Å; L409-E412 PolarHBondContact O-N 2.89Å; L409-W413 PolarHBondContact O-N 2.88Å
410	A	51.2	Low	53.1	Low	48 Å²	48	83.5 Å²	83.5	40%	0.397	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-53.7	-30.4	174.8	0	0	0	0	0	112.4	P252 S407 K408 E412 W413	P252-A410 HydrophobicContact CG-CB 3.51Å; S407-A410 PolarHBondContact OG-N 3.36Å; K408-A410 PolarHBondContact O-N 3.49Å; A410-E412 VanDerWaalsContact C-N 3.34Å; A410-W413 WeakPolarHBondContact O-CB 3.35Å; A410-W413 PolarHBondContact O-N 3.33Å
411	S	49.9	Very low	50.8	Low	112 Å²	112	85.9 Å²	85.9	78%	0.783	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-70.1	-23.4	173.8	49	0	0	0	0	114	L409 W413	L409-S411 PolarHBondContact O-N 2.94Å; L409-S411 VanDerWaalsContact O-N 3.13Å; S411-W413 VanDerWaalsContact C-N 3.35Å
412	E	52.4	Low	48.5	Very low	91 Å²	91	86.4 Å²	86.4	43%	0.425	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-88.5	-4.3	176.2	-57.8	-171.7	175.5	0	0	112.8	K244 L409 A410 K414	K244-E412 IonicContact NZ-OE2 2.63Å; K244-E412 PolarHBondContact NZ-OE2 2.72Å; L409-E412 HydrophobicContact CB-CB 4.19Å; L409-E412 HydrophobicContact CB-CG 4.12Å; L409-E412 HydrophobicContact CD2-CG 4.33Å; L409-E412 WeakPolarHBondContact CD2-OE1 3.23Å; L409-E412 WeakPolarHBondContact O-CA 3.18Å; L409-E412 WeakPolarHBondContact O-CB 3.2Å; L409-E412 PolarHBondContact O-N 2.89Å; A410-E412 VanDerWaalsContact C-N 3.34Å; E412-K414 PolarHBondContact O-N 3.46Å
413	W	48.7	Very low	46.8	Very low	61 Å²	61	87.2 Å²	87.2	23%	0.231	46%	0.462	C	S	.	.			trans	-66.6	95.9	175.9	-178.8	68.9	0	0	0	109.7	R238 W242 R251 L409 A410 S411	R238-W413 VanDerWaalsContact NH2-CH2 3.31Å; W242-W413 AromaticContact CE3-CD1 3.96Å; W242-W413 HydrophobicContact CH2-CB 4.45Å; W242-W413 AromaticContact CZ3-CD1 3.93Å; R251-W413 VanDerWaalsContact NE-CZ2 3.26Å; L409-W413 PolarHBondContact O-N 2.88Å; A410-W413 WeakPolarHBondContact O-CB 3.35Å; A410-W413 PolarHBondContact O-N 3.33Å; S411-W413 VanDerWaalsContact C-N 3.35Å
414	K	51.7	Low	45.4	Very low	162 Å²	162	86.4 Å²	86.4	70%	0.704	46%	0.462	S	S	*	.			trans	-90.4	137.3	164.3	-63.6	-174.2	179.2	-176	0	108.1	E412	E412-K414 PolarHBondContact O-N 3.46Å
415	N	46.3	Very low	44.3	Very low	90 Å²	90	81.8 Å²	81.8	48%	0.481	45%	0.449	S	S	.	.			trans	-54.6	135.8	166.1	-152.4	22.9	0	0	0	106.2	D417	N415-D417 PolarHBondContact O-N 3.26Å
416	P	43.7	Very low	43.3	Very low	47 Å²	47	83.2 Å²	83.2	31%	0.305	46%	0.455	S	S	.	.			trans	-53.2	108.7	175.6	17.8	-29	0	0	0	108	L135 V418	L135-P416 HydrophobicContact CD1-CB 4.28Å; L135-P416 HydrophobicContact CD1-CG 4.18Å; P416-V418 PolarHBondContact O-N 3.3Å
417	D	38.6	Very low	42.1	Very low	94 Å²	94	86.9 Å²	86.9	50%	0.503	47%	0.473	S	S	.	.			trans	-64.1	128.2	-176.1	-76	-42.1	0	0	0	107.2	N415 D419 V420	N415-D417 PolarHBondContact O-N 3.26Å; D417-D419 HydrophobicContact CB-CB 4.18Å; D417-D419 PolarHBondContact O-N 2.87Å; D417-V420 PolarHBondContact O-N 3.47Å
418	V	40.8	Very low	41.2	Very low	58 Å²	58	95.4 Å²	95.4	35%	0.352	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-21.7	171.1	-174	0	0	0	0	110.5	P416 V420 F421 Q422	P416-V418 PolarHBondContact O-N 3.3Å; V418-V420 VanDerWaalsContact C-N 3.34Å; V418-V420 PolarHBondContact O-N 2.93Å; V418-F421 PolarHBondContact O-N 3.1Å; V418-F421 VanDerWaalsContact O-N 3.15Å; V418-Q422 HydrophobicContact CG1-CG 4.2Å; V418-Q422 PolarHBondContact O-N 3.42Å
419	D	33.8	Very low	40.3	Very low	89 Å²	89	92.8 Å²	92.8	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-25.1	176.8	-88.1	-36.5	0	0	0	116.1	D417 F421 Q422 S423 K426	D417-D419 HydrophobicContact CB-CB 4.18Å; D417-D419 PolarHBondContact O-N 2.87Å; D419-F421 VanDerWaalsContact C-N 3.28Å; D419-F421 PolarHBondContact O-N 3.35Å; D419-Q422 PolarHBondContact O-N 2.98Å; D419-Q422 PolarHBondContact OD1-OE1 3.2Å; D419-S423 VanDerWaalsContact O-CB 3.26Å; D419-S423 WeakPolarHBondContact O-CB 3.28Å; D419-S423 PolarHBondContact O-N 2.73Å; D419-S423 PolarHBondContact O-OG 3.33Å; D419-S423 VanDerWaalsContact O-OG 3.11Å; D419-K426 IonicContact OD1-NZ 3.87Å
420	V	40.6	Very low	39.4	Very low	101 Å²	101	91.7 Å²	91.7	61%	0.612	50%	0.501	S	S	*	.	H	α-helix	trans	-65.1	-38.8	173.1	-176.6	0	0	0	0	110.1	D417 V418 S423 A424	D417-V420 PolarHBondContact O-N 3.47Å; V418-V420 VanDerWaalsContact C-N 3.34Å; V418-V420 PolarHBondContact O-N 2.93Å; V420-S423 PolarHBondContact O-OG 3.4Å; V420-A424 PolarHBondContact O-N 2.85Å
421	F	34.6	Very low	38.7	Very low	52 Å²	52	93.3 Å²	93.3	23%	0.228	51%	0.51	C	S	.	.	H	α-helix	trans	-83	-30.2	174.6	-72	-81.2	0	0	0	113.4	R134 L135 V418 D419 S423 A424 S425	R134-F421 HydrophobicContact CB-CE1 4.19Å; R134-F421 HydrophobicContact CB-CZ 4.21Å; L135-F421 HydrophobicContact CD2-CE2 3.6Å; L135-F421 HydrophobicContact CD2-CZ 3.91Å; L135-F421 HydrophobicContact CG-CE2 3.93Å; L135-F421 HydrophobicContact CG-CZ 4.31Å; V418-F421 PolarHBondContact O-N 3.1Å; V418-F421 VanDerWaalsContact O-N 3.15Å; D419-F421 VanDerWaalsContact C-N 3.28Å; D419-F421 PolarHBondContact O-N 3.35Å; F421-S423 VanDerWaalsContact C-N 3.34Å; F421-A424 PolarHBondContact O-N 3.41Å; F421-S425 VanDerWaalsContact O-CB 3.31Å; F421-S425 WeakPolarHBondContact O-CB 3.31Å; F421-S425 PolarHBondContact O-N 2.88Å; F421-S425 PolarHBondContact O-OG 2.9Å
422	Q	32.8	Very low	37.8	Very low	77 Å²	77	96.1 Å²	96.1	36%	0.36	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-35.3	171.8	-66.6	-172.2	12.1	0	0	111.8	V418 D419 A424 S425 K426	V418-Q422 HydrophobicContact CG1-CG 4.2Å; V418-Q422 PolarHBondContact O-N 3.42Å; D419-Q422 PolarHBondContact O-N 2.98Å; D419-Q422 PolarHBondContact OD1-OE1 3.2Å; Q422-A424 VanDerWaalsContact C-N 3.33Å; Q422-S425 WeakPolarHBondContact CA-OG 2.92Å; Q422-S425 PolarHBondContact O-N 2.73Å; Q422-S425 PolarHBondContact O-OG 2.86Å; Q422-K426 HydrophobicContact CB-CD 4.36Å; Q422-K426 WeakPolarHBondContact O-CA 3.32Å; Q422-K426 WeakPolarHBondContact O-CB 3.32Å; Q422-K426 WeakPolarHBondContact O-CD 3.39Å; Q422-K426 WeakPolarHBondContact O-CG 3.43Å; Q422-K426 PolarHBondContact O-N 2.99Å; Q422-K426 VanDerWaalsContact OE1-NZ 3.12Å
423	S	34.3	Very low	36.9	Very low	74 Å²	74	97.4 Å²	97.4	52%	0.517	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-36	173.6	69.7	0	0	0	0	111.9	D419 V420 F421	D419-S423 VanDerWaalsContact O-CB 3.26Å; D419-S423 WeakPolarHBondContact O-CB 3.28Å; D419-S423 PolarHBondContact O-N 2.73Å; D419-S423 PolarHBondContact O-OG 3.33Å; D419-S423 VanDerWaalsContact O-OG 3.11Å; V420-S423 PolarHBondContact O-OG 3.4Å; F421-S423 VanDerWaalsContact C-N 3.34Å
424	A	32.7	Very low	36.2	Very low	63 Å²	63	98.1 Å²	98.1	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-70.6	-34.1	172.1	0	0	0	0	0	113.1	V420 F421 Q422	V420-A424 PolarHBondContact O-N 2.85Å; F421-A424 PolarHBondContact O-N 3.41Å; Q422-A424 VanDerWaalsContact C-N 3.33Å
425	S	32.8	Very low	35.4	Very low	77 Å²	77	92.7 Å²	92.7	54%	0.538	50%	0.5	S	S	.	.	H	α-helix	trans	-88.7	-20.6	179.8	80.5	0	0	0	0	114.4	F421 Q422 N427	F421-S425 VanDerWaalsContact O-CB 3.31Å; F421-S425 WeakPolarHBondContact O-CB 3.31Å; F421-S425 PolarHBondContact O-N 2.88Å; F421-S425 PolarHBondContact O-OG 2.9Å; Q422-S425 WeakPolarHBondContact CA-OG 2.92Å; Q422-S425 PolarHBondContact O-N 2.73Å; Q422-S425 PolarHBondContact O-OG 2.86Å; S425-N427 PolarHBondContact O-N 3.28Å
426	K	34	Very low	34.9	Very low	136 Å²	136	90.7 Å²	90.7	59%	0.591	49%	0.493	S	S	*	.	H	α-helix	trans	-73.7	-15.5	175.1	-81.1	167.5	-176.6	164.1	0	112	D419 Q422 Q428	D419-K426 IonicContact OD1-NZ 3.87Å; Q422-K426 HydrophobicContact CB-CD 4.36Å; Q422-K426 WeakPolarHBondContact O-CA 3.32Å; Q422-K426 WeakPolarHBondContact O-CB 3.32Å; Q422-K426 WeakPolarHBondContact O-CD 3.39Å; Q422-K426 WeakPolarHBondContact O-CG 3.43Å; Q422-K426 PolarHBondContact O-N 2.99Å; Q422-K426 VanDerWaalsContact OE1-NZ 3.12Å; K426-Q428 PolarHBondContact O-N 3.35Å
427	N	31.7	Very low	34.5	Very low	107 Å²	107	92.2 Å²	92.2	57%	0.572	49%	0.494	S	S	*	.	S	Bend	trans	-72.1	110.2	164.1	-82	-28.8	0	0	0	108.9	S425 K429 G430	S425-N427 PolarHBondContact O-N 3.28Å; N427-K429 PolarHBondContact O-N 3.15Å; N427-G430 PolarHBondContact O-N 3.41Å
428	Q	33.5	Very low	34.4	Very low	197 Å²	197	91.1 Å²	91.1	92%	0.921	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-3.2	171.7	-84.9	178.6	-19.8	0	0	114.9	K426 G430	K426-Q428 PolarHBondContact O-N 3.35Å; Q428-G430 VanDerWaalsContact C-N 3.34Å
429	K	31.9	Very low	34.3	Very low	159 Å²	159	93.9 Å²	93.9	69%	0.691	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-12	167.1	-70.3	-178.2	176.9	178.2	0	114	N427 S431 K432 M433	N427-K429 PolarHBondContact O-N 3.15Å; K429-S431 PolarHBondContact O-N 2.92Å; K429-K432 CarbonylContact O-C 3.58Å; K429-K432 WeakPolarHBondContact O-CA 3.4Å; K429-K432 WeakPolarHBondContact O-CB 3.49Å; K429-K432 PolarHBondContact O-N 3.14Å; K429-M433 WeakPolarHBondContact O-CB 3.47Å; K429-M433 PolarHBondContact O-N 3.49Å
430	G	32.2	Very low	34.5	Very low	31 Å²	31	98.6 Å²	98.6	32%	0.32	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-37.1	-176.2	0	0	0	0	0	115	N427 Q428 K432 M433 M434	N427-G430 PolarHBondContact O-N 3.41Å; Q428-G430 VanDerWaalsContact C-N 3.34Å; G430-K432 VanDerWaalsContact C-N 3.33Å; G430-M433 PolarHBondContact O-N 2.93Å; G430-M434 PolarHBondContact O-N 3.36Å
431	S	36.1	Very low	34.2	Very low	82 Å²	82	99.7 Å²	99.7	57%	0.573	51%	0.506	S	S	*	.	H	α-helix	trans	-72.1	-26.9	174.1	-55.5	0	0	0	0	112.9	K429	K429-S431 PolarHBondContact O-N 2.92Å
432	K	30.9	Very low	34.5	Very low	170 Å²	170	102.1 Å²	102.1	74%	0.739	53%	0.525	S	S	*	.	H	α-helix	trans	-76.4	-29.5	170.3	-124.7	179.1	-178	-178.7	0	111.3	K429 G430 S436	K429-K432 CarbonylContact O-C 3.58Å; K429-K432 WeakPolarHBondContact O-CA 3.4Å; K429-K432 WeakPolarHBondContact O-CB 3.49Å; K429-K432 PolarHBondContact O-N 3.14Å; G430-K432 VanDerWaalsContact C-N 3.33Å; K432-S436 PolarHBondContact O-N 3.29Å; K432-S436 VanDerWaalsContact O-N 3.1Å
433	M	33.4	Very low	34.8	Very low	119 Å²	119	102 Å²	102	59%	0.586	55%	0.545	S	S	*	.	H	α-helix	trans	-75.2	-37.2	-179.5	-160.4	-176.1	-93.8	0	0	112.2	K429 G430 L435 S436 Y437	K429-M433 WeakPolarHBondContact O-CB 3.47Å; K429-M433 PolarHBondContact O-N 3.49Å; G430-M433 PolarHBondContact O-N 2.93Å; M433-L435 VanDerWaalsContact C-N 3.34Å; M433-L435 PolarHBondContact O-N 2.76Å; M433-S436 VanDerWaalsContact CA-OG 3.31Å; M433-S436 WeakPolarHBondContact CA-OG 3.43Å; M433-S436 CarbonylContact O-C 3.55Å; M433-S436 WeakPolarHBondContact O-CA 3.17Å; M433-S436 PolarHBondContact O-N 3.48Å; M433-S436 VanDerWaalsContact O-N 3.1Å; M433-S436 PolarHBondContact O-OG 2.93Å; M433-Y437 WeakPolarHBondContact O-CB 3.44Å; M433-Y437 PolarHBondContact O-N 3.16Å
434	M	32.8	Very low	35.1	Very low	75 Å²	75	106.8 Å²	106.8	37%	0.369	56%	0.556	S	S	.	*	H	α-helix	trans	-59	-42.8	172.4	-110.6	-93.9	-86.5	0	0	112	V149 G430 S436 Y437 E438	V149-M434 WeakPolarHBondContact O-CE 3.35Å; G430-M434 PolarHBondContact O-N 3.36Å; M434-S436 VanDerWaalsContact C-N 3.34Å; M434-S436 PolarHBondContact O-N 3.45Å; M434-Y437 PolarHBondContact O-N 3.5Å; M434-Y437 VanDerWaalsContact O-N 3.15Å; M434-E438 PolarHBondContact O-N 3.31Å
435	L	35.3	Very low	35.8	Very low	48 Å²	48	109 Å²	109	25%	0.251	56%	0.559	S	S	.	*	H	α-helix	trans	-66.8	-33.1	172.8	-75.2	164.9	0	0	0	112.9	F108 M433 Y437 Y452 W456	F108-L435 HydrophobicContact CE1-CD2 3.83Å; F108-L435 HydrophobicContact CZ-CD2 3.64Å; M433-L435 VanDerWaalsContact C-N 3.34Å; M433-L435 PolarHBondContact O-N 2.76Å; L435-Y437 VanDerWaalsContact C-N 3.28Å; L435-Y437 PolarHBondContact O-N 3.49Å; L435-Y452 HydrophobicContact CD2-CD1 4Å; L435-Y452 HydrophobicContact CD2-CE1 3.19Å; L435-W456 HydrophobicContact CD1-CZ2 4.18Å
436	S	36.9	Very low	36.4	Very low	48 Å²	48	112.4 Å²	112.4	34%	0.336	57%	0.566	S	S	.	*	H	α-helix	trans	-75.1	-13.2	172.8	80.6	0	0	0	0	114.2	K432 M433 M434	K432-S436 PolarHBondContact O-N 3.29Å; K432-S436 VanDerWaalsContact O-N 3.1Å; M433-S436 VanDerWaalsContact CA-OG 3.31Å; M433-S436 WeakPolarHBondContact CA-OG 3.43Å; M433-S436 CarbonylContact O-C 3.55Å; M433-S436 WeakPolarHBondContact O-CA 3.17Å; M433-S436 PolarHBondContact O-N 3.48Å; M433-S436 VanDerWaalsContact O-N 3.1Å; M433-S436 PolarHBondContact O-OG 2.93Å; M434-S436 VanDerWaalsContact C-N 3.34Å; M434-S436 PolarHBondContact O-N 3.45Å
437	Y	35.2	Very low	37	Very low	79 Å²	79	113.4 Å²	113.4	31%	0.31	57%	0.573	S	S	.	*	H	α-helix	trans	-92.8	-38	-172.7	-156.5	-85.4	0	0	0	112.3	E141 M433 M434 L435 F439 R440	E141-Y437 WeakPolarHBondContact OE1-CE1 2.84Å; M433-Y437 WeakPolarHBondContact O-CB 3.44Å; M433-Y437 PolarHBondContact O-N 3.16Å; M434-Y437 PolarHBondContact O-N 3.5Å; M434-Y437 VanDerWaalsContact O-N 3.15Å; L435-Y437 VanDerWaalsContact C-N 3.28Å; L435-Y437 PolarHBondContact O-N 3.49Å; Y437-F439 PolarHBondContact O-N 3.22Å; Y437-R440 PolarHBondContact O-N 2.75Å
438	E	36.8	Very low	37.5	Very low	72 Å²	72	115.4 Å²	115.4	34%	0.336	58%	0.577	S	S	.	*	H	α-helix	trans	-65.2	-29.2	167	-79.8	-178.3	163.4	0	0	112.3	F108 M434 R440 L441	F108-E438 VanDerWaalsContact CD1-OE2 3.22Å; F108-E438 WeakPolarHBondContact CD1-OE2 3.24Å; F108-E438 WeakPolarHBondContact CE1-OE2 3.48Å; M434-E438 PolarHBondContact O-N 3.31Å; E438-R440 VanDerWaalsContact C-N 3.32Å; E438-R440 PolarHBondContact O-N 2.98Å; E438-L441 PolarHBondContact O-N 3.49Å
439	F	37.7	Very low	37.7	Very low	116 Å²	116	109.8 Å²	109.8	51%	0.509	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-65.9	-29.2	179.6	-171.9	-104.7	0	0	0	113.7	Y437 L441	Y437-F439 PolarHBondContact O-N 3.22Å; F439-L441 PolarHBondContact O-N 3.28Å
440	R	37.8	Very low	38.3	Very low	188 Å²	188	107.1 Å²	107.1	71%	0.709	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-74.4	-13.5	179.4	-117.3	-177.7	-71.3	175.6	-2.1	113.7	Y437 E438	Y437-R440 PolarHBondContact O-N 2.75Å; E438-R440 VanDerWaalsContact C-N 3.32Å; E438-R440 PolarHBondContact O-N 2.98Å
441	L	35.4	Very low	39	Very low	124 Å²	124	109.9 Å²	109.9	65%	0.649	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-99.6	-11.4	-173.2	-71.2	167.9	0	0	0	114.3	E438 F439	E438-L441 PolarHBondContact O-N 3.49Å; F439-L441 PolarHBondContact O-N 3.28Å
442	T	40.3	Very low	39.2	Very low	103 Å²	103	109.2 Å²	109.2	63%	0.632	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	-10.7	-168.4	58.4	0	0	0	0	116.2	K444	T442-K444 VanDerWaalsContact C-N 3.3Å; T442-K444 PolarHBondContact O-N 3.23Å
443	G	39.5	Very low	39.7	Very low	74 Å²	74	103.4 Å²	103.4	76%	0.763	52%	0.518	S	S	*	.			trans	54.1	29	162.8	0	0	0	0	0	117.7
444	K	40.4	Very low	40.4	Very low	174 Å²	174	104.1 Å²	104.1	76%	0.757	52%	0.516	S	S	*	.			trans	-140	134.4	179.6	-73	-171.2	177.5	178.7	0	115.6	T442	T442-K444 VanDerWaalsContact C-N 3.3Å; T442-K444 PolarHBondContact O-N 3.23Å
445	N	46.7	Very low	40.9	Very low	111 Å²	111	108.1 Å²	108.1	59%	0.594	53%	0.527	S	S	*	.			trans	48.8	109.4	159.8	-79.5	2.5	0	0	0	121.1	E447 K448	N445-E447 PolarHBondContact O-N 3.19Å; N445-E447 VanDerWaalsContact O-N 3.17Å; N445-K448 PolarHBondContact O-N 2.81Å; N445-K448 VanDerWaalsContact O-N 3.16Å
446	E	45.1	Very low	41.2	Very low	147 Å²	147	109 Å²	109	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-55	-24.3	169.9	-156.7	170.1	-160.9	0	0	114	M449 N450	E446-M449 HydrophobicContact CG-CE 3.82Å; E446-M449 VanDerWaalsContact O-CB 3.32Å; E446-M449 WeakPolarHBondContact O-CB 3.25Å; E446-M449 PolarHBondContact O-N 3.36Å; E446-N450 PolarHBondContact O-N 3.43Å
447	E	46.6	Very low	41.6	Very low	157 Å²	157	113 Å²	113	73%	0.734	54%	0.54	S	S	*	.	H	α-helix	trans	-68.1	-40.3	176.2	-129	174.4	-175.1	0	0	112.9	N445 M449 N450 E451	N445-E447 PolarHBondContact O-N 3.19Å; N445-E447 VanDerWaalsContact O-N 3.17Å; E447-M449 VanDerWaalsContact C-N 3.27Å; E447-M449 PolarHBondContact O-N 3.31Å; E447-N450 PolarHBondContact O-N 3.45Å; E447-E451 PolarHBondContact O-N 3.45Å; E447-E451 VanDerWaalsContact O-N 3.13Å
448	K	43.2	Very low	42.1	Very low	149 Å²	149	113.8 Å²	113.8	65%	0.648	55%	0.545	S	S	*	.	H	α-helix	trans	-69.9	-26.5	174.1	-76.1	-172.4	175.9	-177.1	0	111.8	N445 E451 Y452	N445-K448 PolarHBondContact O-N 2.81Å; N445-K448 VanDerWaalsContact O-N 3.16Å; K448-E451 PolarHBondContact O-N 2.7Å; K448-Y452 WeakPolarHBondContact O-CB 3.37Å; K448-Y452 PolarHBondContact O-N 3.41Å
449	M	37.2	Very low	42.3	Very low	80 Å²	80	112.6 Å²	112.6	39%	0.394	55%	0.548	S	S	.	.	H	α-helix	trans	-65.7	-44.1	173.7	178.1	-165.6	73.4	0	0	111.2	E446 E447 E451 Y452 A453	E446-M449 HydrophobicContact CG-CE 3.82Å; E446-M449 VanDerWaalsContact O-CB 3.32Å; E446-M449 WeakPolarHBondContact O-CB 3.25Å; E446-M449 PolarHBondContact O-N 3.36Å; E447-M449 VanDerWaalsContact C-N 3.27Å; E447-M449 PolarHBondContact O-N 3.31Å; M449-E451 VanDerWaalsContact C-N 3.35Å; M449-Y452 PolarHBondContact O-N 3.13Å; M449-A453 VanDerWaalsContact O-CB 3.32Å; M449-A453 WeakPolarHBondContact O-CB 3.44Å; M449-A453 PolarHBondContact O-N 3.36Å
450	N	45.9	Very low	42.6	Very low	102 Å²	102	113.9 Å²	113.9	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-66.3	-39.3	176.2	-72.9	-23.8	0	0	0	111.4	E446 E447 Y454	E446-N450 PolarHBondContact O-N 3.43Å; E447-N450 PolarHBondContact O-N 3.45Å; N450-Y454 WeakPolarHBondContact O-CB 3.45Å; N450-Y454 PolarHBondContact O-N 3.14Å
451	E	45.2	Very low	43.1	Very low	90 Å²	90	109 Å²	109	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-40.9	173	-164.9	-174	174.8	0	0	112.1	E447 K448 M449 Y454 R455	E447-E451 PolarHBondContact O-N 3.45Å; E447-E451 VanDerWaalsContact O-N 3.13Å; K448-E451 PolarHBondContact O-N 2.7Å; M449-E451 VanDerWaalsContact C-N 3.35Å; E451-Y454 PolarHBondContact O-N 2.94Å; E451-R455 WeakPolarHBondContact O-CB 3.35Å; E451-R455 VanDerWaalsContact O-CG 3.23Å; E451-R455 WeakPolarHBondContact O-CG 3.07Å; E451-R455 PolarHBondContact O-N 3.42Å; E451-R455 IonicContact OE1-CZ 2.77Å; E451-R455 VanDerWaalsContact OE1-CZ 3.23Å; E451-R455 IonicContact OE1-NE 2.6Å; E451-R455 PolarHBondContact OE1-NE 2.93Å; E451-R455 VanDerWaalsContact OE1-NE 3.12Å; E451-R455 IonicContact OE1-NH2 3.26Å; E451-R455 PolarHBondContact OE1-NH2 3.49Å
452	Y	40.2	Very low	43.6	Very low	68 Å²	68	111.2 Å²	111.2	27%	0.267	53%	0.534	S	S	.	.	H	α-helix	trans	-68	-48.3	179.1	-171.8	-76.8	0	0	0	111.7	P107 F108 L435 K448 M449 Y454 R455 W456	P107-Y452 PolarHBondContact O-OH 3.37Å; F108-Y452 AromaticContact CD1-CE2 3.8Å; F108-Y452 HydrophobicContact CD1-CE2 3.8Å; F108-Y452 AromaticContact CD1-CZ 3.69Å; F108-Y452 WeakPolarHBondContact CD1-OH 3.13Å; F108-Y452 HydrophobicContact CE1-CE1 4.29Å; F108-Y452 AromaticContact CE1-CE2 3.92Å; F108-Y452 HydrophobicContact CE1-CE2 3.92Å; F108-Y452 AromaticContact CE1-CZ 3.4Å; F108-Y452 VanDerWaalsContact CE1-CZ 3.4Å; F108-Y452 WeakPolarHBondContact CE1-OH 3.45Å; F108-Y452 AromaticContact CZ-CZ 3.99Å; F108-Y452 WeakPolarHBondContact CZ-OH 3.31Å; L435-Y452 HydrophobicContact CD2-CD1 4Å; L435-Y452 HydrophobicContact CD2-CE1 3.19Å; K448-Y452 WeakPolarHBondContact O-CB 3.37Å; K448-Y452 PolarHBondContact O-N 3.41Å; M449-Y452 PolarHBondContact O-N 3.13Å; Y452-Y454 VanDerWaalsContact C-N 3.28Å; Y452-Y454 PolarHBondContact O-N 3.45Å; Y452-R455 PolarHBondContact O-N 2.97Å; Y452-W456 HydrophobicContact CE1-CB 4.25Å; Y452-W456 HydrophobicContact CE1-CG 4.49Å; Y452-W456 VanDerWaalsContact O-CB 3.24Å; Y452-W456 WeakPolarHBondContact O-CB 3.49Å; Y452-W456 PolarHBondContact O-N 2.95Å
453	A	42.4	Very low	43.6	Very low	47 Å²	47	112.1 Å²	112.1	39%	0.388	53%	0.527	S	S	.	.	H	α-helix	trans	-58.7	-42.1	175.7	0	0	0	0	0	111	M449 W456 E457	M449-A453 VanDerWaalsContact O-CB 3.32Å; M449-A453 WeakPolarHBondContact O-CB 3.44Å; M449-A453 PolarHBondContact O-N 3.36Å; A453-W456 PolarHBondContact O-N 2.96Å; A453-E457 PolarHBondContact O-N 3.18Å
454	Y	48.4	Very low	43.9	Very low	135 Å²	135	116.6 Å²	116.6	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-48.3	174.3	177.7	-100.5	0	0	0	112.5	N450 E451 Y452 W456 E457 K458	N450-Y454 WeakPolarHBondContact O-CB 3.45Å; N450-Y454 PolarHBondContact O-N 3.14Å; E451-Y454 PolarHBondContact O-N 2.94Å; Y452-Y454 VanDerWaalsContact C-N 3.28Å; Y452-Y454 PolarHBondContact O-N 3.45Å; Y454-W456 VanDerWaalsContact C-N 3.27Å; Y454-W456 PolarHBondContact O-N 3.27Å; Y454-E457 PolarHBondContact O-N 3.29Å; Y454-K458 HydrophobicContact CE1-CD 3.93Å; Y454-K458 VanDerWaalsContact O-CB 3.28Å; Y454-K458 WeakPolarHBondContact O-CB 3.47Å; Y454-K458 PolarHBondContact O-N 2.9Å; Y454-K458 PolarHBondContact OH-NZ 3.24Å
455	R	43.2	Very low	44.3	Very low	159 Å²	159	112.6 Å²	112.6	60%	0.6	51%	0.505	S	S	*	.	H	α-helix	trans	-59.9	-39.3	176.4	-76.4	173.9	-178.5	-146.9	3.1	111.3	E451 Y452 K458 A459	E451-R455 WeakPolarHBondContact O-CB 3.35Å; E451-R455 VanDerWaalsContact O-CG 3.23Å; E451-R455 WeakPolarHBondContact O-CG 3.07Å; E451-R455 PolarHBondContact O-N 3.42Å; E451-R455 IonicContact OE1-CZ 2.77Å; E451-R455 VanDerWaalsContact OE1-CZ 3.23Å; E451-R455 IonicContact OE1-NE 2.6Å; E451-R455 PolarHBondContact OE1-NE 2.93Å; E451-R455 VanDerWaalsContact OE1-NE 3.12Å; E451-R455 IonicContact OE1-NH2 3.26Å; E451-R455 PolarHBondContact OE1-NH2 3.49Å; Y452-R455 PolarHBondContact O-N 2.97Å; R455-K458 PolarHBondContact O-N 3.32Å; R455-A459 VanDerWaalsContact O-CB 3.3Å; R455-A459 WeakPolarHBondContact O-CB 3.4Å; R455-A459 PolarHBondContact O-N 3.31Å
456	W	40.4	Very low	44	Very low	66 Å²	66	115 Å²	115	25%	0.25	51%	0.506	C	S	.	.	H	α-helix	trans	-69.6	-44.3	179.1	-168.8	87.3	0	0	0	112.7	L435 Y452 A453 Y454 K458 A459 R460	L435-W456 HydrophobicContact CD1-CZ2 4.18Å; Y452-W456 HydrophobicContact CE1-CB 4.25Å; Y452-W456 HydrophobicContact CE1-CG 4.49Å; Y452-W456 VanDerWaalsContact O-CB 3.24Å; Y452-W456 WeakPolarHBondContact O-CB 3.49Å; Y452-W456 PolarHBondContact O-N 2.95Å; A453-W456 PolarHBondContact O-N 2.96Å; Y454-W456 VanDerWaalsContact C-N 3.27Å; Y454-W456 PolarHBondContact O-N 3.27Å; W456-K458 VanDerWaalsContact C-N 3.32Å; W456-K458 PolarHBondContact O-N 2.85Å; W456-A459 PolarHBondContact O-N 2.93Å; W456-R460 VanDerWaalsContact O-CB 3.28Å; W456-R460 WeakPolarHBondContact O-CB 3.47Å; W456-R460 PolarHBondContact O-N 3.24Å
457	E	46.6	Very low	43.9	Very low	133 Å²	133	111.5 Å²	111.5	62%	0.621	49%	0.49	S	S	*	.	H	α-helix	trans	-61.5	-41.7	171.8	-79	-167.1	158.5	0	0	111.6	A453 Y454 R460 E461	A453-E457 PolarHBondContact O-N 3.18Å; Y454-E457 PolarHBondContact O-N 3.29Å; E457-R460 PolarHBondContact O-N 3.27Å; E457-E461 WeakPolarHBondContact O-CB 3.45Å; E457-E461 PolarHBondContact O-N 3.08Å
458	K	45.2	Very low	44	Very low	94 Å²	94	108.9 Å²	108.9	41%	0.409	48%	0.48	S	S	.	.	H	α-helix	trans	-67.1	-37.8	178.3	-153.5	174.5	-167.9	169.6	0	112.2	Y454 R455 W456 R462	Y454-K458 HydrophobicContact CE1-CD 3.93Å; Y454-K458 VanDerWaalsContact O-CB 3.28Å; Y454-K458 WeakPolarHBondContact O-CB 3.47Å; Y454-K458 PolarHBondContact O-N 2.9Å; Y454-K458 PolarHBondContact OH-NZ 3.24Å; R455-K458 PolarHBondContact O-N 3.32Å; W456-K458 VanDerWaalsContact C-N 3.32Å; W456-K458 PolarHBondContact O-N 2.85Å; K458-R462 VanDerWaalsContact O-CG 3.29Å; K458-R462 WeakPolarHBondContact O-CG 3.17Å; K458-R462 PolarHBondContact O-N 3.38Å
459	A	40.1	Very low	44.2	Very low	48 Å²	48	110.1 Å²	110.1	40%	0.397	48%	0.481	S	S	.	.	H	α-helix	trans	-67.7	-42.8	174.8	0	0	0	0	0	111.8	R455 W456 E461 R462 Y463	R455-A459 VanDerWaalsContact O-CB 3.3Å; R455-A459 WeakPolarHBondContact O-CB 3.4Å; R455-A459 PolarHBondContact O-N 3.31Å; W456-A459 PolarHBondContact O-N 2.93Å; A459-E461 VanDerWaalsContact C-N 3.33Å; A459-E461 PolarHBondContact O-N 3.12Å; A459-R462 PolarHBondContact O-N 3.38Å; A459-Y463 PolarHBondContact O-N 2.99Å
460	R	44.6	Very low	44.4	Very low	142 Å²	142	110.3 Å²	110.3	54%	0.536	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-41.5	174	179.6	-176.8	-76.5	-156.9	-23.1	112	W456 E457 Y463 R464	W456-R460 VanDerWaalsContact O-CB 3.28Å; W456-R460 WeakPolarHBondContact O-CB 3.47Å; W456-R460 PolarHBondContact O-N 3.24Å; E457-R460 PolarHBondContact O-N 3.27Å; R460-Y463 PolarHBondContact O-N 3.07Å; R460-R464 WeakPolarHBondContact O-CB 3.19Å; R460-R464 PolarHBondContact O-N 3.21Å
461	E	47.6	Very low	44.4	Very low	86 Å²	86	112.2 Å²	112.2	40%	0.402	49%	0.486	S	S	.	.	H	α-helix	trans	-67.7	-42.6	176.7	-174.8	54	-150.7	0	0	111.6	E457 A459 Y463 R464 Q465	E457-E461 WeakPolarHBondContact O-CB 3.45Å; E457-E461 PolarHBondContact O-N 3.08Å; A459-E461 VanDerWaalsContact C-N 3.33Å; A459-E461 PolarHBondContact O-N 3.12Å; E461-Y463 VanDerWaalsContact C-N 3.3Å; E461-Y463 PolarHBondContact O-N 3.05Å; E461-R464 PolarHBondContact O-N 3.19Å; E461-Q465 WeakPolarHBondContact O-CB 3.48Å; E461-Q465 WeakPolarHBondContact O-CG 3.47Å; E461-Q465 PolarHBondContact O-N 3.29Å; E461-Q465 PolarHBondContact OE1-NE2 3.21Å
462	R	47.5	Very low	44.4	Very low	170 Å²	170	112.9 Å²	112.9	64%	0.642	49%	0.493	S	S	*	.	H	α-helix	trans	-58.4	-41.2	172.4	-73.4	174.3	-170	-171.6	2.4	112.2	K458 A459 Q465 R466	K458-R462 VanDerWaalsContact O-CG 3.29Å; K458-R462 WeakPolarHBondContact O-CG 3.17Å; K458-R462 PolarHBondContact O-N 3.38Å; A459-R462 PolarHBondContact O-N 3.38Å; R462-Q465 PolarHBondContact O-N 3.48Å; R462-R466 WeakPolarHBondContact O-CB 3.33Å; R462-R466 PolarHBondContact O-N 2.94Å
463	Y	39.4	Very low	44.5	Very low	122 Å²	122	114.5 Å²	114.5	48%	0.478	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-46.7	175.3	177.8	-97.3	0	0	0	111.4	A459 R460 E461 Q465 R466 M467	A459-Y463 PolarHBondContact O-N 2.99Å; R460-Y463 PolarHBondContact O-N 3.07Å; E461-Y463 VanDerWaalsContact C-N 3.3Å; E461-Y463 PolarHBondContact O-N 3.05Å; Y463-Q465 VanDerWaalsContact C-N 3.31Å; Y463-Q465 PolarHBondContact O-N 3.17Å; Y463-R466 PolarHBondContact O-N 3.32Å; Y463-M467 HydrophobicContact CD1-CG 4.13Å; Y463-M467 HydrophobicContact CD2-CG 4.38Å; Y463-M467 HydrophobicContact CE1-CG 3.7Å; Y463-M467 HydrophobicContact CE2-CG 3.98Å; Y463-M467 HydrophobicContact CE2-SD 4.18Å; Y463-M467 HydrophobicContact CG-CG 4.46Å; Y463-M467 WeakPolarHBondContact O-CB 3.33Å; Y463-M467 WeakPolarHBondContact O-CG 3.12Å; Y463-M467 PolarHBondContact O-N 3.39Å
464	R	46.8	Very low	44.6	Very low	168 Å²	168	116.9 Å²	116.9	63%	0.634	51%	0.512	S	S	*	.	H	α-helix	trans	-58.1	-44	176.7	-165.2	178.1	-174.4	140.8	1.4	111.4	R460 E461 M467 L468	R460-R464 WeakPolarHBondContact O-CB 3.19Å; R460-R464 PolarHBondContact O-N 3.21Å; E461-R464 PolarHBondContact O-N 3.19Å; R464-M467 PolarHBondContact O-N 3.24Å; R464-L468 HydrophobicContact CG-CD1 4.36Å; R464-L468 WeakPolarHBondContact O-CB 3.48Å; R464-L468 WeakPolarHBondContact O-CD1 3.38Å; R464-L468 WeakPolarHBondContact O-CG 3.3Å; R464-L468 PolarHBondContact O-N 3.41Å
465	Q	48	Very low	44.5	Very low	91 Å²	91	119 Å²	119	43%	0.425	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-38.9	176.7	-69.6	-173.5	16.1	0	0	112.8	E461 R462 Y463 L468 R469	E461-Q465 WeakPolarHBondContact O-CB 3.48Å; E461-Q465 WeakPolarHBondContact O-CG 3.47Å; E461-Q465 PolarHBondContact O-N 3.29Å; E461-Q465 PolarHBondContact OE1-NE2 3.21Å; R462-Q465 PolarHBondContact O-N 3.48Å; Y463-Q465 VanDerWaalsContact C-N 3.31Å; Y463-Q465 PolarHBondContact O-N 3.17Å; Q465-L468 PolarHBondContact O-N 3.2Å; Q465-R469 WeakPolarHBondContact O-CG 3.35Å; Q465-R469 PolarHBondContact O-N 3.2Å
466	R	41.2	Very low	44.8	Very low	162 Å²	162	115.4 Å²	115.4	61%	0.611	51%	0.512	S	S	*	.	H	α-helix	trans	-64.5	-43.9	174.7	-173.7	176.7	-178.8	-173.7	0	111.5	R462 Y463 L468 R469 L470	R462-R466 WeakPolarHBondContact O-CB 3.33Å; R462-R466 PolarHBondContact O-N 2.94Å; Y463-R466 PolarHBondContact O-N 3.32Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 2.84Å; R466-R469 PolarHBondContact O-N 2.76Å; R466-L470 HydrophobicContact CG-CD1 4.3Å; R466-L470 WeakPolarHBondContact O-CG 3.25Å; R466-L470 PolarHBondContact O-N 2.73Å
467	M	42.3	Very low	45.1	Very low	72 Å²	72	117 Å²	117	36%	0.355	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-36.6	176.2	-70.1	-55.8	-65.5	0	0	112.2	Y463 R464 L470 K471	Y463-M467 HydrophobicContact CD1-CG 4.13Å; Y463-M467 HydrophobicContact CD2-CG 4.38Å; Y463-M467 HydrophobicContact CE1-CG 3.7Å; Y463-M467 HydrophobicContact CE2-CG 3.98Å; Y463-M467 HydrophobicContact CE2-SD 4.18Å; Y463-M467 HydrophobicContact CG-CG 4.46Å; Y463-M467 WeakPolarHBondContact O-CB 3.33Å; Y463-M467 WeakPolarHBondContact O-CG 3.12Å; Y463-M467 PolarHBondContact O-N 3.39Å; R464-M467 PolarHBondContact O-N 3.24Å; M467-L470 HydrophobicContact SD-CD1 4.23Å; M467-K471 WeakPolarHBondContact O-CG 3.39Å; M467-K471 PolarHBondContact O-N 2.98Å; M467-K471 VanDerWaalsContact O-N 3.09Å
468	L	48.6	Very low	45.1	Very low	102 Å²	102	117 Å²	117	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-43.6	171.4	-80.3	161.8	0	0	0	111.7	R464 Q465 R466 K471 L472	R464-L468 HydrophobicContact CG-CD1 4.36Å; R464-L468 WeakPolarHBondContact O-CB 3.48Å; R464-L468 WeakPolarHBondContact O-CD1 3.38Å; R464-L468 WeakPolarHBondContact O-CG 3.3Å; R464-L468 PolarHBondContact O-N 3.41Å; Q465-L468 PolarHBondContact O-N 3.2Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 2.84Å; L468-K471 PolarHBondContact O-N 3.02Å; L468-L472 WeakPolarHBondContact O-CB 3.43Å; L468-L472 PolarHBondContact O-N 2.96Å
469	R	47.8	Very low	45.3	Very low	176 Å²	176	119.2 Å²	119.2	66%	0.664	53%	0.532	S	S	*	.	H	α-helix	trans	-63.9	-41.8	176.4	-76.3	-178.6	-173.7	-173	2	112.8	Q465 R466 L472 N473	Q465-R469 WeakPolarHBondContact O-CG 3.35Å; Q465-R469 PolarHBondContact O-N 3.2Å; R466-R469 PolarHBondContact O-N 2.76Å; R469-L472 WeakPolarHBondContact O-CB 3.45Å; R469-L472 PolarHBondContact O-N 2.83Å; R469-N473 WeakPolarHBondContact O-CB 3.41Å; R469-N473 PolarHBondContact O-N 3.02Å
470	L	40.8	Very low	45.8	Very low	83 Å²	83	122.4 Å²	122.4	44%	0.435	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-44.7	176.5	-72.3	169.6	0	0	0	111.2	R466 M467 L472 N473 D474	R466-L470 HydrophobicContact CG-CD1 4.3Å; R466-L470 WeakPolarHBondContact O-CG 3.25Å; R466-L470 PolarHBondContact O-N 2.73Å; M467-L470 HydrophobicContact SD-CD1 4.23Å; L470-L472 VanDerWaalsContact C-N 3.29Å; L470-L472 PolarHBondContact O-N 2.93Å; L470-N473 PolarHBondContact O-N 3.39Å; L470-D474 PolarHBondContact O-N 3.35Å
471	K	45.2	Very low	46	Very low	142 Å²	142	119.8 Å²	119.8	62%	0.617	53%	0.531	S	S	*	.	H	α-helix	trans	-62.6	-33.8	173.8	-74.1	-178.7	178	-173.9	0	113.3	M467 L468 R475	M467-K471 WeakPolarHBondContact O-CG 3.39Å; M467-K471 PolarHBondContact O-N 2.98Å; M467-K471 VanDerWaalsContact O-N 3.09Å; L468-K471 PolarHBondContact O-N 3.02Å; K471-R475 PolarHBondContact O-N 3.1Å
472	L	45.2	Very low	46	Very low	105 Å²	105	118.3 Å²	118.3	55%	0.55	53%	0.534	S	S	.	.	H	α-helix	trans	-70.5	-42.2	175.7	-140	89.9	0	0	0	111.2	L468 R469 L470 R475 N476	L468-L472 WeakPolarHBondContact O-CB 3.43Å; L468-L472 PolarHBondContact O-N 2.96Å; R469-L472 WeakPolarHBondContact O-CB 3.45Å; R469-L472 PolarHBondContact O-N 2.83Å; L470-L472 VanDerWaalsContact C-N 3.29Å; L470-L472 PolarHBondContact O-N 2.93Å; L472-R475 PolarHBondContact O-N 3.04Å; L472-N476 WeakPolarHBondContact O-CB 3.35Å; L472-N476 VanDerWaalsContact O-CG 3.24Å; L472-N476 PolarHBondContact O-N 3.48Å; L472-N476 PolarHBondContact O-ND2 3.02Å
473	N	43.9	Very low	46.3	Very low	101 Å²	101	116 Å²	116	54%	0.54	53%	0.528	S	S	.	.	H	α-helix	trans	-65.6	-39.6	177.4	-78.2	-1.2	0	0	0	111.9	R469 L470 N476 K477	R469-N473 WeakPolarHBondContact O-CB 3.41Å; R469-N473 PolarHBondContact O-N 3.02Å; L470-N473 PolarHBondContact O-N 3.39Å; N473-N476 PolarHBondContact O-N 3.04Å; N473-K477 VanDerWaalsContact O-CB 3.3Å; N473-K477 WeakPolarHBondContact O-CB 2.89Å; N473-K477 PolarHBondContact O-N 3.25Å
474	D	43.8	Very low	47	Very low	98 Å²	98	112.3 Å²	112.3	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-41.7	174.3	-81.1	-16.4	0	0	0	112	L470 K477 Q478	L470-D474 PolarHBondContact O-N 3.35Å; D474-K477 PolarHBondContact O-N 3.19Å; D474-Q478 WeakPolarHBondContact O-CB 3.28Å; D474-Q478 VanDerWaalsContact O-CG 3.3Å; D474-Q478 WeakPolarHBondContact O-CG 3.44Å; D474-Q478 PolarHBondContact O-N 3.12Å
475	R	46.5	Very low	47.3	Very low	180 Å²	180	111.1 Å²	111.1	68%	0.679	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-42.3	174.4	-83.7	-176.3	173.5	-179.3	-2.6	112.3	K471 L472 Q479	K471-R475 PolarHBondContact O-N 3.1Å; L472-R475 PolarHBondContact O-N 3.04Å; R475-Q479 WeakPolarHBondContact O-CG 3.37Å; R475-Q479 PolarHBondContact O-N 3.01Å
476	N	49.5	Very low	47.4	Very low	82 Å²	82	110.4 Å²	110.4	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-38	178.5	-69.4	-13.9	0	0	0	111.6	L472 N473 Q479 F480	L472-N476 WeakPolarHBondContact O-CB 3.35Å; L472-N476 VanDerWaalsContact O-CG 3.24Å; L472-N476 PolarHBondContact O-N 3.48Å; L472-N476 PolarHBondContact O-ND2 3.02Å; N473-N476 PolarHBondContact O-N 3.04Å; N476-Q479 PolarHBondContact O-N 2.78Å; N476-F480 VanDerWaalsContact O-CB 3.31Å; N476-F480 WeakPolarHBondContact O-CB 2.99Å; N476-F480 PolarHBondContact O-N 3.39Å
477	K	45.7	Very low	48.2	Very low	100 Å²	100	107.4 Å²	107.4	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-46.1	174.9	-173.8	173.6	175.8	176.9	0	110.9	N473 D474 Q479 F480 E481	N473-K477 VanDerWaalsContact O-CB 3.3Å; N473-K477 WeakPolarHBondContact O-CB 2.89Å; N473-K477 PolarHBondContact O-N 3.25Å; D474-K477 PolarHBondContact O-N 3.19Å; K477-Q479 PolarHBondContact O-N 3.34Å; K477-F480 PolarHBondContact O-N 3.25Å; K477-E481 WeakPolarHBondContact CE-OE1 3.41Å; K477-E481 HydrophobicContact CG-CG 4.42Å; K477-E481 WeakPolarHBondContact CG-OE1 3.45Å; K477-E481 WeakPolarHBondContact O-CB 3.38Å; K477-E481 WeakPolarHBondContact O-CG 3.48Å; K477-E481 PolarHBondContact O-N 3.05Å
478	Q	47.8	Very low	48.9	Very low	133 Å²	133	109.1 Å²	109.1	62%	0.621	51%	0.511	S	S	*	.	H	α-helix	trans	-61.6	-40.4	175.1	-74.3	175.7	-3	0	0	112.8	D474 A482	D474-Q478 WeakPolarHBondContact O-CB 3.28Å; D474-Q478 VanDerWaalsContact O-CG 3.3Å; D474-Q478 WeakPolarHBondContact O-CG 3.44Å; D474-Q478 PolarHBondContact O-N 3.12Å; Q478-A482 VanDerWaalsContact O-CB 3.24Å; Q478-A482 WeakPolarHBondContact O-CB 3.46Å; Q478-A482 PolarHBondContact O-N 3.38Å
479	Q	49.3	Very low	49.1	Very low	141 Å²	141	108 Å²	108	66%	0.659	50%	0.503	S	S	*	.	H	α-helix	trans	-66.9	-38.3	174.9	-78.7	-174.6	-12.1	0	0	112.7	R475 N476 K477 K483	R475-Q479 WeakPolarHBondContact O-CG 3.37Å; R475-Q479 PolarHBondContact O-N 3.01Å; N476-Q479 PolarHBondContact O-N 2.78Å; K477-Q479 PolarHBondContact O-N 3.34Å; Q479-K483 WeakPolarHBondContact O-CB 3.17Å; Q479-K483 PolarHBondContact O-N 2.85Å; Q479-K483 VanDerWaalsContact O-N 3.09Å
480	F	49.4	Very low	49.4	Very low	114 Å²	114	103.2 Å²	103.2	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-70.8	-43.7	179	-174	-99.2	0	0	0	112.2	N476 K477 K483 N484	N476-F480 VanDerWaalsContact O-CB 3.31Å; N476-F480 WeakPolarHBondContact O-CB 2.99Å; N476-F480 PolarHBondContact O-N 3.39Å; K477-F480 PolarHBondContact O-N 3.25Å; F480-K483 WeakPolarHBondContact O-CB 3.48Å; F480-K483 PolarHBondContact O-N 3.42Å; F480-N484 VanDerWaalsContact CE1-ND2 3.29Å; F480-N484 WeakPolarHBondContact CE1-ND2 3.44Å; F480-N484 PolarHBondContact O-N 2.59Å
481	E	49.1	Very low	50.1	Low	88 Å²	88	103.4 Å²	103.4	41%	0.411	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-41.4	175.8	-73.2	172.5	177.9	0	0	111.8	K477 K483 N484 Y485	K477-E481 WeakPolarHBondContact CE-OE1 3.41Å; K477-E481 HydrophobicContact CG-CG 4.42Å; K477-E481 WeakPolarHBondContact CG-OE1 3.45Å; K477-E481 WeakPolarHBondContact O-CB 3.38Å; K477-E481 WeakPolarHBondContact O-CG 3.48Å; K477-E481 PolarHBondContact O-N 3.05Å; E481-K483 VanDerWaalsContact C-N 3.28Å; E481-K483 PolarHBondContact O-N 3.32Å; E481-N484 PolarHBondContact O-N 3.14Å; E481-Y485 WeakPolarHBondContact O-CB 3.32Å; E481-Y485 PolarHBondContact O-N 3.03Å
482	A	48.8	Very low	50.7	Low	55 Å²	55	99.9 Å²	99.9	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-61.5	-37.9	173.7	0	0	0	0	0	111.9	Q478 M486	Q478-A482 VanDerWaalsContact O-CB 3.24Å; Q478-A482 WeakPolarHBondContact O-CB 3.46Å; Q478-A482 PolarHBondContact O-N 3.38Å; A482-M486 WeakPolarHBondContact O-CB 3.21Å; A482-M486 WeakPolarHBondContact O-CG 3.3Å; A482-M486 PolarHBondContact O-N 2.68Å; A482-M486 VanDerWaalsContact O-N 3.15Å
483	K	53.9	Low	51.2	Low	122 Å²	122	98.6 Å²	98.6	53%	0.53	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-47.3	176.6	-172.5	-176.7	172.2	-167.7	0	112	Q479 F480 E481 Y485 M486 E487	Q479-K483 WeakPolarHBondContact O-CB 3.17Å; Q479-K483 PolarHBondContact O-N 2.85Å; Q479-K483 VanDerWaalsContact O-N 3.09Å; F480-K483 WeakPolarHBondContact O-CB 3.48Å; F480-K483 PolarHBondContact O-N 3.42Å; E481-K483 VanDerWaalsContact C-N 3.28Å; E481-K483 PolarHBondContact O-N 3.32Å; K483-Y485 PolarHBondContact O-N 2.74Å; K483-M486 PolarHBondContact O-N 3.26Å; K483-E487 WeakPolarHBondContact CE-OE1 3.41Å; K483-E487 IonicContact NZ-OE1 3.86Å; K483-E487 PolarHBondContact O-N 2.82Å
484	N	54.2	Low	51.6	Low	43 Å²	43	101.2 Å²	101.2	23%	0.23	47%	0.472	C	S	.	.	H	α-helix	trans	-64.6	-39.3	178.9	-80.2	6.5	0	0	0	112.4	F480 E481 M486 E487 Q488	F480-N484 VanDerWaalsContact CE1-ND2 3.29Å; F480-N484 WeakPolarHBondContact CE1-ND2 3.44Å; F480-N484 PolarHBondContact O-N 2.59Å; E481-N484 PolarHBondContact O-N 3.14Å; N484-M486 VanDerWaalsContact C-N 3.33Å; N484-M486 PolarHBondContact O-N 3.21Å; N484-E487 PolarHBondContact O-N 2.87Å; N484-Q488 PolarHBondContact O-N 2.95Å
485	Y	53.1	Low	52.1	Low	143 Å²	143	103.8 Å²	103.8	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-61.3	-42.7	174.6	-179.2	-100.3	0	0	0	111.5	E481 K483 Q488 Q489	E481-Y485 WeakPolarHBondContact O-CB 3.32Å; E481-Y485 PolarHBondContact O-N 3.03Å; K483-Y485 PolarHBondContact O-N 2.74Å; Y485-Q488 PolarHBondContact O-N 3.45Å; Y485-Q489 HydrophobicContact CD1-CG 4.44Å; Y485-Q489 HydrophobicContact CE1-CG 4.08Å; Y485-Q489 WeakPolarHBondContact O-CG 3.31Å; Y485-Q489 PolarHBondContact O-N 3.49Å
486	M	49.9	Very low	52.6	Low	77 Å²	77	99.6 Å²	99.6	38%	0.379	47%	0.466	S	S	.	.	H	α-helix	trans	-65.3	-39.7	175.8	-72.4	-68.9	-62.2	0	0	112.6	A482 K483 N484 Q489 I490 A539	A482-M486 WeakPolarHBondContact O-CB 3.21Å; A482-M486 WeakPolarHBondContact O-CG 3.3Å; A482-M486 PolarHBondContact O-N 2.68Å; A482-M486 VanDerWaalsContact O-N 3.15Å; K483-M486 PolarHBondContact O-N 3.26Å; N484-M486 VanDerWaalsContact C-N 3.33Å; N484-M486 PolarHBondContact O-N 3.21Å; M486-Q489 PolarHBondContact O-N 2.81Å; M486-I490 WeakPolarHBondContact O-CG1 3.35Å; M486-I490 PolarHBondContact O-N 3.47Å; M486-I490 VanDerWaalsContact O-N 3.08Å; M486-A539 HydrophobicContact CE-CB 3.92Å
487	E	56.7	Low	52.8	Low	98 Å²	98	100.7 Å²	100.7	46%	0.458	46%	0.464	S	S	.	.	H	α-helix	trans	-66.6	-38.7	176.8	-74.7	176.6	178.4	0	0	112.1	K483 N484 I490 E491	K483-E487 WeakPolarHBondContact CE-OE1 3.41Å; K483-E487 IonicContact NZ-OE1 3.86Å; K483-E487 PolarHBondContact O-N 2.82Å; N484-E487 PolarHBondContact O-N 2.87Å; E487-I490 PolarHBondContact O-N 3.26Å; E487-E491 PolarHBondContact O-N 3.03Å; E487-E491 VanDerWaalsContact O-N 3.11Å
488	Q	57.5	Low	53.1	Low	108 Å²	108	100.4 Å²	100.4	51%	0.505	47%	0.466	S	S	.	.	H	α-helix	trans	-64.6	-39.3	172.6	-85	-176.7	-12.4	0	0	112.9	N484 Y485 I490 E491 N492	N484-Q488 PolarHBondContact O-N 2.95Å; Y485-Q488 PolarHBondContact O-N 3.45Å; Q488-I490 VanDerWaalsContact C-N 3.35Å; Q488-E491 PolarHBondContact O-N 2.57Å; Q488-N492 WeakPolarHBondContact O-CB 3.32Å; Q488-N492 VanDerWaalsContact O-CG 3.24Å; Q488-N492 PolarHBondContact O-N 3.46Å; Q488-N492 PolarHBondContact O-ND2 3.33Å
489	Q	53	Low	53.4	Low	78 Å²	78	97.8 Å²	97.8	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.2	-72	-64.9	-52.8	0	0	111.7	Y485 M486 E491 N492 D493	Y485-Q489 HydrophobicContact CD1-CG 4.44Å; Y485-Q489 HydrophobicContact CE1-CG 4.08Å; Y485-Q489 WeakPolarHBondContact O-CG 3.31Å; Y485-Q489 PolarHBondContact O-N 3.49Å; M486-Q489 PolarHBondContact O-N 2.81Å; Q489-E491 VanDerWaalsContact C-N 3.32Å; Q489-E491 PolarHBondContact O-N 3.22Å; Q489-N492 PolarHBondContact O-N 3.37Å; Q489-D493 WeakPolarHBondContact O-CB 3.44Å; Q489-D493 PolarHBondContact O-N 3.16Å
490	I	54.6	Low	53.5	Low	76 Å²	76	96.1 Å²	96.1	39%	0.39	45%	0.452	S	S	.	.	H	α-helix	trans	-62.2	-41	175.2	-69.3	166	0	0	0	111.3	M486 E487 Q488 R494	M486-I490 WeakPolarHBondContact O-CG1 3.35Å; M486-I490 PolarHBondContact O-N 3.47Å; M486-I490 VanDerWaalsContact O-N 3.08Å; E487-I490 PolarHBondContact O-N 3.26Å; Q488-I490 VanDerWaalsContact C-N 3.35Å; I490-R494 WeakPolarHBondContact O-CB 3.42Å; I490-R494 PolarHBondContact O-N 3.17Å
491	E	55.2	Low	53.7	Low	87 Å²	87	94.3 Å²	94.3	41%	0.407	45%	0.447	S	S	.	.	H	α-helix	trans	-72.8	-35.9	-179.2	-166.5	60.9	-157.4	0	0	112.3	E487 Q488 Q489 R494 R495	E487-E491 PolarHBondContact O-N 3.03Å; E487-E491 VanDerWaalsContact O-N 3.11Å; Q488-E491 PolarHBondContact O-N 2.57Å; Q489-E491 VanDerWaalsContact C-N 3.32Å; Q489-E491 PolarHBondContact O-N 3.22Å; E491-R494 WeakPolarHBondContact O-CB 3.46Å; E491-R494 PolarHBondContact O-N 2.83Å; E491-R495 PolarHBondContact O-N 3.48Å
492	N	57.1	Low	53.8	Low	69 Å²	69	95.9 Å²	95.9	37%	0.369	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-47	173.1	-69.8	-14.6	0	0	0	111.3	Q488 Q489 R494 R495 D496	Q488-N492 WeakPolarHBondContact O-CB 3.32Å; Q488-N492 VanDerWaalsContact O-CG 3.24Å; Q488-N492 PolarHBondContact O-N 3.46Å; Q488-N492 PolarHBondContact O-ND2 3.33Å; Q489-N492 PolarHBondContact O-N 3.37Å; N492-R494 PolarHBondContact O-N 3Å; N492-R494 VanDerWaalsContact O-N 3.17Å; N492-R495 PolarHBondContact O-N 3.33Å; N492-D496 PolarHBondContact O-N 2.93Å
493	D	56.3	Low	54	Low	77 Å²	77	98 Å²	98	41%	0.412	46%	0.458	S	S	.	.	H	α-helix	trans	-57.6	-31.5	173.7	-92.8	18.1	0	0	0	112.2	Q489 R497	Q489-D493 WeakPolarHBondContact O-CB 3.44Å; Q489-D493 PolarHBondContact O-N 3.16Å; D493-R497 VanDerWaalsContact O-CG 3.23Å; D493-R497 WeakPolarHBondContact O-CG 3.29Å; D493-R497 PolarHBondContact O-N 3.42Å; D493-R497 PolarHBondContact O-NE 3.12Å
494	R	52.9	Low	53.9	Low	157 Å²	157	95.8 Å²	95.8	59%	0.592	46%	0.455	S	S	*	.	H	α-helix	trans	-75.3	-39.1	177.2	-168.1	179.9	-179.1	-177.9	-1.1	111.8	I490 E491 N492 L498	I490-R494 WeakPolarHBondContact O-CB 3.42Å; I490-R494 PolarHBondContact O-N 3.17Å; E491-R494 WeakPolarHBondContact O-CB 3.46Å; E491-R494 PolarHBondContact O-N 2.83Å; N492-R494 PolarHBondContact O-N 3Å; N492-R494 VanDerWaalsContact O-N 3.17Å; R494-L498 HydrophobicContact CG-CD1 4.48Å; R494-L498 VanDerWaalsContact O-CG 3.31Å; R494-L498 WeakPolarHBondContact O-CG 3.28Å; R494-L498 PolarHBondContact O-N 2.77Å; R494-L498 VanDerWaalsContact O-N 3.11Å
495	R	54.6	Low	53.6	Low	151 Å²	151	96 Å²	96	57%	0.57	46%	0.462	S	S	*	.	H	α-helix	trans	-65.9	-47.9	173.5	-90	-177.5	176.8	156.9	-0.3	112	E491 N492 R497 L498 D499	E491-R495 PolarHBondContact O-N 3.48Å; N492-R495 PolarHBondContact O-N 3.33Å; R495-R497 PolarHBondContact O-N 3.32Å; R495-L498 CarbonylContact O-C 3.55Å; R495-L498 WeakPolarHBondContact O-CA 3.4Å; R495-L498 WeakPolarHBondContact O-CB 3.47Å; R495-L498 PolarHBondContact O-N 3.49Å; R495-D499 PolarHBondContact O-N 3.1Å
496	D	57.1	Low	53.4	Low	93 Å²	93	93.5 Å²	93.5	50%	0.497	46%	0.458	S	S	.	.	H	α-helix	trans	-59.1	-38.5	180	-67.6	-9.4	0	0	0	110.8	N492 D499 D500	N492-D496 PolarHBondContact O-N 2.93Å; D496-D499 PolarHBondContact O-N 3.04Å; D496-D500 WeakPolarHBondContact O-CB 3.3Å; D496-D500 PolarHBondContact O-N 3.3Å
497	R	53.2	Low	53.4	Low	105 Å²	105	97.3 Å²	97.3	40%	0.396	47%	0.472	S	S	.	.	H	α-helix	trans	-68.9	-33.6	173.2	-71.9	177.5	-150.9	-130.6	2	114	D493 R495 I501	D493-R497 VanDerWaalsContact O-CG 3.23Å; D493-R497 WeakPolarHBondContact O-CG 3.29Å; D493-R497 PolarHBondContact O-N 3.42Å; D493-R497 PolarHBondContact O-NE 3.12Å; R495-R497 PolarHBondContact O-N 3.32Å; R497-I501 WeakPolarHBondContact O-CD1 3.4Å; R497-I501 WeakPolarHBondContact O-CG1 3.26Å; R497-I501 PolarHBondContact O-N 3.38Å
498	L	52.5	Low	53	Low	93 Å²	93	98.9 Å²	98.9	49%	0.487	48%	0.475	S	S	.	.	H	α-helix	trans	-70.1	-40.9	175.5	-77.2	164.9	0	0	0	110.6	R494 R495 D500 I501 E502	R494-L498 HydrophobicContact CG-CD1 4.48Å; R494-L498 VanDerWaalsContact O-CG 3.31Å; R494-L498 WeakPolarHBondContact O-CG 3.28Å; R494-L498 PolarHBondContact O-N 2.77Å; R494-L498 VanDerWaalsContact O-N 3.11Å; R495-L498 CarbonylContact O-C 3.55Å; R495-L498 WeakPolarHBondContact O-CA 3.4Å; R495-L498 WeakPolarHBondContact O-CB 3.47Å; R495-L498 PolarHBondContact O-N 3.49Å; L498-D500 VanDerWaalsContact C-N 3.33Å; L498-I501 PolarHBondContact O-N 3.11Å; L498-E502 WeakPolarHBondContact O-CB 3.4Å; L498-E502 PolarHBondContact O-N 3.1Å
499	D	53.3	Low	52.5	Low	79 Å²	79	100 Å²	100	42%	0.422	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-38.8	174.4	-71.6	-2.3	0	0	0	110.6	R495 D496 E502 N503	R495-D499 PolarHBondContact O-N 3.1Å; D496-D499 PolarHBondContact O-N 3.04Å; D499-E502 PolarHBondContact O-N 3.4Å; D499-N503 VanDerWaalsContact O-CB 3.23Å; D499-N503 WeakPolarHBondContact O-CB 3.47Å; D499-N503 VanDerWaalsContact O-CG 3.22Å; D499-N503 PolarHBondContact O-N 3.28Å; D499-N503 PolarHBondContact O-ND2 3.32Å
500	D	52.3	Low	52.2	Low	106 Å²	106	101.4 Å²	101.4	57%	0.567	50%	0.498	S	S	*	.	H	α-helix	trans	-62.8	-42.4	172.5	-79.2	-20.7	0	0	0	111.9	D496 L498 V504	D496-D500 WeakPolarHBondContact O-CB 3.3Å; D496-D500 PolarHBondContact O-N 3.3Å; L498-D500 VanDerWaalsContact C-N 3.33Å; D500-V504 WeakPolarHBondContact O-CB 3.09Å; D500-V504 WeakPolarHBondContact O-CG2 3.32Å; D500-V504 PolarHBondContact O-N 3.39Å
501	I	53.4	Low	51.9	Low	75 Å²	75	102.4 Å²	102.4	39%	0.385	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-43.6	175.6	-70.4	163.4	0	0	0	110.8	R497 L498 V504 A505 L528	R497-I501 WeakPolarHBondContact O-CD1 3.4Å; R497-I501 WeakPolarHBondContact O-CG1 3.26Å; R497-I501 PolarHBondContact O-N 3.38Å; L498-I501 PolarHBondContact O-N 3.11Å; I501-V504 PolarHBondContact O-N 3.23Å; I501-A505 WeakPolarHBondContact O-CB 3.37Å; I501-A505 PolarHBondContact O-N 3.01Å; I501-L528 HydrophobicContact CD1-CD2 4.44Å
502	E	51.3	Low	51.4	Low	122 Å²	122	107.1 Å²	107.1	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-68.2	-39.4	-178.9	-158.6	170.5	-148.5	0	0	111.1	L498 D499 A505 L506	L498-E502 WeakPolarHBondContact O-CB 3.4Å; L498-E502 PolarHBondContact O-N 3.1Å; D499-E502 PolarHBondContact O-N 3.4Å; E502-A505 PolarHBondContact O-N 2.9Å; E502-L506 HydrophobicContact CG-CD1 4.44Å; E502-L506 WeakPolarHBondContact O-CB 3.41Å; E502-L506 PolarHBondContact O-N 3.07Å
503	N	51.6	Low	50.6	Low	100 Å²	100	107.5 Å²	107.5	54%	0.535	55%	0.55	S	S	.	.	H	α-helix	trans	-67.2	-37.7	174	-77.1	-47.7	0	0	0	112.6	D499 K507	D499-N503 VanDerWaalsContact O-CB 3.23Å; D499-N503 WeakPolarHBondContact O-CB 3.47Å; D499-N503 VanDerWaalsContact O-CG 3.22Å; D499-N503 PolarHBondContact O-N 3.28Å; D499-N503 PolarHBondContact O-ND2 3.32Å; N503-K507 WeakPolarHBondContact O-CB 3.48Å; N503-K507 PolarHBondContact O-N 2.89Å
504	V	52.9	Low	49.5	Very low	75 Å²	75	107.7 Å²	107.7	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-65	-45.4	172.3	170	0	0	0	0	110.2	D500 I501 L506 K507 Y508	D500-V504 WeakPolarHBondContact O-CB 3.09Å; D500-V504 WeakPolarHBondContact O-CG2 3.32Å; D500-V504 PolarHBondContact O-N 3.39Å; I501-V504 PolarHBondContact O-N 3.23Å; V504-L506 PolarHBondContact O-N 2.7Å; V504-K507 WeakPolarHBondContact O-CB 3.15Å; V504-K507 PolarHBondContact O-N 3.16Å; V504-K507 VanDerWaalsContact O-N 3.15Å; V504-Y508 HydrophobicContact CG1-CD2 4Å; V504-Y508 HydrophobicContact CG1-CE2 3.93Å; V504-Y508 WeakPolarHBondContact O-CD2 3.44Å; V504-Y508 PolarHBondContact O-N 3.18Å; V504-Y508 VanDerWaalsContact O-N 3.09Å
505	A	48.2	Very low	48.8	Very low	46 Å²	46	107.6 Å²	107.6	38%	0.38	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-40.6	177.2	0	0	0	0	0	112.8	I501 E502 K507 Y508 L509	I501-A505 WeakPolarHBondContact O-CB 3.37Å; I501-A505 PolarHBondContact O-N 3.01Å; E502-A505 PolarHBondContact O-N 2.9Å; A505-K507 VanDerWaalsContact C-N 3.32Å; A505-K507 PolarHBondContact O-N 3.44Å; A505-Y508 PolarHBondContact O-N 3.03Å; A505-L509 WeakPolarHBondContact O-CG 3.3Å; A505-L509 PolarHBondContact O-N 2.89Å
506	L	48.5	Very low	48.5	Very low	91 Å²	91	105.2 Å²	105.2	48%	0.476	58%	0.58	S	S	.	*	H	α-helix	trans	-63.3	-35.6	173.3	-93.7	151.3	0	0	0	112.5	E502 V504 L509 T510	E502-L506 HydrophobicContact CG-CD1 4.44Å; E502-L506 WeakPolarHBondContact O-CB 3.41Å; E502-L506 PolarHBondContact O-N 3.07Å; V504-L506 PolarHBondContact O-N 2.7Å; L506-L509 PolarHBondContact O-N 3.37Å; L506-T510 WeakPolarHBondContact O-CB 3.27Å; L506-T510 WeakPolarHBondContact O-CG2 3.38Å; L506-T510 PolarHBondContact O-N 2.92Å; L506-T510 PolarHBondContact O-OG1 3.27Å
507	K	48.7	Very low	47.9	Very low	157 Å²	157	107.9 Å²	107.9	68%	0.683	59%	0.594	S	S	*	*	H	α-helix	trans	-65.3	-41.4	174.7	-134.3	176.3	-176.3	-178.9	0	111.6	N503 V504 A505 T510 T511	N503-K507 WeakPolarHBondContact O-CB 3.48Å; N503-K507 PolarHBondContact O-N 2.89Å; V504-K507 WeakPolarHBondContact O-CB 3.15Å; V504-K507 PolarHBondContact O-N 3.16Å; V504-K507 VanDerWaalsContact O-N 3.15Å; A505-K507 VanDerWaalsContact C-N 3.32Å; A505-K507 PolarHBondContact O-N 3.44Å; K507-T510 PolarHBondContact O-N 2.97Å; K507-T510 PolarHBondContact O-OG1 3.14Å; K507-T511 PolarHBondContact O-N 2.93Å; K507-T511 PolarHBondContact O-OG1 3.42Å
508	Y	49.8	Very low	47.2	Very low	131 Å²	131	112.2 Å²	112.2	51%	0.514	62%	0.619	S	S	.	*	H	α-helix	trans	-66.2	-39.8	174.4	-86.3	-82.6	0	0	0	112.7	V504 A505 T510 T511	V504-Y508 HydrophobicContact CG1-CD2 4Å; V504-Y508 HydrophobicContact CG1-CE2 3.93Å; V504-Y508 WeakPolarHBondContact O-CD2 3.44Å; V504-Y508 PolarHBondContact O-N 3.18Å; V504-Y508 VanDerWaalsContact O-N 3.09Å; A505-Y508 PolarHBondContact O-N 3.03Å; Y508-T510 VanDerWaalsContact C-N 3.35Å; Y508-T510 PolarHBondContact O-N 3.39Å; Y508-T511 PolarHBondContact O-N 2.97Å; Y508-T511 PolarHBondContact O-OG1 2.95Å
509	L	46.6	Very low	46.7	Very low	133 Å²	133	117.1 Å²	117.1	70%	0.696	64%	0.636	S	S	*	*	H	α-helix	trans	-71.4	-25.2	178.7	-74.7	164.8	0	0	0	113.8	A505 L506	A505-L509 WeakPolarHBondContact O-CG 3.3Å; A505-L509 PolarHBondContact O-N 2.89Å; L506-L509 PolarHBondContact O-N 3.37Å
510	T	46.8	Very low	46.2	Very low	107 Å²	107	121.1 Å²	121.1	66%	0.656	66%	0.658	S	S	*	*	H	α-helix	trans	-88.7	-8.4	178	48.2	0	0	0	0	113.5	L506 K507 Y508	L506-T510 WeakPolarHBondContact O-CB 3.27Å; L506-T510 WeakPolarHBondContact O-CG2 3.38Å; L506-T510 PolarHBondContact O-N 2.92Å; L506-T510 PolarHBondContact O-OG1 3.27Å; K507-T510 PolarHBondContact O-N 2.97Å; K507-T510 PolarHBondContact O-OG1 3.14Å; Y508-T510 VanDerWaalsContact C-N 3.35Å; Y508-T510 PolarHBondContact O-N 3.39Å
511	T	47.1	Very low	45.7	Very low	97 Å²	97	119.2 Å²	119.2	60%	0.595	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	22.3	176.1	50.1	0	0	0	0	114.4	K507 Y508 G513	K507-T511 PolarHBondContact O-N 2.93Å; K507-T511 PolarHBondContact O-OG1 3.42Å; Y508-T511 PolarHBondContact O-N 2.97Å; Y508-T511 PolarHBondContact O-OG1 2.95Å; T511-G513 PolarHBondContact O-N 3.09Å
512	E	44.6	Very low	45	Very low	185 Å²	185	125 Å²	125	86%	0.864	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	80.7	161.6	-78.4	-163.2	158.7	0	0	110.5
513	G	40.2	Very low	44.6	Very low	77 Å²	77	123 Å²	123	79%	0.794	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.1	16.5	174	0	0	0	0	0	115.4	T511	T511-G513 PolarHBondContact O-N 3.09Å
514	A	35.1	Very low	44	Very low	82 Å²	82	122.8 Å²	122.8	68%	0.678	68%	0.677	S	S	*	*	S	Bend	trans	-169.2	114.6	159.5	0	0	0	0	0	112.7
515	N	37.9	Very low	43.3	Very low	155 Å²	155	124.7 Å²	124.7	83%	0.829	68%	0.682	S	S	*	*			trans	77.7	116.7	151.4	-64.3	-15.9	0	0	0	120.9
516	S	47.1	Very low	43	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	69%	0.692	S	S	*	*			trans	-43.6	121.4	152.6	50.7	0	0	0	0	112.8
517	D	44.3	Very low	42.7	Very low	148 Å²	148	130.1 Å²	130.1	79%	0.791	71%	0.707	S	S	*	*			trans	152.1	79.6	138.8	-79.1	-22.9	0	0	0	108.7
518	E	39.3	Very low	42.4	Very low	197 Å²	197	126 Å²	126	92%	0.921	69%	0.692	S	S	*	*			trans	-166.3	82.5	155	-109.7	165	-160.2	0	0	109	D520	E518-D520 PolarHBondContact O-N 3.37Å
519	K	41.8	Very low	42.1	Very low	195 Å²	195	126.8 Å²	126.8	85%	0.848	70%	0.7	S	S	*	*			trans	-66.5	117	149.6	-78.5	175.9	176.1	177.1	0	106.2
520	D	42.8	Very low	42.2	Very low	163 Å²	163	126.2 Å²	126.2	87%	0.872	69%	0.692	S	S	*	*			trans	149.4	65.8	149.5	-73	-16.9	0	0	0	111.9	E518	E518-D520 PolarHBondContact O-N 3.37Å
521	A	40.9	Very low	42.2	Very low	66 Å²	66	125.2 Å²	125.2	55%	0.545	68%	0.682	S	S	.	*			trans	-151.6	65.9	159.1	0	0	0	0	0	110	V523	A521-V523 VanDerWaalsContact C-N 3.33Å; A521-V523 PolarHBondContact O-N 2.83Å
522	E	40.3	Very low	42	Very low	197 Å²	197	129.9 Å²	129.9	92%	0.921	69%	0.689	S	S	*	*			trans	-61.6	103	153.9	-95.6	-175.5	156.6	0	0	106.7	N524	E522-N524 VanDerWaalsContact C-N 3.32Å; E522-N524 PolarHBondContact O-N 3.23Å
523	V	41.8	Very low	42.1	Very low	80 Å²	80	124.9 Å²	124.9	49%	0.485	67%	0.669	S	S	.	*			trans	-60.9	103.1	164.9	176.6	0	0	0	0	106	A521 M525 L528	A521-V523 VanDerWaalsContact C-N 3.33Å; A521-V523 PolarHBondContact O-N 2.83Å; V523-M525 VanDerWaalsContact C-N 3.28Å; V523-M525 PolarHBondContact O-N 2.86Å; V523-L528 HydrophobicContact CG1-CD1 4.29Å
524	N	40.2	Very low	42.6	Very low	95 Å²	95	124.3 Å²	124.3	51%	0.508	65%	0.647	S	S	.	*			trans	-67	89.4	178.4	-169.6	-3.8	0	0	0	108.6	E522 S526 E527	E522-N524 VanDerWaalsContact C-N 3.32Å; E522-N524 PolarHBondContact O-N 3.23Å; N524-S526 VanDerWaalsContact CG-OG 3.3Å; N524-S526 PolarHBondContact ND2-OG 2.69Å; N524-S526 PolarHBondContact O-N 3.35Å; N524-S526 WeakPolarHBondContact OD1-CB 3.36Å; N524-S526 PolarHBondContact OD1-N 2.84Å; N524-S526 PolarHBondContact OD1-OG 2.77Å; N524-E527 PolarHBondContact O-N 3.46Å
525	M	37.8	Very low	43.4	Very low	115 Å²	115	122.9 Å²	122.9	57%	0.567	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-9.8	179.8	-76.9	-70.2	-71.3	0	0	113.6	V523	V523-M525 VanDerWaalsContact C-N 3.28Å; V523-M525 PolarHBondContact O-N 2.86Å
526	S	41	Very low	43.9	Very low	84 Å²	84	118.8 Å²	118.8	59%	0.587	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-23.5	173.4	72.9	0	0	0	0	114.3	N524	N524-S526 VanDerWaalsContact CG-OG 3.3Å; N524-S526 PolarHBondContact ND2-OG 2.69Å; N524-S526 PolarHBondContact O-N 3.35Å; N524-S526 WeakPolarHBondContact OD1-CB 3.36Å; N524-S526 PolarHBondContact OD1-N 2.84Å; N524-S526 PolarHBondContact OD1-OG 2.77Å
527	E	42.5	Very low	44.1	Very low	167 Å²	167	121 Å²	121	78%	0.78	60%	0.6	S	S	*	*	S	Bend	trans	-83.1	-16.2	177.4	-77.8	-167.4	149.1	0	0	113.7	N524	N524-E527 PolarHBondContact O-N 3.46Å
528	L	41.5	Very low	44.4	Very low	71 Å²	71	117.1 Å²	117.1	37%	0.372	58%	0.58	S	S	.	*	S	Bend	trans	-84.4	-9.4	178.6	-98.7	143.7	0	0	0	114	I501 V523	I501-L528 HydrophobicContact CD1-CD2 4.44Å; V523-L528 HydrophobicContact CG1-CD1 4.29Å
529	H	44.6	Very low	44.8	Very low	148 Å²	148	108.8 Å²	108.8	69%	0.685	55%	0.545	S	S	*	.			trans	-103.2	78.5	172.3	-75.2	-63.3	0	0	0	110.9	D531	H529-D531 PolarHBondContact O-N 2.99Å; H529-D531 VanDerWaalsContact O-N 3.12Å
530	K	48.2	Very low	45.1	Very low	120 Å²	120	105 Å²	105	52%	0.522	53%	0.53	S	S	.	.			trans	-62.9	114.6	150.5	-93.5	-168.9	174.8	-172.1	0	106.7	R532 V535 D538	K530-R532 PolarHBondContact O-N 3.11Å; K530-V535 HydrophobicContact CB-CG2 4.14Å; K530-D538 IonicContact NZ-OD2 3.99Å
531	D	47.8	Very low	45.5	Very low	86 Å²	86	103.9 Å²	103.9	46%	0.46	52%	0.517	S	S	.	.			trans	-53.9	142.4	177.6	-176.8	16.2	0	0	0	108.9	H529 N533 D534 V535	H529-D531 PolarHBondContact O-N 2.99Å; H529-D531 VanDerWaalsContact O-N 3.12Å; D531-N533 PolarHBondContact O-N 2.92Å; D531-N533 PolarHBondContact OD2-ND2 3.09Å; D531-D534 PolarHBondContact O-N 2.78Å; D531-V535 PolarHBondContact O-N 2.9Å
532	R	42.5	Very low	45.8	Very low	195 Å²	195	106.2 Å²	106.2	74%	0.736	52%	0.52	S	S	*	.	H	α-helix	trans	-48.6	-31.6	178.6	174.6	-179.5	158.6	-171.4	-3.8	111.6	K530 L536	K530-R532 PolarHBondContact O-N 3.11Å; R532-L536 HydrophobicContact CG-CD1 3.99Å; R532-L536 WeakPolarHBondContact O-CB 2.88Å; R532-L536 WeakPolarHBondContact O-CD1 3.33Å; R532-L536 VanDerWaalsContact O-CG 3.3Å; R532-L536 WeakPolarHBondContact O-CG 3.38Å; R532-L536 PolarHBondContact O-N 2.73Å; R532-L536 VanDerWaalsContact O-N 3.08Å
533	N	45.8	Very low	46.2	Very low	81 Å²	81	100.7 Å²	100.7	43%	0.433	50%	0.496	S	S	.	.	H	α-helix	trans	-69.7	-27	177.9	-65.2	-47.6	0	0	0	114.4	D531 R537	D531-N533 PolarHBondContact O-N 2.92Å; D531-N533 PolarHBondContact OD2-ND2 3.09Å; N533-R537 WeakPolarHBondContact O-CB 3.39Å; N533-R537 PolarHBondContact O-N 3.09Å; N533-R537 VanDerWaalsContact O-N 3.11Å
534	D	52.5	Low	46.4	Very low	65 Å²	65	105.8 Å²	105.8	35%	0.348	51%	0.506	S	S	.	.	H	α-helix	trans	-82.4	-39.2	178.7	-70.9	-22.4	0	0	0	111.3	D531 L536 R537 D538	D531-D534 PolarHBondContact O-N 2.78Å; D534-L536 VanDerWaalsContact C-N 3.33Å; D534-L536 PolarHBondContact O-N 2.69Å; D534-R537 PolarHBondContact O-N 2.92Å; D534-R537 IonicContact OD1-CZ 3.74Å; D534-R537 IonicContact OD1-NE 3.66Å; D534-R537 IonicContact OD1-NH2 3.63Å; D534-D538 PolarHBondContact O-N 2.92Å
535	V	52	Low	46.7	Very low	51 Å²	51	109.2 Å²	109.2	31%	0.309	52%	0.517	S	S	.	.	H	α-helix	trans	-62.2	-42.4	171.3	-178.6	0	0	0	0	110.7	K530 D531 R537 D538 A539	K530-V535 HydrophobicContact CB-CG2 4.14Å; D531-V535 PolarHBondContact O-N 2.9Å; V535-R537 PolarHBondContact O-N 3.39Å; V535-D538 PolarHBondContact O-N 3.21Å; V535-A539 WeakPolarHBondContact O-CB 3.38Å; V535-A539 PolarHBondContact O-N 3.4Å
536	L	46.7	Very low	47	Very low	69 Å²	69	113 Å²	113	36%	0.361	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-37	174.4	-79.1	166.1	0	0	0	112.7	R532 D534 Q540	R532-L536 HydrophobicContact CG-CD1 3.99Å; R532-L536 WeakPolarHBondContact O-CB 2.88Å; R532-L536 WeakPolarHBondContact O-CD1 3.33Å; R532-L536 VanDerWaalsContact O-CG 3.3Å; R532-L536 WeakPolarHBondContact O-CG 3.38Å; R532-L536 PolarHBondContact O-N 2.73Å; R532-L536 VanDerWaalsContact O-N 3.08Å; D534-L536 VanDerWaalsContact C-N 3.33Å; D534-L536 PolarHBondContact O-N 2.69Å; L536-Q540 WeakPolarHBondContact O-CG 3.24Å; L536-Q540 PolarHBondContact O-N 3.42Å
537	R	51.9	Low	47.1	Very low	148 Å²	148	115 Å²	115	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-68.3	-41.6	176.4	-93.6	-174.8	-98.5	-176	-6	112.7	N533 D534 V535 Q540 K541	N533-R537 WeakPolarHBondContact O-CB 3.39Å; N533-R537 PolarHBondContact O-N 3.09Å; N533-R537 VanDerWaalsContact O-N 3.11Å; D534-R537 PolarHBondContact O-N 2.92Å; D534-R537 IonicContact OD1-CZ 3.74Å; D534-R537 IonicContact OD1-NE 3.66Å; D534-R537 IonicContact OD1-NH2 3.63Å; V535-R537 PolarHBondContact O-N 3.39Å; R537-Q540 PolarHBondContact O-N 3.18Å; R537-K541 PolarHBondContact O-N 3.41Å; R537-K541 VanDerWaalsContact O-N 3.11Å
538	D	50.5	Low	47.1	Very low	67 Å²	67	109.5 Å²	109.5	36%	0.358	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-37.3	177.6	-76.5	-17.2	0	0	0	111.5	K530 D534 V535 K541 L542	K530-D538 IonicContact NZ-OD2 3.99Å; D534-D538 PolarHBondContact O-N 2.92Å; V535-D538 PolarHBondContact O-N 3.21Å; D538-K541 PolarHBondContact O-N 2.99Å; D538-K541 IonicContact OD1-NZ 3.9Å; D538-L542 PolarHBondContact O-N 3.02Å; D538-L542 VanDerWaalsContact O-N 3.15Å
539	A	48.3	Very low	47.1	Very low	22 Å²	22	110.9 Å²	110.9	18%	0.182	52%	0.524	C	S	.	.	H	α-helix	trans	-63.3	-42.5	172.3	0	0	0	0	0	112.6	M486 V535 K541 L542 I543	M486-A539 HydrophobicContact CE-CB 3.92Å; V535-A539 WeakPolarHBondContact O-CB 3.38Å; V535-A539 PolarHBondContact O-N 3.4Å; A539-K541 VanDerWaalsContact C-N 3.32Å; A539-K541 PolarHBondContact O-N 3.09Å; A539-L542 PolarHBondContact O-N 3.37Å; A539-I543 WeakPolarHBondContact O-CG1 3.31Å; A539-I543 PolarHBondContact O-N 3.03Å
540	Q	47.8	Very low	46.8	Very low	114 Å²	114	112.6 Å²	112.6	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-32.9	175.8	-77.1	177.8	-4.3	0	0	112.9	L536 R537 R544	L536-Q540 WeakPolarHBondContact O-CG 3.24Å; L536-Q540 PolarHBondContact O-N 3.42Å; R537-Q540 PolarHBondContact O-N 3.18Å; Q540-R544 PolarHBondContact O-N 3.11Å; Q540-R544 VanDerWaalsContact O-N 3.14Å
541	K	50.2	Low	46.3	Very low	141 Å²	141	113.8 Å²	113.8	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-66.6	-39.2	172.7	-75.5	175	-176.7	166.8	0	112.1	R537 D538 A539 R544 K545	R537-K541 PolarHBondContact O-N 3.41Å; R537-K541 VanDerWaalsContact O-N 3.11Å; D538-K541 PolarHBondContact O-N 2.99Å; D538-K541 IonicContact OD1-NZ 3.9Å; A539-K541 VanDerWaalsContact C-N 3.32Å; A539-K541 PolarHBondContact O-N 3.09Å; K541-R544 PolarHBondContact O-N 2.89Å; K541-K545 WeakPolarHBondContact O-CB 3.35Å; K541-K545 PolarHBondContact O-N 3.3Å; K541-K545 VanDerWaalsContact O-N 3.08Å
542	L	47.7	Very low	45.7	Very low	114 Å²	114	114.2 Å²	114.2	60%	0.597	55%	0.552	S	S	*	*	H	α-helix	trans	-66.4	-38.5	176	-89.9	155.2	0	0	0	112.7	D538 A539 K545 R546	D538-L542 PolarHBondContact O-N 3.02Å; D538-L542 VanDerWaalsContact O-N 3.15Å; A539-L542 PolarHBondContact O-N 3.37Å; L542-K545 PolarHBondContact O-N 2.65Å; L542-R546 PolarHBondContact O-N 3.48Å; L542-R546 VanDerWaalsContact O-N 3.08Å
543	I	48.1	Very low	45.3	Very low	81 Å²	81	109.9 Å²	109.9	42%	0.415	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-49	174.5	-68.1	167.4	0	0	0	110.6	A539 K545 R546 E547	A539-I543 WeakPolarHBondContact O-CG1 3.31Å; A539-I543 PolarHBondContact O-N 3.03Å; I543-K545 PolarHBondContact O-N 2.97Å; I543-R546 PolarHBondContact O-N 2.9Å; I543-R546 VanDerWaalsContact O-N 3.08Å; I543-E547 HydrophobicContact CG2-CG 4.36Å; I543-E547 WeakPolarHBondContact O-CG 3.35Å; I543-E547 PolarHBondContact O-N 3.36Å
544	R	47.5	Very low	44.9	Very low	188 Å²	188	111.9 Å²	111.9	71%	0.709	57%	0.569	S	S	*	*	H	α-helix	trans	-60.2	-33.1	175.9	-73.8	-177.7	-178.4	176.3	2.3	112.9	Q540 K541 G548	Q540-R544 PolarHBondContact O-N 3.11Å; Q540-R544 VanDerWaalsContact O-N 3.14Å; K541-R544 PolarHBondContact O-N 2.89Å; R544-G548 PolarHBondContact O-N 3.38Å
545	K	45.2	Very low	44.1	Very low	166 Å²	166	122.1 Å²	122.1	72%	0.722	61%	0.61	S	S	*	*	H	α-helix	trans	-70.1	-33.1	176.9	-152.1	176.8	-175.8	-177.9	0	112.4	K541 L542 I543	K541-K545 WeakPolarHBondContact O-CB 3.35Å; K541-K545 PolarHBondContact O-N 3.3Å; K541-K545 VanDerWaalsContact O-N 3.08Å; L542-K545 PolarHBondContact O-N 2.65Å; I543-K545 PolarHBondContact O-N 2.97Å
546	R	44.4	Very low	43.7	Very low	196 Å²	196	125.7 Å²	125.7	74%	0.74	63%	0.625	S	S	*	*	H	α-helix	trans	-80.6	-32.4	174.3	-83.8	-175.1	173	174.6	-0.5	113.5	L542 I543 G548 T549	L542-R546 PolarHBondContact O-N 3.48Å; L542-R546 VanDerWaalsContact O-N 3.08Å; I543-R546 PolarHBondContact O-N 2.9Å; I543-R546 VanDerWaalsContact O-N 3.08Å; R546-G548 VanDerWaalsContact C-N 3.35Å; R546-T549 WeakPolarHBondContact CA-OG1 3.37Å; R546-T549 PolarHBondContact O-N 3.46Å; R546-T549 PolarHBondContact O-OG1 2.98Å
547	E	44.7	Very low	43.5	Very low	125 Å²	125	128.6 Å²	128.6	58%	0.584	64%	0.639	S	S	*	*	H	α-helix	trans	-70.1	-33.4	172.5	-71	178.6	157.4	0	0	111.6	I543 T549 F550	I543-E547 HydrophobicContact CG2-CG 4.36Å; I543-E547 WeakPolarHBondContact O-CG 3.35Å; I543-E547 PolarHBondContact O-N 3.36Å; E547-T549 VanDerWaalsContact C-N 3.25Å; E547-T549 PolarHBondContact O-N 3.27Å; E547-F550 PolarHBondContact O-N 3.14Å
548	G	42.2	Very low	43	Very low	52 Å²	52	127.6 Å²	127.6	54%	0.536	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.4	-26.6	172.4	0	0	0	0	0	114.4	R544 R546	R544-G548 PolarHBondContact O-N 3.38Å; R546-G548 VanDerWaalsContact C-N 3.35Å
549	T	40.4	Very low	42.6	Very low	99 Å²	99	131.1 Å²	131.1	61%	0.607	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-10.4	176.5	41.1	0	0	0	0	114.5	R546 E547	R546-T549 WeakPolarHBondContact CA-OG1 3.37Å; R546-T549 PolarHBondContact O-N 3.46Å; R546-T549 PolarHBondContact O-OG1 2.98Å; E547-T549 VanDerWaalsContact C-N 3.25Å; E547-T549 PolarHBondContact O-N 3.27Å
550	F	37.9	Very low	42.3	Very low	185 Å²	185	137.9 Å²	137.9	81%	0.811	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-7.5	177.3	-98.8	-86.7	0	0	0	114.2	E547	E547-F550 PolarHBondContact O-N 3.14Å
551	N	38.1	Very low	41.9	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	70%	0.701	S	S	*	*	S	Bend	trans	-104.3	8.7	179.2	-90.6	-11.3	0	0	0	114.9	S553	N551-S553 PolarHBondContact O-N 3.26Å
552	S	34.9	Very low	41.3	Very low	94 Å²	94	139.4 Å²	139.4	66%	0.657	71%	0.707	S	S	*	*			trans	-87.8	85	166.3	61.8	0	0	0	0	110.3
553	S	33.7	Very low	40.8	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	72%	0.716	S	S	*	*			trans	-63.1	136.3	163.2	-55.2	0	0	0	0	110.1	N551	N551-S553 PolarHBondContact O-N 3.26Å
554	P	37.7	Very low	40.2	Very low	124 Å²	124	146.4 Å²	146.4	81%	0.805	74%	0.741	S	S	*	*			trans	-65.8	132.4	154.2	-5.4	22.4	0	0	0	107.6
555	K	35.7	Very low	39.5	Very low	279 Å²	279	142.6 Å²	142.6	100%	1.213	74%	0.744	S	S	*	*			trans	-57	0	172.8	-80.1	-177.1	175.2	178.9	0	112.3

Retrieved 555 of 555 residues in 476.8 ms (Link to these results)

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