A0A077ZIZ4_TRITR Loading...

adenylate cyclase

AlphaFold DB , UniProt , Accession A0A077ZIZ4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 677 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	29.5	Very low	27.5	Very low	233 Å²	233	167 Å²	167	100%	1.148	85%	0.847	S	S	*	*				0	124.5	0	-94.9	172.6	171.2	0	0	108.8
2	M	27.2	Very low	27.3	Very low	170 Å²	170	166.6 Å²	166.6	84%	0.837	84%	0.839	S	S	*	*			trans	65.5	97.6	154.3	-64.6	177.2	178.2	0	0	118.9
3	R	26.7	Very low	27.4	Very low	246 Å²	246	166 Å²	166	93%	0.928	84%	0.84	S	S	*	*				51.8	99.5	86.5	-85.9	-171	178.4	175.8	0.3	113.1
4	L	27.1	Very low	27.2	Very low	170 Å²	170	166.4 Å²	166.4	89%	0.89	83%	0.834	S	S	*	*			trans	-155.6	111.7	151.4	-92.5	133.5	0	0	0	103.6
5	S	26.5	Very low	27.1	Very low	106 Å²	106	168.5 Å²	168.5	74%	0.741	84%	0.836	S	S	*	*				151.9	141.6	82.1	177.2	0	0	0	0	103.8
6	V	32.6	Very low	27.2	Very low	129 Å²	129	162.9 Å²	162.9	78%	0.782	82%	0.824	S	S	*	*			cis	-163.9	152.8	3.8	133.6	0	0	0	0	106.3
7	H	27.3	Very low	27.1	Very low	172 Å²	172	159.5 Å²	159.5	80%	0.796	82%	0.819	S	S	*	*			trans	-42.5	157.1	-179.6	-98.4	-99.9	0	0	0	117.9
8	P	27.3	Very low	27	Very low	111 Å²	111	157.1 Å²	157.1	72%	0.721	81%	0.813	S	S	*	*			trans	-76	138.7	176	34.1	-31.5	0	0	0	110.1
9	C	26.1	Very low	27.1	Very low	120 Å²	120	156.3 Å²	156.3	81%	0.811	82%	0.816	S	S	*	*			trans	-116.5	86.1	166.6	-145.9	0	0	0	0	109	K11	C9-K11 PolarHBondContact O-N 2.74Å
10	F	24.9	Very low	27.1	Very low	192 Å²	192	154.5 Å²	154.5	84%	0.842	81%	0.812	S	S	*	*			trans	-52.4	119.3	151.1	-114.2	-99.1	0	0	0	108.1
11	K	27.7	Very low	27.3	Very low	188 Å²	188	155 Å²	155	82%	0.817	81%	0.813	S	S	*	*			trans	-142.1	105.6	151.7	-113.7	-178.2	-179	-179.3	0	108.3	C9 N13	C9-K11 PolarHBondContact O-N 2.74Å; K11-N13 PolarHBondContact O-N 3.08Å
12	E	25	Very low	27.2	Very low	162 Å²	162	150.5 Å²	150.5	76%	0.757	79%	0.794	S	S	*	*			trans	-45.3	126.6	157.2	-71	175.2	118.9	0	0	109.2
13	N	28.7	Very low	27.7	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	78%	0.781	S	S	*	*			trans	-138.8	92.7	154.4	-104	-4.8	0	0	0	108.1	K11	K11-N13 PolarHBondContact O-N 3.08Å
14	K	24.7	Very low	27.9	Very low	172 Å²	172	143 Å²	143	75%	0.748	78%	0.775	S	S	*	*			trans	-67.8	154.8	153	-76.1	173.4	167.2	166.3	0	108.8
15	F	25.6	Very low	28.1	Very low	197 Å²	197	140.6 Å²	140.6	86%	0.864	77%	0.772	S	S	*	*			trans	73.7	142.8	166.8	-75.6	-83.1	0	0	0	115.2
16	A	28.3	Very low	28.2	Very low	79 Å²	79	140.7 Å²	140.7	65%	0.653	77%	0.773	S	S	*	*			cis	-162.4	154.9	11.3	0	0	0	0	0	110.4
17	S	25.9	Very low	28.3	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	77%	0.769	S	S	*	*			trans	42.5	115.9	137.1	-52.9	0	0	0	0	122.2
18	T	25.4	Very low	28.4	Very low	116 Å²	116	141.2 Å²	141.2	71%	0.712	77%	0.773	S	S	*	*				46.3	114.3	117	-33.8	0	0	0	0	118.7	V20	T18-V20 HydrophobicContact CG2-CG2 4.13Å
19	T	28.9	Very low	28.7	Very low	142 Å²	142	141.8 Å²	141.8	87%	0.871	78%	0.777	S	S	*	*			trans	-140.2	115.2	135.9	35.5	0	0	0	0	110.5
20	V	27	Very low	29	Very low	121 Å²	121	140.6 Å²	140.6	73%	0.733	78%	0.776	S	S	*	*			trans	-70	133.3	170.2	170.5	0	0	0	0	108.7	T18	T18-V20 HydrophobicContact CG2-CG2 4.13Å
21	I	30.9	Very low	29.2	Very low	165 Å²	165	137.6 Å²	137.6	85%	0.846	77%	0.773	S	S	*	*			trans	-131.6	112.2	155.5	-58.3	178.9	0	0	0	107.2
22	D	27.8	Very low	29.1	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	77%	0.771	S	S	*	*			trans	-143	168.8	160.7	-123.2	-7.5	0	0	0	104.2
23	P	37.2	Very low	29.4	Very low	87 Å²	87	131 Å²	131	57%	0.565	77%	0.768	S	S	*	*			cis	-146.4	-171.2	8.1	20.3	9.5	0	0	0	114.6
24	H	31.1	Very low	29.3	Very low	172 Å²	172	133 Å²	133	80%	0.796	77%	0.773	S	S	*	*			trans	88	108.6	150.5	-61.4	-61	0	0	0	120.9
25	S	32.2	Very low	29.6	Very low	119 Å²	119	128 Å²	128	83%	0.832	77%	0.77	S	S	*	*				167.3	119.3	95.2	49.4	0	0	0	0	112.8
26	S	27.5	Very low	29.7	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	77%	0.774	S	S	*	*			trans	-70.2	161.2	159	60.2	0	0	0	0	110.2
27	P	35.6	Very low	29.7	Very low	110 Å²	110	126.9 Å²	126.9	71%	0.714	78%	0.777	S	S	*	*				-156.7	156.9	55.3	39.6	-16.8	0	0	0	120
28	K	28.4	Very low	29.7	Very low	203 Å²	203	126.8 Å²	126.8	88%	0.883	78%	0.776	S	S	*	*			trans	53.2	152.2	138	-73.1	-177.3	178.3	177.8	0	124.1
29	P	34.1	Very low	29.7	Very low	122 Å²	122	131.7 Å²	131.7	79%	0.792	78%	0.782	S	S	*	*			trans	-110.8	164.9	-163.5	39.6	-25.7	0	0	0	115.1
30	A	31.9	Very low	29.8	Very low	95 Å²	95	131.9 Å²	131.9	79%	0.785	78%	0.777	S	S	*	*			trans	-149.7	111.5	164.7	0	0	0	0	0	108.1
31	V	29	Very low	29.7	Very low	129 Å²	129	131 Å²	131	78%	0.782	78%	0.777	S	S	*	*				79.6	119.9	78.2	174.4	0	0	0	0	114.7
32	S	26.8	Very low	29.5	Very low	110 Å²	110	134 Å²	134	77%	0.769	78%	0.777	S	S	*	*			trans	70.8	141.4	154.7	73.9	0	0	0	0	117.3
33	S	30.9	Very low	29.3	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	78%	0.777	S	S	*	*			cis	-164.7	132.3	30	40.1	0	0	0	0	108.3
34	Q	26.7	Very low	28.8	Very low	202 Å²	202	136.1 Å²	136.1	94%	0.944	79%	0.788	S	S	*	*				53.7	130.3	109.5	-70.4	-172	-10.6	0	0	118.1
35	G	30.2	Very low	28.4	Very low	66 Å²	66	133.5 Å²	133.5	68%	0.68	79%	0.785	S	S	*	*			trans	145	78	159.4	0	0	0	0	0	112.7
36	L	27.3	Very low	28.1	Very low	184 Å²	184	136.2 Å²	136.2	96%	0.963	78%	0.782	S	S	*	*				69.3	131.4	100	-103.6	95.2	0	0	0	116.5
37	G	28.9	Very low	28	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	78%	0.782	S	S	*	*			trans	111.3	90	148.9	0	0	0	0	0	114.1
38	S	26.2	Very low	27.4	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	79%	0.787	S	S	*	*				73.3	121.3	80.9	-176.1	0	0	0	0	114.3
39	R	25.4	Very low	27.4	Very low	220 Å²	220	135.5 Å²	135.5	83%	0.83	78%	0.783	S	S	*	*			trans	57.8	113	149.7	-73.9	175	169.7	172.5	-3.6	117.5
40	N	29.8	Very low	26.9	Very low	145 Å²	145	138.1 Å²	138.1	78%	0.775	79%	0.79	S	S	*	*				-174.4	132.9	101	-97.9	-21.5	0	0	0	112.7	R42	N40-R42 PolarHBondContact O-N 2.76Å
41	S	24.8	Very low	26.7	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	79%	0.785	S	S	*	*			trans	-40	125.8	153.4	177.7	0	0	0	0	110.9
42	R	27.6	Very low	26.6	Very low	227 Å²	227	140.8 Å²	140.8	86%	0.857	79%	0.788	S	S	*	*			trans	-128.6	100.5	157	-72.9	-170.4	-151.5	165.1	8.1	108.2	N40 V44	N40-R42 PolarHBondContact O-N 2.76Å; R42-V44 PolarHBondContact O-N 3.27Å
43	N	24.3	Very low	26.6	Very low	136 Å²	136	141.8 Å²	141.8	73%	0.727	79%	0.794	S	S	*	*			trans	-45.9	118.7	147.8	-74.3	-24.3	0	0	0	108.6	T45	N43-T45 PolarHBondContact O-N 3.28Å
44	V	26.5	Very low	26.4	Very low	133 Å²	133	146 Å²	146	81%	0.806	80%	0.802	S	S	*	*			trans	-92.9	89	161.2	179.7	0	0	0	0	106.4	R42	R42-V44 PolarHBondContact O-N 3.27Å
45	T	23.1	Very low	26.5	Very low	117 Å²	117	145.5 Å²	145.5	72%	0.718	80%	0.8	S	S	*	*			trans	-98.4	112.2	162.3	-21.2	0	0	0	0	106.2	N43	N43-T45 PolarHBondContact O-N 3.28Å
46	F	25.3	Very low	26.3	Very low	177 Å²	177	150 Å²	150	78%	0.776	81%	0.808	S	S	*	*			trans	-136.4	93.5	167.6	-106.4	-94.3	0	0	0	106.5
47	K	25.9	Very low	26.3	Very low	172 Å²	172	147.5 Å²	147.5	75%	0.748	80%	0.8	S	S	*	*				81.3	103.3	91.4	-93.4	-172.7	174.5	-177.6	0	112.4
48	S	23	Very low	26.3	Very low	120 Å²	120	150.9 Å²	150.9	84%	0.839	80%	0.802	S	S	*	*			trans	-53.7	128.4	151.5	50.3	0	0	0	0	111.4
49	S	26.7	Very low	26.4	Very low	113 Å²	113	154.5 Å²	154.5	79%	0.79	80%	0.804	S	S	*	*			trans	-150.9	99.1	161.4	51.9	0	0	0	0	109.6
50	L	24.6	Very low	26.6	Very low	178 Å²	178	151.6 Å²	151.6	93%	0.932	81%	0.805	S	S	*	*			trans	-68.4	121.5	150.9	-86.4	119.8	0	0	0	108.2
51	S	27.2	Very low	26.5	Very low	98 Å²	98	153.2 Å²	153.2	69%	0.685	81%	0.805	S	S	*	*			trans	159	150.7	141.5	68.2	0	0	0	0	110.1
52	E	28.1	Very low	26.5	Very low	181 Å²	181	154.7 Å²	154.7	85%	0.846	80%	0.804	S	S	*	*			trans	79.5	81.6	166.9	-62.8	172.7	146.2	0	0	116.9
53	C	25.1	Very low	26.5	Very low	131 Å²	131	152 Å²	152	89%	0.885	80%	0.801	S	S	*	*				177.9	81.6	123.3	-92	0	0	0	0	109.1
54	E	28.5	Very low	26.8	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	79%	0.792	S	S	*	*			trans	-64.3	157.5	143	-81.5	177.2	134.7	0	0	108.1
55	E	28.9	Very low	26.9	Very low	191 Å²	191	150.1 Å²	150.1	89%	0.893	79%	0.787	S	S	*	*			trans	76.8	73.3	-174.3	-63.4	-174.5	139	0	0	116.4
56	L	24.9	Very low	27	Very low	162 Å²	162	148.9 Å²	148.9	85%	0.848	78%	0.783	S	S	*	*			trans	-145.9	84.8	134.3	-99.1	164.9	0	0	0	107.6	D58	L56-D58 PolarHBondContact O-N 2.7Å
57	V	28.2	Very low	27.5	Very low	131 Å²	131	143.6 Å²	143.6	79%	0.794	77%	0.772	S	S	*	*			trans	-46.1	117.4	133.1	173.5	0	0	0	0	105.5
58	D	29	Very low	27.8	Very low	139 Å²	139	140.4 Å²	140.4	74%	0.743	77%	0.771	S	S	*	*	S	Bend	cis	-144.3	110.7	15.4	-138.2	-8.5	0	0	0	110.2	L56	L56-D58 PolarHBondContact O-N 2.7Å
59	K	26.7	Very low	28	Very low	179 Å²	179	137.4 Å²	137.4	78%	0.778	75%	0.754	S	S	*	*			trans	21.8	127.2	166.1	-64.4	178.6	177.6	174.2	0	120.7
60	D	30.5	Very low	28.4	Very low	159 Å²	159	140.7 Å²	140.7	85%	0.85	75%	0.754	S	S	*	*			trans	82.1	159.8	167.4	-59.7	-32.5	0	0	0	118.1
61	K	27.1	Very low	28.7	Very low	179 Å²	179	140.5 Å²	140.5	78%	0.778	75%	0.748	S	S	*	*				-155.7	139.1	-87.4	-131.5	178.5	-178.5	178.5	0	107.2
62	I	25.8	Very low	29	Very low	135 Å²	135	138.7 Å²	138.7	69%	0.692	73%	0.734	S	S	*	*			trans	84.4	104.2	158.7	-50	166.8	0	0	0	119.8
63	Q	27.3	Very low	29.1	Very low	170 Å²	170	132.7 Å²	132.7	79%	0.794	71%	0.711	S	S	*	*			trans	50.9	106.9	135.9	-153.4	163.3	-6.6	0	0	123.1
64	C	31	Very low	29.9	Very low	80 Å²	80	128.8 Å²	128.8	54%	0.541	69%	0.688	S	S	.	*				165.9	160	125.4	-94	0	0	0	0	115.8	E75	C64-E75 WeakPolarHBondContact CB-OE2 3.44Å
65	Q	28.8	Very low	29.8	Very low	150 Å²	150	123.2 Å²	123.2	70%	0.701	66%	0.662	S	S	*	*			trans	-87.4	154.4	-164.5	-63.2	174.5	-20.4	0	0	115.1
66	S	24.9	Very low	29.9	Very low	90 Å²	90	121.9 Å²	121.9	63%	0.629	65%	0.653	S	S	*	*			trans	60.4	146.2	140.8	72.9	0	0	0	0	123.8
67	A	35.6	Very low	30.4	Very low	67 Å²	67	120.3 Å²	120.3	55%	0.554	65%	0.645	S	S	*	*			trans	77.4	114.4	154.9	0	0	0	0	0	117.3	P72	A67-P72 HydrophobicContact CB-CB 4.45Å
68	S	31.8	Very low	30.3	Very low	105 Å²	105	115.8 Å²	115.8	73%	0.734	63%	0.625	S	S	*	*				44.1	128	68	-161.1	0	0	0	0	113.6	P72	S68-P72 VanDerWaalsContact O-CB 3.22Å; S68-P72 WeakPolarHBondContact O-CB 3.37Å
69	A	27.4	Very low	30.5	Very low	56 Å²	56	114.4 Å²	114.4	46%	0.463	62%	0.622	S	S	.	*	S	Bend	trans	101.6	156.4	139.1	0	0	0	0	0	117.6	E71 P72	A69-E71 CarbonylContact C-O 3.52Å; A69-E71 VanDerWaalsContact C-O 3.24Å; A69-E71 CarbonylContact O-C 3.07Å; A69-P72 WeakPolarHBondContact O-CB 3.17Å; A69-P72 WeakPolarHBondContact O-CD 3.4Å; A69-P72 WeakPolarHBondContact O-CG 3.36Å
70	K	34.8	Very low	30.9	Very low	183 Å²	183	111.5 Å²	111.5	80%	0.796	61%	0.611	S	S	*	*	S	Bend	trans	46.5	-153.3	140.9	-68	164.9	163.9	178.4	0	116.3	P72	K70-P72 VanDerWaalsContact O-CD 3.23Å; K70-P72 WeakPolarHBondContact O-CD 3.36Å
71	E	31.8	Very low	31.2	Very low	173 Å²	173	108.3 Å²	108.3	81%	0.808	60%	0.601	S	S	*	*	S	Bend		7.1	101.2	95.8	-51.7	168.4	133.4	0	0	111.5	A69	A69-E71 CarbonylContact C-O 3.52Å; A69-E71 VanDerWaalsContact C-O 3.24Å; A69-E71 CarbonylContact O-C 3.07Å
72	P	33.3	Very low	31.7	Very low	61 Å²	61	103.1 Å²	103.1	40%	0.396	59%	0.588	S	S	.	*			trans	-149.7	144.9	138	43.9	-26.7	0	0	0	114.7	A67 S68 A69 K70	A67-P72 HydrophobicContact CB-CB 4.45Å; S68-P72 VanDerWaalsContact O-CB 3.22Å; S68-P72 WeakPolarHBondContact O-CB 3.37Å; A69-P72 WeakPolarHBondContact O-CB 3.17Å; A69-P72 WeakPolarHBondContact O-CD 3.4Å; A69-P72 WeakPolarHBondContact O-CG 3.36Å; K70-P72 VanDerWaalsContact O-CD 3.23Å; K70-P72 WeakPolarHBondContact O-CD 3.36Å
73	P	30.5	Very low	32.2	Very low	54 Å²	54	102 Å²	102	35%	0.351	58%	0.581	S	S	.	*				-76.8	-160.3	-78.9	38.5	-24.9	0	0	0	104.3	E75 N77 G78	P73-E75 HydrophobicContact CG-CG 4.28Å; P73-N77 CarbonylContact O-C 3.24Å; P73-G78 WeakPolarHBondContact O-CA 3.34Å; P73-G78 PolarHBondContact O-N 3.15Å; P73-G78 VanDerWaalsContact O-N 3.07Å
74	A	41.9	Very low	32.5	Very low	50 Å²	50	98.1 Å²	98.1	41%	0.413	57%	0.567	S	S	.	*			cis	74.9	30.4	22.6	0	0	0	0	0	117.5	K76 N77 G78	A74-K76 CarbonylContact C-O 3.55Å; A74-K76 WeakPolarHBondContact CA-O 2.75Å; A74-K76 WeakPolarHBondContact CB-O 3.38Å; A74-K76 CarbonylContact O-C 3.57Å; A74-K76 VanDerWaalsContact O-C 3.26Å; A74-K76 VanDerWaalsContact O-O 3.04Å; A74-N77 WeakPolarHBondContact CA-OD1 3.27Å; A74-N77 WeakPolarHBondContact CB-OD1 3.28Å; A74-G78 VanDerWaalsContact N-N 3.12Å
75	E	25.3	Very low	32.8	Very low	73 Å²	73	100 Å²	100	34%	0.341	57%	0.567	S	S	.	*	S	Bend	trans	-115.3	89.1	152.9	-86.9	-169.4	146.4	0	0	115.8	C64 P73 N77	C64-E75 WeakPolarHBondContact CB-OE2 3.44Å; P73-E75 HydrophobicContact CG-CG 4.28Å; E75-N77 VanDerWaalsContact CA-N 3.32Å; E75-N77 PolarHBondContact O-N 2.8Å
76	K	31.4	Very low	33.1	Very low	164 Å²	164	96.2 Å²	96.2	71%	0.713	55%	0.554	S	S	*	*	S	Bend	cis	-47.2	-24.4	-25.8	-88	-170.5	-173.8	172.2	0	111.6	A74	A74-K76 CarbonylContact C-O 3.55Å; A74-K76 WeakPolarHBondContact CA-O 2.75Å; A74-K76 WeakPolarHBondContact CB-O 3.38Å; A74-K76 CarbonylContact O-C 3.57Å; A74-K76 VanDerWaalsContact O-C 3.26Å; A74-K76 VanDerWaalsContact O-O 3.04Å
77	N	35.8	Very low	33.5	Very low	128 Å²	128	97.1 Å²	97.1	68%	0.684	55%	0.551	S	S	*	*	S	Bend	trans	-160.9	36.1	-161.4	-71.8	-47.6	0	0	0	117.6	P73 A74 E75	P73-N77 CarbonylContact O-C 3.24Å; A74-N77 WeakPolarHBondContact CA-OD1 3.27Å; A74-N77 WeakPolarHBondContact CB-OD1 3.28Å; E75-N77 VanDerWaalsContact CA-N 3.32Å; E75-N77 PolarHBondContact O-N 2.8Å
78	G	25.6	Very low	33.5	Very low	36 Å²	36	96.6 Å²	96.6	37%	0.371	54%	0.544	S	S	.	.	S	Bend	trans	107.7	21.3	149.1	0	0	0	0	0	125.6	P73 A74	P73-G78 WeakPolarHBondContact O-CA 3.34Å; P73-G78 PolarHBondContact O-N 3.15Å; P73-G78 VanDerWaalsContact O-N 3.07Å; A74-G78 VanDerWaalsContact N-N 3.12Å
79	V	34.1	Very low	33.9	Very low	111 Å²	111	95.5 Å²	95.5	67%	0.673	53%	0.533	S	S	*	.			trans	-126.2	-9.2	-163.3	177.8	0	0	0	0	114.2	S81	V79-S81 PolarHBondContact O-N 3.35Å
80	E	34.5	Very low	34.5	Very low	118 Å²	118	99.8 Å²	99.8	55%	0.551	54%	0.543	S	S	*	.	H	α-helix	trans	-77.4	-15	-174.1	-134.2	159	-160.9	0	0	113.9
81	S	36.8	Very low	34.7	Very low	91 Å²	91	96.2 Å²	96.2	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-83.8	-19.2	178.2	68.4	0	0	0	0	114.8	V79 H85	V79-S81 PolarHBondContact O-N 3.35Å; S81-H85 WeakPolarHBondContact O-CB 3.31Å; S81-H85 PolarHBondContact O-N 2.81Å
82	S	36.8	Very low	34.7	Very low	71 Å²	71	91 Å²	91	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-80.7	-31	-171.8	-170.4	0	0	0	0	113.1	V86	S82-V86 WeakPolarHBondContact O-CB 3.39Å; S82-V86 WeakPolarHBondContact O-CG2 3.37Å; S82-V86 PolarHBondContact O-N 3.24Å
83	I	36.3	Very low	35	Very low	110 Å²	110	92 Å²	92	56%	0.564	53%	0.531	S	S	*	.	H	α-helix	trans	-75.6	-39	178.3	-64.8	171.2	0	0	0	110.1	V86 L87	I83-V86 PolarHBondContact O-N 3.39Å; I83-L87 HydrophobicContact CG2-CD1 4.32Å; I83-L87 WeakPolarHBondContact O-CB 3.49Å; I83-L87 PolarHBondContact O-N 2.93Å
84	D	35.1	Very low	35.5	Very low	90 Å²	90	98 Å²	98	48%	0.481	56%	0.558	S	S	.	*	H	α-helix	trans	-72.8	-28.9	172.6	-68.2	-17.9	0	0	0	112.3	S88	D84-S88 WeakPolarHBondContact O-CA 3.27Å; D84-S88 WeakPolarHBondContact O-CB 3.36Å; D84-S88 PolarHBondContact O-N 2.68Å; D84-S88 PolarHBondContact O-OG 2.84Å; D84-S88 VanDerWaalsContact O-OG 3.1Å
85	H	35.5	Very low	35.3	Very low	119 Å²	119	99.8 Å²	99.8	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-72.5	-34	170.7	-164	-67.7	0	0	0	112.1	S81 S88 T89	S81-H85 WeakPolarHBondContact O-CB 3.31Å; S81-H85 PolarHBondContact O-N 2.81Å; H85-S88 PolarHBondContact O-OG 3.03Å; H85-T89 VanDerWaalsContact O-CB 3.27Å; H85-T89 WeakPolarHBondContact O-CB 3.48Å; H85-T89 VanDerWaalsContact O-CG2 3.29Å; H85-T89 WeakPolarHBondContact O-CG2 3.21Å; H85-T89 PolarHBondContact O-N 3.39Å; H85-T89 PolarHBondContact O-OG1 3.05Å
86	V	35.9	Very low	36	Very low	71 Å²	71	107.4 Å²	107.4	43%	0.43	59%	0.594	S	S	.	*	H	α-helix	trans	-73.5	-39.2	173.9	170.3	0	0	0	0	110.4	S82 I83 T89 H90	S82-V86 WeakPolarHBondContact O-CB 3.39Å; S82-V86 WeakPolarHBondContact O-CG2 3.37Å; S82-V86 PolarHBondContact O-N 3.24Å; I83-V86 PolarHBondContact O-N 3.39Å; V86-T89 WeakPolarHBondContact CA-OG1 3.15Å; V86-T89 PolarHBondContact O-OG1 3.26Å; V86-H90 WeakPolarHBondContact O-CB 3.41Å; V86-H90 PolarHBondContact O-CD2 2.86Å; V86-H90 PolarHBondContact O-N 3Å
87	L	33.3	Very low	36.3	Very low	108 Å²	108	109.1 Å²	109.1	57%	0.565	60%	0.602	S	S	*	*	H	α-helix	trans	-69.4	-39.9	172.8	-101.4	79.1	0	0	0	112	I83 H90 T91	I83-L87 HydrophobicContact CG2-CD1 4.32Å; I83-L87 WeakPolarHBondContact O-CB 3.49Å; I83-L87 PolarHBondContact O-N 2.93Å; L87-H90 PolarHBondContact O-N 3.13Å; L87-T91 WeakPolarHBondContact O-CB 3.25Å; L87-T91 PolarHBondContact O-N 3.13Å; L87-T91 PolarHBondContact O-OG1 3.04Å
88	S	35.9	Very low	36.6	Very low	57 Å²	57	112.2 Å²	112.2	40%	0.399	61%	0.612	S	S	.	*	H	α-helix	trans	-72.4	-33.4	177.8	78.9	0	0	0	0	112.8	D84 H85 H90 T91 A92	D84-S88 WeakPolarHBondContact O-CA 3.27Å; D84-S88 WeakPolarHBondContact O-CB 3.36Å; D84-S88 PolarHBondContact O-N 2.68Å; D84-S88 PolarHBondContact O-OG 2.84Å; D84-S88 VanDerWaalsContact O-OG 3.1Å; H85-S88 PolarHBondContact O-OG 3.03Å; S88-H90 VanDerWaalsContact C-N 3.26Å; S88-H90 PolarHBondContact O-N 3.42Å; S88-T91 PolarHBondContact O-N 3.15Å; S88-A92 WeakPolarHBondContact O-CB 3.16Å; S88-A92 PolarHBondContact O-N 3.17Å
89	T	39.2	Very low	37.7	Very low	82 Å²	82	114.1 Å²	114.1	50%	0.503	62%	0.624	S	S	.	*	H	α-helix	trans	-71.1	-20.7	171.9	45.3	0	0	0	0	113.4	H85 V86	H85-T89 VanDerWaalsContact O-CB 3.27Å; H85-T89 WeakPolarHBondContact O-CB 3.48Å; H85-T89 VanDerWaalsContact O-CG2 3.29Å; H85-T89 WeakPolarHBondContact O-CG2 3.21Å; H85-T89 PolarHBondContact O-N 3.39Å; H85-T89 PolarHBondContact O-OG1 3.05Å; V86-T89 WeakPolarHBondContact CA-OG1 3.15Å; V86-T89 PolarHBondContact O-OG1 3.26Å
90	H	41.1	Very low	39	Very low	145 Å²	145	115 Å²	115	67%	0.671	63%	0.625	S	S	*	*	H	α-helix	trans	-93.9	-15	173.8	-79.8	-65.7	0	0	0	114.1	V86 L87 S88	V86-H90 WeakPolarHBondContact O-CB 3.41Å; V86-H90 PolarHBondContact O-CD2 2.86Å; V86-H90 PolarHBondContact O-N 3Å; L87-H90 PolarHBondContact O-N 3.13Å; S88-H90 VanDerWaalsContact C-N 3.26Å; S88-H90 PolarHBondContact O-N 3.42Å
91	T	38.1	Very low	40.4	Very low	109 Å²	109	114.9 Å²	114.9	67%	0.669	62%	0.624	S	S	*	*	H	α-helix	trans	-112.9	-14	178.7	46.8	0	0	0	0	114.9	L87 S88 S93	L87-T91 WeakPolarHBondContact O-CB 3.25Å; L87-T91 PolarHBondContact O-N 3.13Å; L87-T91 PolarHBondContact O-OG1 3.04Å; S88-T91 PolarHBondContact O-N 3.15Å; T91-S93 PolarHBondContact O-N 3.01Å; T91-S93 VanDerWaalsContact O-N 3.16Å
92	A	33	Very low	42	Very low	64 Å²	64	113.8 Å²	113.8	53%	0.529	61%	0.614	S	S	.	*	S	Bend	trans	-75.1	104.5	173.6	0	0	0	0	0	111.4	S88	S88-A92 WeakPolarHBondContact O-CB 3.16Å; S88-A92 PolarHBondContact O-N 3.17Å
93	S	38.2	Very low	43.4	Very low	81 Å²	81	113.3 Å²	113.3	57%	0.566	61%	0.606	S	S	*	*			trans	62.1	102.5	150	68.1	0	0	0	0	115.9	T91 S95	T91-S93 PolarHBondContact O-N 3.01Å; T91-S93 VanDerWaalsContact O-N 3.16Å; S93-S95 WeakPolarHBondContact CB-OG 3.45Å; S93-S95 PolarHBondContact O-N 3.41Å
94	I	42.8	Very low	45.1	Very low	179 Å²	179	112.9 Å²	112.9	92%	0.918	60%	0.6	S	S	*	*			cis	47	-1.9	41.3	-58.3	-177.5	0	0	0	115	R96	I94-R96 PolarHBondContact O-N 3.27Å
95	S	36.4	Very low	46.9	Very low	89 Å²	89	108.7 Å²	108.7	62%	0.622	58%	0.578	S	S	*	*			trans	-92.2	79.9	161.5	59.7	0	0	0	0	109.9	S93 F97	S93-S95 WeakPolarHBondContact CB-OG 3.45Å; S93-S95 PolarHBondContact O-N 3.41Å; S95-F97 PolarHBondContact O-N 3.45Å
96	R	40.1	Very low	48.5	Very low	232 Å²	232	107.5 Å²	107.5	88%	0.875	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	43.4	-172	-151.6	-178.6	-163.2	155.7	4.1	114	I94	I94-R96 PolarHBondContact O-N 3.27Å
97	F	38.5	Very low	49.8	Very low	201 Å²	201	111.6 Å²	111.6	88%	0.882	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	-6.9	-176.8	-92.3	-80.6	0	0	0	117.7	S95	S95-F97 PolarHBondContact O-N 3.45Å
98	E	41.6	Very low	51.4	Low	193 Å²	193	108.8 Å²	108.8	90%	0.902	57%	0.566	S	S	*	*	S	Bend	trans	-137.9	6.1	-172.6	-79.7	-177.9	152.7	0	0	117.3	N100	E98-N100 PolarHBondContact O-N 2.84Å
99	A	48.7	Very low	52.7	Low	76 Å²	76	106.5 Å²	106.5	63%	0.628	55%	0.551	S	S	*	*			trans	-84.3	118.7	178.6	0	0	0	0	0	112.1	H101	A99-H101 PolarHBondContact O-N 2.97Å
100	N	60.5	Low	53.8	Low	128 Å²	128	107.8 Å²	107.8	68%	0.684	55%	0.551	S	S	*	*			trans	-48.3	125.6	175.9	-127.9	-17.5	0	0	0	111.3	E98 V102 D103 F104	E98-N100 PolarHBondContact O-N 2.84Å; N100-V102 PolarHBondContact O-N 3.42Å; N100-D103 PolarHBondContact O-N 2.86Å; N100-F104 PolarHBondContact O-N 3.2Å
101	H	65	Low	54.6	Low	116 Å²	116	104.5 Å²	104.5	54%	0.537	55%	0.55	S	S	.	.	H	α-helix	trans	-52.2	-34	-173.2	-67.7	-63.9	0	0	0	113.9	A99 F104 D105 I137	A99-H101 PolarHBondContact O-N 2.97Å; H101-F104 PolarHBondContact O-N 3.15Å; H101-D105 PolarHBondContact O-N 3.34Å; H101-I137 HydrophobicContact CB-CB 4.36Å; H101-I137 HydrophobicContact CB-CG2 3.94Å
102	V	70.3	Confident	55.7	Low	69 Å²	69	101.7 Å²	101.7	42%	0.418	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-44.3	179	-170.6	0	0	0	0	112.3	N100 D105 M106 D138 V141	N100-V102 PolarHBondContact O-N 3.42Å; V102-D105 PolarHBondContact O-N 3.01Å; V102-M106 VanDerWaalsContact O-CB 3.26Å; V102-M106 WeakPolarHBondContact O-CB 3.24Å; V102-M106 PolarHBondContact O-N 2.96Å; V102-D138 WeakPolarHBondContact CG2-OD2 3.37Å; V102-V141 HydrophobicContact CG1-CG2 4.31Å
103	D	66.2	Low	56.7	Low	60 Å²	60	105.4 Å²	105.4	32%	0.321	53%	0.53	S	S	.	.	H	α-helix	trans	-68.9	-40.4	-178.1	-176	40	0	0	0	110.5	N100 M106 R107	N100-D103 PolarHBondContact O-N 2.86Å; D103-M106 PolarHBondContact O-N 3Å; D103-R107 WeakPolarHBondContact O-CB 3.43Å; D103-R107 VanDerWaalsContact O-CG 3.25Å; D103-R107 WeakPolarHBondContact O-CG 3.31Å; D103-R107 PolarHBondContact O-N 2.96Å; D103-R107 IonicContact OD1-CZ 3.67Å; D103-R107 IonicContact OD1-NE 2.78Å; D103-R107 PolarHBondContact OD1-NE 3.39Å; D103-R107 IonicContact OD1-NH2 2.67Å; D103-R107 IonicContact OD2-CZ 3.99Å; D103-R107 IonicContact OD2-NE 2.77Å; D103-R107 PolarHBondContact OD2-NE 2.9Å; D103-R107 IonicContact OD2-NH2 2.65Å; D103-R107 PolarHBondContact OD2-NH2 2.84Å
104	F	71.2	Confident	57.2	Low	102 Å²	102	103.2 Å²	103.2	45%	0.447	52%	0.521	S	S	.	.	H	α-helix	trans	-59.5	-49.4	173.9	-178.6	-95.6	0	0	0	111.8	N100 H101 M106 R107 L108 I137	N100-F104 PolarHBondContact O-N 3.2Å; H101-F104 PolarHBondContact O-N 3.15Å; F104-M106 VanDerWaalsContact C-N 3.33Å; F104-M106 PolarHBondContact O-N 3.28Å; F104-R107 PolarHBondContact O-N 3.01Å; F104-L108 HydrophobicContact CE1-CD2 4.11Å; F104-L108 VanDerWaalsContact O-CB 3.24Å; F104-L108 WeakPolarHBondContact O-CB 3.27Å; F104-L108 PolarHBondContact O-N 2.68Å; F104-I137 HydrophobicContact CD1-CD1 4.31Å
105	D	73	Confident	57	Low	2 Å²	2	100.7 Å²	100.7	1%	0.011	52%	0.519	C	S	.	.	H	α-helix	trans	-68.7	-31.9	179.9	-75.8	-32.7	0	0	0	113.1	H101 V102 L108 A109 F136 I137 D138 V141	H101-D105 PolarHBondContact O-N 3.34Å; V102-D105 PolarHBondContact O-N 3.01Å; D105-L108 PolarHBondContact O-N 3.22Å; D105-A109 VanDerWaalsContact O-CB 3.23Å; D105-A109 WeakPolarHBondContact O-CB 3.45Å; D105-A109 PolarHBondContact O-N 3.2Å; D105-F136 HydrophobicContact CB-CB 4.2Å; D105-F136 HydrophobicContact CB-CD1 3.8Å; D105-F136 HydrophobicContact CB-CG 4.45Å; D105-F136 WeakPolarHBondContact O-CE1 3.44Å; D105-I137 VanDerWaalsContact CG-N 3.3Å; D105-I137 PolarHBondContact OD1-N 3.04Å; D105-I137 VanDerWaalsContact OD2-CA 3.22Å; D105-I137 WeakPolarHBondContact OD2-CA 3.41Å; D105-I137 VanDerWaalsContact OD2-CB 3.22Å; D105-I137 WeakPolarHBondContact OD2-CB 3.42Å; D105-I137 PolarHBondContact OD2-N 2.92Å; D105-D138 PolarHBondContact OD2-N 2.59Å; D105-V141 HydrophobicContact CB-CB 4.27Å; D105-V141 HydrophobicContact CB-CG1 4.09Å; D105-V141 HydrophobicContact CB-CG2 4.34Å
106	M	70.3	Confident	56.9	Low	93 Å²	93	101.8 Å²	101.8	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-69.4	-44.2	175.7	-162.5	164	79.4	0	0	111	V102 D103 F104 L108 A109 E110	V102-M106 VanDerWaalsContact O-CB 3.26Å; V102-M106 WeakPolarHBondContact O-CB 3.24Å; V102-M106 PolarHBondContact O-N 2.96Å; D103-M106 PolarHBondContact O-N 3Å; F104-M106 VanDerWaalsContact C-N 3.33Å; F104-M106 PolarHBondContact O-N 3.28Å; M106-L108 VanDerWaalsContact C-N 3.33Å; M106-L108 PolarHBondContact O-N 3.35Å; M106-A109 WeakPolarHBondContact O-CB 3.28Å; M106-A109 PolarHBondContact O-N 2.82Å; M106-E110 WeakPolarHBondContact O-CG 3.5Å; M106-E110 PolarHBondContact O-N 2.7Å
107	R	62.9	Low	56.6	Low	157 Å²	157	98.7 Å²	98.7	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-63	-39	172.1	-70.4	177.6	-166.9	-161.3	7	111.9	D103 F104 E110 A111	D103-R107 WeakPolarHBondContact O-CB 3.43Å; D103-R107 VanDerWaalsContact O-CG 3.25Å; D103-R107 WeakPolarHBondContact O-CG 3.31Å; D103-R107 PolarHBondContact O-N 2.96Å; D103-R107 IonicContact OD1-CZ 3.67Å; D103-R107 IonicContact OD1-NE 2.78Å; D103-R107 PolarHBondContact OD1-NE 3.39Å; D103-R107 IonicContact OD1-NH2 2.67Å; D103-R107 IonicContact OD2-CZ 3.99Å; D103-R107 IonicContact OD2-NE 2.77Å; D103-R107 PolarHBondContact OD2-NE 2.9Å; D103-R107 IonicContact OD2-NH2 2.65Å; D103-R107 PolarHBondContact OD2-NH2 2.84Å; F104-R107 PolarHBondContact O-N 3.01Å; R107-E110 PolarHBondContact O-N 3.32Å; R107-A111 VanDerWaalsContact O-CB 3.3Å; R107-A111 WeakPolarHBondContact O-CB 3.29Å; R107-A111 PolarHBondContact O-N 2.91Å
108	L	65.5	Low	56.4	Low	49 Å²	49	93.2 Å²	93.2	26%	0.257	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-42	174	-175.4	61.6	0	0	0	110.9	F104 D105 M106 A111 I112 L134 F136	F104-L108 HydrophobicContact CE1-CD2 4.11Å; F104-L108 VanDerWaalsContact O-CB 3.24Å; F104-L108 WeakPolarHBondContact O-CB 3.27Å; F104-L108 PolarHBondContact O-N 2.68Å; D105-L108 PolarHBondContact O-N 3.22Å; M106-L108 VanDerWaalsContact C-N 3.33Å; M106-L108 PolarHBondContact O-N 3.35Å; L108-A111 PolarHBondContact O-N 3.33Å; L108-I112 HydrophobicContact CD1-CD1 4.15Å; L108-I112 HydrophobicContact CG-CD1 3.91Å; L108-I112 WeakPolarHBondContact O-CB 3.29Å; L108-I112 WeakPolarHBondContact O-CD1 3.38Å; L108-I112 WeakPolarHBondContact O-CG1 3.36Å; L108-I112 PolarHBondContact O-N 3.05Å; L108-L134 HydrophobicContact CD2-CD2 4.07Å; L108-F136 HydrophobicContact CB-CE1 4.1Å; L108-F136 HydrophobicContact CD2-CD1 4.07Å; L108-F136 HydrophobicContact CD2-CE1 4.02Å; L108-F136 HydrophobicContact CG-CD1 4.43Å; L108-F136 HydrophobicContact CG-CE1 3.92Å
109	A	64.5	Low	55.9	Low	10 Å²	10	93.9 Å²	93.9	8%	0.083	52%	0.522	C	S	.	.	H	α-helix	trans	-65.7	-37.6	175.7	0	0	0	0	0	111.9	D105 M106 R113 F136 V141 Y145	D105-A109 VanDerWaalsContact O-CB 3.23Å; D105-A109 WeakPolarHBondContact O-CB 3.45Å; D105-A109 PolarHBondContact O-N 3.2Å; M106-A109 WeakPolarHBondContact O-CB 3.28Å; M106-A109 PolarHBondContact O-N 2.82Å; A109-R113 VanDerWaalsContact O-CB 3.24Å; A109-R113 WeakPolarHBondContact O-CB 3.11Å; A109-R113 WeakPolarHBondContact O-CG 3.4Å; A109-R113 PolarHBondContact O-N 2.91Å; A109-F136 HydrophobicContact CB-CE1 3.82Å; A109-F136 HydrophobicContact CB-CZ 3.95Å; A109-V141 HydrophobicContact CB-CG1 4.16Å; A109-Y145 HydrophobicContact CB-CD2 4.21Å
110	E	61.4	Low	55	Low	108 Å²	108	92.7 Å²	92.7	51%	0.505	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-44.4	173.2	-78.1	175.6	-178.8	0	0	112.2	M106 R107 I112 R113 G114	M106-E110 WeakPolarHBondContact O-CG 3.5Å; M106-E110 PolarHBondContact O-N 2.7Å; R107-E110 PolarHBondContact O-N 3.32Å; E110-I112 VanDerWaalsContact C-N 3.31Å; E110-I112 PolarHBondContact O-N 2.82Å; E110-R113 PolarHBondContact O-N 3.34Å; E110-G114 PolarHBondContact O-N 2.84Å
111	A	59.2	Low	53.4	Low	77 Å²	77	94 Å²	94	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-61.1	-39.7	174.6	0	0	0	0	0	111.8	R107 L108 G114	R107-A111 VanDerWaalsContact O-CB 3.3Å; R107-A111 WeakPolarHBondContact O-CB 3.29Å; R107-A111 PolarHBondContact O-N 2.91Å; L108-A111 PolarHBondContact O-N 3.33Å; A111-G114 PolarHBondContact O-N 3.07Å
112	I	60.5	Low	51.8	Low	49 Å²	49	98.6 Å²	98.6	25%	0.251	54%	0.537	S	S	.	.	H	α-helix	trans	-72.5	-37.6	175.9	-65.5	163.6	0	0	0	111.6	L108 E110 G114 L129 L134 F136 Y145	L108-I112 HydrophobicContact CD1-CD1 4.15Å; L108-I112 HydrophobicContact CG-CD1 3.91Å; L108-I112 WeakPolarHBondContact O-CB 3.29Å; L108-I112 WeakPolarHBondContact O-CD1 3.38Å; L108-I112 WeakPolarHBondContact O-CG1 3.36Å; L108-I112 PolarHBondContact O-N 3.05Å; E110-I112 VanDerWaalsContact C-N 3.31Å; E110-I112 PolarHBondContact O-N 2.82Å; I112-G114 PolarHBondContact O-N 2.86Å; I112-L129 HydrophobicContact CD1-CD1 4.41Å; I112-L129 HydrophobicContact CD1-CD2 3.91Å; I112-L129 HydrophobicContact CG2-CD1 4.01Å; I112-L134 HydrophobicContact CD1-CD2 3.74Å; I112-F136 HydrophobicContact CD1-CE1 4.21Å; I112-F136 HydrophobicContact CD1-CZ 3.88Å; I112-Y145 HydrophobicContact CB-CE2 4.47Å; I112-Y145 HydrophobicContact CG2-CE2 4.01Å; I112-Y145 VanDerWaalsContact CG2-OH 3.31Å; I112-Y145 WeakPolarHBondContact CG2-OH 3.39Å
113	R	54.5	Low	49.7	Very low	142 Å²	142	103.3 Å²	103.3	54%	0.536	56%	0.56	S	S	.	*	H	α-helix	trans	-63.2	-24.6	173.2	-81.5	175.1	118.5	-170.7	-4.3	111.8	A109 E110 Y145 H148	A109-R113 VanDerWaalsContact O-CB 3.24Å; A109-R113 WeakPolarHBondContact O-CB 3.11Å; A109-R113 WeakPolarHBondContact O-CG 3.4Å; A109-R113 PolarHBondContact O-N 2.91Å; E110-R113 PolarHBondContact O-N 3.34Å; R113-Y145 HydrophobicContact CG-CE2 4.25Å; R113-H148 PolarHBondContact NH2-CD2 3.44Å; R113-H148 PolarHBondContact NH2-NE2 2.8Å
114	G	47.2	Very low	48.4	Very low	36 Å²	36	107.7 Å²	107.7	37%	0.371	58%	0.581	S	S	.	*			trans	70.5	149.9	-166.5	0	0	0	0	0	109.7	E110 A111 I112 S116	E110-G114 PolarHBondContact O-N 2.84Å; A111-G114 PolarHBondContact O-N 3.07Å; I112-G114 PolarHBondContact O-N 2.86Å; G114-S116 PolarHBondContact O-N 3.28Å
115	S	40	Very low	46.9	Very low	126 Å²	126	110.5 Å²	110.5	88%	0.881	59%	0.589	S	S	*	*			trans	-60.7	76.5	173.5	42.5	0	0	0	0	111.7	L117	S115-L117 PolarHBondContact O-N 3.44Å
116	S	34.8	Very low	45.6	Very low	111 Å²	111	119.7 Å²	119.7	78%	0.776	62%	0.624	S	S	*	*			trans	-84.7	38.7	168.5	-179.4	0	0	0	0	111.1	G114	G114-S116 PolarHBondContact O-N 3.28Å
117	L	33.7	Very low	44.7	Very low	167 Å²	167	125 Å²	125	87%	0.874	64%	0.644	S	S	*	*			trans	-107.9	17.4	-179.2	-105.7	152.3	0	0	0	113.4	S115	S115-L117 PolarHBondContact O-N 3.44Å
118	A	33.3	Very low	44.2	Very low	87 Å²	87	120 Å²	120	72%	0.719	64%	0.636	S	S	*	*	S	Bend	trans	-103.9	109.6	155.3	0	0	0	0	0	107.7	G120	A118-G120 PolarHBondContact O-N 3.35Å
119	E	31	Very low	43.9	Very low	207 Å²	207	119.7 Å²	119.7	97%	0.967	64%	0.635	S	S	*	*			trans	-43	120.6	175.8	-68.6	167.1	132.4	0	0	111.9
120	G	30	Very low	43.6	Very low	50 Å²	50	123 Å²	123	52%	0.515	65%	0.651	S	S	.	*			trans	143.8	79.7	171	0	0	0	0	0	115.4	A118 Y122	A118-G120 PolarHBondContact O-N 3.35Å; G120-Y122 WeakPolarHBondContact O-CD2 3.38Å; G120-Y122 PolarHBondContact O-N 3.04Å
121	D	26.7	Very low	43.6	Very low	156 Å²	156	121.3 Å²	121.3	83%	0.834	65%	0.65	S	S	*	*			trans	30.1	44.1	133.7	-80.4	-7.9	0	0	0	122.2
122	Y	31.7	Very low	43.3	Very low	212 Å²	212	126.6 Å²	126.6	83%	0.831	66%	0.658	S	S	*	*			trans	-133.8	78	168.9	-49.9	-72.8	0	0	0	114.8	G120 I124	G120-Y122 WeakPolarHBondContact O-CD2 3.38Å; G120-Y122 PolarHBondContact O-N 3.04Å; Y122-I124 PolarHBondContact O-N 3.09Å
123	L	26.4	Very low	43.1	Very low	169 Å²	169	129 Å²	129	89%	0.885	68%	0.676	S	S	*	*			trans	20.5	89.8	143	-69.8	161.8	0	0	0	119.8
124	I	37.6	Very low	43.4	Very low	152 Å²	152	125.6 Å²	125.6	78%	0.779	67%	0.668	S	S	*	*			trans	-140.4	86.8	143.5	-52.3	178.5	0	0	0	109.6	Y122 R126	Y122-I124 PolarHBondContact O-N 3.09Å; I124-R126 PolarHBondContact O-N 2.79Å
125	R	39.8	Very low	44.3	Very low	160 Å²	160	131.4 Å²	131.4	60%	0.604	68%	0.683	S	S	*	*			trans	-70.6	105.8	169.8	-104.9	-176	-168.1	-154.4	1.6	109.4
126	R	46.7	Very low	45.9	Very low	196 Å²	196	126 Å²	126	74%	0.74	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-70.1	143.9	165.4	-68.1	-176.6	-176.7	-168	1.1	109.5	I124 F149	I124-R126 PolarHBondContact O-N 2.79Å; R126-F149 VanDerWaalsContact O-CE1 3.32Å; R126-F149 WeakPolarHBondContact O-CE1 3.45Å
127	K	51.5	Low	47.8	Very low	203 Å²	203	125.4 Å²	125.4	88%	0.883	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-52.9	144.2	175.5	-79.4	179.7	175.1	178.9	0	110.2
128	A	53.3	Low	49.9	Very low	53 Å²	53	118.9 Å²	118.9	44%	0.438	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-54.3	152.7	170.6	0	0	0	0	0	110.9	N130 F149	A128-N130 PolarHBondContact O-N 3.34Å; A128-F149 HydrophobicContact CB-CB 4.11Å; A128-F149 HydrophobicContact CB-CD1 4.37Å; A128-F149 HydrophobicContact CB-CD2 4.33Å; A128-F149 HydrophobicContact CB-CG 4Å
129	L	58.6	Low	52	Low	42 Å²	42	118.9 Å²	118.9	22%	0.22	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-54.1	138.4	-180	-73.4	85.5	0	0	0	110.3	I112 L134 F136 Y145	I112-L129 HydrophobicContact CD1-CD1 4.41Å; I112-L129 HydrophobicContact CD1-CD2 3.91Å; I112-L129 HydrophobicContact CG2-CD1 4.01Å; L129-L134 HydrophobicContact CD2-CB 3.51Å; L129-L134 HydrophobicContact CD2-CD2 3.16Å; L129-L134 HydrophobicContact CD2-CG 3.9Å; L129-F136 HydrophobicContact CD1-CE2 4.32Å; L129-F136 HydrophobicContact CD2-CE2 4.25Å; L129-F136 HydrophobicContact CD2-CZ 4.45Å; L129-Y145 HydrophobicContact CD1-CD1 3.71Å; L129-Y145 HydrophobicContact CD1-CE1 2.94Å; L129-Y145 HydrophobicContact CD1-CE2 3.92Å; L129-Y145 HydrophobicContact CD1-CG 4.49Å; L129-Y145 WeakPolarHBondContact CD1-OH 3.45Å; L129-Y145 HydrophobicContact CG-CE1 4.37Å
130	N	58.3	Low	54.4	Low	80 Å²	80	114 Å²	114	43%	0.428	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-63.6	124.7	172	170.2	7.5	0	0	0	108.7	A128 F132 T133	A128-N130 PolarHBondContact O-N 3.34Å; N130-F132 PolarHBondContact O-N 3.2Å; N130-F132 WeakPolarHBondContact OD1-CD2 3.24Å; N130-F132 PolarHBondContact OD1-N 3.03Å; N130-F132 VanDerWaalsContact OD1-N 3.16Å; N130-T133 VanDerWaalsContact CB-OG1 3.32Å; N130-T133 WeakPolarHBondContact CB-OG1 3.41Å; N130-T133 PolarHBondContact O-N 3.25Å; N130-T133 VanDerWaalsContact O-N 3.12Å; N130-T133 PolarHBondContact O-OG1 3.22Å
131	P	60.2	Low	56.6	Low	73 Å²	73	112.6 Å²	112.6	47%	0.474	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.8	-15.8	-175.6	20.9	-32.6	0	0	0	114.1
132	F	54.3	Low	59.1	Low	187 Å²	187	106.5 Å²	106.5	82%	0.82	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-11.5	-177.6	-62.6	-71.8	0	0	0	114.9	N130	N130-F132 PolarHBondContact O-N 3.2Å; N130-F132 WeakPolarHBondContact OD1-CD2 3.24Å; N130-F132 PolarHBondContact OD1-N 3.03Å; N130-F132 VanDerWaalsContact OD1-N 3.16Å
133	T	56.5	Low	61.1	Low	101 Å²	101	99.2 Å²	99.2	62%	0.62	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-15.6	-168.1	45.4	0	0	0	0	115.6	N130	N130-T133 VanDerWaalsContact CB-OG1 3.32Å; N130-T133 WeakPolarHBondContact CB-OG1 3.41Å; N130-T133 PolarHBondContact O-N 3.25Å; N130-T133 VanDerWaalsContact O-N 3.12Å; N130-T133 PolarHBondContact O-OG1 3.22Å
134	L	59.3	Low	63.4	Low	70 Å²	70	98.8 Å²	98.8	37%	0.366	49%	0.49	S	S	.	.			trans	-156.5	120.6	177.2	-151.4	115.9	0	0	0	110.7	L108 I112 L129	L108-L134 HydrophobicContact CD2-CD2 4.07Å; I112-L134 HydrophobicContact CD1-CD2 3.74Å; L129-L134 HydrophobicContact CD2-CB 3.51Å; L129-L134 HydrophobicContact CD2-CD2 3.16Å; L129-L134 HydrophobicContact CD2-CG 3.9Å
135	K	67.3	Low	64.9	Low	158 Å²	158	92.3 Å²	92.3	69%	0.687	46%	0.456	S	S	*	.			trans	-111.6	138.9	168.5	-71.5	-176.6	177.5	-178	0	107.6
136	F	73.8	Confident	66.3	Low	12 Å²	12	90.4 Å²	90.4	5%	0.053	45%	0.448	C	S	.	.			trans	-72.8	151.5	165.8	-63.3	-84.8	0	0	0	108.4	D105 L108 A109 I112 L129 D138 V141 E142 Y145	D105-F136 HydrophobicContact CB-CB 4.2Å; D105-F136 HydrophobicContact CB-CD1 3.8Å; D105-F136 HydrophobicContact CB-CG 4.45Å; D105-F136 WeakPolarHBondContact O-CE1 3.44Å; L108-F136 HydrophobicContact CB-CE1 4.1Å; L108-F136 HydrophobicContact CD2-CD1 4.07Å; L108-F136 HydrophobicContact CD2-CE1 4.02Å; L108-F136 HydrophobicContact CG-CD1 4.43Å; L108-F136 HydrophobicContact CG-CE1 3.92Å; A109-F136 HydrophobicContact CB-CE1 3.82Å; A109-F136 HydrophobicContact CB-CZ 3.95Å; I112-F136 HydrophobicContact CD1-CE1 4.21Å; I112-F136 HydrophobicContact CD1-CZ 3.88Å; L129-F136 HydrophobicContact CD1-CE2 4.32Å; L129-F136 HydrophobicContact CD2-CE2 4.25Å; L129-F136 HydrophobicContact CD2-CZ 4.45Å; F136-D138 VanDerWaalsContact C-N 3.34Å; F136-V141 HydrophobicContact CD1-CG1 4.36Å; F136-E142 HydrophobicContact CB-CB 4.14Å; F136-E142 HydrophobicContact CD2-CB 3.96Å; F136-E142 HydrophobicContact CD2-CG 4.14Å; F136-E142 HydrophobicContact CG-CB 4.48Å; F136-Y145 HydrophobicContact CE2-CD1 4.28Å; F136-Y145 HydrophobicContact CE2-CD2 4.3Å; F136-Y145 AromaticContact CE2-CG 3.98Å; F136-Y145 HydrophobicContact CE2-CG 3.98Å; F136-Y145 HydrophobicContact CZ-CD2 4.14Å; F136-Y145 HydrophobicContact CZ-CG 4.29Å
137	I	75	Confident	67.3	Low	98 Å²	98	89.5 Å²	89.5	50%	0.503	45%	0.445	S	S	.	.	S	Bend	trans	-69.4	-37.3	177.2	-55.7	172	0	0	0	109.9	H101 F104 D105	H101-I137 HydrophobicContact CB-CB 4.36Å; H101-I137 HydrophobicContact CB-CG2 3.94Å; F104-I137 HydrophobicContact CD1-CD1 4.31Å; D105-I137 VanDerWaalsContact CG-N 3.3Å; D105-I137 PolarHBondContact OD1-N 3.04Å; D105-I137 VanDerWaalsContact OD2-CA 3.22Å; D105-I137 WeakPolarHBondContact OD2-CA 3.41Å; D105-I137 VanDerWaalsContact OD2-CB 3.22Å; D105-I137 WeakPolarHBondContact OD2-CB 3.42Å; D105-I137 PolarHBondContact OD2-N 2.92Å
138	D	77.2	Confident	67.9	Low	31 Å²	31	83.9 Å²	83.9	17%	0.166	42%	0.422	C	S	.	.	S	Bend	trans	-92.2	115	177.4	-173	-16.2	0	0	0	111.6	V102 D105 F136 V140 V141 E142	V102-D138 WeakPolarHBondContact CG2-OD2 3.37Å; D105-D138 PolarHBondContact OD2-N 2.59Å; F136-D138 VanDerWaalsContact C-N 3.34Å; D138-V140 PolarHBondContact O-N 2.68Å; D138-V140 VanDerWaalsContact OD1-CB 3.29Å; D138-V140 WeakPolarHBondContact OD1-CB 3.4Å; D138-V140 WeakPolarHBondContact OD1-CG2 3.48Å; D138-V140 PolarHBondContact OD1-N 3.2Å; D138-V141 HydrophobicContact CB-CB 4.31Å; D138-V141 HydrophobicContact CB-CG2 3.99Å; D138-V141 PolarHBondContact O-N 3.07Å; D138-E142 PolarHBondContact O-N 3.26Å; D138-E142 VanDerWaalsContact O-N 3.14Å
139	P	77.9	Confident	68.3	Low	87 Å²	87	83.5 Å²	83.5	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-65.2	-22.3	179.1	27.2	-34.6	0	0	0	113.7	T143	P139-T143 WeakPolarHBondContact O-CB 3.43Å; P139-T143 PolarHBondContact O-N 3.23Å; P139-T143 PolarHBondContact O-OG1 3.07Å
140	V	81	Confident	68.2	Low	104 Å²	104	86.9 Å²	86.9	63%	0.63	44%	0.436	S	S	*	.	H	α-helix	trans	-70.9	-46.1	177.2	-177.6	0	0	0	0	110.2	D138 E142 T143 K144	D138-V140 PolarHBondContact O-N 2.68Å; D138-V140 VanDerWaalsContact OD1-CB 3.29Å; D138-V140 WeakPolarHBondContact OD1-CB 3.4Å; D138-V140 WeakPolarHBondContact OD1-CG2 3.48Å; D138-V140 PolarHBondContact OD1-N 3.2Å; V140-E142 VanDerWaalsContact C-N 3.34Å; V140-T143 PolarHBondContact O-N 3.42Å; V140-K144 WeakPolarHBondContact O-CB 3.49Å; V140-K144 PolarHBondContact O-N 2.81Å
141	V	76.4	Confident	67.8	Low	20 Å²	20	86.2 Å²	86.2	12%	0.121	44%	0.442	C	S	.	.	H	α-helix	trans	-62.9	-43.3	176	-179.9	0	0	0	0	110	V102 D105 A109 F136 D138 T143 K144 Y145	V102-V141 HydrophobicContact CG1-CG2 4.31Å; D105-V141 HydrophobicContact CB-CB 4.27Å; D105-V141 HydrophobicContact CB-CG1 4.09Å; D105-V141 HydrophobicContact CB-CG2 4.34Å; A109-V141 HydrophobicContact CB-CG1 4.16Å; F136-V141 HydrophobicContact CD1-CG1 4.36Å; D138-V141 HydrophobicContact CB-CB 4.31Å; D138-V141 HydrophobicContact CB-CG2 3.99Å; D138-V141 PolarHBondContact O-N 3.07Å; V141-T143 PolarHBondContact O-N 2.73Å; V141-K144 PolarHBondContact O-N 2.86Å; V141-Y145 WeakPolarHBondContact O-CB 3.39Å; V141-Y145 PolarHBondContact O-N 2.71Å
142	E	77.7	Confident	66.9	Low	29 Å²	29	91 Å²	91	14%	0.136	46%	0.458	C	S	.	.	H	α-helix	trans	-59.8	-46.1	175.6	-174	164.5	-160.3	0	0	112.5	F136 D138 V140 K144 Y145 R146	F136-E142 HydrophobicContact CB-CB 4.14Å; F136-E142 HydrophobicContact CD2-CB 3.96Å; F136-E142 HydrophobicContact CD2-CG 4.14Å; F136-E142 HydrophobicContact CG-CB 4.48Å; D138-E142 PolarHBondContact O-N 3.26Å; D138-E142 VanDerWaalsContact O-N 3.14Å; V140-E142 VanDerWaalsContact C-N 3.34Å; E142-K144 PolarHBondContact O-N 2.82Å; E142-Y145 PolarHBondContact O-N 3.4Å; E142-R146 HydrophobicContact CG-CG 4.42Å; E142-R146 WeakPolarHBondContact O-CB 3.48Å; E142-R146 VanDerWaalsContact O-CG 3.3Å; E142-R146 WeakPolarHBondContact O-CG 3.29Å; E142-R146 PolarHBondContact O-N 2.67Å; E142-R146 IonicContact OE1-CZ 3.58Å; E142-R146 IonicContact OE1-NE 3.57Å; E142-R146 PolarHBondContact OE1-NE 3.11Å; E142-R146 VanDerWaalsContact OE1-NE 3.14Å; E142-R146 IonicContact OE1-NH2 2.71Å; E142-R146 PolarHBondContact OE1-NH2 2.89Å
143	T	75.1	Confident	66.4	Low	59 Å²	59	87.4 Å²	87.4	36%	0.362	45%	0.453	S	S	.	.	H	α-helix	trans	-64.8	-41.5	179.9	-58.4	0	0	0	0	111.2	P139 V140 V141 R146 R147	P139-T143 WeakPolarHBondContact O-CB 3.43Å; P139-T143 PolarHBondContact O-N 3.23Å; P139-T143 PolarHBondContact O-OG1 3.07Å; V140-T143 PolarHBondContact O-N 3.42Å; V141-T143 PolarHBondContact O-N 2.73Å; T143-R146 PolarHBondContact O-N 3.35Å; T143-R147 WeakPolarHBondContact O-CB 3.38Å; T143-R147 WeakPolarHBondContact O-CG 3.34Å; T143-R147 PolarHBondContact O-N 3.31Å
144	K	74.8	Confident	65.4	Low	159 Å²	159	89.2 Å²	89.2	69%	0.691	47%	0.467	S	S	*	.	H	α-helix	trans	-64.3	-44.1	176.3	-169.2	177.3	-176.7	-179.4	0	111.4	V140 V141 E142 H148	V140-K144 WeakPolarHBondContact O-CB 3.49Å; V140-K144 PolarHBondContact O-N 2.81Å; V141-K144 PolarHBondContact O-N 2.86Å; E142-K144 PolarHBondContact O-N 2.82Å; K144-H148 PolarHBondContact O-N 3.02Å
145	Y	68.3	Low	64.4	Low	17 Å²	17	89.2 Å²	89.2	7%	0.067	48%	0.484	C	S	.	.	H	α-helix	trans	-59.4	-50.1	174.6	-177.5	-81.2	0	0	0	110.9	A109 I112 R113 L129 F136 V141 E142 R147 H148 F149	A109-Y145 HydrophobicContact CB-CD2 4.21Å; I112-Y145 HydrophobicContact CB-CE2 4.47Å; I112-Y145 HydrophobicContact CG2-CE2 4.01Å; I112-Y145 VanDerWaalsContact CG2-OH 3.31Å; I112-Y145 WeakPolarHBondContact CG2-OH 3.39Å; R113-Y145 HydrophobicContact CG-CE2 4.25Å; L129-Y145 HydrophobicContact CD1-CD1 3.71Å; L129-Y145 HydrophobicContact CD1-CE1 2.94Å; L129-Y145 HydrophobicContact CD1-CE2 3.92Å; L129-Y145 HydrophobicContact CD1-CG 4.49Å; L129-Y145 WeakPolarHBondContact CD1-OH 3.45Å; L129-Y145 HydrophobicContact CG-CE1 4.37Å; F136-Y145 HydrophobicContact CE2-CD1 4.28Å; F136-Y145 HydrophobicContact CE2-CD2 4.3Å; F136-Y145 AromaticContact CE2-CG 3.98Å; F136-Y145 HydrophobicContact CE2-CG 3.98Å; F136-Y145 HydrophobicContact CZ-CD2 4.14Å; F136-Y145 HydrophobicContact CZ-CG 4.29Å; V141-Y145 WeakPolarHBondContact O-CB 3.39Å; V141-Y145 PolarHBondContact O-N 2.71Å; E142-Y145 PolarHBondContact O-N 3.4Å; Y145-R147 PolarHBondContact O-N 3.32Å; Y145-H148 WeakPolarHBondContact O-CB 3.42Å; Y145-H148 PolarHBondContact O-N 2.76Å; Y145-F149 HydrophobicContact CD1-CD2 4.11Å; Y145-F149 AromaticContact CD1-CE2 3.86Å; Y145-F149 HydrophobicContact CD1-CE2 3.86Å; Y145-F149 HydrophobicContact CD2-CE2 4.31Å; Y145-F149 AromaticContact CE1-CD2 3.67Å; Y145-F149 HydrophobicContact CE1-CD2 3.67Å; Y145-F149 AromaticContact CE1-CE2 3.2Å; Y145-F149 HydrophobicContact CE1-CE2 3.2Å; Y145-F149 HydrophobicContact CE1-CZ 4.04Å; Y145-F149 AromaticContact CE2-CE2 3.79Å; Y145-F149 HydrophobicContact CE2-CE2 3.79Å; Y145-F149 HydrophobicContact CE2-CZ 4.29Å; Y145-F149 HydrophobicContact CG-CE2 4.33Å; Y145-F149 AromaticContact CZ-CE2 3.18Å; Y145-F149 AromaticContact CZ-CZ 3.65Å; Y145-F149 WeakPolarHBondContact O-CD2 3.38Å; Y145-F149 WeakPolarHBondContact OH-CE2 3.35Å; Y145-F149 VanDerWaalsContact OH-CZ 3.3Å; Y145-F149 WeakPolarHBondContact OH-CZ 3.41Å
146	R	69.4	Low	63	Low	119 Å²	119	88.5 Å²	88.5	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-41.1	-178.3	-71.7	177.1	-179.6	-145.1	2.8	112.9	E142 T143 H148 F149 C150	E142-R146 HydrophobicContact CG-CG 4.42Å; E142-R146 WeakPolarHBondContact O-CB 3.48Å; E142-R146 VanDerWaalsContact O-CG 3.3Å; E142-R146 WeakPolarHBondContact O-CG 3.29Å; E142-R146 PolarHBondContact O-N 2.67Å; E142-R146 IonicContact OE1-CZ 3.58Å; E142-R146 IonicContact OE1-NE 3.57Å; E142-R146 PolarHBondContact OE1-NE 3.11Å; E142-R146 VanDerWaalsContact OE1-NE 3.14Å; E142-R146 IonicContact OE1-NH2 2.71Å; E142-R146 PolarHBondContact OE1-NH2 2.89Å; T143-R146 PolarHBondContact O-N 3.35Å; R146-H148 PolarHBondContact O-N 3.07Å; R146-F149 PolarHBondContact O-N 3.42Å; R146-F149 VanDerWaalsContact O-N 3.08Å; R146-C150 PolarHBondContact O-N 3.21Å
147	R	68.4	Low	61.3	Low	177 Å²	177	93.9 Å²	93.9	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-58.1	-35.3	176.7	-78.9	179	-175.7	145.7	2.3	112.9	T143 Y145 F149 C150 A151	T143-R147 WeakPolarHBondContact O-CB 3.38Å; T143-R147 WeakPolarHBondContact O-CG 3.34Å; T143-R147 PolarHBondContact O-N 3.31Å; Y145-R147 PolarHBondContact O-N 3.32Å; R147-F149 PolarHBondContact O-N 3.4Å; R147-C150 PolarHBondContact O-N 3.03Å; R147-A151 PolarHBondContact O-N 3.23Å
148	H	64	Low	59.2	Low	85 Å²	85	100.7 Å²	100.7	39%	0.394	55%	0.548	S	S	.	.	H	α-helix	trans	-61.5	-27.6	177.6	-176.7	-87.8	0	0	0	113.3	R113 K144 Y145 R146	R113-H148 PolarHBondContact NH2-CD2 3.44Å; R113-H148 PolarHBondContact NH2-NE2 2.8Å; K144-H148 PolarHBondContact O-N 3.02Å; Y145-H148 WeakPolarHBondContact O-CB 3.42Å; Y145-H148 PolarHBondContact O-N 2.76Å; R146-H148 PolarHBondContact O-N 3.07Å
149	F	60.7	Low	57.2	Low	46 Å²	46	111 Å²	111	20%	0.202	59%	0.585	C	S	.	*	H	α-helix	trans	-93.4	-18.5	178.3	-65.5	-86.9	0	0	0	113.6	R126 A128 Y145 R146 R147	R126-F149 VanDerWaalsContact O-CE1 3.32Å; R126-F149 WeakPolarHBondContact O-CE1 3.45Å; A128-F149 HydrophobicContact CB-CB 4.11Å; A128-F149 HydrophobicContact CB-CD1 4.37Å; A128-F149 HydrophobicContact CB-CD2 4.33Å; A128-F149 HydrophobicContact CB-CG 4Å; Y145-F149 HydrophobicContact CD1-CD2 4.11Å; Y145-F149 AromaticContact CD1-CE2 3.86Å; Y145-F149 HydrophobicContact CD1-CE2 3.86Å; Y145-F149 HydrophobicContact CD2-CE2 4.31Å; Y145-F149 AromaticContact CE1-CD2 3.67Å; Y145-F149 HydrophobicContact CE1-CD2 3.67Å; Y145-F149 AromaticContact CE1-CE2 3.2Å; Y145-F149 HydrophobicContact CE1-CE2 3.2Å; Y145-F149 HydrophobicContact CE1-CZ 4.04Å; Y145-F149 AromaticContact CE2-CE2 3.79Å; Y145-F149 HydrophobicContact CE2-CE2 3.79Å; Y145-F149 HydrophobicContact CE2-CZ 4.29Å; Y145-F149 HydrophobicContact CG-CE2 4.33Å; Y145-F149 AromaticContact CZ-CE2 3.18Å; Y145-F149 AromaticContact CZ-CZ 3.65Å; Y145-F149 WeakPolarHBondContact O-CD2 3.38Å; Y145-F149 WeakPolarHBondContact OH-CE2 3.35Å; Y145-F149 VanDerWaalsContact OH-CZ 3.3Å; Y145-F149 WeakPolarHBondContact OH-CZ 3.41Å; R146-F149 PolarHBondContact O-N 3.42Å; R146-F149 VanDerWaalsContact O-N 3.08Å; R147-F149 PolarHBondContact O-N 3.4Å
150	C	56.3	Low	55.1	Low	112 Å²	112	114.2 Å²	114.2	76%	0.757	60%	0.597	S	S	*	*	H	α-helix	trans	-92.9	-15.9	-178.4	-66.1	0	0	0	0	114.8	R146 R147 E152	R146-C150 PolarHBondContact O-N 3.21Å; R147-C150 PolarHBondContact O-N 3.03Å; C150-E152 PolarHBondContact O-N 3.1Å
151	A	50	Low	52.9	Low	66 Å²	66	112.5 Å²	112.5	55%	0.545	60%	0.6	S	S	.	*			trans	-87.5	94.9	179.2	0	0	0	0	0	111.5	R147	R147-A151 PolarHBondContact O-N 3.23Å
152	E	42.3	Very low	50.9	Low	173 Å²	173	119.8 Å²	119.8	81%	0.808	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-90.7	124.7	160.5	-96.8	-178.1	170.4	0	0	109.8	C150	C150-E152 PolarHBondContact O-N 3.1Å
153	P	43.4	Very low	49.1	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-82	137.8	156.7	30.7	-26.7	0	0	0	109.6	G155	P153-G155 PolarHBondContact O-N 2.96Å
154	P	35.5	Very low	47.4	Very low	138 Å²	138	125.3 Å²	125.3	90%	0.896	67%	0.669	S	S	*	*	S	Bend	trans	-77.5	123.1	-177	30.5	-30.9	0	0	0	111.1
155	G	37.2	Very low	45.5	Very low	71 Å²	71	122.2 Å²	122.2	73%	0.732	66%	0.664	S	S	*	*			trans	110.2	90.6	151	0	0	0	0	0	118	P153	P153-G155 PolarHBondContact O-N 2.96Å
156	V	39.2	Very low	43.9	Very low	142 Å²	142	127.5 Å²	127.5	86%	0.861	69%	0.693	S	S	*	*			trans	-156	127.9	141	-173.8	0	0	0	0	109.3
157	P	36.9	Very low	42.5	Very low	126 Å²	126	125 Å²	125	82%	0.818	69%	0.691	S	S	*	*			trans	-85.5	153.8	-178.4	32.7	-32	0	0	0	114.6
158	R	31.5	Very low	40.9	Very low	241 Å²	241	125.5 Å²	125.5	91%	0.909	69%	0.693	S	S	*	*			trans	-70.7	147.8	178.4	-80.7	177.8	165	160.5	-4.2	113.7
159	R	34.4	Very low	39.4	Very low	248 Å²	248	128.1 Å²	128.1	94%	0.936	71%	0.709	S	S	*	*			trans	-127.2	119.6	160.5	-156.8	172.5	179.3	171.7	-1.2	111.4
160	N	34.7	Very low	38.5	Very low	153 Å²	153	131.3 Å²	131.3	82%	0.818	73%	0.733	S	S	*	*			trans	-67.5	161.1	174.2	-60.5	-26.1	0	0	0	110.3
161	G	34.3	Very low	37.5	Very low	68 Å²	68	134.4 Å²	134.4	70%	0.701	73%	0.728	S	S	*	*			cis	131.4	67.5	25.1	0	0	0	0	0	109.5
162	F	34.1	Very low	36.8	Very low	173 Å²	173	137.1 Å²	137.1	76%	0.759	73%	0.73	S	S	*	*	S	Bend	trans	-138.4	-29.8	-179.3	-165.1	-108.6	0	0	0	114.7	S164	F162-S164 PolarHBondContact O-N 2.92Å
163	V	39.8	Very low	36.5	Very low	121 Å²	121	137.9 Å²	137.9	73%	0.733	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-20.4	-172.4	-177.9	0	0	0	0	113.8	T165 T167	V163-T165 VanDerWaalsContact C-N 3.35Å; V163-T165 PolarHBondContact O-N 3.49Å; V163-T167 PolarHBondContact O-OG1 3.14Å
164	S	39.9	Very low	36.3	Very low	83 Å²	83	141.5 Å²	141.5	58%	0.58	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-9.5	-173.9	56.6	0	0	0	0	115.5	F162	F162-S164 PolarHBondContact O-N 2.92Å
165	T	35.5	Very low	36.1	Very low	95 Å²	95	140.7 Å²	140.7	58%	0.583	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-36.4	-178.4	-51.8	0	0	0	0	112	V163 R168	V163-T165 VanDerWaalsContact C-N 3.35Å; V163-T165 PolarHBondContact O-N 3.49Å; T165-R168 WeakPolarHBondContact O-CB 3.49Å; T165-R168 PolarHBondContact O-N 3.42Å
166	L	34.9	Very low	35.9	Very low	128 Å²	128	140.8 Å²	140.8	67%	0.67	72%	0.724	S	S	*	*	H	α-helix	trans	-72.6	-35.9	-175.5	-121.6	132.8	0	0	0	112.3	R168 L169	L166-R168 PolarHBondContact O-N 3.14Å; L166-L169 PolarHBondContact O-N 3.26Å
167	T	39.6	Very low	35.8	Very low	67 Å²	67	145 Å²	145	41%	0.411	72%	0.724	S	S	.	*	H	α-helix	trans	-69.9	-13.3	175.4	-19.2	0	0	0	0	113.4	V163	V163-T167 PolarHBondContact O-OG1 3.14Å
168	R	33.9	Very low	35.9	Very low	187 Å²	187	144 Å²	144	71%	0.706	71%	0.712	S	S	*	*	H	α-helix	trans	-87.3	-22	-178.2	-146.8	-175.4	-97	-164.6	-4.9	112.5	T165 L166 H172	T165-R168 WeakPolarHBondContact O-CB 3.49Å; T165-R168 PolarHBondContact O-N 3.42Å; L166-R168 PolarHBondContact O-N 3.14Å; R168-H172 PolarHBondContact O-CD2 3.27Å
169	L	34.3	Very low	36.2	Very low	139 Å²	139	139.4 Å²	139.4	73%	0.728	70%	0.701	S	S	*	*	H	α-helix	trans	-84.5	-34.6	-178.1	-74.9	164.8	0	0	0	112.8	L166	L166-L169 PolarHBondContact O-N 3.26Å
170	T	41.3	Very low	36.5	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	69%	0.689	S	S	*	*	H	α-helix	trans	-78.7	-23.5	179.1	52.7	0	0	0	0	113.3	H172	T170-H172 VanDerWaalsContact C-N 3.34Å; T170-H172 PolarHBondContact O-N 2.92Å
171	R	36.1	Very low	36.8	Very low	177 Å²	177	136.2 Å²	136.2	67%	0.668	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	3.7	-175.4	-140.8	-177.3	-83.7	176.6	-9.8	114.7
172	H	34.8	Very low	37.5	Very low	123 Å²	123	135.6 Å²	135.6	57%	0.569	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-11.1	-175.3	-111.3	-71.7	0	0	0	114.6	R168 T170	R168-H172 PolarHBondContact O-CD2 3.27Å; T170-H172 VanDerWaalsContact C-N 3.34Å; T170-H172 PolarHBondContact O-N 2.92Å
173	Q	35.7	Very low	38.1	Very low	188 Å²	188	132.9 Å²	132.9	88%	0.879	66%	0.66	S	S	*	*	S	Bend	trans	-91.8	-13.7	-170.3	-128.4	-174.8	-33.3	0	0	115.9
174	E	38	Very low	38.8	Very low	189 Å²	189	129.5 Å²	129.5	88%	0.883	65%	0.645	S	S	*	*	S	Bend	trans	-110.6	6	-179	-74.3	-177.3	145.1	0	0	114.8	G176	E174-G176 PolarHBondContact O-N 3.07Å
175	K	33.1	Very low	39.8	Very low	121 Å²	121	128.3 Å²	128.3	53%	0.526	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	13.2	-170.5	-106.5	178	-178.2	174.4	0	116.9
176	G	32	Very low	41.1	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-17.2	-164.5	0	0	0	0	0	117.9	E174	E174-G176 PolarHBondContact O-N 3.07Å
177	R	36.8	Very low	42.8	Very low	231 Å²	231	127.4 Å²	127.4	87%	0.872	62%	0.621	S	S	*	*	S	Bend	trans	-129.7	-18.3	-168.2	-70.9	-173.6	-158.2	159.7	8.3	117.7
178	D	40.2	Very low	44.5	Very low	105 Å²	105	126 Å²	126	56%	0.561	61%	0.614	S	S	*	*			trans	-118.2	26.6	-166.9	-71.6	4.1	0	0	0	114.2	W180 K437	D178-W180 PolarHBondContact O-N 3.44Å; D178-W180 VanDerWaalsContact O-N 3.16Å; D178-K437 IonicContact OD2-NZ 3.14Å; D178-K437 PolarHBondContact OD2-NZ 2.99Å
179	Q	36.3	Very low	46.6	Very low	143 Å²	143	117.9 Å²	117.9	67%	0.668	59%	0.585	S	S	*	*			trans	-87.4	90.3	-179.8	-158.3	155.1	7.9	0	0	110.4	Q181	Q179-Q181 PolarHBondContact O-N 2.96Å
180	W	42.3	Very low	48.7	Very low	183 Å²	183	115 Å²	115	69%	0.693	57%	0.57	S	S	*	*			trans	-55.3	105.3	169.5	-67.8	87.8	0	0	0	109.7	D178	D178-W180 PolarHBondContact O-N 3.44Å; D178-W180 VanDerWaalsContact O-N 3.16Å
181	Q	40.8	Very low	50.7	Low	152 Å²	152	114.9 Å²	114.9	71%	0.71	56%	0.56	S	S	*	*			trans	-108.5	133.6	169.8	-68	-167.1	-47.2	0	0	108.1	Q179 D183	Q179-Q181 PolarHBondContact O-N 2.96Å; Q181-D183 PolarHBondContact O-N 3.03Å
182	V	47.2	Very low	53	Low	54 Å²	54	107.3 Å²	107.3	33%	0.327	53%	0.532	S	S	.	.			trans	-63.5	105	167.5	-179.1	0	0	0	0	106.4	A184 D426 C430	V182-A184 PolarHBondContact O-N 3.1Å; V182-D426 HydrophobicContact CG1-CB 4.33Å; V182-C430 HydrophobicContact CG2-CB 4.11Å; V182-C430 WeakPolarHBondContact CG2-SG 3.31Å
183	D	48.6	Very low	55.4	Low	117 Å²	117	102 Å²	102	63%	0.626	51%	0.509	S	S	*	.			trans	-60.8	125	174.6	-101.5	-48.9	0	0	0	108.6	Q181 K186	Q181-D183 PolarHBondContact O-N 3.03Å; D183-K186 IonicContact OD1-NZ 3.22Å; D183-K186 PolarHBondContact OD1-NZ 3.34Å
184	A	54.3	Low	57.8	Low	50 Å²	50	98.1 Å²	98.1	41%	0.413	49%	0.493	S	S	.	.			trans	-54.2	146.4	171.6	0	0	0	0	0	108.9	V182 K186	V182-A184 PolarHBondContact O-N 3.1Å; A184-K186 WeakPolarHBondContact O-CG 3.28Å; A184-K186 PolarHBondContact O-N 3.42Å
185	P	59.2	Low	60.2	Low	57 Å²	57	93 Å²	93	37%	0.37	47%	0.471	S	S	.	.			trans	-72.5	68.7	-178.9	28.9	-33.6	0	0	0	110.7	M187 S188 F419	P185-M187 PolarHBondContact O-N 3.22Å; P185-S188 PolarHBondContact O-N 2.94Å; P185-F419 HydrophobicContact CG-CE2 3.88Å; P185-F419 HydrophobicContact CG-CZ 3.71Å
186	K	63.8	Low	62.7	Low	85 Å²	85	87.6 Å²	87.6	37%	0.37	45%	0.448	S	S	.	.	H	α-helix	trans	-58.3	-40	-177.2	-69.6	161.3	-174.3	158	0	110	D183 A184 L246	D183-K186 IonicContact OD1-NZ 3.22Å; D183-K186 PolarHBondContact OD1-NZ 3.34Å; A184-K186 WeakPolarHBondContact O-CG 3.28Å; A184-K186 PolarHBondContact O-N 3.42Å; K186-L246 HydrophobicContact CB-CD1 4.01Å; K186-L246 HydrophobicContact CG-CD1 4.31Å; K186-L246 WeakPolarHBondContact O-CD1 3.39Å
187	M	69.9	Low	65.3	Low	120 Å²	120	84.7 Å²	84.7	59%	0.591	42%	0.415	S	S	*	.	H	α-helix	trans	-71	-38.6	-177.5	-61.5	-53.5	-67.4	0	0	113	P185 V189 L190 F191	P185-M187 PolarHBondContact O-N 3.22Å; M187-V189 VanDerWaalsContact C-N 3.34Å; M187-V189 PolarHBondContact O-N 2.86Å; M187-L190 WeakPolarHBondContact O-CB 3.16Å; M187-L190 PolarHBondContact O-N 3.03Å; M187-F191 HydrophobicContact CB-CE2 4.36Å; M187-F191 HydrophobicContact CE-CE2 4.45Å; M187-F191 WeakPolarHBondContact O-CD2 3.35Å; M187-F191 PolarHBondContact O-N 2.8Å; M187-F191 VanDerWaalsContact O-N 3.14Å
188	S	75.8	Confident	67.8	Low	38 Å²	38	79 Å²	79	27%	0.266	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-35.7	-178.7	165.8	0	0	0	0	112.2	P185 L190 F191 D192 Q314	P185-S188 PolarHBondContact O-N 2.94Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 2.91Å; S188-F191 PolarHBondContact O-N 2.86Å; S188-D192 VanDerWaalsContact O-CG 3.3Å; S188-D192 PolarHBondContact O-N 3.26Å; S188-Q314 PolarHBondContact OG-NE2 2.68Å
189	V	77.6	Confident	70.1	Confident	16 Å²	16	76 Å²	76	10%	0.097	39%	0.385	C	S	.	.	H	α-helix	trans	-62.9	-39.7	174.6	179.8	0	0	0	0	111.5	M187 D192 V193 L246	M187-V189 VanDerWaalsContact C-N 3.34Å; M187-V189 PolarHBondContact O-N 2.86Å; V189-D192 PolarHBondContact O-N 2.96Å; V189-V193 WeakPolarHBondContact O-CG2 3.41Å; V189-V193 PolarHBondContact O-N 3.21Å; V189-V193 VanDerWaalsContact O-N 3.09Å; V189-L246 HydrophobicContact CB-CD1 4.46Å
190	L	77.9	Confident	72.5	Confident	78 Å²	78	69.2 Å²	69.2	41%	0.408	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-42.9	179.5	-168.1	95.9	0	0	0	111.3	M187 S188 V193 L194	M187-L190 WeakPolarHBondContact O-CB 3.16Å; M187-L190 PolarHBondContact O-N 3.03Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 2.91Å; L190-V193 PolarHBondContact O-N 2.82Å; L190-L194 WeakPolarHBondContact O-CB 3.23Å; L190-L194 PolarHBondContact O-N 2.84Å
191	F	84.1	Confident	74.7	Confident	112 Å²	112	64.7 Å²	64.7	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-44.3	177	-74.4	-65.1	0	0	0	112.2	M187 S188 V193 L194 I195	M187-F191 HydrophobicContact CB-CE2 4.36Å; M187-F191 HydrophobicContact CE-CE2 4.45Å; M187-F191 WeakPolarHBondContact O-CD2 3.35Å; M187-F191 PolarHBondContact O-N 2.8Å; M187-F191 VanDerWaalsContact O-N 3.14Å; S188-F191 PolarHBondContact O-N 2.86Å; F191-V193 VanDerWaalsContact C-N 3.31Å; F191-V193 PolarHBondContact O-N 3.4Å; F191-L194 PolarHBondContact O-N 3.34Å; F191-I195 VanDerWaalsContact O-CG1 3.29Å; F191-I195 WeakPolarHBondContact O-CG1 3.49Å; F191-I195 PolarHBondContact O-N 2.92Å
192	D	85.2	Confident	77	Confident	17 Å²	17	60.4 Å²	60.4	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-44.5	177.3	-67.8	-11.9	0	0	0	111.2	S188 V189 I195 S196 N311 F312	S188-D192 VanDerWaalsContact O-CG 3.3Å; S188-D192 PolarHBondContact O-N 3.26Å; V189-D192 PolarHBondContact O-N 2.96Å; D192-I195 PolarHBondContact O-N 3.08Å; D192-S196 PolarHBondContact O-N 2.85Å; D192-S196 PolarHBondContact O-OG 2.91Å; D192-N311 WeakPolarHBondContact CA-OD1 3.5Å; D192-N311 WeakPolarHBondContact CB-OD1 3.08Å; D192-N311 PolarHBondContact O-ND2 3.37Å; D192-N311 PolarHBondContact OD1-OD1 3.38Å; D192-F312 HydrophobicContact CB-CD1 3.66Å; D192-F312 HydrophobicContact CB-CE1 3.76Å; D192-F312 HydrophobicContact CB-CG 4.18Å; D192-F312 HydrophobicContact CB-CZ 4.35Å; D192-F312 WeakPolarHBondContact OD2-CA 3.46Å
193	V	83.8	Confident	78.9	Confident	13 Å²	13	57.9 Å²	57.9	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-49.7	174.4	162.6	0	0	0	0	111.3	V189 L190 F191 I195 S196 I197 F232 L263 F312	V189-V193 WeakPolarHBondContact O-CG2 3.41Å; V189-V193 PolarHBondContact O-N 3.21Å; V189-V193 VanDerWaalsContact O-N 3.09Å; L190-V193 PolarHBondContact O-N 2.82Å; F191-V193 VanDerWaalsContact C-N 3.31Å; F191-V193 PolarHBondContact O-N 3.4Å; V193-I195 VanDerWaalsContact C-N 3.31Å; V193-I195 PolarHBondContact O-N 2.56Å; V193-S196 PolarHBondContact O-N 3.29Å; V193-S196 VanDerWaalsContact O-N 3.17Å; V193-S196 PolarHBondContact O-OG 2.8Å; V193-I197 HydrophobicContact CG1-CD1 3.79Å; V193-I197 WeakPolarHBondContact O-CG1 3.3Å; V193-I197 PolarHBondContact O-N 3.48Å; V193-F232 HydrophobicContact CB-CE1 4.46Å; V193-F232 HydrophobicContact CG1-CD1 4.28Å; V193-F232 HydrophobicContact CG1-CE1 3.57Å; V193-F232 HydrophobicContact CG2-CE1 4Å; V193-F232 HydrophobicContact CG2-CZ 4.29Å; V193-L263 HydrophobicContact CG2-CD2 4.48Å; V193-F312 HydrophobicContact CG2-CE1 4.13Å; V193-F312 HydrophobicContact CG2-CZ 4.46Å
194	L	86.1	Confident	80.7	Confident	106 Å²	106	53.5 Å²	53.5	56%	0.555	29%	0.287	S	S	*	.	H	α-helix	trans	-59	-44.5	-178.1	-177.8	69	0	0	0	111.4	L190 F191 S196 I197 L198	L190-L194 WeakPolarHBondContact O-CB 3.23Å; L190-L194 PolarHBondContact O-N 2.84Å; F191-L194 PolarHBondContact O-N 3.34Å; L194-S196 VanDerWaalsContact C-N 3.34Å; L194-S196 PolarHBondContact O-N 2.91Å; L194-I197 PolarHBondContact O-N 3.34Å; L194-L198 PolarHBondContact O-N 3.3Å
195	I	88.4	Confident	82.2	Confident	81 Å²	81	53.6 Å²	53.6	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-41.9	177.9	-66.7	165.7	0	0	0	110.7	F191 D192 V193 I197 L198 M199	F191-I195 VanDerWaalsContact O-CG1 3.29Å; F191-I195 WeakPolarHBondContact O-CG1 3.49Å; F191-I195 PolarHBondContact O-N 2.92Å; D192-I195 PolarHBondContact O-N 3.08Å; V193-I195 VanDerWaalsContact C-N 3.31Å; V193-I195 PolarHBondContact O-N 2.56Å; I195-I197 PolarHBondContact O-N 3.16Å; I195-L198 PolarHBondContact O-N 3.17Å; I195-M199 WeakPolarHBondContact O-CG 3.48Å; I195-M199 PolarHBondContact O-N 3.13Å
196	S	87	Confident	83.5	Confident	7 Å²	7	54 Å²	54	5%	0.049	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-37.2	178.4	68.3	0	0	0	0	113.1	D192 V193 L194 M199 F200 L263	D192-S196 PolarHBondContact O-N 2.85Å; D192-S196 PolarHBondContact O-OG 2.91Å; V193-S196 PolarHBondContact O-N 3.29Å; V193-S196 VanDerWaalsContact O-N 3.17Å; V193-S196 PolarHBondContact O-OG 2.8Å; L194-S196 VanDerWaalsContact C-N 3.34Å; L194-S196 PolarHBondContact O-N 2.91Å; S196-M199 PolarHBondContact O-N 3.09Å; S196-F200 PolarHBondContact O-N 3.21Å; S196-L263 WeakPolarHBondContact OG-CD2 3.5Å; S196-L263 WeakPolarHBondContact OG-CG 3.21Å
197	I	86.6	Confident	84.3	Confident	13 Å²	13	50 Å²	50	7%	0.067	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-42.8	175.8	-67.3	169.4	0	0	0	110.4	V193 L194 I195 M199 F200 I201 V229 L233	V193-I197 HydrophobicContact CG1-CD1 3.79Å; V193-I197 WeakPolarHBondContact O-CG1 3.3Å; V193-I197 PolarHBondContact O-N 3.48Å; L194-I197 PolarHBondContact O-N 3.34Å; I195-I197 PolarHBondContact O-N 3.16Å; I197-M199 PolarHBondContact O-N 3.34Å; I197-F200 WeakPolarHBondContact O-CB 3.28Å; I197-F200 PolarHBondContact O-N 3.14Å; I197-I201 HydrophobicContact CG2-CD1 3.95Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.35Å; I197-V229 HydrophobicContact CB-CG1 4.39Å; I197-V229 HydrophobicContact CD1-CG1 3.92Å; I197-V229 HydrophobicContact CG1-CG1 3.82Å; I197-V229 HydrophobicContact CG2-CG1 3.73Å; I197-L233 HydrophobicContact CD1-CD1 4.1Å; I197-L233 HydrophobicContact CD1-CD2 3.65Å; I197-L233 HydrophobicContact CD1-CG 3.89Å
198	L	88.9	Confident	84.8	Confident	112 Å²	112	49 Å²	49	59%	0.586	26%	0.258	S	S	*	.	H	α-helix	trans	-58.8	-47.4	175.1	-172.6	84.5	0	0	0	111	L194 I195 F200 I201 V202	L194-L198 PolarHBondContact O-N 3.3Å; I195-L198 PolarHBondContact O-N 3.17Å; L198-F200 VanDerWaalsContact C-N 3.31Å; L198-F200 PolarHBondContact O-N 3.45Å; L198-I201 PolarHBondContact O-N 3.38Å; L198-V202 WeakPolarHBondContact O-CG2 3.43Å; L198-V202 PolarHBondContact O-N 3.43Å
199	M	87.6	Confident	85.1	Confident	41 Å²	41	55.4 Å²	55.4	20%	0.202	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-42.1	176.4	-76.5	-167.2	72.3	0	0	112.1	I195 S196 I197 V202 L203 M304	I195-M199 WeakPolarHBondContact O-CG 3.48Å; I195-M199 PolarHBondContact O-N 3.13Å; S196-M199 PolarHBondContact O-N 3.09Å; I197-M199 PolarHBondContact O-N 3.34Å; M199-V202 PolarHBondContact O-N 3.46Å; M199-L203 WeakPolarHBondContact O-CB 3.28Å; M199-L203 WeakPolarHBondContact O-CG 3.43Å; M199-L203 PolarHBondContact O-N 3.12Å; M199-M304 HydrophobicContact CE-CE 4.17Å; M199-M304 HydrophobicContact CE-CG 4.09Å; M199-M304 WeakPolarHBondContact CE-O 3.13Å
200	F	88.3	Confident	85	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-45.7	176	173.5	-98.1	0	0	0	112.2	S196 I197 L198 V202 L203 N204 C225 L226 V229 L266 P267 I270	S196-F200 PolarHBondContact O-N 3.21Å; I197-F200 WeakPolarHBondContact O-CB 3.28Å; I197-F200 PolarHBondContact O-N 3.14Å; L198-F200 VanDerWaalsContact C-N 3.31Å; L198-F200 PolarHBondContact O-N 3.45Å; F200-V202 PolarHBondContact O-N 3.26Å; F200-L203 PolarHBondContact O-N 3.17Å; F200-N204 WeakPolarHBondContact O-CB 3.18Å; F200-N204 PolarHBondContact O-N 2.91Å; F200-C225 HydrophobicContact CE1-CB 4.2Å; F200-C225 HydrophobicContact CE2-CB 3.62Å; F200-C225 HydrophobicContact CZ-CB 3.27Å; F200-L226 HydrophobicContact CE1-CD2 4.04Å; F200-L226 HydrophobicContact CE1-CG 4.37Å; F200-V229 HydrophobicContact CD1-CG2 4.43Å; F200-L266 HydrophobicContact CD1-CD2 4.41Å; F200-L266 HydrophobicContact CD2-CB 4.08Å; F200-L266 HydrophobicContact CD2-CD2 3.6Å; F200-L266 HydrophobicContact CD2-CG 3.77Å; F200-L266 HydrophobicContact CE2-CB 4.44Å; F200-L266 HydrophobicContact CE2-CD2 3.69Å; F200-L266 HydrophobicContact CE2-CG 3.71Å; F200-L266 HydrophobicContact CG-CD2 3.99Å; F200-L266 HydrophobicContact CZ-CD2 4.19Å; F200-P267 HydrophobicContact CB-CG 4.33Å; F200-P267 HydrophobicContact CD2-CG 4.15Å; F200-I270 HydrophobicContact CD2-CD1 4.26Å; F200-I270 HydrophobicContact CE2-CD1 3.75Å; F200-I270 HydrophobicContact CE2-CG1 4.42Å; F200-I270 HydrophobicContact CZ-CD1 4.38Å
201	I	87.6	Confident	84.7	Confident	88 Å²	88	53.8 Å²	53.8	45%	0.451	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-43.8	178.7	-66.9	165.9	0	0	0	111.2	I197 L198 N204 S205	I197-I201 HydrophobicContact CG2-CD1 3.95Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.35Å; L198-I201 PolarHBondContact O-N 3.38Å; I201-N204 PolarHBondContact O-N 3.22Å; I201-S205 WeakPolarHBondContact O-CB 3.41Å; I201-S205 PolarHBondContact O-N 3.19Å; I201-S205 PolarHBondContact O-OG 3.07Å
202	V	89.5	Confident	83.9	Confident	61 Å²	61	49.9 Å²	49.9	37%	0.37	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-49.5	179.5	172.4	0	0	0	0	110.9	L198 M199 F200 N204 S205 L206 M304	L198-V202 WeakPolarHBondContact O-CG2 3.43Å; L198-V202 PolarHBondContact O-N 3.43Å; M199-V202 PolarHBondContact O-N 3.46Å; F200-V202 PolarHBondContact O-N 3.26Å; V202-N204 VanDerWaalsContact C-N 3.32Å; V202-N204 PolarHBondContact O-N 3.43Å; V202-S205 PolarHBondContact O-N 2.91Å; V202-L206 HydrophobicContact CG1-CD1 4.05Å; V202-L206 WeakPolarHBondContact O-CG 3.32Å; V202-L206 PolarHBondContact O-N 2.9Å; V202-M304 HydrophobicContact CG1-CE 4.04Å
203	L	87.5	Confident	83.1	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-37.1	179.1	-76.2	171.2	0	0	0	112.5	M199 F200 A207 P267 M301 M304 V305	M199-L203 WeakPolarHBondContact O-CB 3.28Å; M199-L203 WeakPolarHBondContact O-CG 3.43Å; M199-L203 PolarHBondContact O-N 3.12Å; F200-L203 PolarHBondContact O-N 3.17Å; L203-A207 WeakPolarHBondContact O-CB 3.25Å; L203-A207 PolarHBondContact O-N 2.79Å; L203-P267 HydrophobicContact CB-CB 4.07Å; L203-P267 HydrophobicContact CD1-CB 3.38Å; L203-P267 HydrophobicContact CD1-CG 3.76Å; L203-P267 HydrophobicContact CG-CB 4.35Å; L203-M301 HydrophobicContact CD2-CE 4.18Å; L203-M301 HydrophobicContact CD2-SD 3.43Å; L203-M301 WeakPolarHBondContact CD2-SD 3.31Å; L203-M304 HydrophobicContact CD1-CE 4.49Å; L203-M304 HydrophobicContact CD1-CG 4.28Å; L203-M304 HydrophobicContact CD1-SD 4.44Å; L203-M304 HydrophobicContact CD2-CB 4.03Å; L203-M304 HydrophobicContact CD2-CE 4.15Å; L203-M304 HydrophobicContact CD2-CG 3.85Å; L203-M304 HydrophobicContact CD2-SD 3.34Å; L203-M304 WeakPolarHBondContact CD2-SD 3.47Å; L203-M304 HydrophobicContact CG-CE 3.98Å; L203-M304 HydrophobicContact CG-CG 4.33Å; L203-M304 HydrophobicContact CG-SD 3.86Å; L203-V305 HydrophobicContact CD1-CG2 3.86Å
204	N	85.2	Confident	82.2	Confident	24 Å²	24	57.7 Å²	57.7	13%	0.128	33%	0.325	C	S	.	.	H	α-helix	trans	-63.3	-45.4	174.3	-170	-81.7	0	0	0	112.1	F200 I201 V202 L206 A207 F208 V222 I270	F200-N204 WeakPolarHBondContact O-CB 3.18Å; F200-N204 PolarHBondContact O-N 2.91Å; I201-N204 PolarHBondContact O-N 3.22Å; V202-N204 VanDerWaalsContact C-N 3.32Å; V202-N204 PolarHBondContact O-N 3.43Å; N204-L206 PolarHBondContact O-N 3.02Å; N204-A207 PolarHBondContact O-N 3.43Å; N204-F208 WeakPolarHBondContact O-CB 3.28Å; N204-F208 PolarHBondContact O-N 2.84Å; N204-V222 WeakPolarHBondContact ND2-CG1 3.35Å; N204-V222 WeakPolarHBondContact ND2-CG2 3.32Å; N204-I270 HydrophobicContact CB-CD1 3.93Å
205	S	85.9	Confident	81.5	Confident	52 Å²	52	54.5 Å²	54.5	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-45.3	178.4	-56.1	0	0	0	0	110.8	I201 V202 A207 F208 F209	I201-S205 WeakPolarHBondContact O-CB 3.41Å; I201-S205 PolarHBondContact O-N 3.19Å; I201-S205 PolarHBondContact O-OG 3.07Å; V202-S205 PolarHBondContact O-N 2.91Å; S205-A207 PolarHBondContact O-N 2.82Å; S205-F208 PolarHBondContact O-N 2.93Å; S205-F209 WeakPolarHBondContact O-CD2 3.48Å; S205-F209 PolarHBondContact O-N 2.85Å; S205-F209 VanDerWaalsContact O-N 3.1Å
206	L	86.2	Confident	81	Confident	66 Å²	66	57.2 Å²	57.2	35%	0.346	32%	0.322	S	S	.	.	H	α-helix	trans	-60.5	-45.4	176	-70.2	171	0	0	0	111.6	V202 N204 F208 F209 G210 F297 M301	V202-L206 HydrophobicContact CG1-CD1 4.05Å; V202-L206 WeakPolarHBondContact O-CG 3.32Å; V202-L206 PolarHBondContact O-N 2.9Å; N204-L206 PolarHBondContact O-N 3.02Å; L206-F208 PolarHBondContact O-N 3.02Å; L206-F209 PolarHBondContact O-N 2.82Å; L206-G210 PolarHBondContact O-N 3.16Å; L206-F297 HydrophobicContact CB-CZ 4.26Å; L206-F297 WeakPolarHBondContact O-CZ 3.16Å; L206-M301 HydrophobicContact CB-CE 4.46Å; L206-M301 HydrophobicContact CB-SD 3.89Å; L206-M301 HydrophobicContact CD1-CE 3.69Å; L206-M301 HydrophobicContact CD1-SD 3.97Å
207	A	80.8	Confident	80.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-41.3	177	0	0	0	0	0	112.4	L203 N204 S205 F209 G210 F211 F218 I270 M271	L203-A207 WeakPolarHBondContact O-CB 3.25Å; L203-A207 PolarHBondContact O-N 2.79Å; N204-A207 PolarHBondContact O-N 3.43Å; S205-A207 PolarHBondContact O-N 2.82Å; A207-F209 PolarHBondContact O-N 2.9Å; A207-G210 PolarHBondContact O-N 3.35Å; A207-F211 HydrophobicContact CB-CD2 3.87Å; A207-F211 HydrophobicContact CB-CE2 3.94Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 3.27Å; A207-F218 HydrophobicContact CB-CE2 3.83Å; A207-F218 HydrophobicContact CB-CZ 4.3Å; A207-I270 HydrophobicContact CB-CG2 3.49Å; A207-I270 VanDerWaalsContact CB-CG2 3.49Å; A207-M271 HydrophobicContact CB-CE 3.71Å
208	F	81.8	Confident	80.3	Confident	99 Å²	99	58 Å²	58	43%	0.434	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-43.8	177.1	-178.1	-92.4	0	0	0	112	N204 S205 L206 G212 V213 F218	N204-F208 WeakPolarHBondContact O-CB 3.28Å; N204-F208 PolarHBondContact O-N 2.84Å; S205-F208 PolarHBondContact O-N 2.93Å; L206-F208 PolarHBondContact O-N 3.02Å; F208-G212 PolarHBondContact O-N 3.07Å; F208-V213 HydrophobicContact CD2-CG2 4.2Å; F208-V213 HydrophobicContact CE2-CG2 3.38Å; F208-V213 HydrophobicContact CZ-CG2 3.77Å; F208-F218 HydrophobicContact CB-CZ 4.34Å; F208-F218 HydrophobicContact CD2-CE1 4.35Å
209	F	81.7	Confident	80	Confident	174 Å²	174	55 Å²	55	76%	0.763	32%	0.319	S	S	*	.	H	α-helix	trans	-71.3	-30.6	176.3	-72.7	-64.2	0	0	0	113.3	S205 L206 A207	S205-F209 WeakPolarHBondContact O-CD2 3.48Å; S205-F209 PolarHBondContact O-N 2.85Å; S205-F209 VanDerWaalsContact O-N 3.1Å; L206-F209 PolarHBondContact O-N 2.82Å; A207-F209 PolarHBondContact O-N 2.9Å
210	G	74.9	Confident	79.8	Confident	38 Å²	38	56.8 Å²	56.8	39%	0.392	33%	0.332	S	S	.	.	H	α-helix	trans	-80.6	-44.8	-178.2	0	0	0	0	0	114.7	L206 A207	L206-G210 PolarHBondContact O-N 3.16Å; A207-G210 PolarHBondContact O-N 3.35Å
211	F	71.4	Confident	79.7	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.096	34%	0.343	C	S	.	.	H	α-helix	trans	-98	-23	-171.8	-58.1	-65.8	0	0	0	113.9	A207 M271 N274 Y294 F297 I298	A207-F211 HydrophobicContact CB-CD2 3.87Å; A207-F211 HydrophobicContact CB-CE2 3.94Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 3.27Å; F211-M271 HydrophobicContact CE2-CE 3.95Å; F211-M271 HydrophobicContact CE2-SD 4.21Å; F211-M271 HydrophobicContact CZ-SD 4.33Å; F211-N274 WeakPolarHBondContact CB-OD1 3.46Å; F211-N274 HydrophobicContact CD1-CB 3.91Å; F211-N274 HydrophobicContact CD2-CB 4.12Å; F211-N274 VanDerWaalsContact CD2-CG 3.44Å; F211-N274 VanDerWaalsContact CD2-ND2 3.27Å; F211-N274 WeakPolarHBondContact CD2-ND2 3.49Å; F211-N274 HydrophobicContact CE1-CB 3.98Å; F211-N274 HydrophobicContact CE2-CB 4.17Å; F211-N274 HydrophobicContact CG-CB 4.02Å; F211-N274 VanDerWaalsContact CG-CG 3.43Å; F211-N274 WeakPolarHBondContact CG-OD1 3.19Å; F211-N274 HydrophobicContact CZ-CB 4.12Å; F211-Y294 HydrophobicContact CD1-CD2 4.48Å; F211-Y294 AromaticContact CD1-CE2 3.36Å; F211-Y294 HydrophobicContact CD1-CE2 3.36Å; F211-Y294 AromaticContact CD1-CZ 3.51Å; F211-Y294 WeakPolarHBondContact CD1-OH 3.02Å; F211-Y294 HydrophobicContact CE1-CD2 4.33Å; F211-Y294 HydrophobicContact CE1-CE1 4.21Å; F211-Y294 AromaticContact CE1-CE2 3.43Å; F211-Y294 HydrophobicContact CE1-CE2 3.43Å; F211-Y294 VanDerWaalsContact CE1-CE2 3.43Å; F211-Y294 AromaticContact CE1-CZ 3.35Å; F211-Y294 WeakPolarHBondContact CE1-OH 3.41Å; F211-F297 HydrophobicContact CD2-CE1 4.48Å; F211-F297 HydrophobicContact CE1-CD1 4.32Å; F211-F297 HydrophobicContact CE1-CE1 4.48Å; F211-F297 HydrophobicContact CE2-CD1 4.36Å; F211-F297 AromaticContact CE2-CE1 3.8Å; F211-F297 HydrophobicContact CE2-CE1 3.8Å; F211-F297 AromaticContact CZ-CD1 3.87Å; F211-F297 HydrophobicContact CZ-CD1 3.87Å; F211-F297 AromaticContact CZ-CE1 3.79Å; F211-F297 HydrophobicContact CZ-CE1 3.79Å; F211-I298 HydrophobicContact CE1-CD1 4.16Å; F211-I298 HydrophobicContact CE1-CG1 3.93Å; F211-I298 HydrophobicContact CZ-CD1 4.44Å; F211-I298 HydrophobicContact CZ-CG1 3.8Å
212	G	67.2	Low	79.6	Confident	30 Å²	30	56 Å²	56	31%	0.309	33%	0.326	S	S	.	.			trans	68	175.8	-168.1	0	0	0	0	0	113.1	F208 S214	F208-G212 PolarHBondContact O-N 3.07Å; G212-S214 PolarHBondContact O-N 3.2Å
213	V	68.4	Low	79.4	Confident	88 Å²	88	58.3 Å²	58.3	53%	0.533	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	18.6	-170.6	-158.9	0	0	0	0	112.8	F208 N215 V219	F208-V213 HydrophobicContact CD2-CG2 4.2Å; F208-V213 HydrophobicContact CE2-CG2 3.38Å; F208-V213 HydrophobicContact CZ-CG2 3.77Å; V213-N215 PolarHBondContact O-N 3.04Å; V213-V219 HydrophobicContact CG1-CG2 3.64Å
214	S	64.5	Low	79.4	Confident	105 Å²	105	63.5 Å²	63.5	73%	0.734	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-26.9	-170.8	57.8	0	0	0	0	113.4	G212	G212-S214 PolarHBondContact O-N 3.2Å
215	N	72.5	Confident	79.5	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	36%	0.358	C	S	.	.			trans	-93.2	110.8	-176.8	-164.8	-37.6	0	0	0	111.6	V213 G217 F218 V219 T273 H276	V213-N215 PolarHBondContact O-N 3.04Å; N215-G217 PolarHBondContact O-N 2.89Å; N215-G217 WeakPolarHBondContact OD1-CA 3.38Å; N215-G217 PolarHBondContact OD1-N 3.22Å; N215-F218 HydrophobicContact CB-CB 4.08Å; N215-F218 WeakPolarHBondContact O-CB 3.21Å; N215-F218 PolarHBondContact O-N 3.36Å; N215-F218 VanDerWaalsContact O-N 3.1Å; N215-F218 PolarHBondContact OD1-N 3.43Å; N215-V219 PolarHBondContact O-N 3.23Å; N215-T273 PolarHBondContact ND2-O 2.7Å; N215-H276 PolarHBondContact ND2-O 2.67Å
216	I	78.3	Confident	79.4	Confident	138 Å²	138	63.6 Å²	63.6	71%	0.708	36%	0.359	S	S	*	.	H	α-helix	trans	-57	-37.6	176.5	-63.2	171.3	0	0	0	111	F218 V219 V220	I216-F218 VanDerWaalsContact C-N 3.32Å; I216-F218 PolarHBondContact O-N 3.01Å; I216-V219 PolarHBondContact O-N 3.27Å; I216-V220 HydrophobicContact CG2-CG2 4.26Å; I216-V220 WeakPolarHBondContact O-CG2 3.44Å; I216-V220 PolarHBondContact O-N 3.44Å
217	G	78.4	Confident	79.5	Confident	31 Å²	31	67.9 Å²	67.9	32%	0.32	38%	0.375	S	S	.	.	H	α-helix	trans	-61.9	-38.4	177.9	0	0	0	0	0	112.9	N215 Y221	N215-G217 PolarHBondContact O-N 2.89Å; N215-G217 WeakPolarHBondContact OD1-CA 3.38Å; N215-G217 PolarHBondContact OD1-N 3.22Å; G217-Y221 WeakPolarHBondContact O-CB 3.35Å; G217-Y221 PolarHBondContact O-N 3.44Å
218	F	80.2	Confident	79.7	Confident	5 Å²	5	71.1 Å²	71.1	2%	0.022	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-49.7	174.1	166.6	-97	0	0	0	110.9	A207 F208 N215 I216 V220 Y221 V222 I270 N274	A207-F218 HydrophobicContact CB-CE2 3.83Å; A207-F218 HydrophobicContact CB-CZ 4.3Å; F208-F218 HydrophobicContact CB-CZ 4.34Å; F208-F218 HydrophobicContact CD2-CE1 4.35Å; N215-F218 HydrophobicContact CB-CB 4.08Å; N215-F218 WeakPolarHBondContact O-CB 3.21Å; N215-F218 PolarHBondContact O-N 3.36Å; N215-F218 VanDerWaalsContact O-N 3.1Å; N215-F218 PolarHBondContact OD1-N 3.43Å; I216-F218 VanDerWaalsContact C-N 3.32Å; I216-F218 PolarHBondContact O-N 3.01Å; F218-V220 VanDerWaalsContact C-N 3.34Å; F218-V220 PolarHBondContact O-N 2.89Å; F218-Y221 PolarHBondContact O-N 2.9Å; F218-V222 HydrophobicContact CD2-CG2 4.13Å; F218-V222 HydrophobicContact CE1-CG2 4.25Å; F218-V222 HydrophobicContact CE2-CG2 3.91Å; F218-V222 HydrophobicContact CG-CG2 4.44Å; F218-V222 HydrophobicContact CZ-CG2 3.95Å; F218-V222 VanDerWaalsContact O-CG2 3.3Å; F218-V222 WeakPolarHBondContact O-CG2 3.25Å; F218-V222 PolarHBondContact O-N 3.2Å; F218-I270 HydrophobicContact CD2-CG2 3.72Å; F218-I270 HydrophobicContact CE2-CG2 3.33Å; F218-N274 WeakPolarHBondContact CD2-ND2 3.42Å
219	V	81.4	Confident	79.8	Confident	51 Å²	51	66.9 Å²	66.9	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-59.4	-45	-179.7	179.8	0	0	0	0	111.5	V213 N215 I216 Y221 V222 L223	V213-V219 HydrophobicContact CG1-CG2 3.64Å; N215-V219 PolarHBondContact O-N 3.23Å; I216-V219 PolarHBondContact O-N 3.27Å; V219-Y221 PolarHBondContact O-N 3.46Å; V219-V222 PolarHBondContact O-N 3.46Å; V219-L223 HydrophobicContact CG1-CD1 4.14Å; V219-L223 WeakPolarHBondContact O-CG 3.41Å; V219-L223 PolarHBondContact O-N 2.63Å; V219-L223 VanDerWaalsContact O-N 3.08Å
220	V	84.7	Confident	80	Confident	77 Å²	77	62.6 Å²	62.6	47%	0.467	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-45.1	178.4	172.8	0	0	0	0	111.1	I216 F218 L223 L224	I216-V220 HydrophobicContact CG2-CG2 4.26Å; I216-V220 WeakPolarHBondContact O-CG2 3.44Å; I216-V220 PolarHBondContact O-N 3.44Å; F218-V220 VanDerWaalsContact C-N 3.34Å; F218-V220 PolarHBondContact O-N 2.89Å; V220-L223 PolarHBondContact O-N 2.86Å; V220-L224 HydrophobicContact CG1-CD1 4.08Å; V220-L224 WeakPolarHBondContact O-CG 3.28Å; V220-L224 PolarHBondContact O-N 2.86Å; V220-L224 VanDerWaalsContact O-N 3.1Å
221	Y	85.9	Confident	80.4	Confident	59 Å²	59	62.9 Å²	62.9	23%	0.231	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-43.3	179.6	-174.6	-97.9	0	0	0	112.4	G217 F218 V219 L223 L224 C225 L266 G269 I270 T273	G217-Y221 WeakPolarHBondContact O-CB 3.35Å; G217-Y221 PolarHBondContact O-N 3.44Å; F218-Y221 PolarHBondContact O-N 2.9Å; V219-Y221 PolarHBondContact O-N 3.46Å; Y221-L223 PolarHBondContact O-N 2.99Å; Y221-L224 PolarHBondContact O-N 3.3Å; Y221-C225 WeakPolarHBondContact CE1-SG 3.31Å; Y221-C225 WeakPolarHBondContact O-CB 3.46Å; Y221-C225 PolarHBondContact O-N 3.45Å; Y221-C225 PolarHBondContact O-SG 2.69Å; Y221-L266 WeakPolarHBondContact CE1-O 3.41Å; Y221-L266 PolarHBondContact OH-O 3.32Å; Y221-G269 WeakPolarHBondContact OH-CA 3.35Å; Y221-G269 PolarHBondContact OH-N 3.01Å; Y221-I270 HydrophobicContact CD1-CG1 3.89Å; Y221-I270 HydrophobicContact CE1-CG1 3.74Å; Y221-I270 VanDerWaalsContact CE1-N 3.26Å; Y221-T273 HydrophobicContact CG-CG2 4.22Å
222	V	84.3	Confident	81	Confident	15 Å²	15	62.5 Å²	62.5	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-44.3	178.2	170.9	0	0	0	0	111.3	N204 F218 V219 C225 L226	N204-V222 WeakPolarHBondContact ND2-CG1 3.35Å; N204-V222 WeakPolarHBondContact ND2-CG2 3.32Å; F218-V222 HydrophobicContact CD2-CG2 4.13Å; F218-V222 HydrophobicContact CE1-CG2 4.25Å; F218-V222 HydrophobicContact CE2-CG2 3.91Å; F218-V222 HydrophobicContact CG-CG2 4.44Å; F218-V222 HydrophobicContact CZ-CG2 3.95Å; F218-V222 VanDerWaalsContact O-CG2 3.3Å; F218-V222 WeakPolarHBondContact O-CG2 3.25Å; F218-V222 PolarHBondContact O-N 3.2Å; V219-V222 PolarHBondContact O-N 3.46Å; V222-C225 PolarHBondContact O-N 2.98Å; V222-L226 HydrophobicContact CG1-CD1 3.81Å; V222-L226 HydrophobicContact CG1-CG 4.35Å; V222-L226 WeakPolarHBondContact O-CB 3.39Å; V222-L226 WeakPolarHBondContact O-CG 3.49Å; V222-L226 PolarHBondContact O-N 2.87Å
223	L	86.4	Confident	81.7	Confident	110 Å²	110	64.7 Å²	64.7	58%	0.576	36%	0.36	S	S	*	.	H	α-helix	trans	-63.6	-41.9	177.9	-70.2	174.1	0	0	0	112.4	V219 V220 Y221 F227	V219-L223 HydrophobicContact CG1-CD1 4.14Å; V219-L223 WeakPolarHBondContact O-CG 3.41Å; V219-L223 PolarHBondContact O-N 2.63Å; V219-L223 VanDerWaalsContact O-N 3.08Å; V220-L223 PolarHBondContact O-N 2.86Å; Y221-L223 PolarHBondContact O-N 2.99Å; L223-F227 WeakPolarHBondContact O-CB 3.38Å; L223-F227 PolarHBondContact O-N 3.36Å
224	L	87.6	Confident	82.5	Confident	111 Å²	111	64.2 Å²	64.2	58%	0.581	36%	0.36	S	S	*	.	H	α-helix	trans	-63.2	-41.9	176.3	-72.4	172.7	0	0	0	112	V220 Y221 F227 F228	V220-L224 HydrophobicContact CG1-CD1 4.08Å; V220-L224 WeakPolarHBondContact O-CG 3.28Å; V220-L224 PolarHBondContact O-N 2.86Å; V220-L224 VanDerWaalsContact O-N 3.1Å; Y221-L224 PolarHBondContact O-N 3.3Å; L224-F227 PolarHBondContact O-N 3.16Å; L224-F228 PolarHBondContact O-N 3.2Å
225	C	86.1	Confident	83.4	Confident	5 Å²	5	63 Å²	63	3%	0.034	35%	0.345	C	S	.	.	H	α-helix	trans	-69.2	-42.3	179.4	-67	0	0	0	0	112.3	F200 Y221 V222 F227 F228 V229 L266	F200-C225 HydrophobicContact CE1-CB 4.2Å; F200-C225 HydrophobicContact CE2-CB 3.62Å; F200-C225 HydrophobicContact CZ-CB 3.27Å; Y221-C225 WeakPolarHBondContact CE1-SG 3.31Å; Y221-C225 WeakPolarHBondContact O-CB 3.46Å; Y221-C225 PolarHBondContact O-N 3.45Å; Y221-C225 PolarHBondContact O-SG 2.69Å; V222-C225 PolarHBondContact O-N 2.98Å; C225-F227 VanDerWaalsContact C-N 3.34Å; C225-F228 PolarHBondContact O-N 3.25Å; C225-V229 WeakPolarHBondContact O-CG2 3.39Å; C225-V229 PolarHBondContact O-N 2.77Å; C225-L266 HydrophobicContact CB-CD1 3.99Å; C225-L266 HydrophobicContact CB-CD2 3.94Å; C225-L266 HydrophobicContact CB-CG 3.94Å; C225-L266 WeakPolarHBondContact SG-CD1 3.49Å
226	L	84.8	Confident	83.7	Confident	73 Å²	73	62.1 Å²	62.1	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-43.2	174.4	-75.1	170.6	0	0	0	111.3	F200 V222 F228 V229 V230	F200-L226 HydrophobicContact CE1-CD2 4.04Å; F200-L226 HydrophobicContact CE1-CG 4.37Å; V222-L226 HydrophobicContact CG1-CD1 3.81Å; V222-L226 HydrophobicContact CG1-CG 4.35Å; V222-L226 WeakPolarHBondContact O-CB 3.39Å; V222-L226 WeakPolarHBondContact O-CG 3.49Å; V222-L226 PolarHBondContact O-N 2.87Å; L226-F228 VanDerWaalsContact C-N 3.34Å; L226-F228 PolarHBondContact O-N 2.87Å; L226-V229 PolarHBondContact O-N 2.86Å; L226-V230 WeakPolarHBondContact O-CB 3.3Å; L226-V230 VanDerWaalsContact O-CG2 3.28Å; L226-V230 WeakPolarHBondContact O-CG2 3.06Å; L226-V230 PolarHBondContact O-N 3.37Å
227	F	87.6	Confident	83.8	Confident	155 Å²	155	58.3 Å²	58.3	68%	0.68	33%	0.33	S	S	*	.	H	α-helix	trans	-58.6	-45.9	174.3	177.2	-98.5	0	0	0	111.8	L223 L224 C225 V230 A231	L223-F227 WeakPolarHBondContact O-CB 3.38Å; L223-F227 PolarHBondContact O-N 3.36Å; L224-F227 PolarHBondContact O-N 3.16Å; C225-F227 VanDerWaalsContact C-N 3.34Å; F227-V230 PolarHBondContact O-N 2.92Å; F227-A231 VanDerWaalsContact O-CB 3.23Å; F227-A231 WeakPolarHBondContact O-CB 3.31Å; F227-A231 PolarHBondContact O-N 2.79Å
228	F	85.8	Confident	84.1	Confident	69 Å²	69	62.7 Å²	62.7	30%	0.303	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-46.3	178.1	-179.4	-98.9	0	0	0	112.6	L224 C225 L226 A231 F232 F259 L262 L263	L224-F228 PolarHBondContact O-N 3.2Å; C225-F228 PolarHBondContact O-N 3.25Å; L226-F228 VanDerWaalsContact C-N 3.34Å; L226-F228 PolarHBondContact O-N 2.87Å; F228-A231 PolarHBondContact O-N 2.95Å; F228-F232 WeakPolarHBondContact O-CB 3.36Å; F228-F232 PolarHBondContact O-N 2.75Å; F228-F259 AromaticContact CE1-CE2 3.97Å; F228-F259 HydrophobicContact CE1-CE2 3.97Å; F228-F259 HydrophobicContact CE1-CZ 4.22Å; F228-F259 HydrophobicContact CE2-CE2 4.41Å; F228-F259 HydrophobicContact CZ-CD2 4.18Å; F228-F259 AromaticContact CZ-CE2 3.46Å; F228-F259 HydrophobicContact CZ-CE2 3.46Å; F228-F259 VanDerWaalsContact CZ-CE2 3.46Å; F228-F259 HydrophobicContact CZ-CZ 4.17Å; F228-L262 HydrophobicContact CD1-CD2 4.3Å; F228-L262 HydrophobicContact CE1-CD2 3.46Å; F228-L262 VanDerWaalsContact CE1-CD2 3.46Å; F228-L262 HydrophobicContact CE2-CD2 4.26Å; F228-L262 HydrophobicContact CZ-CD2 3.43Å; F228-L262 VanDerWaalsContact CZ-CD2 3.43Å; F228-L263 HydrophobicContact CE1-CD1 4.42Å
229	V	83.7	Confident	84.1	Confident	9 Å²	9	65 Å²	65	6%	0.055	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-45.2	179.1	170.1	0	0	0	0	111.4	I197 F200 C225 L226 F232 L233 L263 L266	I197-V229 HydrophobicContact CB-CG1 4.39Å; I197-V229 HydrophobicContact CD1-CG1 3.92Å; I197-V229 HydrophobicContact CG1-CG1 3.82Å; I197-V229 HydrophobicContact CG2-CG1 3.73Å; F200-V229 HydrophobicContact CD1-CG2 4.43Å; C225-V229 WeakPolarHBondContact O-CG2 3.39Å; C225-V229 PolarHBondContact O-N 2.77Å; L226-V229 PolarHBondContact O-N 2.86Å; V229-F232 PolarHBondContact O-N 3.43Å; V229-L233 HydrophobicContact CG1-CD1 4.27Å; V229-L233 WeakPolarHBondContact O-CG 3.06Å; V229-L233 PolarHBondContact O-N 3.18Å; V229-L263 HydrophobicContact CG2-CD1 4.49Å; V229-L266 HydrophobicContact CG2-CD2 3.73Å
230	V	85.2	Confident	84	Confident	85 Å²	85	66.6 Å²	66.6	52%	0.515	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-46.5	178.5	172.6	0	0	0	0	110.9	L226 F227 F232 L233 C234	L226-V230 WeakPolarHBondContact O-CB 3.3Å; L226-V230 VanDerWaalsContact O-CG2 3.28Å; L226-V230 WeakPolarHBondContact O-CG2 3.06Å; L226-V230 PolarHBondContact O-N 3.37Å; F227-V230 PolarHBondContact O-N 2.92Å; V230-F232 PolarHBondContact O-N 3.44Å; V230-L233 PolarHBondContact O-N 2.96Å; V230-C234 WeakPolarHBondContact O-CB 3.39Å; V230-C234 PolarHBondContact O-N 2.94Å; V230-C234 PolarHBondContact O-SG 3.16Å; V230-C234 VanDerWaalsContact O-SG 3.33Å
231	A	84.8	Confident	83.8	Confident	43 Å²	43	72.3 Å²	72.3	36%	0.355	38%	0.375	S	S	.	.	H	α-helix	trans	-58.2	-39.9	176.9	0	0	0	0	0	111.6	F227 F228 C234 L235	F227-A231 VanDerWaalsContact O-CB 3.23Å; F227-A231 WeakPolarHBondContact O-CB 3.31Å; F227-A231 PolarHBondContact O-N 2.79Å; F228-A231 PolarHBondContact O-N 2.95Å; A231-C234 PolarHBondContact O-N 3.29Å; A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.08Å; A231-L235 PolarHBondContact O-N 2.82Å
232	F	82.5	Confident	83.6	Confident	14 Å²	14	77.9 Å²	77.9	6%	0.061	40%	0.395	C	S	.	.	H	α-helix	trans	-66.8	-44.6	177	-179.2	-108.4	0	0	0	113.2	V193 F228 V229 V230 L235 T236 L250 F259	V193-F232 HydrophobicContact CB-CE1 4.46Å; V193-F232 HydrophobicContact CG1-CD1 4.28Å; V193-F232 HydrophobicContact CG1-CE1 3.57Å; V193-F232 HydrophobicContact CG2-CE1 4Å; V193-F232 HydrophobicContact CG2-CZ 4.29Å; F228-F232 WeakPolarHBondContact O-CB 3.36Å; F228-F232 PolarHBondContact O-N 2.75Å; V229-F232 PolarHBondContact O-N 3.43Å; V230-F232 PolarHBondContact O-N 3.44Å; F232-L235 PolarHBondContact O-N 2.96Å; F232-T236 HydrophobicContact CD1-CG2 4.48Å; F232-T236 HydrophobicContact CD2-CG2 4.26Å; F232-T236 HydrophobicContact CE1-CG2 4.03Å; F232-T236 HydrophobicContact CE2-CG2 3.77Å; F232-T236 HydrophobicContact CZ-CG2 3.64Å; F232-T236 WeakPolarHBondContact O-CB 3.4Å; F232-T236 WeakPolarHBondContact O-CG2 3.41Å; F232-T236 PolarHBondContact O-N 2.86Å; F232-T236 PolarHBondContact O-OG1 3.42Å; F232-L250 HydrophobicContact CE2-CD1 3.85Å; F232-L250 HydrophobicContact CE2-CD2 3.7Å; F232-L250 HydrophobicContact CE2-CG 4.13Å; F232-L250 HydrophobicContact CZ-CD1 3.6Å; F232-L250 HydrophobicContact CZ-CD2 3.51Å; F232-L250 HydrophobicContact CZ-CG 4.09Å; F232-F259 HydrophobicContact CB-CZ 4.34Å; F232-F259 HydrophobicContact CD1-CE1 4.19Å; F232-F259 AromaticContact CD1-CZ 3.74Å; F232-F259 HydrophobicContact CD1-CZ 3.74Å; F232-F259 AromaticContact CD2-CE1 3.89Å; F232-F259 HydrophobicContact CD2-CE1 3.89Å; F232-F259 AromaticContact CD2-CE2 3.53Å; F232-F259 HydrophobicContact CD2-CE2 3.53Å; F232-F259 AromaticContact CD2-CZ 3.11Å; F232-F259 HydrophobicContact CD2-CZ 3.11Å; F232-F259 AromaticContact CE1-CE1 3.67Å; F232-F259 HydrophobicContact CE1-CE1 3.67Å; F232-F259 AromaticContact CE1-CZ 3.69Å; F232-F259 HydrophobicContact CE1-CZ 3.69Å; F232-F259 HydrophobicContact CE2-CD1 4.18Å; F232-F259 HydrophobicContact CE2-CD2 4.45Å; F232-F259 AromaticContact CE2-CE1 3.35Å; F232-F259 HydrophobicContact CE2-CE1 3.35Å; F232-F259 AromaticContact CE2-CE2 3.66Å; F232-F259 HydrophobicContact CE2-CE2 3.66Å; F232-F259 AromaticContact CE2-CZ 3.08Å; F232-F259 HydrophobicContact CE2-CZ 3.08Å; F232-F259 HydrophobicContact CG-CE1 4.28Å; F232-F259 HydrophobicContact CG-CE2 4.15Å; F232-F259 AromaticContact CG-CZ 3.45Å; F232-F259 HydrophobicContact CG-CZ 3.45Å; F232-F259 VanDerWaalsContact CG-CZ 3.45Å; F232-F259 HydrophobicContact CZ-CD1 4.17Å; F232-F259 AromaticContact CZ-CE1 3.22Å; F232-F259 HydrophobicContact CZ-CE1 3.22Å; F232-F259 HydrophobicContact CZ-CE2 4.37Å; F232-F259 AromaticContact CZ-CZ 3.38Å; F232-F259 HydrophobicContact CZ-CZ 3.38Å
233	L	83.3	Confident	83	Confident	76 Å²	76	82.4 Å²	82.4	40%	0.398	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-42.9	174.5	-73.4	175.5	0	0	0	111.8	I197 V229 V230 T236 A237	I197-L233 HydrophobicContact CD1-CD1 4.1Å; I197-L233 HydrophobicContact CD1-CD2 3.65Å; I197-L233 HydrophobicContact CD1-CG 3.89Å; V229-L233 HydrophobicContact CG1-CD1 4.27Å; V229-L233 WeakPolarHBondContact O-CG 3.06Å; V229-L233 PolarHBondContact O-N 3.18Å; V230-L233 PolarHBondContact O-N 2.96Å; L233-T236 WeakPolarHBondContact CA-OG1 2.86Å; L233-T236 PolarHBondContact O-OG1 3.44Å; L233-A237 VanDerWaalsContact O-CB 3.28Å; L233-A237 WeakPolarHBondContact O-CB 3.34Å; L233-A237 PolarHBondContact O-N 2.67Å
234	C	84.6	Confident	82.2	Confident	79 Å²	79	80 Å²	80	53%	0.534	42%	0.417	S	S	.	.	H	α-helix	trans	-63.9	-42.9	176.6	-69.9	0	0	0	0	112	V230 A231 F238	V230-C234 WeakPolarHBondContact O-CB 3.39Å; V230-C234 PolarHBondContact O-N 2.94Å; V230-C234 PolarHBondContact O-SG 3.16Å; V230-C234 VanDerWaalsContact O-SG 3.33Å; A231-C234 PolarHBondContact O-N 3.29Å; C234-F238 VanDerWaalsContact O-CB 3.23Å; C234-F238 WeakPolarHBondContact O-CB 3.31Å; C234-F238 PolarHBondContact O-N 3.37Å
235	L	83.7	Confident	81.3	Confident	80 Å²	80	77 Å²	77	42%	0.419	41%	0.405	S	S	.	.	H	α-helix	trans	-66.3	-42.7	179.7	-176.5	64.4	0	0	0	112.1	A231 F232 F238 Y239 L247	A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.08Å; A231-L235 PolarHBondContact O-N 2.82Å; F232-L235 PolarHBondContact O-N 2.96Å; L235-F238 PolarHBondContact O-N 2.87Å; L235-Y239 WeakPolarHBondContact O-CB 2.98Å; L235-Y239 PolarHBondContact O-N 3.07Å; L235-L247 HydrophobicContact CD1-CD1 4.28Å; L235-L247 HydrophobicContact CD2-CD1 4.24Å; L235-L247 HydrophobicContact CD2-CD2 3.49Å; L235-L247 VanDerWaalsContact CD2-CD2 3.49Å; L235-L247 HydrophobicContact CG-CD1 4.08Å; L235-L247 HydrophobicContact CG-CD2 3.98Å
236	T	77.7	Confident	80.4	Confident	19 Å²	19	77.2 Å²	77.2	12%	0.117	41%	0.406	C	S	.	.	H	α-helix	trans	-65.8	-44.1	176.9	48.9	0	0	0	0	111.7	F232 L233 Y239 L240 L250	F232-T236 HydrophobicContact CD1-CG2 4.48Å; F232-T236 HydrophobicContact CD2-CG2 4.26Å; F232-T236 HydrophobicContact CE1-CG2 4.03Å; F232-T236 HydrophobicContact CE2-CG2 3.77Å; F232-T236 HydrophobicContact CZ-CG2 3.64Å; F232-T236 WeakPolarHBondContact O-CB 3.4Å; F232-T236 WeakPolarHBondContact O-CG2 3.41Å; F232-T236 PolarHBondContact O-N 2.86Å; F232-T236 PolarHBondContact O-OG1 3.42Å; L233-T236 WeakPolarHBondContact CA-OG1 2.86Å; L233-T236 PolarHBondContact O-OG1 3.44Å; T236-Y239 PolarHBondContact O-N 3.01Å; T236-L240 WeakPolarHBondContact O-CB 3.41Å; T236-L240 PolarHBondContact O-N 3.17Å; T236-L250 HydrophobicContact CG2-CD1 3.48Å; T236-L250 VanDerWaalsContact CG2-CD1 3.48Å
237	A	81	Confident	79.7	Confident	59 Å²	59	74.9 Å²	74.9	49%	0.488	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-43.1	175.1	0	0	0	0	0	112.4	L233 K241	L233-A237 VanDerWaalsContact O-CB 3.28Å; L233-A237 WeakPolarHBondContact O-CB 3.34Å; L233-A237 PolarHBondContact O-N 2.67Å; A237-K241 WeakPolarHBondContact O-CB 3.35Å; A237-K241 PolarHBondContact O-N 3.09Å
238	F	84	Confident	78.8	Confident	122 Å²	122	69.9 Å²	69.9	54%	0.535	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-46.7	176.8	177.1	-99	0	0	0	111.9	C234 L235 K241 R242	C234-F238 VanDerWaalsContact O-CB 3.23Å; C234-F238 WeakPolarHBondContact O-CB 3.31Å; C234-F238 PolarHBondContact O-N 3.37Å; L235-F238 PolarHBondContact O-N 2.87Å; F238-K241 PolarHBondContact O-N 3.08Å; F238-R242 WeakPolarHBondContact O-CB 3.4Å; F238-R242 PolarHBondContact O-N 3.47Å
239	Y	80.5	Confident	78.1	Confident	53 Å²	53	69.8 Å²	69.8	21%	0.208	38%	0.382	C	S	.	.	H	α-helix	trans	-69.4	-39.1	-178.1	-163.8	-88.7	0	0	0	111.8	L235 T236 R242 H243 S245 L246 L247 P248	L235-Y239 WeakPolarHBondContact O-CB 2.98Å; L235-Y239 PolarHBondContact O-N 3.07Å; T236-Y239 PolarHBondContact O-N 3.01Å; Y239-R242 PolarHBondContact O-N 2.82Å; Y239-H243 HydrophobicContact CD1-CB 4.41Å; Y239-H243 AromaticContact CD2-CD2 3.97Å; Y239-H243 HydrophobicContact CE1-CB 4.01Å; Y239-H243 AromaticContact CE2-CD2 3.69Å; Y239-H243 AromaticContact CZ-CD2 4Å; Y239-H243 PolarHBondContact O-N 3.31Å; Y239-S245 WeakPolarHBondContact CD1-O 3.49Å; Y239-L246 WeakPolarHBondContact CD1-O 3.46Å; Y239-L246 WeakPolarHBondContact CE1-O 3.49Å; Y239-L247 VanDerWaalsContact CD1-CA 3.45Å; Y239-L247 HydrophobicContact CD1-CB 4.35Å; Y239-L247 HydrophobicContact CD2-CD1 3.69Å; Y239-L247 HydrophobicContact CE2-CD1 4.28Å; Y239-L247 HydrophobicContact CG-CB 4.29Å; Y239-L247 HydrophobicContact CG-CD1 3.91Å; Y239-P248 VanDerWaalsContact CZ-CD 3.45Å; Y239-P248 WeakPolarHBondContact OH-CD 3.39Å
240	L	79.5	Confident	77.2	Confident	85 Å²	85	69.6 Å²	69.6	45%	0.445	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.9	-164.1	72.9	0	0	0	111.5	T236 G244 S245 L246	T236-L240 WeakPolarHBondContact O-CB 3.41Å; T236-L240 PolarHBondContact O-N 3.17Å; L240-G244 WeakPolarHBondContact O-CA 3.47Å; L240-G244 PolarHBondContact O-N 3.44Å; L240-S245 WeakPolarHBondContact CA-O 3.24Å; L240-L246 HydrophobicContact CD1-CD2 4.2Å
241	K	81.4	Confident	76.4	Confident	198 Å²	198	69.5 Å²	69.5	86%	0.861	38%	0.38	S	S	*	.	H	α-helix	trans	-65.7	-38.5	177.3	-173.7	176.5	-179.4	179.1	0	112.8	A237 F238	A237-K241 WeakPolarHBondContact O-CB 3.35Å; A237-K241 PolarHBondContact O-N 3.09Å; F238-K241 PolarHBondContact O-N 3.08Å
242	R	80.5	Confident	75.9	Confident	175 Å²	175	74 Å²	74	66%	0.66	39%	0.391	S	S	*	.	H	α-helix	trans	-83.7	-38.5	-174.6	-172.1	174.7	-176.7	167	1.6	113.8	F238 Y239	F238-R242 WeakPolarHBondContact O-CB 3.4Å; F238-R242 PolarHBondContact O-N 3.47Å; Y239-R242 PolarHBondContact O-N 2.82Å
243	H	72.7	Confident	75.5	Confident	111 Å²	111	80.8 Å²	80.8	51%	0.514	42%	0.417	S	S	.	.	H	α-helix	trans	-118	-4.5	-169.9	-73.7	-76.7	0	0	0	114.3	Y239 S245	Y239-H243 HydrophobicContact CD1-CB 4.41Å; Y239-H243 AromaticContact CD2-CD2 3.97Å; Y239-H243 HydrophobicContact CE1-CB 4.01Å; Y239-H243 AromaticContact CE2-CD2 3.69Å; Y239-H243 AromaticContact CZ-CD2 4Å; Y239-H243 PolarHBondContact O-N 3.31Å; H243-S245 PolarHBondContact O-N 3.46Å
244	G	69.6	Low	75.2	Confident	60 Å²	60	86 Å²	86	62%	0.619	43%	0.431	S	S	*	.	S	Bend	trans	62.3	12.7	-175.8	0	0	0	0	0	113.9	L240	L240-G244 WeakPolarHBondContact O-CA 3.47Å; L240-G244 PolarHBondContact O-N 3.44Å
245	S	68.2	Low	75.2	Confident	46 Å²	46	84.5 Å²	84.5	32%	0.322	42%	0.421	S	S	.	.	S	Bend	trans	-131.7	164.3	-176.1	-174.7	0	0	0	0	109	Y239 L240 H243	Y239-S245 WeakPolarHBondContact CD1-O 3.49Å; L240-S245 WeakPolarHBondContact CA-O 3.24Å; H243-S245 PolarHBondContact O-N 3.46Å
246	L	67.4	Low	75.1	Confident	11 Å²	11	82 Å²	82	6%	0.058	41%	0.406	C	S	.	.			trans	-81.3	152.9	173.8	-69.8	172.4	0	0	0	110.5	K186 V189 Y239 L240 V251	K186-L246 HydrophobicContact CB-CD1 4.01Å; K186-L246 HydrophobicContact CG-CD1 4.31Å; K186-L246 WeakPolarHBondContact O-CD1 3.39Å; V189-L246 HydrophobicContact CB-CD1 4.46Å; Y239-L246 WeakPolarHBondContact CD1-O 3.46Å; Y239-L246 WeakPolarHBondContact CE1-O 3.49Å; L240-L246 HydrophobicContact CD1-CD2 4.2Å; L246-V251 HydrophobicContact CB-CG2 3.87Å
247	L	70.7	Confident	75.5	Confident	23 Å²	23	82.5 Å²	82.5	12%	0.12	41%	0.407	C	S	.	.			trans	-50.6	129.6	177.9	-170.4	77.7	0	0	0	109.4	L235 Y239 V249 L250 V251	L235-L247 HydrophobicContact CD1-CD1 4.28Å; L235-L247 HydrophobicContact CD2-CD1 4.24Å; L235-L247 HydrophobicContact CD2-CD2 3.49Å; L235-L247 VanDerWaalsContact CD2-CD2 3.49Å; L235-L247 HydrophobicContact CG-CD1 4.08Å; L235-L247 HydrophobicContact CG-CD2 3.98Å; Y239-L247 VanDerWaalsContact CD1-CA 3.45Å; Y239-L247 HydrophobicContact CD1-CB 4.35Å; Y239-L247 HydrophobicContact CD2-CD1 3.69Å; Y239-L247 HydrophobicContact CE2-CD1 4.28Å; Y239-L247 HydrophobicContact CG-CB 4.29Å; Y239-L247 HydrophobicContact CG-CD1 3.91Å; L247-V249 HydrophobicContact CD2-CB 4Å; L247-V249 HydrophobicContact CD2-CG2 4.16Å; L247-V249 HydrophobicContact CG-CB 4.33Å; L247-V249 HydrophobicContact CG-CG2 4.37Å; L247-V249 PolarHBondContact O-N 3.21Å; L247-L250 HydrophobicContact CB-CD1 4.19Å; L247-L250 HydrophobicContact CB-CG 4.43Å; L247-L250 WeakPolarHBondContact O-CB 3.47Å; L247-L250 PolarHBondContact O-N 2.88Å; L247-V251 PolarHBondContact O-N 3.35Å
248	P	69	Low	75.7	Confident	51 Å²	51	83.8 Å²	83.8	33%	0.331	41%	0.409	S	S	.	.	H	α-helix	trans	-60.8	-22.5	-172.3	19.8	-31.8	0	0	0	113	Y239 L250 V251 K252	Y239-P248 VanDerWaalsContact CZ-CD 3.45Å; Y239-P248 WeakPolarHBondContact OH-CD 3.39Å; P248-L250 VanDerWaalsContact C-N 3.27Å; P248-L250 PolarHBondContact O-N 3.01Å; P248-V251 PolarHBondContact O-N 2.9Å; P248-K252 VanDerWaalsContact O-CB 3.29Å; P248-K252 WeakPolarHBondContact O-CB 3.32Å; P248-K252 VanDerWaalsContact O-CG 3.27Å; P248-K252 WeakPolarHBondContact O-CG 3.48Å; P248-K252 PolarHBondContact O-N 3.1Å
249	V	69.8	Low	75.7	Confident	66 Å²	66	79.4 Å²	79.4	40%	0.4	39%	0.39	S	S	.	.	H	α-helix	trans	-62.2	-34	172.4	-178.3	0	0	0	0	111.7	L247 P255 K256	L247-V249 HydrophobicContact CD2-CB 4Å; L247-V249 HydrophobicContact CD2-CG2 4.16Å; L247-V249 HydrophobicContact CG-CB 4.33Å; L247-V249 HydrophobicContact CG-CG2 4.37Å; L247-V249 PolarHBondContact O-N 3.21Å; V249-P255 HydrophobicContact CB-CB 4.46Å; V249-P255 HydrophobicContact CG1-CB 3.62Å; V249-P255 WeakPolarHBondContact O-CB 3.31Å; V249-K256 PolarHBondContact O-N 3.23Å
250	L	65.9	Low	75.9	Confident	6 Å²	6	77 Å²	77	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-81	-20.3	177.6	-63.6	170.9	0	0	0	113.4	F232 T236 L247 P248 F259	F232-L250 HydrophobicContact CE2-CD1 3.85Å; F232-L250 HydrophobicContact CE2-CD2 3.7Å; F232-L250 HydrophobicContact CE2-CG 4.13Å; F232-L250 HydrophobicContact CZ-CD1 3.6Å; F232-L250 HydrophobicContact CZ-CD2 3.51Å; F232-L250 HydrophobicContact CZ-CG 4.09Å; T236-L250 HydrophobicContact CG2-CD1 3.48Å; T236-L250 VanDerWaalsContact CG2-CD1 3.48Å; L247-L250 HydrophobicContact CB-CD1 4.19Å; L247-L250 HydrophobicContact CB-CG 4.43Å; L247-L250 WeakPolarHBondContact O-CB 3.47Å; L247-L250 PolarHBondContact O-N 2.88Å; P248-L250 VanDerWaalsContact C-N 3.27Å; P248-L250 PolarHBondContact O-N 3.01Å; L250-F259 HydrophobicContact CD2-CD1 3.74Å; L250-F259 HydrophobicContact CD2-CE1 4.03Å; L250-F259 HydrophobicContact CD2-CG 4.4Å
251	V	66.7	Low	76.3	Confident	83 Å²	83	75.5 Å²	75.5	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-96.6	-35.4	-177.6	-176.4	0	0	0	0	111.3	L246 L247 P248	L246-V251 HydrophobicContact CB-CG2 3.87Å; L247-V251 PolarHBondContact O-N 3.35Å; P248-V251 PolarHBondContact O-N 2.9Å
252	K	74.3	Confident	76.5	Confident	136 Å²	136	70.1 Å²	70.1	59%	0.591	35%	0.353	S	S	*	.	S	Bend	trans	-67.9	137.7	177.4	-75.7	179.9	179.7	-176.4	0	110.5	P248 W254 P255 K256	P248-K252 VanDerWaalsContact O-CB 3.29Å; P248-K252 WeakPolarHBondContact O-CB 3.32Å; P248-K252 VanDerWaalsContact O-CG 3.27Å; P248-K252 WeakPolarHBondContact O-CG 3.48Å; P248-K252 PolarHBondContact O-N 3.1Å; K252-W254 PolarHBondContact O-N 2.88Å; K252-P255 HydrophobicContact CB-CG 4.11Å; K252-P255 WeakPolarHBondContact O-CD 3.5Å; K252-K256 WeakPolarHBondContact O-CB 3.5Å; K252-K256 PolarHBondContact O-N 2.87Å
253	W	74	Confident	76.8	Confident	157 Å²	157	62 Å²	62	60%	0.595	32%	0.322	S	S	*	.	H	α-helix	trans	-57.8	-54.9	-170.9	-168.7	62.7	0	0	0	113.7	H257	W253-H257 AromaticContact CD1-NE2 3.44Å; W253-H257 AromaticContact CD2-NE2 3.68Å; W253-H257 AromaticContact CE2-NE2 3.26Å; W253-H257 VanDerWaalsContact CE2-NE2 3.26Å; W253-H257 AromaticContact CG-NE2 3.8Å; W253-H257 AromaticContact CZ2-NE2 3.82Å; W253-H257 AromaticContact NE1-CE1 3.87Å; W253-H257 AromaticContact NE1-NE2 3.09Å; W253-H257 PolarHBondContact NE1-NE2 2.71Å; W253-H257 PolarHBondContact O-CD2 3.45Å; W253-H257 PolarHBondContact O-N 3.35Å
254	W	79	Confident	77.5	Confident	186 Å²	186	57.1 Å²	57.1	71%	0.705	30%	0.3	S	S	*	.	H	α-helix	trans	-64.8	-52.6	-176.5	-107.6	101.8	0	0	0	114.2	K252 K256 H257 V258	K252-W254 PolarHBondContact O-N 2.88Å; W254-K256 VanDerWaalsContact C-N 3.26Å; W254-K256 PolarHBondContact O-N 3Å; W254-H257 PolarHBondContact O-N 3.35Å; W254-V258 HydrophobicContact CE3-CG2 4.25Å; W254-V258 HydrophobicContact CZ3-CG2 4.45Å; W254-V258 PolarHBondContact O-N 2.82Å
255	P	83.3	Confident	78.4	Confident	48 Å²	48	55.9 Å²	55.9	31%	0.312	28%	0.279	S	S	.	.	H	α-helix	trans	-65	-31.3	-178.2	-19.8	31.6	0	0	0	112.9	V249 K252 H257 V258 F259	V249-P255 HydrophobicContact CB-CB 4.46Å; V249-P255 HydrophobicContact CG1-CB 3.62Å; V249-P255 WeakPolarHBondContact O-CB 3.31Å; K252-P255 HydrophobicContact CB-CG 4.11Å; K252-P255 WeakPolarHBondContact O-CD 3.5Å; P255-H257 PolarHBondContact O-N 2.65Å; P255-V258 PolarHBondContact O-N 3.36Å; P255-F259 VanDerWaalsContact O-CB 3.24Å; P255-F259 WeakPolarHBondContact O-CB 3.26Å; P255-F259 PolarHBondContact O-N 3.31Å
256	K	82	Confident	79.3	Confident	27 Å²	27	54.3 Å²	54.3	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-44.2	173.1	179.8	-172.2	179.4	-174.4	0	112.5	V249 K252 W254 S260	V249-K256 PolarHBondContact O-N 3.23Å; K252-K256 WeakPolarHBondContact O-CB 3.5Å; K252-K256 PolarHBondContact O-N 2.87Å; W254-K256 VanDerWaalsContact C-N 3.26Å; W254-K256 PolarHBondContact O-N 3Å; K256-S260 VanDerWaalsContact O-CB 3.28Å; K256-S260 WeakPolarHBondContact O-CB 3.49Å; K256-S260 PolarHBondContact O-N 3.16Å; K256-S260 PolarHBondContact O-OG 3.46Å
257	H	85.4	Confident	80.1	Confident	29 Å²	29	54.2 Å²	54.2	13%	0.134	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-47.5	177.6	-70.1	-65	0	0	0	111.4	W253 W254 P255 L261 I315 R316	W253-H257 AromaticContact CD1-NE2 3.44Å; W253-H257 AromaticContact CD2-NE2 3.68Å; W253-H257 AromaticContact CE2-NE2 3.26Å; W253-H257 VanDerWaalsContact CE2-NE2 3.26Å; W253-H257 AromaticContact CG-NE2 3.8Å; W253-H257 AromaticContact CZ2-NE2 3.82Å; W253-H257 AromaticContact NE1-CE1 3.87Å; W253-H257 AromaticContact NE1-NE2 3.09Å; W253-H257 PolarHBondContact NE1-NE2 2.71Å; W253-H257 PolarHBondContact O-CD2 3.45Å; W253-H257 PolarHBondContact O-N 3.35Å; W254-H257 PolarHBondContact O-N 3.35Å; P255-H257 PolarHBondContact O-N 2.65Å; H257-L261 WeakPolarHBondContact O-CB 3.45Å; H257-L261 PolarHBondContact O-N 3.07Å; H257-I315 VanDerWaalsContact ND1-CG2 3.33Å; H257-I315 WeakPolarHBondContact ND1-CG2 3.4Å; H257-R316 PolarHBondContact CE1-N 3.41Å
258	V	85.7	Confident	80.8	Confident	87 Å²	87	54.8 Å²	54.8	53%	0.527	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-50.6	-178.9	177.1	0	0	0	0	110.9	W254 P255 S260 L261 L262	W254-V258 HydrophobicContact CE3-CG2 4.25Å; W254-V258 HydrophobicContact CZ3-CG2 4.45Å; W254-V258 PolarHBondContact O-N 2.82Å; P255-V258 PolarHBondContact O-N 3.36Å; V258-S260 VanDerWaalsContact C-N 3.34Å; V258-S260 PolarHBondContact O-N 3.45Å; V258-L261 PolarHBondContact O-N 3.14Å; V258-L262 WeakPolarHBondContact O-CB 2.7Å; V258-L262 PolarHBondContact O-N 3.3Å
259	F	84.1	Confident	81.4	Confident	29 Å²	29	52.9 Å²	52.9	13%	0.127	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-43.5	-176.7	-178.8	-92.1	0	0	0	111.8	F228 F232 L250 P255 L262 L263	F228-F259 AromaticContact CE1-CE2 3.97Å; F228-F259 HydrophobicContact CE1-CE2 3.97Å; F228-F259 HydrophobicContact CE1-CZ 4.22Å; F228-F259 HydrophobicContact CE2-CE2 4.41Å; F228-F259 HydrophobicContact CZ-CD2 4.18Å; F228-F259 AromaticContact CZ-CE2 3.46Å; F228-F259 HydrophobicContact CZ-CE2 3.46Å; F228-F259 VanDerWaalsContact CZ-CE2 3.46Å; F228-F259 HydrophobicContact CZ-CZ 4.17Å; F232-F259 HydrophobicContact CB-CZ 4.34Å; F232-F259 HydrophobicContact CD1-CE1 4.19Å; F232-F259 AromaticContact CD1-CZ 3.74Å; F232-F259 HydrophobicContact CD1-CZ 3.74Å; F232-F259 AromaticContact CD2-CE1 3.89Å; F232-F259 HydrophobicContact CD2-CE1 3.89Å; F232-F259 AromaticContact CD2-CE2 3.53Å; F232-F259 HydrophobicContact CD2-CE2 3.53Å; F232-F259 AromaticContact CD2-CZ 3.11Å; F232-F259 HydrophobicContact CD2-CZ 3.11Å; F232-F259 AromaticContact CE1-CE1 3.67Å; F232-F259 HydrophobicContact CE1-CE1 3.67Å; F232-F259 AromaticContact CE1-CZ 3.69Å; F232-F259 HydrophobicContact CE1-CZ 3.69Å; F232-F259 HydrophobicContact CE2-CD1 4.18Å; F232-F259 HydrophobicContact CE2-CD2 4.45Å; F232-F259 AromaticContact CE2-CE1 3.35Å; F232-F259 HydrophobicContact CE2-CE1 3.35Å; F232-F259 AromaticContact CE2-CE2 3.66Å; F232-F259 HydrophobicContact CE2-CE2 3.66Å; F232-F259 AromaticContact CE2-CZ 3.08Å; F232-F259 HydrophobicContact CE2-CZ 3.08Å; F232-F259 HydrophobicContact CG-CE1 4.28Å; F232-F259 HydrophobicContact CG-CE2 4.15Å; F232-F259 AromaticContact CG-CZ 3.45Å; F232-F259 HydrophobicContact CG-CZ 3.45Å; F232-F259 VanDerWaalsContact CG-CZ 3.45Å; F232-F259 HydrophobicContact CZ-CD1 4.17Å; F232-F259 AromaticContact CZ-CE1 3.22Å; F232-F259 HydrophobicContact CZ-CE1 3.22Å; F232-F259 HydrophobicContact CZ-CE2 4.37Å; F232-F259 AromaticContact CZ-CZ 3.38Å; F232-F259 HydrophobicContact CZ-CZ 3.38Å; L250-F259 HydrophobicContact CD2-CD1 3.74Å; L250-F259 HydrophobicContact CD2-CE1 4.03Å; L250-F259 HydrophobicContact CD2-CG 4.4Å; P255-F259 VanDerWaalsContact O-CB 3.24Å; P255-F259 WeakPolarHBondContact O-CB 3.26Å; P255-F259 PolarHBondContact O-N 3.31Å; F259-L262 PolarHBondContact O-N 3.08Å; F259-L263 HydrophobicContact CE1-CD2 3.89Å; F259-L263 HydrophobicContact CZ-CD2 4.36Å; F259-L263 WeakPolarHBondContact O-CB 3.22Å; F259-L263 PolarHBondContact O-N 2.93Å
260	S	84.7	Confident	81.7	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-37.9	-178.4	-48.9	0	0	0	0	111.8	K256 V258 L262 L263 I264 I315	K256-S260 VanDerWaalsContact O-CB 3.28Å; K256-S260 WeakPolarHBondContact O-CB 3.49Å; K256-S260 PolarHBondContact O-N 3.16Å; K256-S260 PolarHBondContact O-OG 3.46Å; V258-S260 VanDerWaalsContact C-N 3.34Å; V258-S260 PolarHBondContact O-N 3.45Å; S260-L262 VanDerWaalsContact C-N 3.29Å; S260-L262 PolarHBondContact O-N 3.36Å; S260-L263 PolarHBondContact O-N 3.32Å; S260-I264 WeakPolarHBondContact O-CD1 3.5Å; S260-I264 WeakPolarHBondContact O-CG1 3.4Å; S260-I264 PolarHBondContact O-N 3.41Å; S260-I315 VanDerWaalsContact OG-CD1 3.29Å; S260-I315 WeakPolarHBondContact OG-CD1 3.26Å
261	L	87.5	Confident	82.2	Confident	53 Å²	53	49.6 Å²	49.6	28%	0.277	24%	0.24	S	C	.	.	H	α-helix	trans	-64.2	-36	174.7	-173	65	0	0	0	112	H257 V258 N265	H257-L261 WeakPolarHBondContact O-CB 3.45Å; H257-L261 PolarHBondContact O-N 3.07Å; V258-L261 PolarHBondContact O-N 3.14Å; L261-N265 PolarHBondContact O-N 3.31Å; L261-N265 PolarHBondContact O-ND2 3.35Å
262	L	87	Confident	82.8	Confident	85 Å²	85	50.3 Å²	50.3	45%	0.445	24%	0.241	S	C	.	.	H	α-helix	trans	-66.1	-42.9	174	-176.2	146.9	0	0	0	111.4	F228 V258 F259 S260 N265 L266	F228-L262 HydrophobicContact CD1-CD2 4.3Å; F228-L262 HydrophobicContact CE1-CD2 3.46Å; F228-L262 VanDerWaalsContact CE1-CD2 3.46Å; F228-L262 HydrophobicContact CE2-CD2 4.26Å; F228-L262 HydrophobicContact CZ-CD2 3.43Å; F228-L262 VanDerWaalsContact CZ-CD2 3.43Å; V258-L262 WeakPolarHBondContact O-CB 2.7Å; V258-L262 PolarHBondContact O-N 3.3Å; F259-L262 PolarHBondContact O-N 3.08Å; S260-L262 VanDerWaalsContact C-N 3.29Å; S260-L262 PolarHBondContact O-N 3.36Å; L262-N265 PolarHBondContact O-N 2.78Å; L262-L266 PolarHBondContact O-N 3.14Å; L262-L266 VanDerWaalsContact O-N 3.15Å
263	L	86	Confident	82.8	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-37.3	179.7	-166.4	59.9	0	0	0	112.4	V193 S196 F228 V229 F259 S260 L266 F312	V193-L263 HydrophobicContact CG2-CD2 4.48Å; S196-L263 WeakPolarHBondContact OG-CD2 3.5Å; S196-L263 WeakPolarHBondContact OG-CG 3.21Å; F228-L263 HydrophobicContact CE1-CD1 4.42Å; V229-L263 HydrophobicContact CG2-CD1 4.49Å; F259-L263 HydrophobicContact CE1-CD2 3.89Å; F259-L263 HydrophobicContact CZ-CD2 4.36Å; F259-L263 WeakPolarHBondContact O-CB 3.22Å; F259-L263 PolarHBondContact O-N 2.93Å; S260-L263 PolarHBondContact O-N 3.32Å; L263-L266 HydrophobicContact CD1-CD2 4.43Å; L263-L266 WeakPolarHBondContact O-CB 3.44Å; L263-F312 HydrophobicContact CD2-CZ 4.04Å
264	I	87.2	Confident	82.6	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-40	174.4	-66.5	162.9	0	0	0	111.6	S260 P267 H309 F312 K320	S260-I264 WeakPolarHBondContact O-CD1 3.5Å; S260-I264 WeakPolarHBondContact O-CG1 3.4Å; S260-I264 PolarHBondContact O-N 3.41Å; I264-P267 VanDerWaalsContact O-CD 3.28Å; I264-P267 WeakPolarHBondContact O-CD 3.41Å; I264-H309 HydrophobicContact CG2-CB 4.44Å; I264-F312 HydrophobicContact CD1-CB 4.49Å; I264-F312 HydrophobicContact CD1-CD2 3.51Å; I264-F312 HydrophobicContact CD1-CE2 4.13Å; I264-F312 HydrophobicContact CD1-CG 4.33Å; I264-F312 HydrophobicContact CG1-CD2 3.48Å; I264-F312 VanDerWaalsContact CG1-CD2 3.48Å; I264-F312 HydrophobicContact CG1-CE2 3.59Å; I264-K320 HydrophobicContact CD1-CD 4.37Å
265	N	88.3	Confident	82.1	Confident	33 Å²	33	33.2 Å²	33.2	18%	0.176	18%	0.182	C	C	.	.	H	α-helix	trans	-86.8	-4.7	-176.3	-76.2	-63.3	0	0	0	114.3	L261 L262 P267 L268 H309 S323	L261-N265 PolarHBondContact O-N 3.31Å; L261-N265 PolarHBondContact O-ND2 3.35Å; L262-N265 PolarHBondContact O-N 2.78Å; N265-P267 VanDerWaalsContact C-N 3.32Å; N265-L268 WeakPolarHBondContact O-CB 3.49Å; N265-L268 PolarHBondContact O-N 2.84Å; N265-H309 PolarHBondContact OD1-CE1 2.63Å; N265-H309 PolarHBondContact OD1-NE2 2.83Å; N265-S323 PolarHBondContact ND2-OG 3.48Å; N265-S323 PolarHBondContact OD1-OG 3.16Å
266	L	87.4	Confident	80.9	Confident	14 Å²	14	37.4 Å²	37.4	7%	0.073	20%	0.197	C	C	.	.	H	α-helix	trans	-53.8	-38.1	179.7	-160.6	71.6	0	0	0	114	F200 Y221 C225 V229 L262 L263 L268	F200-L266 HydrophobicContact CD1-CD2 4.41Å; F200-L266 HydrophobicContact CD2-CB 4.08Å; F200-L266 HydrophobicContact CD2-CD2 3.6Å; F200-L266 HydrophobicContact CD2-CG 3.77Å; F200-L266 HydrophobicContact CE2-CB 4.44Å; F200-L266 HydrophobicContact CE2-CD2 3.69Å; F200-L266 HydrophobicContact CE2-CG 3.71Å; F200-L266 HydrophobicContact CG-CD2 3.99Å; F200-L266 HydrophobicContact CZ-CD2 4.19Å; Y221-L266 WeakPolarHBondContact CE1-O 3.41Å; Y221-L266 PolarHBondContact OH-O 3.32Å; C225-L266 HydrophobicContact CB-CD1 3.99Å; C225-L266 HydrophobicContact CB-CD2 3.94Å; C225-L266 HydrophobicContact CB-CG 3.94Å; C225-L266 WeakPolarHBondContact SG-CD1 3.49Å; V229-L266 HydrophobicContact CG2-CD2 3.73Å; L262-L266 PolarHBondContact O-N 3.14Å; L262-L266 VanDerWaalsContact O-N 3.15Å; L263-L266 HydrophobicContact CD1-CD2 4.43Å; L263-L266 WeakPolarHBondContact O-CB 3.44Å; L266-L268 VanDerWaalsContact C-N 3.26Å; L266-L268 PolarHBondContact O-N 2.87Å
267	P	84.8	Confident	79.3	Confident	8 Å²	8	39 Å²	39	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-71.5	-17.8	177.4	-15.4	30.2	0	0	0	113.9	F200 L203 I264 N265 I270 V305	F200-P267 HydrophobicContact CB-CG 4.33Å; F200-P267 HydrophobicContact CD2-CG 4.15Å; L203-P267 HydrophobicContact CB-CB 4.07Å; L203-P267 HydrophobicContact CD1-CB 3.38Å; L203-P267 HydrophobicContact CD1-CG 3.76Å; L203-P267 HydrophobicContact CG-CB 4.35Å; I264-P267 VanDerWaalsContact O-CD 3.28Å; I264-P267 WeakPolarHBondContact O-CD 3.41Å; N265-P267 VanDerWaalsContact C-N 3.32Å; P267-I270 WeakPolarHBondContact O-CB 3.32Å; P267-I270 PolarHBondContact O-N 2.89Å; P267-V305 HydrophobicContact CB-CG2 3.91Å
268	L	85.2	Confident	77.3	Confident	35 Å²	35	42.2 Å²	42.2	18%	0.183	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-41.3	-179.8	179.9	64.7	0	0	0	112.3	N265 L266 I270 M271 L272 V305 L327	N265-L268 WeakPolarHBondContact O-CB 3.49Å; N265-L268 PolarHBondContact O-N 2.84Å; L266-L268 VanDerWaalsContact C-N 3.26Å; L266-L268 PolarHBondContact O-N 2.87Å; L268-I270 PolarHBondContact O-N 2.78Å; L268-M271 WeakPolarHBondContact O-CB 3.48Å; L268-M271 PolarHBondContact O-N 3.01Å; L268-L272 HydrophobicContact CD2-CD1 4.21Å; L268-L272 HydrophobicContact CG-CD1 4.03Å; L268-L272 HydrophobicContact CG-CG 4.3Å; L268-L272 PolarHBondContact O-N 3.24Å; L268-L272 VanDerWaalsContact O-N 3.1Å; L268-V305 HydrophobicContact CB-CG1 4.43Å; L268-L327 HydrophobicContact CD1-CD2 3.28Å; L268-L327 HydrophobicContact CD2-CD2 3.4Å; L268-L327 VanDerWaalsContact CD2-CD2 3.4Å; L268-L327 HydrophobicContact CG-CD2 3.87Å
269	G	80.4	Confident	75	Confident	11 Å²	11	42.5 Å²	42.5	11%	0.113	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-21.6	-178	0	0	0	0	0	112.8	Y221 M271 L272 T273	Y221-G269 WeakPolarHBondContact OH-CA 3.35Å; Y221-G269 PolarHBondContact OH-N 3.01Å; G269-M271 VanDerWaalsContact C-N 3.29Å; G269-M271 PolarHBondContact O-N 3.4Å; G269-L272 PolarHBondContact O-N 2.82Å; G269-T273 VanDerWaalsContact O-CG2 3.31Å; G269-T273 WeakPolarHBondContact O-CG2 3.36Å; G269-T273 PolarHBondContact O-N 2.73Å; G269-T273 PolarHBondContact O-OG1 2.96Å
270	I	78.1	Confident	72.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-40.1	170.2	-52.3	-178.4	0	0	0	110.1	F200 N204 A207 F218 Y221 P267 L268 T273 N274	F200-I270 HydrophobicContact CD2-CD1 4.26Å; F200-I270 HydrophobicContact CE2-CD1 3.75Å; F200-I270 HydrophobicContact CE2-CG1 4.42Å; F200-I270 HydrophobicContact CZ-CD1 4.38Å; N204-I270 HydrophobicContact CB-CD1 3.93Å; A207-I270 HydrophobicContact CB-CG2 3.49Å; A207-I270 VanDerWaalsContact CB-CG2 3.49Å; F218-I270 HydrophobicContact CD2-CG2 3.72Å; F218-I270 HydrophobicContact CE2-CG2 3.33Å; Y221-I270 HydrophobicContact CD1-CG1 3.89Å; Y221-I270 HydrophobicContact CE1-CG1 3.74Å; Y221-I270 VanDerWaalsContact CE1-N 3.26Å; P267-I270 WeakPolarHBondContact O-CB 3.32Å; P267-I270 PolarHBondContact O-N 2.89Å; L268-I270 PolarHBondContact O-N 2.78Å; I270-T273 PolarHBondContact O-OG1 3.41Å; I270-N274 PolarHBondContact O-ND2 3.35Å
271	M	76.3	Confident	70.4	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-73.6	-43	178.4	-59	-59.6	108.3	0	0	111.6	A207 F211 L268 G269 T273 N274 L275 M301 I302	A207-M271 HydrophobicContact CB-CE 3.71Å; F211-M271 HydrophobicContact CE2-CE 3.95Å; F211-M271 HydrophobicContact CE2-SD 4.21Å; F211-M271 HydrophobicContact CZ-SD 4.33Å; L268-M271 WeakPolarHBondContact O-CB 3.48Å; L268-M271 PolarHBondContact O-N 3.01Å; G269-M271 VanDerWaalsContact C-N 3.29Å; G269-M271 PolarHBondContact O-N 3.4Å; M271-T273 VanDerWaalsContact C-N 3.34Å; M271-T273 PolarHBondContact O-N 3.27Å; M271-N274 PolarHBondContact O-N 2.9Å; M271-L275 PolarHBondContact O-N 2.93Å; M271-M301 HydrophobicContact CE-CB 4.17Å; M271-M301 HydrophobicContact CE-CG 4.25Å; M271-M301 HydrophobicContact CG-CB 4.21Å; M271-M301 HydrophobicContact SD-CB 3.34Å; M271-M301 WeakPolarHBondContact SD-CB 3.32Å; M271-M301 HydrophobicContact SD-CG 3.84Å; M271-I302 HydrophobicContact CG-CG1 4.37Å
272	L	77.7	Confident	67.8	Low	98 Å²	98	61.5 Å²	61.5	51%	0.513	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-35.3	-178.7	-66.8	174.4	0	0	0	113.1	L268 G269 N274 L275 H276	L268-L272 HydrophobicContact CD2-CD1 4.21Å; L268-L272 HydrophobicContact CG-CD1 4.03Å; L268-L272 HydrophobicContact CG-CG 4.3Å; L268-L272 PolarHBondContact O-N 3.24Å; L268-L272 VanDerWaalsContact O-N 3.1Å; G269-L272 PolarHBondContact O-N 2.82Å; L272-N274 VanDerWaalsContact C-N 3.3Å; L272-N274 PolarHBondContact O-N 3.07Å; L272-L275 HydrophobicContact CD2-CD1 4.24Å; L272-L275 PolarHBondContact O-N 2.91Å; L272-H276 PolarHBondContact O-N 2.98Å
273	T	75.9	Confident	65.1	Low	27 Å²	27	60.4 Å²	60.4	17%	0.166	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-34.3	176.1	47	0	0	0	0	112.4	N215 Y221 G269 I270 M271 L275 H276	N215-T273 PolarHBondContact ND2-O 2.7Å; Y221-T273 HydrophobicContact CG-CG2 4.22Å; G269-T273 VanDerWaalsContact O-CG2 3.31Å; G269-T273 WeakPolarHBondContact O-CG2 3.36Å; G269-T273 PolarHBondContact O-N 2.73Å; G269-T273 PolarHBondContact O-OG1 2.96Å; I270-T273 PolarHBondContact O-OG1 3.41Å; M271-T273 VanDerWaalsContact C-N 3.34Å; M271-T273 PolarHBondContact O-N 3.27Å; T273-L275 VanDerWaalsContact C-N 3.27Å; T273-L275 PolarHBondContact O-N 3.27Å; T273-H276 PolarHBondContact O-N 3.21Å
274	N	69.8	Low	62.7	Low	17 Å²	17	64.1 Å²	64.1	9%	0.091	35%	0.346	C	S	.	.	H	α-helix	trans	-76.5	-11.5	176.4	-73.1	-65.7	0	0	0	113.8	F211 F218 I270 M271 L272	F211-N274 WeakPolarHBondContact CB-OD1 3.46Å; F211-N274 HydrophobicContact CD1-CB 3.91Å; F211-N274 HydrophobicContact CD2-CB 4.12Å; F211-N274 VanDerWaalsContact CD2-CG 3.44Å; F211-N274 VanDerWaalsContact CD2-ND2 3.27Å; F211-N274 WeakPolarHBondContact CD2-ND2 3.49Å; F211-N274 HydrophobicContact CE1-CB 3.98Å; F211-N274 HydrophobicContact CE2-CB 4.17Å; F211-N274 HydrophobicContact CG-CB 4.02Å; F211-N274 VanDerWaalsContact CG-CG 3.43Å; F211-N274 WeakPolarHBondContact CG-OD1 3.19Å; F211-N274 HydrophobicContact CZ-CB 4.12Å; F218-N274 WeakPolarHBondContact CD2-ND2 3.42Å; I270-N274 PolarHBondContact O-ND2 3.35Å; M271-N274 PolarHBondContact O-N 2.9Å; L272-N274 VanDerWaalsContact C-N 3.3Å; L272-N274 PolarHBondContact O-N 3.07Å
275	L	67.4	Low	60.2	Low	76 Å²	76	69.6 Å²	69.6	40%	0.398	38%	0.375	S	S	.	.	H	α-helix	trans	-87.4	-18.2	172.5	-69	169.6	0	0	0	113.1	M271 L272 T273 I298 L334	M271-L275 PolarHBondContact O-N 2.93Å; L272-L275 HydrophobicContact CD2-CD1 4.24Å; L272-L275 PolarHBondContact O-N 2.91Å; T273-L275 VanDerWaalsContact C-N 3.27Å; T273-L275 PolarHBondContact O-N 3.27Å; L275-I298 HydrophobicContact CD2-CD1 4.17Å; L275-L334 HydrophobicContact CD1-CD1 4.09Å; L275-L334 HydrophobicContact CD1-CD2 4.34Å; L275-L334 HydrophobicContact CD2-CD1 3.51Å; L275-L334 HydrophobicContact CD2-CD2 4.2Å; L275-L334 HydrophobicContact CG-CD1 4.46Å
276	H	59.4	Low	57.9	Low	136 Å²	136	74 Å²	74	63%	0.63	39%	0.394	S	S	*	.			trans	-98.4	110.7	-174.1	-160.5	70.1	0	0	0	111.8	N215 L272 T273	N215-H276 PolarHBondContact ND2-O 2.67Å; L272-H276 PolarHBondContact O-N 2.98Å; T273-H276 PolarHBondContact O-N 3.21Å
277	C	47.4	Very low	55.8	Low	59 Å²	59	76.1 Å²	76.1	40%	0.399	41%	0.408	S	S	.	.			trans	-95.1	140.8	167.6	-155.4	0	0	0	0	109.7
278	P	43.4	Very low	53.7	Low	97 Å²	97	77.8 Å²	77.8	63%	0.63	42%	0.418	S	S	*	.			trans	-64.7	142	-175.2	-16.7	30.8	0	0	0	113.3	E280 Q281	P278-E280 PolarHBondContact O-N 3.27Å; P278-Q281 PolarHBondContact O-N 3.5Å
279	A	37.5	Very low	51.7	Low	93 Å²	93	83.1 Å²	83.1	77%	0.769	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	19.6	-162.7	0	0	0	0	0	118.6
280	E	38	Very low	50.4	Low	193 Å²	193	86.5 Å²	86.5	90%	0.902	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	1	173.2	-68.1	-158.6	167.4	0	0	114.4	P278	P278-E280 PolarHBondContact O-N 3.27Å
281	Q	35	Very low	49.6	Very low	149 Å²	149	88.6 Å²	88.6	70%	0.696	48%	0.482	S	S	*	.			trans	-134.4	53.1	171.6	-73.1	173.1	-13.4	0	0	109.8	P278 S283	P278-Q281 PolarHBondContact O-N 3.5Å; Q281-S283 PolarHBondContact O-N 2.94Å
282	F	31.6	Very low	49.1	Very low	143 Å²	143	95.1 Å²	95.1	63%	0.627	51%	0.512	S	S	*	.			trans	-72	52.3	160.5	-141.5	-86.2	0	0	0	109.3	F284	F282-F284 PolarHBondContact O-N 3.16Å
283	S	30.6	Very low	48.9	Very low	61 Å²	61	97 Å²	97	43%	0.427	52%	0.523	S	S	.	.			trans	-71.7	95.5	157.3	60.2	0	0	0	0	105.3	Q281 I285 Q286	Q281-S283 PolarHBondContact O-N 2.94Å; S283-I285 PolarHBondContact O-N 2.77Å; S283-Q286 PolarHBondContact O-N 3.44Å
284	F	36.4	Very low	48.8	Very low	82 Å²	82	98.6 Å²	98.6	36%	0.36	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-26.7	-31.3	162.4	-173.8	-108.7	0	0	0	113.5	F282 Q286 T287 V288 S341	F282-F284 PolarHBondContact O-N 3.16Å; F284-Q286 VanDerWaalsContact C-N 3.33Å; F284-Q286 PolarHBondContact O-N 2.98Å; F284-T287 PolarHBondContact O-N 3.43Å; F284-T287 PolarHBondContact O-OG1 3.3Å; F284-V288 HydrophobicContact CD1-CG2 3.61Å; F284-V288 HydrophobicContact CE1-CG2 3.62Å; F284-V288 HydrophobicContact CG-CG2 4.18Å; F284-V288 HydrophobicContact CZ-CG2 4.19Å; F284-V288 WeakPolarHBondContact O-CB 3.34Å; F284-V288 WeakPolarHBondContact O-CG2 3.48Å; F284-V288 PolarHBondContact O-N 2.93Å; F284-S341 WeakPolarHBondContact CZ-O 3.45Å
285	I	34.9	Very low	49.1	Very low	126 Å²	126	98.9 Å²	98.9	65%	0.646	53%	0.528	S	S	*	.	H	α-helix	trans	-49.8	-33.3	173.2	-56.7	176.1	0	0	0	115.4	S283 N289	S283-I285 PolarHBondContact O-N 2.77Å; I285-N289 PolarHBondContact O-N 3.42Å
286	Q	38.2	Very low	49.7	Very low	125 Å²	125	98.9 Å²	98.9	58%	0.584	53%	0.528	S	S	*	.	H	α-helix	trans	-84.8	-31.6	-178.1	-159	166.8	-7.7	0	0	113.2	S283 F284	S283-Q286 PolarHBondContact O-N 3.44Å; F284-Q286 VanDerWaalsContact C-N 3.33Å; F284-Q286 PolarHBondContact O-N 2.98Å
287	T	42.9	Very low	50.8	Low	59 Å²	59	94.7 Å²	94.7	36%	0.362	51%	0.508	S	S	.	.	H	α-helix	trans	-70.2	-32.4	166.8	22.1	0	0	0	0	112.3	F284 N289 M290	F284-T287 PolarHBondContact O-N 3.43Å; F284-T287 PolarHBondContact O-OG1 3.3Å; T287-N289 PolarHBondContact O-N 3.38Å; T287-M290 WeakPolarHBondContact O-CB 3.5Å; T287-M290 WeakPolarHBondContact O-CG 3.39Å; T287-M290 PolarHBondContact O-N 3.33Å
288	V	42.5	Very low	52.4	Low	43 Å²	43	92.1 Å²	92.1	26%	0.261	49%	0.49	S	S	.	.	H	α-helix	trans	-68.8	-20.1	177	170.8	0	0	0	0	112.3	F284	F284-V288 HydrophobicContact CD1-CG2 3.61Å; F284-V288 HydrophobicContact CE1-CG2 3.62Å; F284-V288 HydrophobicContact CG-CG2 4.18Å; F284-V288 HydrophobicContact CZ-CG2 4.19Å; F284-V288 WeakPolarHBondContact O-CB 3.34Å; F284-V288 WeakPolarHBondContact O-CG2 3.48Å; F284-V288 PolarHBondContact O-N 2.93Å
289	N	42.7	Very low	54.4	Low	147 Å²	147	88 Å²	88	79%	0.786	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	13.2	177.8	-140.2	17.6	0	0	0	113.8	I285 T287 G291	I285-N289 PolarHBondContact O-N 3.42Å; T287-N289 PolarHBondContact O-N 3.38Å; N289-G291 PolarHBondContact O-N 3.16Å; N289-G291 VanDerWaalsContact O-N 3.07Å
290	M	53.8	Low	56.7	Low	81 Å²	81	88.3 Å²	88.3	40%	0.399	45%	0.451	S	S	.	.			trans	-71.9	100.9	170.8	-66.1	-65.4	-173.3	0	0	108.3	T287 Y294	T287-M290 WeakPolarHBondContact O-CB 3.5Å; T287-M290 WeakPolarHBondContact O-CG 3.39Å; T287-M290 PolarHBondContact O-N 3.33Å; M290-Y294 HydrophobicContact CB-CD1 4.17Å; M290-Y294 HydrophobicContact CE-CD1 4.45Å; M290-Y294 HydrophobicContact CE-CE1 3.81Å; M290-Y294 HydrophobicContact CG-CD1 4.12Å; M290-Y294 HydrophobicContact CG-CE1 4.32Å; M290-Y294 HydrophobicContact SD-CD1 3.39Å; M290-Y294 WeakPolarHBondContact SD-CD1 2.83Å; M290-Y294 HydrophobicContact SD-CD2 4.4Å; M290-Y294 HydrophobicContact SD-CE1 3.32Å; M290-Y294 WeakPolarHBondContact SD-CE1 3.44Å; M290-Y294 HydrophobicContact SD-CE2 4.34Å; M290-Y294 HydrophobicContact SD-CG 3.94Å
291	G	59.9	Low	59	Low	44 Å²	44	79.7 Å²	79.7	45%	0.454	41%	0.411	S	S	.	.			trans	-56.3	151.4	177.1	0	0	0	0	0	111.7	N289 N293 Y294	N289-G291 PolarHBondContact O-N 3.16Å; N289-G291 VanDerWaalsContact O-N 3.07Å; G291-N293 PolarHBondContact O-N 3.09Å; G291-Y294 WeakPolarHBondContact O-CB 3.39Å; G291-Y294 PolarHBondContact O-N 3.06Å
292	E	66.9	Low	61.5	Low	141 Å²	141	73.1 Å²	73.1	66%	0.659	38%	0.381	S	S	*	.	H	α-helix	trans	-49.5	-34.9	-179.5	-62.9	179.2	156.3	0	0	112.7	Y294 L295 L296	E292-Y294 VanDerWaalsContact C-N 3.31Å; E292-Y294 PolarHBondContact O-N 3.26Å; E292-L295 PolarHBondContact O-N 3.38Å; E292-L296 PolarHBondContact O-N 3.41Å
293	N	72.7	Confident	64.2	Low	137 Å²	137	67.3 Å²	67.3	73%	0.733	36%	0.356	S	S	*	.	H	α-helix	trans	-60.2	-35.5	175.9	-64.6	-32.5	0	0	0	113.7	G291 F297	G291-N293 PolarHBondContact O-N 3.09Å; N293-F297 WeakPolarHBondContact O-CB 3.23Å; N293-F297 PolarHBondContact O-N 3.45Å
294	Y	73.8	Confident	67	Low	61 Å²	61	67.1 Å²	67.1	24%	0.239	35%	0.349	C	S	.	.	H	α-helix	trans	-73.1	-42.3	-179	-174.4	-94.2	0	0	0	111.6	F211 M290 G291 E292 F297 I298	F211-Y294 HydrophobicContact CD1-CD2 4.48Å; F211-Y294 AromaticContact CD1-CE2 3.36Å; F211-Y294 HydrophobicContact CD1-CE2 3.36Å; F211-Y294 AromaticContact CD1-CZ 3.51Å; F211-Y294 WeakPolarHBondContact CD1-OH 3.02Å; F211-Y294 HydrophobicContact CE1-CD2 4.33Å; F211-Y294 HydrophobicContact CE1-CE1 4.21Å; F211-Y294 AromaticContact CE1-CE2 3.43Å; F211-Y294 HydrophobicContact CE1-CE2 3.43Å; F211-Y294 VanDerWaalsContact CE1-CE2 3.43Å; F211-Y294 AromaticContact CE1-CZ 3.35Å; F211-Y294 WeakPolarHBondContact CE1-OH 3.41Å; M290-Y294 HydrophobicContact CB-CD1 4.17Å; M290-Y294 HydrophobicContact CE-CD1 4.45Å; M290-Y294 HydrophobicContact CE-CE1 3.81Å; M290-Y294 HydrophobicContact CG-CD1 4.12Å; M290-Y294 HydrophobicContact CG-CE1 4.32Å; M290-Y294 HydrophobicContact SD-CD1 3.39Å; M290-Y294 WeakPolarHBondContact SD-CD1 2.83Å; M290-Y294 HydrophobicContact SD-CD2 4.4Å; M290-Y294 HydrophobicContact SD-CE1 3.32Å; M290-Y294 WeakPolarHBondContact SD-CE1 3.44Å; M290-Y294 HydrophobicContact SD-CE2 4.34Å; M290-Y294 HydrophobicContact SD-CG 3.94Å; G291-Y294 WeakPolarHBondContact O-CB 3.39Å; G291-Y294 PolarHBondContact O-N 3.06Å; E292-Y294 VanDerWaalsContact C-N 3.31Å; E292-Y294 PolarHBondContact O-N 3.26Å; Y294-F297 PolarHBondContact O-N 3.37Å; Y294-I298 HydrophobicContact CD1-CD1 3.72Å; Y294-I298 HydrophobicContact CE1-CD1 3.29Å; Y294-I298 HydrophobicContact CE1-CG1 4.32Å; Y294-I298 PolarHBondContact O-N 3.09Å; Y294-I298 VanDerWaalsContact O-N 3.07Å
295	L	75.4	Confident	69.6	Low	23 Å²	23	63.4 Å²	63.4	12%	0.12	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-45.4	174.4	-179.5	63.6	0	0	0	110.8	E292 F297 I298 C299 C338	E292-L295 PolarHBondContact O-N 3.38Å; L295-F297 VanDerWaalsContact C-N 3.3Å; L295-F297 PolarHBondContact O-N 3.4Å; L295-I298 PolarHBondContact O-N 2.93Å; L295-C299 PolarHBondContact O-N 3.45Å; L295-C299 PolarHBondContact O-SG 3.11Å; L295-C338 HydrophobicContact CD1-CB 4.21Å; L295-C338 HydrophobicContact CD2-CB 4.2Å
296	L	80.6	Confident	72.3	Confident	76 Å²	76	57.4 Å²	57.4	40%	0.398	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-42.7	176.4	-176.3	66.4	0	0	0	111.6	E292 C299 L300 F393	E292-L296 PolarHBondContact O-N 3.41Å; L296-C299 PolarHBondContact O-N 3.05Å; L296-L300 HydrophobicContact CG-CD1 4.29Å; L296-L300 WeakPolarHBondContact O-CG 3.34Å; L296-L300 PolarHBondContact O-N 3.13Å; L296-F393 HydrophobicContact CD1-CE2 4.28Å; L296-F393 HydrophobicContact CD1-CZ 4.36Å
297	F	82.9	Confident	74.8	Confident	49 Å²	49	55.9 Å²	55.9	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-46.6	177.2	-177.6	-102.9	0	0	0	112.4	L206 F211 N293 Y294 L295 C299 L300 M301	L206-F297 HydrophobicContact CB-CZ 4.26Å; L206-F297 WeakPolarHBondContact O-CZ 3.16Å; F211-F297 HydrophobicContact CD2-CE1 4.48Å; F211-F297 HydrophobicContact CE1-CD1 4.32Å; F211-F297 HydrophobicContact CE1-CE1 4.48Å; F211-F297 HydrophobicContact CE2-CD1 4.36Å; F211-F297 AromaticContact CE2-CE1 3.8Å; F211-F297 HydrophobicContact CE2-CE1 3.8Å; F211-F297 AromaticContact CZ-CD1 3.87Å; F211-F297 HydrophobicContact CZ-CD1 3.87Å; F211-F297 AromaticContact CZ-CE1 3.79Å; F211-F297 HydrophobicContact CZ-CE1 3.79Å; N293-F297 WeakPolarHBondContact O-CB 3.23Å; N293-F297 PolarHBondContact O-N 3.45Å; Y294-F297 PolarHBondContact O-N 3.37Å; L295-F297 VanDerWaalsContact C-N 3.3Å; L295-F297 PolarHBondContact O-N 3.4Å; F297-C299 VanDerWaalsContact C-N 3.33Å; F297-C299 PolarHBondContact O-N 3.4Å; F297-L300 PolarHBondContact O-N 2.65Å; F297-M301 HydrophobicContact CD1-CG 4.47Å; F297-M301 HydrophobicContact CE1-CG 4.08Å; F297-M301 HydrophobicContact CE2-CE 4.49Å; F297-M301 HydrophobicContact CE2-CG 4.44Å; F297-M301 HydrophobicContact CZ-CG 4.05Å; F297-M301 HydrophobicContact CZ-SD 4.25Å; F297-M301 WeakPolarHBondContact O-CG 2.85Å; F297-M301 PolarHBondContact O-N 2.89Å; F297-M301 VanDerWaalsContact O-N 3.08Å
298	I	81.4	Confident	77.1	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-42.2	175.9	-67.9	168.9	0	0	0	111	F211 L275 Y294 L295 L300 M301 I302 L334	F211-I298 HydrophobicContact CE1-CD1 4.16Å; F211-I298 HydrophobicContact CE1-CG1 3.93Å; F211-I298 HydrophobicContact CZ-CD1 4.44Å; F211-I298 HydrophobicContact CZ-CG1 3.8Å; L275-I298 HydrophobicContact CD2-CD1 4.17Å; Y294-I298 HydrophobicContact CD1-CD1 3.72Å; Y294-I298 HydrophobicContact CE1-CD1 3.29Å; Y294-I298 HydrophobicContact CE1-CG1 4.32Å; Y294-I298 PolarHBondContact O-N 3.09Å; Y294-I298 VanDerWaalsContact O-N 3.07Å; L295-I298 PolarHBondContact O-N 2.93Å; I298-L300 PolarHBondContact O-N 3.4Å; I298-M301 PolarHBondContact O-N 3.13Å; I298-I302 HydrophobicContact CG2-CD1 3.75Å; I298-I302 HydrophobicContact CG2-CG1 4.37Å; I298-I302 WeakPolarHBondContact O-CG1 3.36Å; I298-I302 PolarHBondContact O-N 2.94Å; I298-L334 HydrophobicContact CG2-CD2 3.57Å
299	C	83.9	Confident	79.4	Confident	10 Å²	10	51.4 Å²	51.4	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-47.1	178.2	-65.9	0	0	0	0	111.5	L295 L296 F297 M301 I302 M303 L331	L295-C299 PolarHBondContact O-N 3.45Å; L295-C299 PolarHBondContact O-SG 3.11Å; L296-C299 PolarHBondContact O-N 3.05Å; F297-C299 VanDerWaalsContact C-N 3.33Å; F297-C299 PolarHBondContact O-N 3.4Å; C299-M301 VanDerWaalsContact C-N 3.33Å; C299-M301 PolarHBondContact O-N 3.01Å; C299-I302 PolarHBondContact O-N 3.36Å; C299-M303 WeakPolarHBondContact O-CB 3.34Å; C299-M303 VanDerWaalsContact O-CG 3.23Å; C299-M303 WeakPolarHBondContact O-CG 3.49Å; C299-M303 PolarHBondContact O-N 2.96Å; C299-L331 HydrophobicContact CB-CD1 4Å
300	L	86.7	Confident	81.7	Confident	100 Å²	100	46.2 Å²	46.2	52%	0.524	24%	0.242	S	C	.	.	H	α-helix	trans	-61.7	-39.5	178.1	-71	172.8	0	0	0	112.5	L296 F297 I298 M303 M304	L296-L300 HydrophobicContact CG-CD1 4.29Å; L296-L300 WeakPolarHBondContact O-CG 3.34Å; L296-L300 PolarHBondContact O-N 3.13Å; F297-L300 PolarHBondContact O-N 2.65Å; I298-L300 PolarHBondContact O-N 3.4Å; L300-M303 PolarHBondContact O-N 3.1Å; L300-M304 PolarHBondContact O-N 3.25Å
301	M	85.9	Confident	83.4	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.064	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-44	177.2	-68.2	-62.9	95.9	0	0	112	L203 L206 M271 F297 I298 C299 M303 M304 V305	L203-M301 HydrophobicContact CD2-CE 4.18Å; L203-M301 HydrophobicContact CD2-SD 3.43Å; L203-M301 WeakPolarHBondContact CD2-SD 3.31Å; L206-M301 HydrophobicContact CB-CE 4.46Å; L206-M301 HydrophobicContact CB-SD 3.89Å; L206-M301 HydrophobicContact CD1-CE 3.69Å; L206-M301 HydrophobicContact CD1-SD 3.97Å; M271-M301 HydrophobicContact CE-CB 4.17Å; M271-M301 HydrophobicContact CE-CG 4.25Å; M271-M301 HydrophobicContact CG-CB 4.21Å; M271-M301 HydrophobicContact SD-CB 3.34Å; M271-M301 WeakPolarHBondContact SD-CB 3.32Å; M271-M301 HydrophobicContact SD-CG 3.84Å; F297-M301 HydrophobicContact CD1-CG 4.47Å; F297-M301 HydrophobicContact CE1-CG 4.08Å; F297-M301 HydrophobicContact CE2-CE 4.49Å; F297-M301 HydrophobicContact CE2-CG 4.44Å; F297-M301 HydrophobicContact CZ-CG 4.05Å; F297-M301 HydrophobicContact CZ-SD 4.25Å; F297-M301 WeakPolarHBondContact O-CG 2.85Å; F297-M301 PolarHBondContact O-N 2.89Å; F297-M301 VanDerWaalsContact O-N 3.08Å; I298-M301 PolarHBondContact O-N 3.13Å; C299-M301 VanDerWaalsContact C-N 3.33Å; C299-M301 PolarHBondContact O-N 3.01Å; M301-M303 VanDerWaalsContact C-N 3.3Å; M301-M303 PolarHBondContact O-N 3.39Å; M301-M304 PolarHBondContact O-N 2.85Å; M301-V305 WeakPolarHBondContact O-CG2 3.3Å; M301-V305 PolarHBondContact O-N 3.11Å; M301-V305 VanDerWaalsContact O-N 3.09Å
302	I	87.2	Confident	84.7	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-39.5	176.1	-66.4	169.6	0	0	0	110.6	M271 I298 C299 M304 V305 M306 L331 L334	M271-I302 HydrophobicContact CG-CG1 4.37Å; I298-I302 HydrophobicContact CG2-CD1 3.75Å; I298-I302 HydrophobicContact CG2-CG1 4.37Å; I298-I302 WeakPolarHBondContact O-CG1 3.36Å; I298-I302 PolarHBondContact O-N 2.94Å; C299-I302 PolarHBondContact O-N 3.36Å; I302-M304 PolarHBondContact O-N 3.49Å; I302-V305 WeakPolarHBondContact O-CB 3.49Å; I302-V305 PolarHBondContact O-N 3.06Å; I302-M306 WeakPolarHBondContact O-CG 3.36Å; I302-M306 PolarHBondContact O-N 3.3Å; I302-L331 HydrophobicContact CB-CD1 4.27Å; I302-L331 HydrophobicContact CD1-CD1 3.97Å; I302-L331 HydrophobicContact CG2-CB 4.05Å; I302-L331 HydrophobicContact CG2-CD1 4.38Å; I302-L331 HydrophobicContact CG2-CD2 4.16Å; I302-L331 HydrophobicContact CG2-CG 4.44Å; I302-L334 HydrophobicContact CD1-CD2 4.21Å
303	M	88.8	Confident	85.5	Confident	21 Å²	21	36.1 Å²	36.1	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-41.2	174.6	-70.7	-62.6	-67.6	0	0	112.2	C299 L300 M301 V305 M306 F307 L331 V400 V401 S404	C299-M303 WeakPolarHBondContact O-CB 3.34Å; C299-M303 VanDerWaalsContact O-CG 3.23Å; C299-M303 WeakPolarHBondContact O-CG 3.49Å; C299-M303 PolarHBondContact O-N 2.96Å; L300-M303 PolarHBondContact O-N 3.1Å; M301-M303 VanDerWaalsContact C-N 3.3Å; M301-M303 PolarHBondContact O-N 3.39Å; M303-V305 VanDerWaalsContact C-N 3.3Å; M303-V305 PolarHBondContact O-N 3.12Å; M303-M306 WeakPolarHBondContact O-CB 3.38Å; M303-M306 PolarHBondContact O-N 3.39Å; M303-M306 VanDerWaalsContact O-N 3.14Å; M303-M306 HydrophobicContact SD-SD 3.75Å; M303-F307 HydrophobicContact CE-CE2 4.15Å; M303-F307 WeakPolarHBondContact O-CD2 3.37Å; M303-F307 PolarHBondContact O-N 3.09Å; M303-L331 HydrophobicContact CG-CD2 4.02Å; M303-L331 HydrophobicContact SD-CD2 3.74Å; M303-V400 HydrophobicContact CE-CG1 3.9Å; M303-V401 HydrophobicContact SD-CG2 3.91Å; M303-S404 VanDerWaalsContact CE-CB 3.45Å; M303-S404 WeakPolarHBondContact CE-OG 3.48Å
304	M	89.8	Confident	85.8	Confident	57 Å²	57	30.4 Å²	30.4	28%	0.281	15%	0.154	S	C	.	.	H	α-helix	trans	-63.3	-35.4	175.1	-174.8	172.2	172.5	0	0	112.3	M199 V202 L203 L300 M301 I302 F307 G308	M199-M304 HydrophobicContact CE-CE 4.17Å; M199-M304 HydrophobicContact CE-CG 4.09Å; M199-M304 WeakPolarHBondContact CE-O 3.13Å; V202-M304 HydrophobicContact CG1-CE 4.04Å; L203-M304 HydrophobicContact CD1-CE 4.49Å; L203-M304 HydrophobicContact CD1-CG 4.28Å; L203-M304 HydrophobicContact CD1-SD 4.44Å; L203-M304 HydrophobicContact CD2-CB 4.03Å; L203-M304 HydrophobicContact CD2-CE 4.15Å; L203-M304 HydrophobicContact CD2-CG 3.85Å; L203-M304 HydrophobicContact CD2-SD 3.34Å; L203-M304 WeakPolarHBondContact CD2-SD 3.47Å; L203-M304 HydrophobicContact CG-CE 3.98Å; L203-M304 HydrophobicContact CG-CG 4.33Å; L203-M304 HydrophobicContact CG-SD 3.86Å; L300-M304 PolarHBondContact O-N 3.25Å; M301-M304 PolarHBondContact O-N 2.85Å; I302-M304 PolarHBondContact O-N 3.49Å; M304-F307 PolarHBondContact O-N 3.04Å; M304-G308 PolarHBondContact O-N 2.89Å
305	V	90.4	Very high	86.3	Confident	4 Å²	4	27.9 Å²	27.9	2%	0.024	15%	0.145	C	C	.	.	H	α-helix	trans	-67.5	-38.7	172	180	0	0	0	0	111.7	L203 P267 L268 M301 I302 M303 G308 H309 L327	L203-V305 HydrophobicContact CD1-CG2 3.86Å; P267-V305 HydrophobicContact CB-CG2 3.91Å; L268-V305 HydrophobicContact CB-CG1 4.43Å; M301-V305 WeakPolarHBondContact O-CG2 3.3Å; M301-V305 PolarHBondContact O-N 3.11Å; M301-V305 VanDerWaalsContact O-N 3.09Å; I302-V305 WeakPolarHBondContact O-CB 3.49Å; I302-V305 PolarHBondContact O-N 3.06Å; M303-V305 VanDerWaalsContact C-N 3.3Å; M303-V305 PolarHBondContact O-N 3.12Å; V305-G308 PolarHBondContact O-N 3.48Å; V305-H309 PolarHBondContact O-ND1 2.92Å; V305-L327 HydrophobicContact CG1-CD1 3.91Å
306	M	91.5	Very high	87	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-49.5	172.8	-71.2	177.5	65.7	0	0	110.8	I302 M303 G308 H309 L327 V401 F405 I408	I302-M306 WeakPolarHBondContact O-CG 3.36Å; I302-M306 PolarHBondContact O-N 3.3Å; M303-M306 WeakPolarHBondContact O-CB 3.38Å; M303-M306 PolarHBondContact O-N 3.39Å; M303-M306 VanDerWaalsContact O-N 3.14Å; M303-M306 HydrophobicContact SD-SD 3.75Å; M306-G308 PolarHBondContact O-N 3.46Å; M306-H309 VanDerWaalsContact O-CB 3.31Å; M306-H309 WeakPolarHBondContact O-CB 3.21Å; M306-H309 PolarHBondContact O-N 3.41Å; M306-H309 PolarHBondContact O-ND1 2.71Å; M306-L327 HydrophobicContact CG-CB 3.99Å; M306-L327 HydrophobicContact CG-CD1 4.45Å; M306-V401 HydrophobicContact CE-CG1 4.38Å; M306-F405 HydrophobicContact CE-CB 4.44Å; M306-I408 HydrophobicContact CB-CD1 3.89Å; M306-I408 WeakPolarHBondContact O-CD1 3.37Å
307	F	92	Very high	87.4	Confident	93 Å²	93	30.3 Å²	30.3	41%	0.408	15%	0.149	S	C	.	.	H	α-helix	trans	-62.6	-29	176	-77	-70.5	0	0	0	113.4	M303 M304 H309 V310 L407 I408	M303-F307 HydrophobicContact CE-CE2 4.15Å; M303-F307 WeakPolarHBondContact O-CD2 3.37Å; M303-F307 PolarHBondContact O-N 3.09Å; M304-F307 PolarHBondContact O-N 3.04Å; F307-H309 PolarHBondContact O-N 3.49Å; F307-H309 VanDerWaalsContact O-N 3.16Å; F307-V310 WeakPolarHBondContact O-CB 3.43Å; F307-V310 WeakPolarHBondContact O-CG2 3.3Å; F307-V310 PolarHBondContact O-N 3Å; F307-V310 VanDerWaalsContact O-N 3.11Å; F307-L407 HydrophobicContact CE1-CD2 4.22Å; F307-I408 HydrophobicContact CD1-CD1 4.19Å; F307-I408 HydrophobicContact CD1-CG1 4.18Å; F307-I408 HydrophobicContact CE1-CD1 4.44Å; F307-I408 HydrophobicContact CE1-CG1 4.38Å; F307-I408 HydrophobicContact CG-CD1 4.49Å
308	G	90.3	Very high	87.7	Confident	8 Å²	8	36.5 Å²	36.5	8%	0.082	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-22.4	172.6	0	0	0	0	0	114.5	M304 V305 M306 V310 N311	M304-G308 PolarHBondContact O-N 2.89Å; V305-G308 PolarHBondContact O-N 3.48Å; M306-G308 PolarHBondContact O-N 3.46Å; G308-V310 PolarHBondContact O-N 2.65Å; G308-N311 WeakPolarHBondContact O-CB 2.91Å; G308-N311 PolarHBondContact O-N 2.89Å
309	H	91.7	Very high	88.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-7.3	175.9	-71.8	74.6	0	0	0	114.1	I264 N265 V305 M306 F307 N311 K320 S323 C324 L327 I408 N412	I264-H309 HydrophobicContact CG2-CB 4.44Å; N265-H309 PolarHBondContact OD1-CE1 2.63Å; N265-H309 PolarHBondContact OD1-NE2 2.83Å; V305-H309 PolarHBondContact O-ND1 2.92Å; M306-H309 VanDerWaalsContact O-CB 3.31Å; M306-H309 WeakPolarHBondContact O-CB 3.21Å; M306-H309 PolarHBondContact O-N 3.41Å; M306-H309 PolarHBondContact O-ND1 2.71Å; F307-H309 PolarHBondContact O-N 3.49Å; F307-H309 VanDerWaalsContact O-N 3.16Å; H309-N311 VanDerWaalsContact C-N 3.28Å; H309-K320 PolarHBondContact CD2-O 3.42Å; H309-S323 WeakPolarHBondContact NE2-CB 3.34Å; H309-S323 PolarHBondContact NE2-OG 3.34Å; H309-C324 HydrophobicContact CB-CB 4.44Å; H309-L327 WeakPolarHBondContact CE1-CD1 3.43Å; H309-I408 HydrophobicContact CB-CG2 4.36Å; H309-N412 PolarHBondContact O-ND2 3.27Å; H309-N412 PolarHBondContact O-OD1 3.3Å; H309-N412 VanDerWaalsContact O-OD1 3.07Å
310	V	90.7	Very high	88.5	Confident	37 Å²	37	38.2 Å²	38.2	22%	0.224	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-24	172.6	176.8	0	0	0	0	111.6	F307 G308 I408 V411 F415	F307-V310 WeakPolarHBondContact O-CB 3.43Å; F307-V310 WeakPolarHBondContact O-CG2 3.3Å; F307-V310 PolarHBondContact O-N 3Å; F307-V310 VanDerWaalsContact O-N 3.11Å; G308-V310 PolarHBondContact O-N 2.65Å; V310-I408 HydrophobicContact CG2-CG1 4.2Å; V310-I408 HydrophobicContact CG2-CG2 4.25Å; V310-V411 HydrophobicContact CG1-CG1 3.68Å; V310-V411 HydrophobicContact CG2-CG1 4.42Å; V310-F415 HydrophobicContact CG1-CD2 4.05Å; V310-F415 HydrophobicContact CG1-CE2 3.62Å
311	N	89.6	Confident	88.7	Confident	22 Å²	22	34 Å²	34	12%	0.118	16%	0.162	C	C	.	.			trans	-65.7	169.2	176.5	-162.9	5.9	0	0	0	111.5	D192 G308 H309 K320	D192-N311 WeakPolarHBondContact CA-OD1 3.5Å; D192-N311 WeakPolarHBondContact CB-OD1 3.08Å; D192-N311 PolarHBondContact O-ND2 3.37Å; D192-N311 PolarHBondContact OD1-OD1 3.38Å; G308-N311 WeakPolarHBondContact O-CB 2.91Å; G308-N311 PolarHBondContact O-N 2.89Å; H309-N311 VanDerWaalsContact C-N 3.28Å; N311-K320 PolarHBondContact O-NZ 3.08Å
312	F	86.7	Confident	89	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.018	17%	0.174	C	C	.	.			trans	56.9	65.7	-175.4	-58	-87.6	0	0	0	111.9	D192 V193 L263 I264 Q314 I315 K320	D192-F312 HydrophobicContact CB-CD1 3.66Å; D192-F312 HydrophobicContact CB-CE1 3.76Å; D192-F312 HydrophobicContact CB-CG 4.18Å; D192-F312 HydrophobicContact CB-CZ 4.35Å; D192-F312 WeakPolarHBondContact OD2-CA 3.46Å; V193-F312 HydrophobicContact CG2-CE1 4.13Å; V193-F312 HydrophobicContact CG2-CZ 4.46Å; L263-F312 HydrophobicContact CD2-CZ 4.04Å; I264-F312 HydrophobicContact CD1-CB 4.49Å; I264-F312 HydrophobicContact CD1-CD2 3.51Å; I264-F312 HydrophobicContact CD1-CE2 4.13Å; I264-F312 HydrophobicContact CD1-CG 4.33Å; I264-F312 HydrophobicContact CG1-CD2 3.48Å; I264-F312 VanDerWaalsContact CG1-CD2 3.48Å; I264-F312 HydrophobicContact CG1-CE2 3.59Å; F312-Q314 PolarHBondContact O-N 3.29Å; F312-I315 HydrophobicContact CB-CD1 3.82Å; F312-I315 HydrophobicContact CB-CG1 4.36Å; F312-I315 HydrophobicContact CG-CD1 4.35Å; F312-I315 PolarHBondContact O-N 3.34Å; F312-K320 PolarHBondContact O-NZ 3.39Å
313	S	82.7	Confident	89.2	Confident	28 Å²	28	36.1 Å²	36.1	20%	0.196	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.7	177.6	59.2	0	0	0	0	113	I315	S313-I315 PolarHBondContact O-N 3.16Å
314	Q	80.2	Confident	89.4	Confident	18 Å²	18	35.1 Å²	35.1	8%	0.084	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.8	-176.6	-46.2	-173	-2.8	0	0	114.2	S188 F312 F419	S188-Q314 PolarHBondContact OG-NE2 2.68Å; F312-Q314 PolarHBondContact O-N 3.29Å; Q314-F419 HydrophobicContact CB-CE1 4.23Å; Q314-F419 HydrophobicContact CB-CE2 4.44Å; Q314-F419 HydrophobicContact CB-CZ 4.13Å; Q314-F419 HydrophobicContact CG-CD2 4.2Å; Q314-F419 HydrophobicContact CG-CE1 4.42Å; Q314-F419 HydrophobicContact CG-CE2 3.75Å; Q314-F419 HydrophobicContact CG-CZ 3.86Å
315	I	84.8	Confident	89.6	Confident	7 Å²	7	37 Å²	37	4%	0.036	18%	0.179	C	C	.	.	S	Bend	trans	-103.4	154.8	-178.3	-74.5	175	0	0	0	110.2	H257 S260 F312 S313 S317 K320	H257-I315 VanDerWaalsContact ND1-CG2 3.33Å; H257-I315 WeakPolarHBondContact ND1-CG2 3.4Å; S260-I315 VanDerWaalsContact OG-CD1 3.29Å; S260-I315 WeakPolarHBondContact OG-CD1 3.26Å; F312-I315 HydrophobicContact CB-CD1 3.82Å; F312-I315 HydrophobicContact CB-CG1 4.36Å; F312-I315 HydrophobicContact CG-CD1 4.35Å; F312-I315 PolarHBondContact O-N 3.34Å; S313-I315 PolarHBondContact O-N 3.16Å; I315-S317 PolarHBondContact O-N 2.95Å; I315-K320 HydrophobicContact CB-CD 4.44Å; I315-K320 HydrophobicContact CG2-CD 4.01Å; I315-K320 HydrophobicContact CG2-CG 4.06Å
316	R	88.4	Confident	89.7	Confident	134 Å²	134	42.1 Å²	42.1	51%	0.506	21%	0.205	S	C	.	.			trans	-62.1	135.7	176.7	-168.8	172.8	-179.4	175.6	-1.7	109.5	H257 W318 P319	H257-R316 PolarHBondContact CE1-N 3.41Å; R316-W318 PolarHBondContact O-N 2.89Å; R316-P319 WeakPolarHBondContact O-CD 3.38Å
317	S	89.4	Confident	89.7	Confident	16 Å²	16	42.8 Å²	42.8	11%	0.112	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-43.4	-178.3	53.2	0	0	0	0	112.6	I315 K320 S321 E416	I315-S317 PolarHBondContact O-N 2.95Å; S317-K320 WeakPolarHBondContact O-CB 3.14Å; S317-K320 PolarHBondContact O-N 2.97Å; S317-S321 PolarHBondContact O-N 2.77Å; S317-S321 PolarHBondContact O-OG 2.58Å; S317-E416 WeakPolarHBondContact CB-OE2 2.94Å; S317-E416 PolarHBondContact N-OE2 3.42Å; S317-E416 PolarHBondContact OG-OE2 2.96Å
318	W	88.6	Confident	89.6	Confident	179 Å²	179	38.6 Å²	38.6	68%	0.678	19%	0.191	S	C	*	.	H	α-helix	trans	-54.6	-51.5	-172.4	175.7	-86.5	0	0	0	114.9	R316 K320 S321 V322	R316-W318 PolarHBondContact O-N 2.89Å; W318-K320 VanDerWaalsContact C-N 3.27Å; W318-K320 PolarHBondContact O-N 2.83Å; W318-S321 PolarHBondContact O-N 2.89Å; W318-V322 HydrophobicContact CD2-CG2 4.04Å; W318-V322 VanDerWaalsContact CE2-CG2 3.48Å; W318-V322 HydrophobicContact CG-CG2 4.3Å; W318-V322 HydrophobicContact CZ2-CG2 3.81Å; W318-V322 WeakPolarHBondContact O-CG2 3.4Å; W318-V322 PolarHBondContact O-N 2.9Å
319	P	91.3	Very high	89.7	Confident	48 Å²	48	42.2 Å²	42.2	31%	0.312	21%	0.208	S	C	.	.	H	α-helix	trans	-56.3	-38.4	175.6	-26.9	33.7	0	0	0	114.1	R316 S323	R316-P319 WeakPolarHBondContact O-CD 3.38Å; P319-S323 WeakPolarHBondContact O-CB 3.32Å; P319-S323 PolarHBondContact O-N 2.88Å
320	K	91.2	Very high	89.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-68.6	-43.8	177.9	-60.9	-171.6	-70.5	166.2	0	110.9	I264 H309 N311 F312 I315 S317 W318 S323 C324 N412	I264-K320 HydrophobicContact CD1-CD 4.37Å; H309-K320 PolarHBondContact CD2-O 3.42Å; N311-K320 PolarHBondContact O-NZ 3.08Å; F312-K320 PolarHBondContact O-NZ 3.39Å; I315-K320 HydrophobicContact CB-CD 4.44Å; I315-K320 HydrophobicContact CG2-CD 4.01Å; I315-K320 HydrophobicContact CG2-CG 4.06Å; S317-K320 WeakPolarHBondContact O-CB 3.14Å; S317-K320 PolarHBondContact O-N 2.97Å; W318-K320 VanDerWaalsContact C-N 3.27Å; W318-K320 PolarHBondContact O-N 2.83Å; K320-S323 PolarHBondContact O-N 3.35Å; K320-C324 WeakPolarHBondContact O-CB 3.32Å; K320-C324 PolarHBondContact O-N 2.88Å; K320-N412 WeakPolarHBondContact CE-OD1 3.09Å; K320-N412 PolarHBondContact NZ-OD1 3.1Å
321	S	91.9	Very high	89.3	Confident	12 Å²	12	42.6 Å²	42.6	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-41.5	175.9	-62.2	0	0	0	0	112.5	S317 W318 C324 F325	S317-S321 PolarHBondContact O-N 2.77Å; S317-S321 PolarHBondContact O-OG 2.58Å; W318-S321 PolarHBondContact O-N 2.89Å; S321-C324 PolarHBondContact O-N 3.16Å; S321-F325 WeakPolarHBondContact O-CB 3.37Å; S321-F325 PolarHBondContact O-N 3.36Å
322	V	92.6	Very high	89.1	Confident	52 Å²	52	43.6 Å²	43.6	32%	0.315	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-45	176.1	171.2	0	0	0	0	111	W318 C324 F325 L326	W318-V322 HydrophobicContact CD2-CG2 4.04Å; W318-V322 VanDerWaalsContact CE2-CG2 3.48Å; W318-V322 HydrophobicContact CG-CG2 4.3Å; W318-V322 HydrophobicContact CZ2-CG2 3.81Å; W318-V322 WeakPolarHBondContact O-CG2 3.4Å; W318-V322 PolarHBondContact O-N 2.9Å; V322-C324 VanDerWaalsContact C-N 3.33Å; V322-C324 PolarHBondContact O-N 3.08Å; V322-F325 WeakPolarHBondContact O-CB 3.33Å; V322-F325 PolarHBondContact O-N 3.43Å; V322-L326 HydrophobicContact CG1-CD1 4.24Å; V322-L326 WeakPolarHBondContact O-CG 3.36Å; V322-L326 PolarHBondContact O-N 3.41Å
323	S	91.6	Very high	89.1	Confident	17 Å²	17	45 Å²	45	12%	0.119	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-45.9	174.8	-171.6	0	0	0	0	111.3	N265 H309 P319 K320 F325 L326 L327	N265-S323 PolarHBondContact ND2-OG 3.48Å; N265-S323 PolarHBondContact OD1-OG 3.16Å; H309-S323 WeakPolarHBondContact NE2-CB 3.34Å; H309-S323 PolarHBondContact NE2-OG 3.34Å; P319-S323 WeakPolarHBondContact O-CB 3.32Å; P319-S323 PolarHBondContact O-N 2.88Å; K320-S323 PolarHBondContact O-N 3.35Å; S323-F325 PolarHBondContact O-N 3.22Å; S323-L326 PolarHBondContact O-N 2.97Å; S323-L327 WeakPolarHBondContact O-CG 3.5Å; S323-L327 PolarHBondContact O-N 3.46Å
324	C	92.2	Very high	89	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-37.2	175.7	-172.7	0	0	0	0	113.1	H309 K320 S321 V322 L327 G328 I408	H309-C324 HydrophobicContact CB-CB 4.44Å; K320-C324 WeakPolarHBondContact O-CB 3.32Å; K320-C324 PolarHBondContact O-N 2.88Å; S321-C324 PolarHBondContact O-N 3.16Å; V322-C324 VanDerWaalsContact C-N 3.33Å; V322-C324 PolarHBondContact O-N 3.08Å; C324-L327 PolarHBondContact O-N 3.49Å; C324-G328 PolarHBondContact O-N 3.23Å; C324-I408 HydrophobicContact CB-CG2 4.42Å
325	F	93.1	Very high	89	Confident	97 Å²	97	44 Å²	44	43%	0.425	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-45.9	176.3	-177.3	-112.5	0	0	0	111.5	S321 V322 S323 L327 G328 L329 F405	S321-F325 WeakPolarHBondContact O-CB 3.37Å; S321-F325 PolarHBondContact O-N 3.36Å; V322-F325 WeakPolarHBondContact O-CB 3.33Å; V322-F325 PolarHBondContact O-N 3.43Å; S323-F325 PolarHBondContact O-N 3.22Å; F325-L327 VanDerWaalsContact C-N 3.3Å; F325-L327 PolarHBondContact O-N 2.98Å; F325-G328 PolarHBondContact O-N 3.06Å; F325-L329 HydrophobicContact CD1-CD1 3.98Å; F325-L329 HydrophobicContact CD1-CG 4.47Å; F325-L329 HydrophobicContact CE1-CD1 3.43Å; F325-L329 VanDerWaalsContact CE1-CD1 3.43Å; F325-L329 HydrophobicContact CE1-CG 4.11Å; F325-L329 HydrophobicContact CE2-CD1 4.5Å; F325-L329 HydrophobicContact CE2-CG 4.36Å; F325-L329 HydrophobicContact CZ-CD1 3.73Å; F325-L329 HydrophobicContact CZ-CD2 4.23Å; F325-L329 HydrophobicContact CZ-CG 4.04Å; F325-L329 PolarHBondContact O-N 3.07Å; F325-F405 HydrophobicContact CB-CD2 4.27Å; F325-F405 HydrophobicContact CB-CE2 3.55Å; F325-F405 HydrophobicContact CB-CZ 3.99Å; F325-F405 HydrophobicContact CD2-CD2 4.37Å; F325-F405 HydrophobicContact CD2-CE1 4.01Å; F325-F405 AromaticContact CD2-CE2 3.88Å; F325-F405 HydrophobicContact CD2-CE2 3.88Å; F325-F405 AromaticContact CD2-CZ 3.66Å; F325-F405 HydrophobicContact CD2-CZ 3.66Å; F325-F405 HydrophobicContact CG-CE2 4.17Å; F325-F405 HydrophobicContact CG-CZ 4.18Å
326	L	92.8	Very high	88.9	Confident	111 Å²	111	48.3 Å²	48.3	58%	0.581	25%	0.253	S	S	*	.	H	α-helix	trans	-62.3	-38.5	177.1	-68	174	0	0	0	111.7	V322 S323 L329 G330	V322-L326 HydrophobicContact CG1-CD1 4.24Å; V322-L326 WeakPolarHBondContact O-CG 3.36Å; V322-L326 PolarHBondContact O-N 3.41Å; S323-L326 PolarHBondContact O-N 2.97Å; L326-L329 PolarHBondContact O-N 3.42Å; L326-G330 PolarHBondContact O-N 2.6Å
327	L	91.2	Very high	88.4	Confident	14 Å²	14	47 Å²	47	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-44.4	173	-74	177.2	0	0	0	112.8	L268 V305 M306 H309 S323 C324 F325 G330 L331	L268-L327 HydrophobicContact CD1-CD2 3.28Å; L268-L327 HydrophobicContact CD2-CD2 3.4Å; L268-L327 VanDerWaalsContact CD2-CD2 3.4Å; L268-L327 HydrophobicContact CG-CD2 3.87Å; V305-L327 HydrophobicContact CG1-CD1 3.91Å; M306-L327 HydrophobicContact CG-CB 3.99Å; M306-L327 HydrophobicContact CG-CD1 4.45Å; H309-L327 WeakPolarHBondContact CE1-CD1 3.43Å; S323-L327 WeakPolarHBondContact O-CG 3.5Å; S323-L327 PolarHBondContact O-N 3.46Å; C324-L327 PolarHBondContact O-N 3.49Å; F325-L327 VanDerWaalsContact C-N 3.3Å; F325-L327 PolarHBondContact O-N 2.98Å; L327-G330 PolarHBondContact O-N 2.92Å; L327-L331 PolarHBondContact O-N 3.21Å
328	G	90.7	Very high	87.5	Confident	4 Å²	4	48 Å²	48	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-41.9	176.5	0	0	0	0	0	112.6	C324 F325 L331 I332	C324-G328 PolarHBondContact O-N 3.23Å; F325-G328 PolarHBondContact O-N 3.06Å; G328-L331 PolarHBondContact O-N 3.21Å; G328-I332 WeakPolarHBondContact O-CG1 3.13Å; G328-I332 PolarHBondContact O-N 3.37Å
329	L	91.6	Very high	86.6	Confident	85 Å²	85	41 Å²	41	45%	0.445	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-40.9	173.1	-71.6	-177.9	0	0	0	112.2	F325 L326 L331 I332 G333	F325-L329 HydrophobicContact CD1-CD1 3.98Å; F325-L329 HydrophobicContact CD1-CG 4.47Å; F325-L329 HydrophobicContact CE1-CD1 3.43Å; F325-L329 VanDerWaalsContact CE1-CD1 3.43Å; F325-L329 HydrophobicContact CE1-CG 4.11Å; F325-L329 HydrophobicContact CE2-CD1 4.5Å; F325-L329 HydrophobicContact CE2-CG 4.36Å; F325-L329 HydrophobicContact CZ-CD1 3.73Å; F325-L329 HydrophobicContact CZ-CD2 4.23Å; F325-L329 HydrophobicContact CZ-CG 4.04Å; F325-L329 PolarHBondContact O-N 3.07Å; L326-L329 PolarHBondContact O-N 3.42Å; L329-L331 VanDerWaalsContact C-N 3.32Å; L329-L331 PolarHBondContact O-N 2.81Å; L329-I332 PolarHBondContact O-N 3.11Å; L329-G333 PolarHBondContact O-N 3.29Å
330	G	87.3	Confident	85.5	Confident	44 Å²	44	46.1 Å²	46.1	45%	0.454	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-40	174.9	0	0	0	0	0	112.6	L326 L327 G333 L334	L326-G330 PolarHBondContact O-N 2.6Å; L327-G330 PolarHBondContact O-N 2.92Å; G330-G333 PolarHBondContact O-N 2.97Å; G330-L334 WeakPolarHBondContact O-CB 3.35Å; G330-L334 PolarHBondContact O-N 3.21Å
331	L	86.9	Confident	84.2	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-45.1	175.6	-179.7	57.6	0	0	0	112.1	C299 I302 M303 L327 G328 L329 L334 V335 V401	C299-L331 HydrophobicContact CB-CD1 4Å; I302-L331 HydrophobicContact CB-CD1 4.27Å; I302-L331 HydrophobicContact CD1-CD1 3.97Å; I302-L331 HydrophobicContact CG2-CB 4.05Å; I302-L331 HydrophobicContact CG2-CD1 4.38Å; I302-L331 HydrophobicContact CG2-CD2 4.16Å; I302-L331 HydrophobicContact CG2-CG 4.44Å; M303-L331 HydrophobicContact CG-CD2 4.02Å; M303-L331 HydrophobicContact SD-CD2 3.74Å; L327-L331 PolarHBondContact O-N 3.21Å; G328-L331 PolarHBondContact O-N 3.21Å; L329-L331 VanDerWaalsContact C-N 3.32Å; L329-L331 PolarHBondContact O-N 2.81Å; L331-L334 PolarHBondContact O-N 3.16Å; L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.5Å; L331-V401 HydrophobicContact CD2-CG2 3.47Å; L331-V401 VanDerWaalsContact CD2-CG2 3.47Å; L331-V401 HydrophobicContact CG-CG2 4.2Å
332	I	86.9	Confident	82.6	Confident	42 Å²	42	48.9 Å²	48.9	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-46.2	175.7	-69.1	167.2	0	0	0	110.5	G328 L329 L334 V335 Q336 Y398 V401	G328-I332 WeakPolarHBondContact O-CG1 3.13Å; G328-I332 PolarHBondContact O-N 3.37Å; L329-I332 PolarHBondContact O-N 3.11Å; I332-L334 VanDerWaalsContact C-N 3.32Å; I332-L334 PolarHBondContact O-N 2.84Å; I332-V335 PolarHBondContact O-N 2.96Å; I332-Q336 WeakPolarHBondContact O-CG 3.47Å; I332-Q336 PolarHBondContact O-N 3.4Å; I332-Y398 HydrophobicContact CB-CE1 4.29Å; I332-Y398 HydrophobicContact CG1-CD1 3.96Å; I332-Y398 HydrophobicContact CG1-CE1 4.16Å; I332-Y398 HydrophobicContact CG2-CD1 4.25Å; I332-Y398 HydrophobicContact CG2-CE1 3.7Å; I332-V401 HydrophobicContact CD1-CG1 4.22Å; I332-V401 HydrophobicContact CG1-CG1 4.38Å
333	G	85.2	Confident	80.8	Confident	34 Å²	34	52.5 Å²	52.5	35%	0.351	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-38.5	177.6	0	0	0	0	0	112.9	L329 G330 Q336 F337	L329-G333 PolarHBondContact O-N 3.29Å; G330-G333 PolarHBondContact O-N 2.97Å; G333-Q336 PolarHBondContact O-N 3.5Å; G333-F337 VanDerWaalsContact O-CB 3.3Å; G333-F337 WeakPolarHBondContact O-CB 3.48Å; G333-F337 PolarHBondContact O-N 3.41Å
334	L	81.8	Confident	78.8	Confident	24 Å²	24	53 Å²	53	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-47.4	175.5	-179.3	68.6	0	0	0	111.7	L275 I298 I302 G330 L331 I332 Q336 F337 C338	L275-L334 HydrophobicContact CD1-CD1 4.09Å; L275-L334 HydrophobicContact CD1-CD2 4.34Å; L275-L334 HydrophobicContact CD2-CD1 3.51Å; L275-L334 HydrophobicContact CD2-CD2 4.2Å; L275-L334 HydrophobicContact CG-CD1 4.46Å; I298-L334 HydrophobicContact CG2-CD2 3.57Å; I302-L334 HydrophobicContact CD1-CD2 4.21Å; G330-L334 WeakPolarHBondContact O-CB 3.35Å; G330-L334 PolarHBondContact O-N 3.21Å; L331-L334 PolarHBondContact O-N 3.16Å; I332-L334 VanDerWaalsContact C-N 3.32Å; I332-L334 PolarHBondContact O-N 2.84Å; L334-Q336 PolarHBondContact O-N 3.27Å; L334-F337 PolarHBondContact O-N 3.38Å; L334-C338 PolarHBondContact O-N 3.48Å; L334-C338 PolarHBondContact O-SG 3.38Å; L334-C338 VanDerWaalsContact O-SG 3.35Å
335	V	80.6	Confident	76.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-43.2	178.7	173	0	0	0	0	110.8	L331 I332 C338 L339 V397	L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.5Å; I332-V335 PolarHBondContact O-N 2.96Å; V335-C338 PolarHBondContact O-N 2.97Å; V335-L339 HydrophobicContact CG1-CD1 3.78Å; V335-L339 HydrophobicContact CG1-CG 4.46Å; V335-L339 WeakPolarHBondContact O-CB 3.29Å; V335-L339 VanDerWaalsContact O-CG 3.26Å; V335-L339 WeakPolarHBondContact O-CG 3.27Å; V335-L339 PolarHBondContact O-N 3.21Å; V335-V397 HydrophobicContact CG2-CG1 4.29Å
336	Q	81.9	Confident	74.6	Confident	99 Å²	99	60.2 Å²	60.2	46%	0.463	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-43.1	175.5	-73.4	179.7	-6.5	0	0	112.5	I332 G333 L334 L339 H340 Y398	I332-Q336 WeakPolarHBondContact O-CG 3.47Å; I332-Q336 PolarHBondContact O-N 3.4Å; G333-Q336 PolarHBondContact O-N 3.5Å; L334-Q336 PolarHBondContact O-N 3.27Å; Q336-L339 PolarHBondContact O-N 3.36Å; Q336-H340 WeakPolarHBondContact O-CB 3.4Å; Q336-H340 PolarHBondContact O-N 3.25Å; Q336-Y398 WeakPolarHBondContact CG-OH 3.09Å; Q336-Y398 PolarHBondContact NE2-OH 3.33Å; Q336-Y398 VanDerWaalsContact NE2-OH 3.16Å
337	F	77.5	Confident	72.2	Confident	106 Å²	106	61.2 Å²	61.2	47%	0.465	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-43.5	178.5	179.9	-99	0	0	0	112	G333 L334 S341	G333-F337 VanDerWaalsContact O-CB 3.3Å; G333-F337 WeakPolarHBondContact O-CB 3.48Å; G333-F337 PolarHBondContact O-N 3.41Å; L334-F337 PolarHBondContact O-N 3.38Å; F337-S341 WeakPolarHBondContact O-CB 3.48Å; F337-S341 PolarHBondContact O-N 3.32Å; F337-S341 PolarHBondContact O-OG 3.46Å
338	C	71.2	Confident	70.2	Confident	37 Å²	37	66.5 Å²	66.5	25%	0.25	37%	0.369	C	S	.	.	H	α-helix	trans	-64.5	-41	176.5	-70.4	0	0	0	0	112.2	L295 L334 V335 C342	L295-C338 HydrophobicContact CD1-CB 4.21Å; L295-C338 HydrophobicContact CD2-CB 4.2Å; L334-C338 PolarHBondContact O-N 3.48Å; L334-C338 PolarHBondContact O-SG 3.38Å; L334-C338 VanDerWaalsContact O-SG 3.35Å; V335-C338 PolarHBondContact O-N 2.97Å; C338-C342 PolarHBondContact O-N 3.49Å; C338-C342 PolarHBondContact O-SG 3.11Å
339	L	70	Confident	68.3	Low	32 Å²	32	72.5 Å²	72.5	17%	0.168	40%	0.4	C	S	.	.	H	α-helix	trans	-68.1	-45.7	177.9	-71.9	167.4	0	0	0	112	V335 Q336 S341 C342 D343 Q394	V335-L339 HydrophobicContact CG1-CD1 3.78Å; V335-L339 HydrophobicContact CG1-CG 4.46Å; V335-L339 WeakPolarHBondContact O-CB 3.29Å; V335-L339 VanDerWaalsContact O-CG 3.26Å; V335-L339 WeakPolarHBondContact O-CG 3.27Å; V335-L339 PolarHBondContact O-N 3.21Å; Q336-L339 PolarHBondContact O-N 3.36Å; L339-S341 VanDerWaalsContact C-N 3.28Å; L339-S341 PolarHBondContact O-N 2.9Å; L339-C342 PolarHBondContact O-N 3.01Å; L339-D343 PolarHBondContact O-N 3.44Å; L339-Q394 HydrophobicContact CD1-CB 4.13Å; L339-Q394 HydrophobicContact CD1-CG 4.04Å
340	H	68.4	Low	66.4	Low	155 Å²	155	72.3 Å²	72.3	72%	0.718	40%	0.402	S	S	*	.	H	α-helix	trans	-62.8	-36.7	178.8	-170.9	62.8	0	0	0	112.2	Q336 C342 D343	Q336-H340 WeakPolarHBondContact O-CB 3.4Å; Q336-H340 PolarHBondContact O-N 3.25Å; H340-C342 PolarHBondContact O-N 3.26Å; H340-D343 PolarHBondContact O-N 3.48Å
341	S	63.2	Low	64.8	Low	9 Å²	9	75.3 Å²	75.3	6%	0.063	41%	0.408	C	S	.	.	H	α-helix	trans	-68.1	-20.4	176.4	-56.8	0	0	0	0	113.1	F284 F337 L339	F284-S341 WeakPolarHBondContact CZ-O 3.45Å; F337-S341 WeakPolarHBondContact O-CB 3.48Å; F337-S341 PolarHBondContact O-N 3.32Å; F337-S341 PolarHBondContact O-OG 3.46Å; L339-S341 VanDerWaalsContact C-N 3.28Å; L339-S341 PolarHBondContact O-N 2.9Å
342	C	59	Low	63.2	Low	64 Å²	64	81.4 Å²	81.4	43%	0.432	44%	0.438	S	S	.	.	H	α-helix	trans	-86.7	-20.8	178.8	-69.2	0	0	0	0	114.1	C338 L339 H340	C338-C342 PolarHBondContact O-N 3.49Å; C338-C342 PolarHBondContact O-SG 3.11Å; L339-C342 PolarHBondContact O-N 3.01Å; H340-C342 PolarHBondContact O-N 3.26Å
343	D	54.5	Low	61.5	Low	128 Å²	128	82.5 Å²	82.5	68%	0.684	45%	0.453	S	S	*	.	S	Bend	trans	-89.2	-1.6	-176.3	-75.1	-13.5	0	0	0	113.5	L339 H340 K390	L339-D343 PolarHBondContact O-N 3.44Å; H340-D343 PolarHBondContact O-N 3.48Å; D343-K390 IonicContact OD1-NZ 3.66Å
344	G	48	Very low	60	Low	27 Å²	27	86 Å²	86	28%	0.278	46%	0.463	S	S	.	.	S	Bend	trans	-104.6	115.2	-178.4	0	0	0	0	0	115.1	T346	G344-T346 PolarHBondContact O-N 3.03Å
345	E	50	Low	58.5	Low	175 Å²	175	88.3 Å²	88.3	82%	0.818	49%	0.486	S	S	*	.	S	Bend	trans	74.3	-9.2	149.5	-58.8	-151	143	0	0	122.5
346	T	47.3	Very low	56.9	Low	73 Å²	73	95.6 Å²	95.6	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-87.9	-21.2	-172.8	22.4	0	0	0	0	116.5	G344	G344-T346 PolarHBondContact O-N 3.03Å
347	L	42.3	Very low	55.4	Low	133 Å²	133	95.5 Å²	95.5	70%	0.696	54%	0.535	S	S	*	.	H	α-helix	trans	-80.4	-26.2	-177.5	-161.2	72.1	0	0	0	113.7
348	I	50.8	Low	54	Low	124 Å²	124	94.3 Å²	94.3	64%	0.636	54%	0.54	S	S	*	.	H	α-helix	trans	-77	-37.2	-176	-58.6	173.9	0	0	0	110.8	M352	I348-M352 PolarHBondContact O-N 2.89Å
349	L	50.1	Low	52.5	Low	131 Å²	131	98.2 Å²	98.2	69%	0.686	57%	0.568	S	S	*	*	H	α-helix	trans	-71.1	-33.8	-177.1	-127	110	0	0	0	113	A353	L349-A353 PolarHBondContact O-N 3.35Å
350	V	52.3	Low	50.8	Low	81 Å²	81	107.9 Å²	107.9	49%	0.491	60%	0.602	S	S	.	*	H	α-helix	trans	-74.3	-39.2	-178.7	176.9	0	0	0	0	111.5	M352 A353 L354	V350-M352 VanDerWaalsContact C-N 3.33Å; V350-M352 PolarHBondContact O-N 3.06Å; V350-A353 PolarHBondContact O-N 2.71Å; V350-L354 HydrophobicContact CG1-CD1 3.57Å; V350-L354 WeakPolarHBondContact O-CD1 3.43Å; V350-L354 PolarHBondContact O-N 2.71Å
351	N	53.5	Low	49.5	Very low	106 Å²	106	108.1 Å²	108.1	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-33	176.3	-82.1	-18.6	0	0	0	112.8	A355	N351-A355 PolarHBondContact O-N 2.92Å
352	M	53.1	Low	48.2	Very low	129 Å²	129	114.4 Å²	114.4	64%	0.635	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-33.6	173.1	-70.2	-146.2	-79	0	0	112.8	I348 V350	I348-M352 PolarHBondContact O-N 2.89Å; V350-M352 VanDerWaalsContact C-N 3.33Å; V350-M352 PolarHBondContact O-N 3.06Å
353	A	51.9	Low	47.1	Very low	66 Å²	66	119.9 Å²	119.9	55%	0.545	65%	0.653	S	S	.	*	H	α-helix	trans	-72.9	-37	177.3	0	0	0	0	0	112.9	L349 V350	L349-A353 PolarHBondContact O-N 3.35Å; V350-A353 PolarHBondContact O-N 2.71Å
354	L	51.9	Low	46.3	Very low	107 Å²	107	121.4 Å²	121.4	56%	0.56	65%	0.653	S	S	*	*	H	α-helix	trans	-70	-34.1	177.3	-93.5	109.3	0	0	0	113	V350 N356 S357	V350-L354 HydrophobicContact CG1-CD1 3.57Å; V350-L354 WeakPolarHBondContact O-CD1 3.43Å; V350-L354 PolarHBondContact O-N 2.71Å; L354-N356 PolarHBondContact O-N 3.25Å; L354-S357 PolarHBondContact O-N 3.3Å; L354-S357 PolarHBondContact O-OG 3.46Å
355	A	51.6	Low	45.8	Very low	72 Å²	72	126.2 Å²	126.2	60%	0.595	67%	0.673	S	S	*	*	H	α-helix	trans	-63.4	-25.2	179.3	0	0	0	0	0	114	N351 S357	N351-A355 PolarHBondContact O-N 2.92Å; A355-S357 VanDerWaalsContact C-N 3.34Å; A355-S357 PolarHBondContact O-N 3.3Å
356	N	47	Very low	45.1	Very low	154 Å²	154	124.7 Å²	124.7	82%	0.824	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-3.4	-178.2	-87.5	-10.9	0	0	0	114.9	L354	L354-N356 PolarHBondContact O-N 3.25Å
357	S	49.1	Very low	44.6	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	69%	0.686	S	S	*	*	S	Bend	trans	-111.1	-5.7	-166.7	65.8	0	0	0	0	116.3	L354 A355	L354-S357 PolarHBondContact O-N 3.3Å; L354-S357 PolarHBondContact O-OG 3.46Å; A355-S357 VanDerWaalsContact C-N 3.34Å; A355-S357 PolarHBondContact O-N 3.3Å
358	S	49.6	Very low	44.6	Very low	81 Å²	81	126.5 Å²	126.5	57%	0.566	69%	0.692	S	S	*	*	S	Bend	trans	-137.1	126.5	-172.6	51.2	0	0	0	0	112.5
359	S	39.4	Very low	44.3	Very low	119 Å²	119	126.3 Å²	126.3	83%	0.832	70%	0.696	S	S	*	*			trans	74.1	107	178.4	68.1	0	0	0	0	114.7
360	R	34.9	Very low	44.1	Very low	235 Å²	235	124.1 Å²	124.1	89%	0.887	70%	0.698	S	S	*	*			cis	49.2	115.6	41	-83.9	-166.3	-165.4	171.2	6	114.3
361	H	39.8	Very low	43.6	Very low	159 Å²	159	123.2 Å²	123.2	74%	0.736	71%	0.705	S	S	*	*			trans	95.4	96.2	165.6	-70.6	-69.9	0	0	0	119.6
362	D	37.1	Very low	43.2	Very low	142 Å²	142	121.3 Å²	121.3	76%	0.759	70%	0.7	S	S	*	*				50.5	113.9	119.8	-52.3	-32.1	0	0	0	120.8
363	F	34.8	Very low	42.8	Very low	179 Å²	179	118.9 Å²	118.9	79%	0.785	70%	0.695	S	S	*	*				138.7	103.8	127.1	-161.7	-91	0	0	0	113.4
364	F	38.5	Very low	42.4	Very low	159 Å²	159	121.7 Å²	121.7	70%	0.697	70%	0.701	S	S	*	*			trans	43.5	125.3	152.9	-67.8	-103.4	0	0	0	118.9
365	D	36.1	Very low	42.1	Very low	128 Å²	128	121.3 Å²	121.3	68%	0.684	70%	0.702	S	S	*	*			cis	-155.4	135.7	10.9	-101.8	-39.7	0	0	0	105.9
366	N	37.3	Very low	41.7	Very low	144 Å²	144	126.1 Å²	126.1	77%	0.77	71%	0.706	S	S	*	*	S	Bend	trans	28.2	102.5	155.7	-57.4	-34.9	0	0	0	119.1
367	N	36	Very low	41.7	Very low	144 Å²	144	124.4 Å²	124.4	77%	0.77	70%	0.697	S	S	*	*			trans	121.3	90.9	152.9	-64.4	-20.6	0	0	0	117.9	T369	N367-T369 VanDerWaalsContact C-N 3.32Å; N367-T369 HydrophobicContact CB-CG2 4.49Å; N367-T369 PolarHBondContact O-N 3.19Å; N367-T369 PolarHBondContact O-OG1 2.73Å
368	A	41.2	Very low	41.5	Very low	100 Å²	100	124.5 Å²	124.5	83%	0.826	69%	0.689	S	S	*	*			trans	-45.8	52.7	168.4	0	0	0	0	0	119.4
369	T	46	Very low	41.5	Very low	119 Å²	119	123.2 Å²	123.2	73%	0.73	68%	0.68	S	S	*	*			trans	-106.1	-16.9	-168.5	50.5	0	0	0	0	117.1	N367	N367-T369 VanDerWaalsContact C-N 3.32Å; N367-T369 HydrophobicContact CB-CG2 4.49Å; N367-T369 PolarHBondContact O-N 3.19Å; N367-T369 PolarHBondContact O-OG1 2.73Å
370	A	44.8	Very low	41.9	Very low	86 Å²	86	119.6 Å²	119.6	71%	0.711	66%	0.662	S	S	*	*	S	Bend	trans	-94.1	-26.1	-173.9	0	0	0	0	0	115.8	S372	A370-S372 VanDerWaalsContact C-N 3.32Å; A370-S372 PolarHBondContact O-N 3.07Å
371	G	41.9	Very low	42.4	Very low	62 Å²	62	115.9 Å²	115.9	64%	0.639	65%	0.654	S	S	*	*	S	Bend	trans	-74.3	-18	-178.6	0	0	0	0	0	114.8
372	S	45.6	Very low	42.8	Very low	66 Å²	66	113.4 Å²	113.4	46%	0.462	65%	0.645	S	S	.	*	H	α-helix	trans	-75.4	-33.3	-175.9	-65.4	0	0	0	0	113.9	A370 L374 Y376	A370-S372 VanDerWaalsContact C-N 3.32Å; A370-S372 PolarHBondContact O-N 3.07Å; S372-L374 PolarHBondContact O-N 2.99Å; S372-Y376 VanDerWaalsContact O-CD2 3.3Å; S372-Y376 WeakPolarHBondContact O-CD2 3.05Å; S372-Y376 PolarHBondContact O-N 2.92Å
373	S	45.5	Very low	43.3	Very low	78 Å²	78	110 Å²	110	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-73.5	-33.3	-168.7	72.9	0	0	0	0	114.6	Y376 N377	S373-Y376 WeakPolarHBondContact O-CB 3.46Å; S373-Y376 PolarHBondContact O-N 3.03Å; S373-N377 PolarHBondContact O-N 2.95Å; S373-N377 VanDerWaalsContact O-N 3.17Å
374	L	41.5	Very low	43.9	Very low	125 Å²	125	103.2 Å²	103.2	65%	0.654	61%	0.613	S	S	*	*	H	α-helix	trans	-70.1	-38.3	-180	-164.2	77.1	0	0	0	111.8	S372 Y376 N377 I378	S372-L374 PolarHBondContact O-N 2.99Å; L374-Y376 VanDerWaalsContact C-N 3.31Å; L374-N377 PolarHBondContact O-N 3.36Å; L374-I378 PolarHBondContact O-N 3.14Å
375	V	45.7	Very low	44.4	Very low	98 Å²	98	100.3 Å²	100.3	59%	0.594	61%	0.608	S	S	*	*	H	α-helix	trans	-65.6	-37.5	173.8	-179.6	0	0	0	0	110.4	N377 S379	V375-N377 PolarHBondContact O-N 3.42Å; V375-S379 VanDerWaalsContact O-CB 3.28Å; V375-S379 WeakPolarHBondContact O-CB 3.44Å; V375-S379 PolarHBondContact O-N 3.19Å; V375-S379 PolarHBondContact O-OG 2.98Å
376	Y	43.7	Very low	45	Very low	174 Å²	174	100.2 Å²	100.2	68%	0.682	60%	0.599	S	S	*	*	H	α-helix	trans	-60.5	-42.6	174.4	-101.2	-87.9	0	0	0	112.7	S372 S373 L374 S379 G380	S372-Y376 VanDerWaalsContact O-CD2 3.3Å; S372-Y376 WeakPolarHBondContact O-CD2 3.05Å; S372-Y376 PolarHBondContact O-N 2.92Å; S373-Y376 WeakPolarHBondContact O-CB 3.46Å; S373-Y376 PolarHBondContact O-N 3.03Å; L374-Y376 VanDerWaalsContact C-N 3.31Å; Y376-S379 WeakPolarHBondContact CA-OG 3.48Å; Y376-S379 PolarHBondContact O-OG 3.41Å; Y376-G380 PolarHBondContact O-N 3.33Å
377	N	46.6	Very low	46	Very low	117 Å²	117	96.9 Å²	96.9	63%	0.626	59%	0.587	S	S	*	*	H	α-helix	trans	-69.3	-38.4	-178.2	-77.7	-18.3	0	0	0	113.9	S373 L374 V375 G380 Q381	S373-N377 PolarHBondContact O-N 2.95Å; S373-N377 VanDerWaalsContact O-N 3.17Å; L374-N377 PolarHBondContact O-N 3.36Å; V375-N377 PolarHBondContact O-N 3.42Å; N377-G380 PolarHBondContact O-N 3.06Å; N377-Q381 PolarHBondContact O-N 3.35Å
378	I	46.4	Very low	47	Very low	100 Å²	100	95.7 Å²	95.7	51%	0.513	58%	0.581	S	S	.	*	H	α-helix	trans	-73	-39.8	177.7	-63	173.5	0	0	0	110.6	L374 G380 Q381 I382	L374-I378 PolarHBondContact O-N 3.14Å; I378-G380 VanDerWaalsContact C-N 3.27Å; I378-G380 PolarHBondContact O-N 3.48Å; I378-Q381 PolarHBondContact O-N 2.96Å; I378-I382 HydrophobicContact CG2-CD1 3.96Å; I378-I382 WeakPolarHBondContact O-CG1 3.19Å; I378-I382 PolarHBondContact O-N 2.96Å
379	S	49	Very low	48	Very low	54 Å²	54	94.8 Å²	94.8	38%	0.378	57%	0.569	S	S	.	*	H	α-helix	trans	-63.8	-32.5	175	70.7	0	0	0	0	112.6	V375 Y376 S383	V375-S379 VanDerWaalsContact O-CB 3.28Å; V375-S379 WeakPolarHBondContact O-CB 3.44Å; V375-S379 PolarHBondContact O-N 3.19Å; V375-S379 PolarHBondContact O-OG 2.98Å; Y376-S379 WeakPolarHBondContact CA-OG 3.48Å; Y376-S379 PolarHBondContact O-OG 3.41Å; S379-S383 VanDerWaalsContact O-CB 3.26Å; S379-S383 WeakPolarHBondContact O-CB 3.35Å; S379-S383 PolarHBondContact O-N 3.41Å; S379-S383 PolarHBondContact O-OG 3.42Å
380	G	47.6	Very low	48.9	Very low	43 Å²	43	91.6 Å²	91.6	44%	0.443	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-42.6	175	0	0	0	0	0	113.9	Y376 N377 I378 G384	Y376-G380 PolarHBondContact O-N 3.33Å; N377-G380 PolarHBondContact O-N 3.06Å; I378-G380 VanDerWaalsContact C-N 3.27Å; I378-G380 PolarHBondContact O-N 3.48Å; G380-G384 PolarHBondContact O-N 3.02Å; G380-G384 VanDerWaalsContact O-N 3.11Å
381	Q	46.4	Very low	50.1	Low	157 Å²	157	89.9 Å²	89.9	73%	0.734	53%	0.53	S	S	*	.	H	α-helix	trans	-70.1	-39.2	178.8	-76.6	-170.1	-33.7	0	0	112.9	N377 I378 G384 T385	N377-Q381 PolarHBondContact O-N 3.35Å; I378-Q381 PolarHBondContact O-N 2.96Å; Q381-G384 PolarHBondContact O-N 3.5Å; Q381-T385 PolarHBondContact O-N 2.65Å
382	I	47.1	Very low	51.5	Low	107 Å²	107	90.8 Å²	90.8	55%	0.549	53%	0.526	S	S	.	.	H	α-helix	trans	-67.8	-41	176.9	-64.1	171	0	0	0	110.4	I378 G384 T385 Y386	I378-I382 HydrophobicContact CG2-CD1 3.96Å; I378-I382 WeakPolarHBondContact O-CG1 3.19Å; I378-I382 PolarHBondContact O-N 2.96Å; I382-G384 VanDerWaalsContact C-N 3.32Å; I382-G384 PolarHBondContact O-N 2.83Å; I382-T385 PolarHBondContact O-N 3.05Å; I382-T385 PolarHBondContact O-OG1 3.47Å; I382-Y386 WeakPolarHBondContact O-CB 3.47Å; I382-Y386 PolarHBondContact O-N 3.33Å; I382-Y386 VanDerWaalsContact O-N 3.09Å
383	S	48.3	Very low	52.9	Low	69 Å²	69	91 Å²	91	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-62.9	-36.2	176.5	-60.4	0	0	0	0	112.8	S379 S387	S379-S383 VanDerWaalsContact O-CB 3.26Å; S379-S383 WeakPolarHBondContact O-CB 3.35Å; S379-S383 PolarHBondContact O-N 3.41Å; S379-S383 PolarHBondContact O-OG 3.42Å; S383-S387 WeakPolarHBondContact O-CB 3.46Å; S383-S387 PolarHBondContact O-N 3.29Å
384	G	47.2	Very low	54.5	Low	37 Å²	37	90.4 Å²	90.4	38%	0.381	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-50.3	175.6	0	0	0	0	0	112.8	G380 Q381 I382 Y386 S387 D388	G380-G384 PolarHBondContact O-N 3.02Å; G380-G384 VanDerWaalsContact O-N 3.11Å; Q381-G384 PolarHBondContact O-N 3.5Å; I382-G384 VanDerWaalsContact C-N 3.32Å; I382-G384 PolarHBondContact O-N 2.83Å; G384-Y386 VanDerWaalsContact C-N 3.34Å; G384-Y386 PolarHBondContact O-N 2.93Å; G384-S387 PolarHBondContact O-N 3.31Å; G384-D388 PolarHBondContact O-N 2.98Å
385	T	47.6	Very low	56.6	Low	98 Å²	98	88.2 Å²	88.2	60%	0.601	50%	0.499	S	S	*	.	H	α-helix	trans	-66.9	-32.4	179.7	57.9	0	0	0	0	113.7	Q381 I382 S389	Q381-T385 PolarHBondContact O-N 2.65Å; I382-T385 PolarHBondContact O-N 3.05Å; I382-T385 PolarHBondContact O-OG1 3.47Å; T385-S389 PolarHBondContact O-N 2.98Å
386	Y	50.1	Low	58.5	Low	127 Å²	127	89.1 Å²	89.1	50%	0.498	50%	0.497	S	S	.	.	H	α-helix	trans	-74.6	-34.7	178.1	-165.3	-115.7	0	0	0	112.3	I382 G384 K390	I382-Y386 WeakPolarHBondContact O-CB 3.47Å; I382-Y386 PolarHBondContact O-N 3.33Å; I382-Y386 VanDerWaalsContact O-N 3.09Å; G384-Y386 VanDerWaalsContact C-N 3.34Å; G384-Y386 PolarHBondContact O-N 2.93Å; Y386-K390 HydrophobicContact CD1-CD 4.35Å; Y386-K390 HydrophobicContact CE1-CD 4.22Å; Y386-K390 PolarHBondContact O-N 3.41Å
387	S	57	Low	60.5	Low	73 Å²	73	81.8 Å²	81.8	51%	0.51	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-41.1	174.2	-173.4	0	0	0	0	112	S383 G384 K390 A391	S383-S387 WeakPolarHBondContact O-CB 3.46Å; S383-S387 PolarHBondContact O-N 3.29Å; G384-S387 PolarHBondContact O-N 3.31Å; S387-K390 PolarHBondContact O-N 3.23Å; S387-A391 PolarHBondContact O-N 3.31Å; S387-A391 VanDerWaalsContact O-N 3.11Å
388	D	57.4	Low	62.5	Low	119 Å²	119	78.8 Å²	78.8	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-65.7	-39.9	-179.8	-76.3	-15.7	0	0	0	112.3	G384 A391 C392	G384-D388 PolarHBondContact O-N 2.98Å; D388-A391 PolarHBondContact O-N 2.95Å; D388-C392 PolarHBondContact O-N 3.48Å; D388-C392 VanDerWaalsContact O-N 3.13Å
389	S	61.8	Low	64.7	Low	82 Å²	82	78.4 Å²	78.4	57%	0.573	45%	0.448	S	S	*	.	H	α-helix	trans	-66.5	-39.1	178	-165.8	0	0	0	0	112.6	T385 C392 F393	T385-S389 PolarHBondContact O-N 2.98Å; S389-C392 PolarHBondContact O-N 3.35Å; S389-F393 PolarHBondContact O-N 3.46Å
390	K	65.7	Low	66.7	Low	52 Å²	52	79 Å²	79	23%	0.226	45%	0.449	C	S	.	.	H	α-helix	trans	-65.6	-43	176.3	-76	178.9	169.4	-178.7	0	112.3	D343 Y386 S387 C392 F393 Q394	D343-K390 IonicContact OD1-NZ 3.66Å; Y386-K390 HydrophobicContact CD1-CD 4.35Å; Y386-K390 HydrophobicContact CE1-CD 4.22Å; Y386-K390 PolarHBondContact O-N 3.41Å; S387-K390 PolarHBondContact O-N 3.23Å; K390-C392 VanDerWaalsContact C-N 3.3Å; K390-C392 PolarHBondContact O-N 2.94Å; K390-F393 PolarHBondContact O-N 3.48Å; K390-Q394 PolarHBondContact O-N 2.85Å; K390-Q394 VanDerWaalsContact O-N 3.07Å
391	A	69.2	Low	68.8	Low	49 Å²	49	77.1 Å²	77.1	41%	0.405	43%	0.43	S	S	.	.	H	α-helix	trans	-64	-36.7	178.8	0	0	0	0	0	112	S387 D388 T395	S387-A391 PolarHBondContact O-N 3.31Å; S387-A391 VanDerWaalsContact O-N 3.11Å; D388-A391 PolarHBondContact O-N 2.95Å; A391-T395 WeakPolarHBondContact O-CB 3.1Å; A391-T395 PolarHBondContact O-N 3.42Å; A391-T395 VanDerWaalsContact O-N 3.15Å; A391-T395 PolarHBondContact O-OG1 2.84Å
392	C	72.2	Confident	71	Confident	81 Å²	81	75.6 Å²	75.6	55%	0.547	42%	0.421	S	S	.	.	H	α-helix	trans	-62.9	-50.2	175	-169.1	0	0	0	0	111.6	D388 S389 K390 Q394 T395 E396	D388-C392 PolarHBondContact O-N 3.48Å; D388-C392 VanDerWaalsContact O-N 3.13Å; S389-C392 PolarHBondContact O-N 3.35Å; K390-C392 VanDerWaalsContact C-N 3.3Å; K390-C392 PolarHBondContact O-N 2.94Å; C392-Q394 PolarHBondContact O-N 3.47Å; C392-T395 PolarHBondContact O-N 3.5Å; C392-E396 WeakPolarHBondContact O-CB 3.38Å; C392-E396 PolarHBondContact O-N 3.39Å
393	F	75.4	Confident	73.2	Confident	71 Å²	71	75.4 Å²	75.4	31%	0.311	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-44	178.6	-179.6	-102.5	0	0	0	112.8	L296 S389 K390 T395 E396 V397	L296-F393 HydrophobicContact CD1-CE2 4.28Å; L296-F393 HydrophobicContact CD1-CZ 4.36Å; S389-F393 PolarHBondContact O-N 3.46Å; K390-F393 PolarHBondContact O-N 3.48Å; F393-T395 VanDerWaalsContact C-N 3.35Å; F393-T395 PolarHBondContact O-N 2.83Å; F393-E396 PolarHBondContact O-N 3.41Å; F393-V397 HydrophobicContact CD1-CG2 4.42Å; F393-V397 HydrophobicContact CE1-CG2 4.03Å; F393-V397 HydrophobicContact CE2-CG2 4.21Å; F393-V397 HydrophobicContact CZ-CG2 3.93Å; F393-V397 WeakPolarHBondContact O-CG2 3.28Å; F393-V397 PolarHBondContact O-N 3.38Å
394	Q	79.4	Confident	75.4	Confident	65 Å²	65	72.8 Å²	72.8	30%	0.304	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-44.1	177.9	179.6	178.4	-21	0	0	111.9	L339 K390 C392 V397 Y398	L339-Q394 HydrophobicContact CD1-CB 4.13Å; L339-Q394 HydrophobicContact CD1-CG 4.04Å; K390-Q394 PolarHBondContact O-N 2.85Å; K390-Q394 VanDerWaalsContact O-N 3.07Å; C392-Q394 PolarHBondContact O-N 3.47Å; Q394-V397 PolarHBondContact O-N 2.91Å; Q394-Y398 HydrophobicContact CG-CD2 4.14Å; Q394-Y398 HydrophobicContact CG-CE1 4.21Å; Q394-Y398 HydrophobicContact CG-CE2 3.44Å; Q394-Y398 VanDerWaalsContact CG-CE2 3.44Å; Q394-Y398 VanDerWaalsContact CG-CZ 3.46Å; Q394-Y398 WeakPolarHBondContact CG-OH 3.45Å; Q394-Y398 VanDerWaalsContact NE2-CE2 3.3Å; Q394-Y398 PolarHBondContact NE2-OH 2.88Å; Q394-Y398 WeakPolarHBondContact O-CD2 3.47Å; Q394-Y398 VanDerWaalsContact O-CG 3.27Å; Q394-Y398 PolarHBondContact O-N 3.36Å; Q394-Y398 VanDerWaalsContact O-N 3.17Å
395	T	84.5	Confident	77.6	Confident	79 Å²	79	73.1 Å²	73.1	49%	0.485	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-40.9	180	-54.7	0	0	0	0	111	A391 C392 F393 Y398 I399	A391-T395 WeakPolarHBondContact O-CB 3.1Å; A391-T395 PolarHBondContact O-N 3.42Å; A391-T395 VanDerWaalsContact O-N 3.15Å; A391-T395 PolarHBondContact O-OG1 2.84Å; C392-T395 PolarHBondContact O-N 3.5Å; F393-T395 VanDerWaalsContact C-N 3.35Å; F393-T395 PolarHBondContact O-N 2.83Å; T395-Y398 PolarHBondContact O-N 3Å; T395-I399 HydrophobicContact CG2-CD1 3.95Å; T395-I399 VanDerWaalsContact O-CG1 3.31Å; T395-I399 WeakPolarHBondContact O-CG1 3.34Å; T395-I399 PolarHBondContact O-N 3.49Å
396	E	86.7	Confident	79.8	Confident	118 Å²	118	72.5 Å²	72.5	55%	0.551	39%	0.385	S	S	*	.	H	α-helix	trans	-60.3	-48.7	176.5	-171.7	-180	173.5	0	0	111.7	C392 F393 Y398 I399 V400	C392-E396 WeakPolarHBondContact O-CB 3.38Å; C392-E396 PolarHBondContact O-N 3.39Å; F393-E396 PolarHBondContact O-N 3.41Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 3.02Å; E396-I399 PolarHBondContact O-N 3.37Å; E396-V400 HydrophobicContact CG-CG2 4.46Å; E396-V400 VanDerWaalsContact O-CG2 3.3Å; E396-V400 WeakPolarHBondContact O-CG2 3.09Å; E396-V400 PolarHBondContact O-N 2.97Å
397	V	85.1	Confident	81.9	Confident	19 Å²	19	70.8 Å²	70.8	12%	0.115	39%	0.385	C	S	.	.	H	α-helix	trans	-59.8	-43.3	178.6	173.8	0	0	0	0	111.3	V335 F393 Q394 I399 V400 V401	V335-V397 HydrophobicContact CG2-CG1 4.29Å; F393-V397 HydrophobicContact CD1-CG2 4.42Å; F393-V397 HydrophobicContact CE1-CG2 4.03Å; F393-V397 HydrophobicContact CE2-CG2 4.21Å; F393-V397 HydrophobicContact CZ-CG2 3.93Å; F393-V397 WeakPolarHBondContact O-CG2 3.28Å; F393-V397 PolarHBondContact O-N 3.38Å; Q394-V397 PolarHBondContact O-N 2.91Å; V397-I399 PolarHBondContact O-N 3.04Å; V397-V400 PolarHBondContact O-N 2.95Å; V397-V401 HydrophobicContact CG1-CG2 4.22Å; V397-V401 WeakPolarHBondContact O-CB 3.5Å; V397-V401 VanDerWaalsContact O-CG2 3.27Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.46Å
398	Y	89.3	Confident	83.7	Confident	55 Å²	55	67.4 Å²	67.4	22%	0.216	36%	0.361	C	S	.	.	H	α-helix	trans	-63.3	-42.1	178.3	-64.4	-17.8	0	0	0	112.7	I332 Q336 Q394 T395 E396 F402	I332-Y398 HydrophobicContact CB-CE1 4.29Å; I332-Y398 HydrophobicContact CG1-CD1 3.96Å; I332-Y398 HydrophobicContact CG1-CE1 4.16Å; I332-Y398 HydrophobicContact CG2-CD1 4.25Å; I332-Y398 HydrophobicContact CG2-CE1 3.7Å; Q336-Y398 WeakPolarHBondContact CG-OH 3.09Å; Q336-Y398 PolarHBondContact NE2-OH 3.33Å; Q336-Y398 VanDerWaalsContact NE2-OH 3.16Å; Q394-Y398 HydrophobicContact CG-CD2 4.14Å; Q394-Y398 HydrophobicContact CG-CE1 4.21Å; Q394-Y398 HydrophobicContact CG-CE2 3.44Å; Q394-Y398 VanDerWaalsContact CG-CE2 3.44Å; Q394-Y398 VanDerWaalsContact CG-CZ 3.46Å; Q394-Y398 WeakPolarHBondContact CG-OH 3.45Å; Q394-Y398 VanDerWaalsContact NE2-CE2 3.3Å; Q394-Y398 PolarHBondContact NE2-OH 2.88Å; Q394-Y398 WeakPolarHBondContact O-CD2 3.47Å; Q394-Y398 VanDerWaalsContact O-CG 3.27Å; Q394-Y398 PolarHBondContact O-N 3.36Å; Q394-Y398 VanDerWaalsContact O-N 3.17Å; T395-Y398 PolarHBondContact O-N 3Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 3.02Å; Y398-F402 VanDerWaalsContact O-CB 3.25Å; Y398-F402 WeakPolarHBondContact O-CB 3.32Å; Y398-F402 PolarHBondContact O-N 2.95Å
399	I	91.6	Very high	85.4	Confident	91 Å²	91	64 Å²	64	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-63.2	-45.1	176.2	-68.4	168.5	0	0	0	110.2	T395 E396 V397 F402 L403	T395-I399 HydrophobicContact CG2-CD1 3.95Å; T395-I399 VanDerWaalsContact O-CG1 3.31Å; T395-I399 WeakPolarHBondContact O-CG1 3.34Å; T395-I399 PolarHBondContact O-N 3.49Å; E396-I399 PolarHBondContact O-N 3.37Å; V397-I399 PolarHBondContact O-N 3.04Å; I399-F402 PolarHBondContact O-N 3.42Å; I399-L403 HydrophobicContact CG2-CD1 3.7Å; I399-L403 HydrophobicContact CG2-CG 4.23Å; I399-L403 WeakPolarHBondContact O-CB 3.1Å; I399-L403 VanDerWaalsContact O-CG 3.31Å; I399-L403 WeakPolarHBondContact O-CG 3.43Å; I399-L403 PolarHBondContact O-N 2.97Å
400	V	91.4	Very high	87	Confident	66 Å²	66	65.9 Å²	65.9	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-45.1	179.8	170.3	0	0	0	0	111.8	M303 E396 V397 S404	M303-V400 HydrophobicContact CE-CG1 3.9Å; E396-V400 HydrophobicContact CG-CG2 4.46Å; E396-V400 VanDerWaalsContact O-CG2 3.3Å; E396-V400 WeakPolarHBondContact O-CG2 3.09Å; E396-V400 PolarHBondContact O-N 2.97Å; V397-V400 PolarHBondContact O-N 2.95Å; V400-S404 VanDerWaalsContact O-CB 3.22Å; V400-S404 WeakPolarHBondContact O-CB 3.29Å; V400-S404 PolarHBondContact O-N 3.5Å; V400-S404 PolarHBondContact O-OG 3.48Å
401	V	91.1	Very high	88.3	Confident	5 Å²	5	65 Å²	65	3%	0.03	34%	0.341	C	S	.	.	H	α-helix	trans	-64.3	-43.4	177.6	173.4	0	0	0	0	110.9	M303 M306 L331 I332 V397 S404 F405	M303-V401 HydrophobicContact SD-CG2 3.91Å; M306-V401 HydrophobicContact CE-CG1 4.38Å; L331-V401 HydrophobicContact CD2-CG2 3.47Å; L331-V401 VanDerWaalsContact CD2-CG2 3.47Å; L331-V401 HydrophobicContact CG-CG2 4.2Å; I332-V401 HydrophobicContact CD1-CG1 4.22Å; I332-V401 HydrophobicContact CG1-CG1 4.38Å; V397-V401 HydrophobicContact CG1-CG2 4.22Å; V397-V401 WeakPolarHBondContact O-CB 3.5Å; V397-V401 VanDerWaalsContact O-CG2 3.27Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.46Å; V401-S404 PolarHBondContact O-N 2.9Å; V401-F405 WeakPolarHBondContact O-CB 3.44Å; V401-F405 PolarHBondContact O-N 3.33Å
402	F	93.1	Very high	89.4	Confident	125 Å²	125	62.7 Å²	62.7	55%	0.548	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-49.6	178.4	177.8	-103.4	0	0	0	112.3	Y398 I399 S404 F405 L406	Y398-F402 VanDerWaalsContact O-CB 3.25Å; Y398-F402 WeakPolarHBondContact O-CB 3.32Å; Y398-F402 PolarHBondContact O-N 2.95Å; I399-F402 PolarHBondContact O-N 3.42Å; F402-S404 VanDerWaalsContact C-N 3.34Å; F402-S404 PolarHBondContact O-N 2.81Å; F402-F405 PolarHBondContact O-N 2.98Å; F402-L406 HydrophobicContact CD1-CD1 4.12Å; F402-L406 HydrophobicContact CE1-CD1 3.47Å; F402-L406 VanDerWaalsContact CE1-CD1 3.47Å; F402-L406 HydrophobicContact CE1-CG 4.3Å; F402-L406 HydrophobicContact CE2-CD1 4.32Å; F402-L406 HydrophobicContact CE2-CG 4.43Å; F402-L406 HydrophobicContact CZ-CD1 3.59Å; F402-L406 HydrophobicContact CZ-CG 4.18Å; F402-L406 WeakPolarHBondContact O-CG 3.42Å; F402-L406 PolarHBondContact O-N 3.48Å
403	L	94.2	Very high	90.3	Very high	102 Å²	102	65.7 Å²	65.7	53%	0.534	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-40.7	178.1	-71.1	175.2	0	0	0	111.7	I399 L406 L407	I399-L403 HydrophobicContact CG2-CD1 3.7Å; I399-L403 HydrophobicContact CG2-CG 4.23Å; I399-L403 WeakPolarHBondContact O-CB 3.1Å; I399-L403 VanDerWaalsContact O-CG 3.31Å; I399-L403 WeakPolarHBondContact O-CG 3.43Å; I399-L403 PolarHBondContact O-N 2.97Å; L403-L406 PolarHBondContact O-N 3.18Å; L403-L407 WeakPolarHBondContact O-CB 3.5Å; L403-L407 PolarHBondContact O-N 3.04Å
404	S	92.8	Very high	91	Very high	14 Å²	14	66.6 Å²	66.6	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-40.4	177.6	-59.8	0	0	0	0	111.9	M303 V400 V401 F402 L407 I408	M303-S404 VanDerWaalsContact CE-CB 3.45Å; M303-S404 WeakPolarHBondContact CE-OG 3.48Å; V400-S404 VanDerWaalsContact O-CB 3.22Å; V400-S404 WeakPolarHBondContact O-CB 3.29Å; V400-S404 PolarHBondContact O-N 3.5Å; V400-S404 PolarHBondContact O-OG 3.48Å; V401-S404 PolarHBondContact O-N 2.9Å; F402-S404 VanDerWaalsContact C-N 3.34Å; F402-S404 PolarHBondContact O-N 2.81Å; S404-L407 PolarHBondContact O-N 2.99Å; S404-I408 WeakPolarHBondContact O-CB 3.32Å; S404-I408 WeakPolarHBondContact O-CD1 3.3Å; S404-I408 VanDerWaalsContact O-CG1 3.23Å; S404-I408 WeakPolarHBondContact O-CG1 3.47Å; S404-I408 PolarHBondContact O-N 3.17Å
405	F	93.9	Very high	91.5	Very high	45 Å²	45	68.1 Å²	68.1	20%	0.197	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-49.4	173.8	171.2	-107.4	0	0	0	111.8	M306 F325 V401 F402 L407 I408 V409	M306-F405 HydrophobicContact CE-CB 4.44Å; F325-F405 HydrophobicContact CB-CD2 4.27Å; F325-F405 HydrophobicContact CB-CE2 3.55Å; F325-F405 HydrophobicContact CB-CZ 3.99Å; F325-F405 HydrophobicContact CD2-CD2 4.37Å; F325-F405 HydrophobicContact CD2-CE1 4.01Å; F325-F405 AromaticContact CD2-CE2 3.88Å; F325-F405 HydrophobicContact CD2-CE2 3.88Å; F325-F405 AromaticContact CD2-CZ 3.66Å; F325-F405 HydrophobicContact CD2-CZ 3.66Å; F325-F405 HydrophobicContact CG-CE2 4.17Å; F325-F405 HydrophobicContact CG-CZ 4.18Å; V401-F405 WeakPolarHBondContact O-CB 3.44Å; V401-F405 PolarHBondContact O-N 3.33Å; F402-F405 PolarHBondContact O-N 2.98Å; F405-L407 VanDerWaalsContact C-N 3.3Å; F405-L407 PolarHBondContact O-N 3.32Å; F405-I408 PolarHBondContact O-N 3.38Å; F405-V409 HydrophobicContact CD2-CG2 3.97Å; F405-V409 HydrophobicContact CE1-CG2 4.1Å; F405-V409 HydrophobicContact CE2-CG2 3.47Å; F405-V409 VanDerWaalsContact CE2-CG2 3.47Å; F405-V409 HydrophobicContact CG-CG2 4.46Å; F405-V409 HydrophobicContact CZ-CG2 3.57Å; F405-V409 VanDerWaalsContact O-CG2 3.29Å; F405-V409 WeakPolarHBondContact O-CG2 3.24Å; F405-V409 PolarHBondContact O-N 3.09Å
406	L	94.3	Very high	91.7	Very high	84 Å²	84	65.2 Å²	65.2	44%	0.44	32%	0.315	S	S	.	.	H	α-helix	trans	-58.4	-43.1	177.6	-71.3	-176.6	0	0	0	111.9	F402 L403 V409 F410	F402-L406 HydrophobicContact CD1-CD1 4.12Å; F402-L406 HydrophobicContact CE1-CD1 3.47Å; F402-L406 VanDerWaalsContact CE1-CD1 3.47Å; F402-L406 HydrophobicContact CE1-CG 4.3Å; F402-L406 HydrophobicContact CE2-CD1 4.32Å; F402-L406 HydrophobicContact CE2-CG 4.43Å; F402-L406 HydrophobicContact CZ-CD1 3.59Å; F402-L406 HydrophobicContact CZ-CG 4.18Å; F402-L406 WeakPolarHBondContact O-CG 3.42Å; F402-L406 PolarHBondContact O-N 3.48Å; L403-L406 PolarHBondContact O-N 3.18Å; L406-V409 PolarHBondContact O-N 3.38Å; L406-F410 WeakPolarHBondContact O-CB 3.46Å; L406-F410 PolarHBondContact O-N 3.47Å
407	L	94.8	Very high	91.7	Very high	92 Å²	92	61.1 Å²	61.1	48%	0.482	30%	0.301	S	S	.	.	H	α-helix	trans	-60.8	-49.4	176.8	180	63.8	0	0	0	111.6	F307 L403 S404 F405 V409 F410 V411	F307-L407 HydrophobicContact CE1-CD2 4.22Å; L403-L407 WeakPolarHBondContact O-CB 3.5Å; L403-L407 PolarHBondContact O-N 3.04Å; S404-L407 PolarHBondContact O-N 2.99Å; F405-L407 VanDerWaalsContact C-N 3.3Å; F405-L407 PolarHBondContact O-N 3.32Å; L407-V409 PolarHBondContact O-N 2.66Å; L407-F410 PolarHBondContact O-N 2.93Å; L407-V411 HydrophobicContact CD1-CG2 4.03Å; L407-V411 HydrophobicContact CG-CG2 4.39Å; L407-V411 WeakPolarHBondContact O-CB 3.25Å; L407-V411 VanDerWaalsContact O-CG2 3.28Å; L407-V411 WeakPolarHBondContact O-CG2 3.4Å; L407-V411 PolarHBondContact O-N 3.4Å
408	I	94	Very high	91.7	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-41.5	-178.6	-69.1	160.5	0	0	0	111.3	M306 F307 H309 V310 C324 S404 F405 N412	M306-I408 HydrophobicContact CB-CD1 3.89Å; M306-I408 WeakPolarHBondContact O-CD1 3.37Å; F307-I408 HydrophobicContact CD1-CD1 4.19Å; F307-I408 HydrophobicContact CD1-CG1 4.18Å; F307-I408 HydrophobicContact CE1-CD1 4.44Å; F307-I408 HydrophobicContact CE1-CG1 4.38Å; F307-I408 HydrophobicContact CG-CD1 4.49Å; H309-I408 HydrophobicContact CB-CG2 4.36Å; V310-I408 HydrophobicContact CG2-CG1 4.2Å; V310-I408 HydrophobicContact CG2-CG2 4.25Å; C324-I408 HydrophobicContact CB-CG2 4.42Å; S404-I408 WeakPolarHBondContact O-CB 3.32Å; S404-I408 WeakPolarHBondContact O-CD1 3.3Å; S404-I408 VanDerWaalsContact O-CG1 3.23Å; S404-I408 WeakPolarHBondContact O-CG1 3.47Å; S404-I408 PolarHBondContact O-N 3.17Å; F405-I408 PolarHBondContact O-N 3.38Å; I408-N412 WeakPolarHBondContact CG2-ND2 3.48Å; I408-N412 VanDerWaalsContact O-CB 3.25Å; I408-N412 WeakPolarHBondContact O-CB 3.26Å; I408-N412 PolarHBondContact O-N 3.06Å; I408-N412 PolarHBondContact O-ND2 3.48Å
409	V	93.4	Very high	91.2	Very high	48 Å²	48	64.2 Å²	64.2	29%	0.291	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-46.9	176.7	172.5	0	0	0	0	110.7	F405 L406 L407 Y413	F405-V409 HydrophobicContact CD2-CG2 3.97Å; F405-V409 HydrophobicContact CE1-CG2 4.1Å; F405-V409 HydrophobicContact CE2-CG2 3.47Å; F405-V409 VanDerWaalsContact CE2-CG2 3.47Å; F405-V409 HydrophobicContact CG-CG2 4.46Å; F405-V409 HydrophobicContact CZ-CG2 3.57Å; F405-V409 VanDerWaalsContact O-CG2 3.29Å; F405-V409 WeakPolarHBondContact O-CG2 3.24Å; F405-V409 PolarHBondContact O-N 3.09Å; L406-V409 PolarHBondContact O-N 3.38Å; L407-V409 PolarHBondContact O-N 2.66Å; V409-Y413 WeakPolarHBondContact O-CB 3.41Å; V409-Y413 PolarHBondContact O-N 3.17Å
410	F	94	Very high	90.8	Very high	121 Å²	121	66.6 Å²	66.6	53%	0.531	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-48.5	179	178.5	-101.3	0	0	0	111.9	L406 L407 N412 Y413 Q414	L406-F410 WeakPolarHBondContact O-CB 3.46Å; L406-F410 PolarHBondContact O-N 3.47Å; L407-F410 PolarHBondContact O-N 2.93Å; F410-N412 PolarHBondContact O-N 3.49Å; F410-Y413 PolarHBondContact O-N 3.25Å; F410-Q414 HydrophobicContact CD1-CG 4.3Å; F410-Q414 HydrophobicContact CE1-CG 3.92Å; F410-Q414 HydrophobicContact CE2-CG 4.23Å; F410-Q414 HydrophobicContact CZ-CG 3.89Å; F410-Q414 WeakPolarHBondContact O-CG 3.49Å; F410-Q414 PolarHBondContact O-N 3.06Å
411	V	93.4	Very high	90.3	Very high	35 Å²	35	69.7 Å²	69.7	21%	0.212	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-43.4	179.9	172.9	0	0	0	0	111.3	V310 L407 Y413 Q414 F415	V310-V411 HydrophobicContact CG1-CG1 3.68Å; V310-V411 HydrophobicContact CG2-CG1 4.42Å; L407-V411 HydrophobicContact CD1-CG2 4.03Å; L407-V411 HydrophobicContact CG-CG2 4.39Å; L407-V411 WeakPolarHBondContact O-CB 3.25Å; L407-V411 VanDerWaalsContact O-CG2 3.28Å; L407-V411 WeakPolarHBondContact O-CG2 3.4Å; L407-V411 PolarHBondContact O-N 3.4Å; V411-Y413 VanDerWaalsContact C-N 3.32Å; V411-Y413 PolarHBondContact O-N 2.85Å; V411-Q414 PolarHBondContact O-N 3.41Å; V411-F415 HydrophobicContact CG1-CD2 3.62Å; V411-F415 HydrophobicContact CG1-CE2 3.36Å; V411-F415 HydrophobicContact CG1-CZ 4.12Å; V411-F415 PolarHBondContact O-N 3.46Å
412	N	92.1	Very high	89.6	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-39.3	177	-89.3	-39.6	0	0	0	112.6	H309 K320 I408 F410 E416	H309-N412 PolarHBondContact O-ND2 3.27Å; H309-N412 PolarHBondContact O-OD1 3.3Å; H309-N412 VanDerWaalsContact O-OD1 3.07Å; K320-N412 WeakPolarHBondContact CE-OD1 3.09Å; K320-N412 PolarHBondContact NZ-OD1 3.1Å; I408-N412 WeakPolarHBondContact CG2-ND2 3.48Å; I408-N412 VanDerWaalsContact O-CB 3.25Å; I408-N412 WeakPolarHBondContact O-CB 3.26Å; I408-N412 PolarHBondContact O-N 3.06Å; I408-N412 PolarHBondContact O-ND2 3.48Å; F410-N412 PolarHBondContact O-N 3.49Å; N412-E416 WeakPolarHBondContact O-CB 3.23Å; N412-E416 PolarHBondContact O-N 3.35Å
413	Y	91.7	Very high	88.8	Confident	144 Å²	144	71.7 Å²	71.7	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-65.4	-44.5	175.3	177.9	-101.4	0	0	0	111.7	V409 F410 V411 E416 A417	V409-Y413 WeakPolarHBondContact O-CB 3.41Å; V409-Y413 PolarHBondContact O-N 3.17Å; F410-Y413 PolarHBondContact O-N 3.25Å; V411-Y413 VanDerWaalsContact C-N 3.32Å; V411-Y413 PolarHBondContact O-N 2.85Å; Y413-E416 PolarHBondContact O-N 3.05Å; Y413-A417 WeakPolarHBondContact O-CB 3.36Å; Y413-A417 PolarHBondContact O-N 3.19Å
414	Q	91.2	Very high	88	Confident	90 Å²	90	73.7 Å²	73.7	42%	0.421	36%	0.357	S	S	.	.	H	α-helix	trans	-62	-44.6	177.5	-71.7	-69.1	-2.3	0	0	112.3	F410 V411 A417 S418	F410-Q414 HydrophobicContact CD1-CG 4.3Å; F410-Q414 HydrophobicContact CE1-CG 3.92Å; F410-Q414 HydrophobicContact CE2-CG 4.23Å; F410-Q414 HydrophobicContact CZ-CG 3.89Å; F410-Q414 WeakPolarHBondContact O-CG 3.49Å; F410-Q414 PolarHBondContact O-N 3.06Å; V411-Q414 PolarHBondContact O-N 3.41Å; Q414-A417 PolarHBondContact O-N 3.26Å; Q414-S418 VanDerWaalsContact O-CB 3.32Å; Q414-S418 WeakPolarHBondContact O-CB 3.4Å; Q414-S418 PolarHBondContact O-N 2.97Å
415	F	89.1	Confident	87	Confident	96 Å²	96	74.6 Å²	74.6	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-40.4	177.3	-74.6	-35.3	0	0	0	113	V310 V411 A417 S418 F419	V310-F415 HydrophobicContact CG1-CD2 4.05Å; V310-F415 HydrophobicContact CG1-CE2 3.62Å; V411-F415 HydrophobicContact CG1-CD2 3.62Å; V411-F415 HydrophobicContact CG1-CE2 3.36Å; V411-F415 HydrophobicContact CG1-CZ 4.12Å; V411-F415 PolarHBondContact O-N 3.46Å; F415-A417 VanDerWaalsContact C-N 3.35Å; F415-S418 PolarHBondContact O-N 2.93Å; F415-F419 WeakPolarHBondContact O-CB 3.41Å; F415-F419 PolarHBondContact O-N 2.78Å
416	E	87.6	Confident	86	Confident	18 Å²	18	76.4 Å²	76.4	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-46	173.5	176.7	-177.4	179.4	0	0	111.1	S317 N412 Y413 R420	S317-E416 WeakPolarHBondContact CB-OE2 2.94Å; S317-E416 PolarHBondContact N-OE2 3.42Å; S317-E416 PolarHBondContact OG-OE2 2.96Å; N412-E416 WeakPolarHBondContact O-CB 3.23Å; N412-E416 PolarHBondContact O-N 3.35Å; Y413-E416 PolarHBondContact O-N 3.05Å; E416-R420 WeakPolarHBondContact O-CB 3.05Å; E416-R420 WeakPolarHBondContact O-CG 3.46Å; E416-R420 PolarHBondContact O-N 3.17Å; E416-R420 IonicContact OE1-CZ 3.54Å; E416-R420 IonicContact OE1-NE 3.14Å; E416-R420 IonicContact OE1-NH1 2.64Å; E416-R420 PolarHBondContact OE1-NH1 2.86Å; E416-R420 IonicContact OE1-NH2 3.2Å; E416-R420 PolarHBondContact OE1-NH2 3.36Å
417	A	87	Confident	85	Confident	33 Å²	33	77 Å²	77	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-46.6	179.4	0	0	0	0	0	111.4	Y413 Q414 F415 F419 R420 M421	Y413-A417 WeakPolarHBondContact O-CB 3.36Å; Y413-A417 PolarHBondContact O-N 3.19Å; Q414-A417 PolarHBondContact O-N 3.26Å; F415-A417 VanDerWaalsContact C-N 3.35Å; A417-F419 PolarHBondContact O-N 3.21Å; A417-R420 PolarHBondContact O-N 3.03Å; A417-M421 WeakPolarHBondContact O-CB 3.38Å; A417-M421 VanDerWaalsContact O-CG 3.31Å; A417-M421 WeakPolarHBondContact O-CG 3.44Å; A417-M421 PolarHBondContact O-N 3.42Å
418	S	84.8	Confident	84.3	Confident	77 Å²	77	77 Å²	77	54%	0.538	38%	0.38	S	S	.	.	H	α-helix	trans	-59.6	-46.8	177.8	179.8	0	0	0	0	112	Q414 F415 R420 M421 S422	Q414-S418 VanDerWaalsContact O-CB 3.32Å; Q414-S418 WeakPolarHBondContact O-CB 3.4Å; Q414-S418 PolarHBondContact O-N 2.97Å; F415-S418 PolarHBondContact O-N 2.93Å; S418-R420 PolarHBondContact O-N 3.41Å; S418-M421 PolarHBondContact O-N 2.89Å; S418-S422 PolarHBondContact O-N 2.82Å
419	F	80.4	Confident	83.2	Confident	61 Å²	61	79.2 Å²	79.2	27%	0.268	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-42	178.7	-176.6	-95.2	0	0	0	112.4	P185 Q314 F415 A417 S422 F423	P185-F419 HydrophobicContact CG-CE2 3.88Å; P185-F419 HydrophobicContact CG-CZ 3.71Å; Q314-F419 HydrophobicContact CB-CE1 4.23Å; Q314-F419 HydrophobicContact CB-CE2 4.44Å; Q314-F419 HydrophobicContact CB-CZ 4.13Å; Q314-F419 HydrophobicContact CG-CD2 4.2Å; Q314-F419 HydrophobicContact CG-CE1 4.42Å; Q314-F419 HydrophobicContact CG-CE2 3.75Å; Q314-F419 HydrophobicContact CG-CZ 3.86Å; F415-F419 WeakPolarHBondContact O-CB 3.41Å; F415-F419 PolarHBondContact O-N 2.78Å; A417-F419 PolarHBondContact O-N 3.21Å; F419-S422 PolarHBondContact O-N 3.08Å; F419-F423 PolarHBondContact O-N 3.15Å
420	R	82.8	Confident	82.3	Confident	141 Å²	141	78.6 Å²	78.6	53%	0.532	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-40.1	176	-76.4	-175.9	177.3	176.6	8.2	112.6	E416 A417 S418 Y424	E416-R420 WeakPolarHBondContact O-CB 3.05Å; E416-R420 WeakPolarHBondContact O-CG 3.46Å; E416-R420 PolarHBondContact O-N 3.17Å; E416-R420 IonicContact OE1-CZ 3.54Å; E416-R420 IonicContact OE1-NE 3.14Å; E416-R420 IonicContact OE1-NH1 2.64Å; E416-R420 PolarHBondContact OE1-NH1 2.86Å; E416-R420 IonicContact OE1-NH2 3.2Å; E416-R420 PolarHBondContact OE1-NH2 3.36Å; A417-R420 PolarHBondContact O-N 3.03Å; S418-R420 PolarHBondContact O-N 3.41Å; R420-Y424 WeakPolarHBondContact O-CB 3.34Å; R420-Y424 PolarHBondContact O-N 3.49Å
421	M	81.1	Confident	81.6	Confident	131 Å²	131	77.2 Å²	77.2	65%	0.645	39%	0.391	S	S	*	.	H	α-helix	trans	-65.5	-43.2	176.6	-73.9	-57.7	-61	0	0	111.6	A417 S418 Y424 G425	A417-M421 WeakPolarHBondContact O-CB 3.38Å; A417-M421 VanDerWaalsContact O-CG 3.31Å; A417-M421 WeakPolarHBondContact O-CG 3.44Å; A417-M421 PolarHBondContact O-N 3.42Å; S418-M421 PolarHBondContact O-N 2.89Å; M421-Y424 PolarHBondContact O-N 3.24Å; M421-G425 PolarHBondContact O-N 3.31Å
422	S	75.3	Confident	80.7	Confident	68 Å²	68	78.5 Å²	78.5	48%	0.476	40%	0.399	S	S	.	.	H	α-helix	trans	-58.8	-49.2	174.9	-170	0	0	0	0	111.5	S418 F419 Y424 G425 D426	S418-S422 PolarHBondContact O-N 2.82Å; F419-S422 PolarHBondContact O-N 3.08Å; S422-Y424 VanDerWaalsContact C-N 3.32Å; S422-Y424 PolarHBondContact O-N 2.87Å; S422-G425 PolarHBondContact O-N 2.89Å; S422-D426 PolarHBondContact O-N 3.47Å
423	F	76.1	Confident	79.9	Confident	104 Å²	104	82 Å²	82	46%	0.456	42%	0.417	S	S	.	.	H	α-helix	trans	-60.8	-41.5	178.5	177	-99.3	0	0	0	112.5	F419 D426 M427	F419-F423 PolarHBondContact O-N 3.15Å; F423-D426 PolarHBondContact O-N 2.96Å; F423-M427 HydrophobicContact CD1-CG 4.35Å; F423-M427 HydrophobicContact CE1-CG 3.84Å; F423-M427 HydrophobicContact CE1-SD 3.59Å; F423-M427 VanDerWaalsContact CE1-SD 3.59Å; F423-M427 HydrophobicContact CE2-CG 4.11Å; F423-M427 HydrophobicContact CE2-SD 4.4Å; F423-M427 HydrophobicContact CZ-CG 3.71Å; F423-M427 HydrophobicContact CZ-SD 3.48Å; F423-M427 WeakPolarHBondContact CZ-SD 3.46Å; F423-M427 WeakPolarHBondContact O-CB 3.47Å; F423-M427 WeakPolarHBondContact O-CG 3.47Å; F423-M427 PolarHBondContact O-N 3.36Å
424	Y	78.9	Confident	79.2	Confident	144 Å²	144	82 Å²	82	57%	0.565	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-42.5	176.8	-177.5	-93.3	0	0	0	111.8	R420 M421 S422 M427 Q428	R420-Y424 WeakPolarHBondContact O-CB 3.34Å; R420-Y424 PolarHBondContact O-N 3.49Å; M421-Y424 PolarHBondContact O-N 3.24Å; S422-Y424 VanDerWaalsContact C-N 3.32Å; S422-Y424 PolarHBondContact O-N 2.87Å; Y424-M427 PolarHBondContact O-N 2.93Å; Y424-Q428 WeakPolarHBondContact O-CB 3.43Å; Y424-Q428 PolarHBondContact O-N 2.98Å
425	G	71.1	Confident	78.8	Confident	34 Å²	34	82.4 Å²	82.4	35%	0.351	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-47.5	175.3	0	0	0	0	0	112.7	M421 S422 M427 Q428 A429	M421-G425 PolarHBondContact O-N 3.31Å; S422-G425 PolarHBondContact O-N 2.89Å; G425-M427 PolarHBondContact O-N 2.98Å; G425-Q428 PolarHBondContact O-N 3.35Å; G425-A429 WeakPolarHBondContact O-CB 3.41Å; G425-A429 PolarHBondContact O-N 3.27Å
426	D	72.2	Confident	78.3	Confident	82 Å²	82	82.9 Å²	82.9	44%	0.439	42%	0.421	S	S	.	.	H	α-helix	trans	-63.2	-43.1	178.6	-66.6	-25.8	0	0	0	111.9	V182 S422 F423 Q428 A429 C430	V182-D426 HydrophobicContact CG1-CB 4.33Å; S422-D426 PolarHBondContact O-N 3.47Å; F423-D426 PolarHBondContact O-N 2.96Å; D426-Q428 VanDerWaalsContact C-N 3.35Å; D426-Q428 PolarHBondContact O-N 3.44Å; D426-A429 PolarHBondContact O-N 2.76Å; D426-C430 PolarHBondContact O-N 3.48Å; D426-C430 PolarHBondContact O-SG 3.24Å
427	M	73.9	Confident	77.8	Confident	98 Å²	98	85.8 Å²	85.8	48%	0.483	43%	0.433	S	S	.	.	H	α-helix	trans	-60.9	-43.4	175.6	-79.4	-141.1	73.4	0	0	112.1	F423 Y424 G425 C430 E431	F423-M427 HydrophobicContact CD1-CG 4.35Å; F423-M427 HydrophobicContact CE1-CG 3.84Å; F423-M427 HydrophobicContact CE1-SD 3.59Å; F423-M427 VanDerWaalsContact CE1-SD 3.59Å; F423-M427 HydrophobicContact CE2-CG 4.11Å; F423-M427 HydrophobicContact CE2-SD 4.4Å; F423-M427 HydrophobicContact CZ-CG 3.71Å; F423-M427 HydrophobicContact CZ-SD 3.48Å; F423-M427 WeakPolarHBondContact CZ-SD 3.46Å; F423-M427 WeakPolarHBondContact O-CB 3.47Å; F423-M427 WeakPolarHBondContact O-CG 3.47Å; F423-M427 PolarHBondContact O-N 3.36Å; Y424-M427 PolarHBondContact O-N 2.93Å; G425-M427 PolarHBondContact O-N 2.98Å; M427-C430 PolarHBondContact O-N 3.1Å; M427-E431 PolarHBondContact O-N 2.87Å; M427-E431 VanDerWaalsContact O-N 3.11Å
428	Q	79.5	Confident	77.6	Confident	90 Å²	90	89.5 Å²	89.5	42%	0.421	45%	0.445	S	S	.	.	H	α-helix	trans	-67	-40.3	178.6	-172.1	172.5	10.3	0	0	111.8	Y424 G425 D426 E431 T432	Y424-Q428 WeakPolarHBondContact O-CB 3.43Å; Y424-Q428 PolarHBondContact O-N 2.98Å; G425-Q428 PolarHBondContact O-N 3.35Å; D426-Q428 VanDerWaalsContact C-N 3.35Å; D426-Q428 PolarHBondContact O-N 3.44Å; Q428-E431 PolarHBondContact O-N 2.98Å; Q428-T432 PolarHBondContact O-N 3.44Å; Q428-T432 PolarHBondContact O-OG1 2.83Å; Q428-T432 VanDerWaalsContact O-OG1 3.06Å
429	A	71.4	Confident	77.7	Confident	49 Å²	49	91.3 Å²	91.3	41%	0.405	45%	0.446	S	S	.	.	H	α-helix	trans	-61.6	-45.7	175.6	0	0	0	0	0	111.7	G425 D426 E431 T432 I433	G425-A429 WeakPolarHBondContact O-CB 3.41Å; G425-A429 PolarHBondContact O-N 3.27Å; D426-A429 PolarHBondContact O-N 2.76Å; A429-E431 VanDerWaalsContact C-N 3.35Å; A429-E431 PolarHBondContact O-N 3.29Å; A429-T432 PolarHBondContact O-N 3.02Å; A429-I433 WeakPolarHBondContact O-CG1 3.49Å; A429-I433 PolarHBondContact O-N 2.91Å
430	C	75.1	Confident	77.8	Confident	34 Å²	34	94 Å²	94	23%	0.23	46%	0.458	C	S	.	.	H	α-helix	trans	-61.7	-39.8	176.3	-75.2	0	0	0	0	113	V182 D426 M427 T432 R434	V182-C430 HydrophobicContact CG2-CB 4.11Å; V182-C430 WeakPolarHBondContact CG2-SG 3.31Å; D426-C430 PolarHBondContact O-N 3.48Å; D426-C430 PolarHBondContact O-SG 3.24Å; M427-C430 PolarHBondContact O-N 3.1Å; C430-T432 VanDerWaalsContact C-N 3.35Å; C430-R434 PolarHBondContact O-N 3.23Å; C430-R434 VanDerWaalsContact O-N 3.08Å
431	E	78.9	Confident	77.8	Confident	93 Å²	93	91.5 Å²	91.5	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-41.6	176.3	-170.1	179.5	162.5	0	0	111.6	M427 Q428 A429 R434 K435	M427-E431 PolarHBondContact O-N 2.87Å; M427-E431 VanDerWaalsContact O-N 3.11Å; Q428-E431 PolarHBondContact O-N 2.98Å; A429-E431 VanDerWaalsContact C-N 3.35Å; A429-E431 PolarHBondContact O-N 3.29Å; E431-R434 PolarHBondContact O-N 3.24Å; E431-K435 WeakPolarHBondContact O-CG 3.38Å; E431-K435 PolarHBondContact O-N 3.48Å; E431-K435 WeakPolarHBondContact OE1-CE 3.36Å; E431-K435 IonicContact OE1-NZ 3.78Å; E431-K435 PolarHBondContact OE1-NZ 3.03Å
432	T	74.3	Confident	78.2	Confident	61 Å²	61	91.2 Å²	91.2	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-46.3	177.5	-60.4	0	0	0	0	111.8	Q428 A429 C430 R434 K435 M436	Q428-T432 PolarHBondContact O-N 3.44Å; Q428-T432 PolarHBondContact O-OG1 2.83Å; Q428-T432 VanDerWaalsContact O-OG1 3.06Å; A429-T432 PolarHBondContact O-N 3.02Å; C430-T432 VanDerWaalsContact C-N 3.35Å; T432-R434 VanDerWaalsContact C-N 3.29Å; T432-R434 PolarHBondContact O-N 3.49Å; T432-K435 PolarHBondContact O-N 3.48Å; T432-M436 HydrophobicContact CG2-CE 3.57Å; T432-M436 HydrophobicContact CG2-CG 4.44Å; T432-M436 HydrophobicContact CG2-SD 4.1Å; T432-M436 WeakPolarHBondContact O-CG 3.36Å; T432-M436 PolarHBondContact O-N 3.46Å
433	I	76.5	Confident	78.8	Confident	73 Å²	73	90.5 Å²	90.5	37%	0.374	45%	0.451	S	S	.	.	H	α-helix	trans	-58	-43.5	176.6	-70	165.8	0	0	0	110.8	A429 M436 K437	A429-I433 WeakPolarHBondContact O-CG1 3.49Å; A429-I433 PolarHBondContact O-N 2.91Å; I433-M436 PolarHBondContact O-N 3.48Å; I433-K437 PolarHBondContact O-N 2.99Å
434	R	76.8	Confident	79.3	Confident	145 Å²	145	89.1 Å²	89.1	55%	0.547	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-47.4	177.4	-175.2	-178.1	65.3	160.3	0.4	111.9	C430 E431 T432 M436 K437 E438	C430-R434 PolarHBondContact O-N 3.23Å; C430-R434 VanDerWaalsContact O-N 3.08Å; E431-R434 PolarHBondContact O-N 3.24Å; T432-R434 VanDerWaalsContact C-N 3.29Å; T432-R434 PolarHBondContact O-N 3.49Å; R434-M436 VanDerWaalsContact C-N 3.32Å; R434-M436 PolarHBondContact O-N 3.46Å; R434-K437 PolarHBondContact O-N 3.47Å; R434-E438 WeakPolarHBondContact O-CG 3.28Å; R434-E438 PolarHBondContact O-N 2.68Å; R434-E438 VanDerWaalsContact O-N 3.08Å
435	K	82.3	Confident	79.6	Confident	99 Å²	99	89.8 Å²	89.8	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-61.3	-41.2	177.4	-72.8	175	-176	166	0	111.6	E431 T432 E438 M439	E431-K435 WeakPolarHBondContact O-CG 3.38Å; E431-K435 PolarHBondContact O-N 3.48Å; E431-K435 WeakPolarHBondContact OE1-CE 3.36Å; E431-K435 IonicContact OE1-NZ 3.78Å; E431-K435 PolarHBondContact OE1-NZ 3.03Å; T432-K435 PolarHBondContact O-N 3.48Å; K435-E438 PolarHBondContact O-N 3.47Å; K435-M439 WeakPolarHBondContact O-CG 3.47Å; K435-M439 PolarHBondContact O-N 3.48Å
436	M	78.4	Confident	80.5	Confident	105 Å²	105	92.1 Å²	92.1	52%	0.517	45%	0.454	S	S	.	.	H	α-helix	trans	-61.6	-42.2	176.6	-74.7	175.3	175.9	0	0	112.2	T432 I433 R434 M439 K440	T432-M436 HydrophobicContact CG2-CE 3.57Å; T432-M436 HydrophobicContact CG2-CG 4.44Å; T432-M436 HydrophobicContact CG2-SD 4.1Å; T432-M436 WeakPolarHBondContact O-CG 3.36Å; T432-M436 PolarHBondContact O-N 3.46Å; I433-M436 PolarHBondContact O-N 3.48Å; R434-M436 VanDerWaalsContact C-N 3.32Å; R434-M436 PolarHBondContact O-N 3.46Å; M436-M439 HydrophobicContact CG-CE 4.29Å; M436-M439 PolarHBondContact O-N 3.18Å; M436-K440 WeakPolarHBondContact O-CB 3.13Å; M436-K440 PolarHBondContact O-N 3.09Å
437	K	76.5	Confident	81.2	Confident	79 Å²	79	91.3 Å²	91.3	34%	0.343	45%	0.449	S	S	.	.	H	α-helix	trans	-61.7	-48.4	175.2	-174.9	174.7	-179.4	175.2	0	111.7	D178 I433 R434 M439 K440 D441	D178-K437 IonicContact OD2-NZ 3.14Å; D178-K437 PolarHBondContact OD2-NZ 2.99Å; I433-K437 PolarHBondContact O-N 2.99Å; R434-K437 PolarHBondContact O-N 3.47Å; K437-M439 VanDerWaalsContact C-N 3.32Å; K437-M439 PolarHBondContact O-N 3.31Å; K437-K440 PolarHBondContact O-N 2.97Å; K437-K440 VanDerWaalsContact O-N 3.16Å; K437-D441 VanDerWaalsContact O-CG 3.25Å; K437-D441 PolarHBondContact O-N 3.45Å
438	E	84.1	Confident	81.7	Confident	111 Å²	111	89.6 Å²	89.6	52%	0.519	45%	0.447	S	S	.	.	H	α-helix	trans	-58.3	-43.3	177.6	-70.6	172.4	178.1	0	0	112.1	R434 K435 Q442	R434-E438 WeakPolarHBondContact O-CG 3.28Å; R434-E438 PolarHBondContact O-N 2.68Å; R434-E438 VanDerWaalsContact O-N 3.08Å; K435-E438 PolarHBondContact O-N 3.47Å; E438-Q442 WeakPolarHBondContact O-CB 3.31Å; E438-Q442 PolarHBondContact O-N 3.05Å; E438-Q442 VanDerWaalsContact O-N 3.09Å
439	M	85.5	Confident	82	Confident	115 Å²	115	89.8 Å²	89.8	57%	0.567	45%	0.451	S	S	*	.	H	α-helix	trans	-66.8	-38.5	176.1	-70.6	-174.1	-60.4	0	0	112.6	K435 M436 K437 Q442 A443	K435-M439 WeakPolarHBondContact O-CG 3.47Å; K435-M439 PolarHBondContact O-N 3.48Å; M436-M439 HydrophobicContact CG-CE 4.29Å; M436-M439 PolarHBondContact O-N 3.18Å; K437-M439 VanDerWaalsContact C-N 3.32Å; K437-M439 PolarHBondContact O-N 3.31Å; M439-Q442 PolarHBondContact O-N 3.16Å; M439-A443 WeakPolarHBondContact O-CB 3.45Å; M439-A443 PolarHBondContact O-N 3.19Å
440	K	83.6	Confident	82.8	Confident	119 Å²	119	92.4 Å²	92.4	52%	0.517	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-48.7	177	174.4	168.8	169.7	46.3	0	111.3	M436 K437 Q442 A443 D444	M436-K440 WeakPolarHBondContact O-CB 3.13Å; M436-K440 PolarHBondContact O-N 3.09Å; K437-K440 PolarHBondContact O-N 2.97Å; K437-K440 VanDerWaalsContact O-N 3.16Å; K440-Q442 VanDerWaalsContact C-N 3.26Å; K440-Q442 PolarHBondContact O-N 3.19Å; K440-A443 PolarHBondContact O-N 3.18Å; K440-A443 VanDerWaalsContact O-N 3.11Å; K440-D444 IonicContact NZ-OD1 3.87Å; K440-D444 IonicContact NZ-OD2 2.63Å; K440-D444 PolarHBondContact NZ-OD2 3.11Å; K440-D444 WeakPolarHBondContact O-CB 3.37Å; K440-D444 PolarHBondContact O-N 3.19Å
441	D	83.2	Confident	83.5	Confident	88 Å²	88	90.9 Å²	90.9	47%	0.471	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-39.4	179.4	-64	-16.1	0	0	0	110.6	K437 W445	K437-D441 VanDerWaalsContact O-CG 3.25Å; K437-D441 PolarHBondContact O-N 3.45Å; D441-W445 WeakPolarHBondContact O-CB 3.4Å; D441-W445 PolarHBondContact O-N 3.01Å
442	Q	89.6	Confident	84	Confident	124 Å²	124	87 Å²	87	58%	0.579	43%	0.43	S	S	*	.	H	α-helix	trans	-64.4	-41.8	174.1	-174.5	177.8	2.4	0	0	112.4	E438 M439 K440 L446	E438-Q442 WeakPolarHBondContact O-CB 3.31Å; E438-Q442 PolarHBondContact O-N 3.05Å; E438-Q442 VanDerWaalsContact O-N 3.09Å; M439-Q442 PolarHBondContact O-N 3.16Å; K440-Q442 VanDerWaalsContact C-N 3.26Å; K440-Q442 PolarHBondContact O-N 3.19Å; Q442-L446 HydrophobicContact CG-CD1 4.36Å; Q442-L446 VanDerWaalsContact O-CG 3.3Å; Q442-L446 WeakPolarHBondContact O-CG 3.24Å; Q442-L446 PolarHBondContact O-N 2.85Å
443	A	87.5	Confident	84.6	Confident	54 Å²	54	90 Å²	90	45%	0.446	44%	0.439	S	S	.	.	H	α-helix	trans	-67	-42.8	178	0	0	0	0	0	112.1	M439 K440 L446 L447	M439-A443 WeakPolarHBondContact O-CB 3.45Å; M439-A443 PolarHBondContact O-N 3.19Å; K440-A443 PolarHBondContact O-N 3.18Å; K440-A443 VanDerWaalsContact O-N 3.11Å; A443-L446 PolarHBondContact O-N 3.27Å; A443-L447 WeakPolarHBondContact O-CB 3.5Å; A443-L447 PolarHBondContact O-N 3.44Å
444	D	85.3	Confident	85.1	Confident	75 Å²	75	87.6 Å²	87.6	40%	0.401	43%	0.426	S	S	.	.	H	α-helix	trans	-63.9	-41.8	178.5	-71.5	-18	0	0	0	110.5	K440 L447 S448	K440-D444 IonicContact NZ-OD1 3.87Å; K440-D444 IonicContact NZ-OD2 2.63Å; K440-D444 PolarHBondContact NZ-OD2 3.11Å; K440-D444 WeakPolarHBondContact O-CB 3.37Å; K440-D444 PolarHBondContact O-N 3.19Å; D444-L447 PolarHBondContact O-N 3.29Å; D444-S448 PolarHBondContact O-N 3.44Å; D444-S448 PolarHBondContact O-OG 3.26Å
445	W	86.4	Confident	85.8	Confident	157 Å²	157	80.7 Å²	80.7	60%	0.595	40%	0.4	S	S	*	.	H	α-helix	trans	-62.6	-44.3	173.9	176.6	77.2	0	0	0	113	D441 L447 S448 N449	D441-W445 WeakPolarHBondContact O-CB 3.4Å; D441-W445 PolarHBondContact O-N 3.01Å; W445-L447 VanDerWaalsContact C-N 3.29Å; W445-L447 PolarHBondContact O-N 3.36Å; W445-S448 WeakPolarHBondContact CA-OG 3.28Å; W445-S448 PolarHBondContact O-N 2.94Å; W445-S448 PolarHBondContact O-OG 2.92Å; W445-N449 WeakPolarHBondContact CH2-ND2 3.45Å; W445-N449 WeakPolarHBondContact CZ2-ND2 3.16Å; W445-N449 VanDerWaalsContact O-CG 3.22Å; W445-N449 PolarHBondContact O-N 3.07Å; W445-N449 VanDerWaalsContact O-N 3.16Å; W445-N449 PolarHBondContact O-ND2 3.05Å; W445-N449 PolarHBondContact O-OD1 3.49Å
446	L	89.3	Confident	86.1	Confident	83 Å²	83	77.5 Å²	77.5	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-38.1	176.2	-74.6	171.6	0	0	0	111.6	Q442 A443 N449 I450	Q442-L446 HydrophobicContact CG-CD1 4.36Å; Q442-L446 VanDerWaalsContact O-CG 3.3Å; Q442-L446 WeakPolarHBondContact O-CG 3.24Å; Q442-L446 PolarHBondContact O-N 2.85Å; A443-L446 PolarHBondContact O-N 3.27Å; L446-N449 PolarHBondContact O-N 2.86Å; L446-I450 WeakPolarHBondContact O-CG1 3.23Å; L446-I450 PolarHBondContact O-N 2.9Å
447	L	86.2	Confident	86.4	Confident	65 Å²	65	77.9 Å²	77.9	34%	0.34	39%	0.389	S	S	.	.	H	α-helix	trans	-68	-44.4	179.2	-175.1	60.9	0	0	0	111.7	A443 D444 W445 N449 I450 I451 V456	A443-L447 WeakPolarHBondContact O-CB 3.5Å; A443-L447 PolarHBondContact O-N 3.44Å; D444-L447 PolarHBondContact O-N 3.29Å; W445-L447 VanDerWaalsContact C-N 3.29Å; W445-L447 PolarHBondContact O-N 3.36Å; L447-N449 PolarHBondContact O-N 2.75Å; L447-I450 PolarHBondContact O-N 2.58Å; L447-I450 VanDerWaalsContact O-N 3.16Å; L447-I451 HydrophobicContact CD1-CD1 4.48Å; L447-I451 PolarHBondContact O-N 2.63Å; L447-I451 VanDerWaalsContact O-N 3.08Å; L447-V456 HydrophobicContact CD2-CG1 3.62Å; L447-V456 HydrophobicContact CD2-CG2 4.32Å; L447-V456 HydrophobicContact CG-CG1 4.2Å; L447-V456 HydrophobicContact CG-CG2 3.99Å
448	S	84.8	Confident	86.9	Confident	63 Å²	63	77.9 Å²	77.9	44%	0.441	39%	0.39	S	S	.	.	H	α-helix	trans	-64.7	-24.6	176.8	57.7	0	0	0	0	113.6	D444 W445	D444-S448 PolarHBondContact O-N 3.44Å; D444-S448 PolarHBondContact O-OG 3.26Å; W445-S448 WeakPolarHBondContact CA-OG 3.28Å; W445-S448 PolarHBondContact O-N 2.94Å; W445-S448 PolarHBondContact O-OG 2.92Å
449	N	86.4	Confident	87.1	Confident	94 Å²	94	74.7 Å²	74.7	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-75.1	-27.2	175	-71.7	-15.1	0	0	0	113.3	W445 L446 L447	W445-N449 WeakPolarHBondContact CH2-ND2 3.45Å; W445-N449 WeakPolarHBondContact CZ2-ND2 3.16Å; W445-N449 VanDerWaalsContact O-CG 3.22Å; W445-N449 PolarHBondContact O-N 3.07Å; W445-N449 VanDerWaalsContact O-N 3.16Å; W445-N449 PolarHBondContact O-ND2 3.05Å; W445-N449 PolarHBondContact O-OD1 3.49Å; L446-N449 PolarHBondContact O-N 2.86Å; L447-N449 PolarHBondContact O-N 2.75Å
450	I	87.8	Confident	87	Confident	103 Å²	103	73.3 Å²	73.3	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-91.4	-36.6	-177.5	-61.1	170	0	0	0	111	L446 L447	L446-I450 WeakPolarHBondContact O-CG1 3.23Å; L446-I450 PolarHBondContact O-N 2.9Å; L447-I450 PolarHBondContact O-N 2.58Å; L447-I450 VanDerWaalsContact O-N 3.16Å
451	I	89.4	Confident	87.1	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.015	40%	0.395	C	S	.	.	S	Bend	trans	-133.4	136.2	-171.4	-57.1	-178.6	0	0	0	109.6	L447 V455 V456 L459 V591 L597	L447-I451 HydrophobicContact CD1-CD1 4.48Å; L447-I451 PolarHBondContact O-N 2.63Å; L447-I451 VanDerWaalsContact O-N 3.08Å; I451-V455 HydrophobicContact CG2-CB 3.52Å; I451-V455 HydrophobicContact CG2-CG1 3.51Å; I451-V455 HydrophobicContact CG2-CG2 4.44Å; I451-V456 HydrophobicContact CB-CG2 4.01Å; I451-V456 HydrophobicContact CG2-CG2 3.96Å; I451-L459 HydrophobicContact CD1-CD1 3.88Å; I451-L459 HydrophobicContact CG2-CD1 4.48Å; I451-V591 HydrophobicContact CD1-CG1 4.44Å; I451-L597 HydrophobicContact CD1-CB 3.99Å; I451-L597 HydrophobicContact CD1-CD1 3.94Å
452	P	90.4	Very high	87.3	Confident	12 Å²	12	76.2 Å²	76.2	8%	0.078	39%	0.391	C	S	.	.			trans	-57.9	145.8	175.8	-24.7	34	0	0	0	113.1	H454 V455 V456 Y599	P452-H454 VanDerWaalsContact C-N 3.31Å; P452-H454 PolarHBondContact O-N 3.28Å; P452-H454 VanDerWaalsContact O-N 3.16Å; P452-V455 HydrophobicContact CB-CG2 4.24Å; P452-V455 HydrophobicContact CG-CG2 4.46Å; P452-V455 WeakPolarHBondContact O-CB 3.37Å; P452-V455 PolarHBondContact O-N 3.42Å; P452-V456 PolarHBondContact O-N 3.44Å; P452-V456 VanDerWaalsContact O-N 3.16Å; P452-Y599 HydrophobicContact CG-CD1 3.7Å; P452-Y599 HydrophobicContact CG-CE1 3.69Å; P452-Y599 HydrophobicContact CG-CG 4.14Å
453	H	86.9	Confident	87.1	Confident	123 Å²	123	75.5 Å²	75.5	57%	0.569	40%	0.4	S	S	*	.	H	α-helix	trans	-56.7	-39	-171.2	-164.7	-2.6	0	0	0	114.1	V455 V456 E457	H453-V455 VanDerWaalsContact C-N 3.28Å; H453-V455 PolarHBondContact O-N 3.28Å; H453-V456 WeakPolarHBondContact O-CB 3.28Å; H453-V456 PolarHBondContact O-N 3.05Å; H453-E457 IonicContact CE1-OE1 3.19Å; H453-E457 IonicContact ND1-OE1 3.07Å; H453-E457 PolarHBondContact O-N 3.45Å
454	H	87.8	Confident	87.1	Confident	23 Å²	23	80.7 Å²	80.7	11%	0.106	41%	0.413	C	S	.	.	H	α-helix	trans	-65.6	-30.6	178.9	67.1	-84.4	0	0	0	113	P452 H458	P452-H454 VanDerWaalsContact C-N 3.31Å; P452-H454 PolarHBondContact O-N 3.28Å; P452-H454 VanDerWaalsContact O-N 3.16Å; H454-H458 PolarHBondContact O-N 3.06Å
455	V	91	Very high	87.4	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-76.8	-37.4	177.1	-178.3	0	0	0	0	110.2	I451 P452 H453 E457 H458 L459 Y465 V591 Y599	I451-V455 HydrophobicContact CG2-CB 3.52Å; I451-V455 HydrophobicContact CG2-CG1 3.51Å; I451-V455 HydrophobicContact CG2-CG2 4.44Å; P452-V455 HydrophobicContact CB-CG2 4.24Å; P452-V455 HydrophobicContact CG-CG2 4.46Å; P452-V455 WeakPolarHBondContact O-CB 3.37Å; P452-V455 PolarHBondContact O-N 3.42Å; H453-V455 VanDerWaalsContact C-N 3.28Å; H453-V455 PolarHBondContact O-N 3.28Å; V455-E457 VanDerWaalsContact C-N 3.33Å; V455-E457 PolarHBondContact O-N 3.49Å; V455-H458 PolarHBondContact O-N 3.26Å; V455-L459 HydrophobicContact CG1-CD1 3.95Å; V455-L459 HydrophobicContact CG1-CG 4.17Å; V455-L459 WeakPolarHBondContact O-CB 3.49Å; V455-L459 WeakPolarHBondContact O-CG 3.37Å; V455-L459 PolarHBondContact O-N 2.97Å; V455-Y465 HydrophobicContact CB-CE1 4.5Å; V455-Y465 HydrophobicContact CB-CE2 4.47Å; V455-Y465 HydrophobicContact CG1-CD1 3.7Å; V455-Y465 HydrophobicContact CG1-CD2 3.94Å; V455-Y465 HydrophobicContact CG1-CE1 4.07Å; V455-Y465 HydrophobicContact CG1-CE2 4.28Å; V455-Y465 HydrophobicContact CG1-CG 3.62Å; V455-Y465 HydrophobicContact CG2-CD1 4.26Å; V455-Y465 HydrophobicContact CG2-CE1 3.76Å; V455-Y465 HydrophobicContact CG2-CE2 4.18Å; V455-V591 HydrophobicContact CG1-CG2 3.58Å; V455-Y599 HydrophobicContact CG1-CD2 4.44Å; V455-Y599 HydrophobicContact CG2-CD2 4.03Å; V455-Y599 HydrophobicContact CG2-CE2 3.68Å
456	V	88	Confident	87.7	Confident	32 Å²	32	74.6 Å²	74.6	19%	0.194	40%	0.399	C	S	.	.	H	α-helix	trans	-58.5	-44.8	175.1	175.4	0	0	0	0	111.1	L447 I451 P452 H453 H458 L459 A460	L447-V456 HydrophobicContact CD2-CG1 3.62Å; L447-V456 HydrophobicContact CD2-CG2 4.32Å; L447-V456 HydrophobicContact CG-CG1 4.2Å; L447-V456 HydrophobicContact CG-CG2 3.99Å; I451-V456 HydrophobicContact CB-CG2 4.01Å; I451-V456 HydrophobicContact CG2-CG2 3.96Å; P452-V456 PolarHBondContact O-N 3.44Å; P452-V456 VanDerWaalsContact O-N 3.16Å; H453-V456 WeakPolarHBondContact O-CB 3.28Å; H453-V456 PolarHBondContact O-N 3.05Å; V456-H458 VanDerWaalsContact C-N 3.32Å; V456-H458 PolarHBondContact O-N 3.08Å; V456-L459 PolarHBondContact O-N 2.87Å; V456-A460 PolarHBondContact O-N 3.29Å
457	E	85.4	Confident	87.8	Confident	113 Å²	113	73.4 Å²	73.4	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-37.1	176.9	-69.8	-178	-174.5	0	0	112.8	H453 V455	H453-E457 IonicContact CE1-OE1 3.19Å; H453-E457 IonicContact ND1-OE1 3.07Å; H453-E457 PolarHBondContact O-N 3.45Å; V455-E457 VanDerWaalsContact C-N 3.33Å; V455-E457 PolarHBondContact O-N 3.49Å
458	H	87.3	Confident	88.2	Confident	79 Å²	79	76 Å²	76	37%	0.366	41%	0.405	S	S	.	.	H	α-helix	trans	-69.8	-43.4	175.2	-166	100.7	0	0	0	111.6	H454 V455 V456 A460 R461 T462 Y465	H454-H458 PolarHBondContact O-N 3.06Å; V455-H458 PolarHBondContact O-N 3.26Å; V456-H458 VanDerWaalsContact C-N 3.32Å; V456-H458 PolarHBondContact O-N 3.08Å; H458-A460 PolarHBondContact O-N 3.27Å; H458-R461 PolarHBondContact O-N 3.38Å; H458-T462 PolarHBondContact O-N 3.31Å; H458-Y465 HydrophobicContact CB-CD2 3.81Å; H458-Y465 HydrophobicContact CB-CE2 4.08Å; H458-Y465 AromaticContact CD2-CD2 3.67Å; H458-Y465 AromaticContact CG-CD2 3.68Å
459	L	86.9	Confident	88.7	Confident	44 Å²	44	73.2 Å²	73.2	23%	0.23	39%	0.385	C	S	.	.	H	α-helix	trans	-65.4	-27.2	178.5	-75.5	175.9	0	0	0	112.9	I451 V455 V456 R461 T462 V591	I451-L459 HydrophobicContact CD1-CD1 3.88Å; I451-L459 HydrophobicContact CG2-CD1 4.48Å; V455-L459 HydrophobicContact CG1-CD1 3.95Å; V455-L459 HydrophobicContact CG1-CG 4.17Å; V455-L459 WeakPolarHBondContact O-CB 3.49Å; V455-L459 WeakPolarHBondContact O-CG 3.37Å; V455-L459 PolarHBondContact O-N 2.97Å; V456-L459 PolarHBondContact O-N 2.87Å; L459-R461 PolarHBondContact O-N 3.24Å; L459-T462 CarbonylContact C-O 3.58Å; L459-T462 WeakPolarHBondContact CA-O 3.33Å; L459-V591 HydrophobicContact CD1-CG2 4.24Å
460	A	84.2	Confident	88.9	Confident	85 Å²	85	76.9 Å²	76.9	70%	0.702	40%	0.399	S	S	*	.	H	α-helix	trans	-64.1	-29.1	172.4	0	0	0	0	0	112.3	V456 H458	V456-A460 PolarHBondContact O-N 3.29Å; H458-A460 PolarHBondContact O-N 3.27Å
461	R	86.5	Confident	89.1	Confident	204 Å²	204	74.4 Å²	74.4	77%	0.77	39%	0.386	S	S	*	.	H	α-helix	trans	-93.9	-40.3	179.4	-60.6	-179.8	-175.7	175.2	4.2	112	H458 L459	H458-R461 PolarHBondContact O-N 3.38Å; L459-R461 PolarHBondContact O-N 3.24Å
462	T	87.4	Confident	89.4	Confident	64 Å²	64	74.2 Å²	74.2	39%	0.393	39%	0.385	S	S	.	.			trans	-123.6	138.5	-172.3	-49.3	0	0	0	0	110.4	H458 L459 K464	H458-T462 PolarHBondContact O-N 3.31Å; L459-T462 CarbonylContact C-O 3.58Å; L459-T462 WeakPolarHBondContact CA-O 3.33Å; T462-K464 WeakPolarHBondContact CG2-O 3.29Å; T462-K464 PolarHBondContact O-N 2.97Å; T462-K464 VanDerWaalsContact O-N 3.16Å
463	S	84.3	Confident	89.7	Confident	109 Å²	109	73.7 Å²	73.7	76%	0.762	38%	0.381	S	S	*	.	S	Bend	trans	-72.4	-5.8	-179.8	56.2	0	0	0	0	115.1
464	K	88	Confident	90.2	Very high	163 Å²	163	67.8 Å²	67.8	71%	0.709	35%	0.354	S	S	*	.			trans	-137.2	146.2	-175.9	-62.5	-178.2	-178.5	179.9	0	109.2	T462	T462-K464 WeakPolarHBondContact CG2-O 3.29Å; T462-K464 PolarHBondContact O-N 2.97Å; T462-K464 VanDerWaalsContact O-N 3.16Å
465	Y	91.3	Very high	90.7	Very high	9 Å²	9	66.7 Å²	66.7	4%	0.035	35%	0.349	C	S	.	.			trans	-128	123.4	174.2	-178.4	-96.4	0	0	0	109.8	V455 H458 E467 A589 G590 V591 Y599	V455-Y465 HydrophobicContact CB-CE1 4.5Å; V455-Y465 HydrophobicContact CB-CE2 4.47Å; V455-Y465 HydrophobicContact CG1-CD1 3.7Å; V455-Y465 HydrophobicContact CG1-CD2 3.94Å; V455-Y465 HydrophobicContact CG1-CE1 4.07Å; V455-Y465 HydrophobicContact CG1-CE2 4.28Å; V455-Y465 HydrophobicContact CG1-CG 3.62Å; V455-Y465 HydrophobicContact CG2-CD1 4.26Å; V455-Y465 HydrophobicContact CG2-CE1 3.76Å; V455-Y465 HydrophobicContact CG2-CE2 4.18Å; H458-Y465 HydrophobicContact CB-CD2 3.81Å; H458-Y465 HydrophobicContact CB-CE2 4.08Å; H458-Y465 AromaticContact CD2-CD2 3.67Å; H458-Y465 AromaticContact CG-CD2 3.68Å; Y465-E467 HydrophobicContact CE1-CB 4.4Å; Y465-E467 HydrophobicContact CE2-CB 4.49Å; Y465-E467 PolarHBondContact OH-OE2 3.14Å; Y465-A589 HydrophobicContact CE1-CB 4.23Å; Y465-G590 WeakPolarHBondContact O-CA 3.27Å; Y465-V591 HydrophobicContact CD1-CG2 4.15Å; Y465-V591 HydrophobicContact CG-CG2 4.48Å; Y465-V591 PolarHBondContact O-N 2.76Å; Y465-Y599 HydrophobicContact CE1-CE2 4.01Å
466	S	91.7	Very high	91	Very high	95 Å²	95	67.2 Å²	67.2	66%	0.664	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.8	121.7	169	-179.5	0	0	0	0	108	A589	S466-A589 WeakPolarHBondContact CA-O 3.34Å
467	E	92.7	Very high	91.4	Very high	58 Å²	58	65.7 Å²	65.7	27%	0.271	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134	-179.4	-166.3	175.9	152.7	0	0	110.1	Y465 H469 T588 A589	Y465-E467 HydrophobicContact CE1-CB 4.4Å; Y465-E467 HydrophobicContact CE2-CB 4.49Å; Y465-E467 PolarHBondContact OH-OE2 3.14Å; E467-H469 IonicContact OE1-CE1 3.89Å; E467-H469 PolarHBondContact OE1-CE1 3.35Å; E467-H469 IonicContact OE1-ND1 3.79Å; E467-H469 PolarHBondContact OE1-ND1 3.49Å; E467-H469 IonicContact OE2-CE1 3.76Å; E467-T588 CarbonylContact O-C 3.55Å; E467-T588 WeakPolarHBondContact O-CA 3.19Å; E467-A589 PolarHBondContact N-O 2.68Å; E467-A589 PolarHBondContact O-N 3.43Å
468	N	94.1	Very high	92	Very high	120 Å²	120	60.4 Å²	60.4	64%	0.642	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.8	173.4	-72.7	-28.8	0	0	0	109.2	T588	N468-T588 WeakPolarHBondContact OD1-CB 3.06Å; N468-T588 VanDerWaalsContact OD1-CG2 3.28Å; N468-T588 WeakPolarHBondContact OD1-CG2 3.44Å; N468-T588 PolarHBondContact OD1-OG1 3.38Å
469	H	94.3	Very high	92.4	Very high	5 Å²	5	56.9 Å²	56.9	2%	0.023	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.4	176.6	-54.8	-73.1	0	0	0	109.7	E467 I472 L535 P586 V587	E467-H469 IonicContact OE1-CE1 3.89Å; E467-H469 PolarHBondContact OE1-CE1 3.35Å; E467-H469 IonicContact OE1-ND1 3.79Å; E467-H469 PolarHBondContact OE1-ND1 3.49Å; E467-H469 IonicContact OE2-CE1 3.76Å; H469-I472 HydrophobicContact CB-CD1 3.24Å; H469-I472 HydrophobicContact CB-CG1 3.61Å; H469-L535 PolarHBondContact CE1-O 2.97Å; H469-L535 PolarHBondContact NE2-O 3.47Å; H469-P586 CarbonylContact O-C 3.43Å; H469-P586 VanDerWaalsContact O-CA 3.24Å; H469-P586 WeakPolarHBondContact O-CA 3.2Å; H469-V587 HydrophobicContact CB-CG2 4.34Å; H469-V587 PolarHBondContact N-O 3.36Å; H469-V587 PolarHBondContact O-N 2.86Å
470	E	91.6	Very high	92.7	Very high	171 Å²	171	56.6 Å²	56.6	80%	0.799	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	-33.4	-171.9	-62.8	179.9	171.4	0	0	114.1	G585 P586	E470-G585 CarbonylContact O-C 3.49Å; E470-P586 VanDerWaalsContact O-CA 3.25Å; E470-P586 WeakPolarHBondContact O-CA 3.36Å
471	M	91.5	Very high	93.1	Very high	50 Å²	50	52.9 Å²	52.9	25%	0.246	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	102.9	-175.6	-168.8	177	-57.4	0	0	110.2	Y547 H549 L550 I584	M471-Y547 HydrophobicContact CE-CD1 4.49Å; M471-Y547 HydrophobicContact CE-CE1 3.68Å; M471-Y547 HydrophobicContact SD-CD1 3.39Å; M471-Y547 WeakPolarHBondContact SD-CD1 3.31Å; M471-Y547 HydrophobicContact SD-CE1 3.15Å; M471-Y547 WeakPolarHBondContact SD-CE1 3.39Å; M471-H549 PolarHBondContact O-NE2 3.37Å; M471-L550 HydrophobicContact SD-CD1 4.11Å; M471-I584 HydrophobicContact CG-CG2 4.01Å
472	I	95.1	Very high	93.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	145.5	178.3	-69	-156	0	0	0	108.5	H469 V474 A532 A533 L535 I584 G585 V587	H469-I472 HydrophobicContact CB-CD1 3.24Å; H469-I472 HydrophobicContact CB-CG1 3.61Å; I472-V474 HydrophobicContact CG2-CG2 4.17Å; I472-A532 HydrophobicContact CG2-CB 4.19Å; I472-A533 WeakPolarHBondContact CG2-O 3.49Å; I472-L535 HydrophobicContact CD1-CB 4.44Å; I472-L535 HydrophobicContact CD1-CD2 3.27Å; I472-L535 HydrophobicContact CD1-CG 3.8Å; I472-I584 WeakPolarHBondContact O-CA 3.33Å; I472-G585 PolarHBondContact N-O 2.94Å; I472-G585 PolarHBondContact O-N 3.33Å; I472-V587 HydrophobicContact CB-CG2 3.83Å; I472-V587 HydrophobicContact CD1-CG2 3.54Å; I472-V587 HydrophobicContact CG1-CG2 3.94Å; I472-V587 HydrophobicContact CG2-CG2 3.95Å
473	A	96.7	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	135.1	168.2	0	0	0	0	0	109.5	A532 A533 L550 L553 Y582 I584	A473-A532 CarbonylContact O-C 3.59Å; A473-A532 WeakPolarHBondContact O-CA 3.34Å; A473-A532 WeakPolarHBondContact O-CB 3.38Å; A473-A533 PolarHBondContact N-O 3.34Å; A473-A533 PolarHBondContact O-N 3.33Å; A473-L550 HydrophobicContact CB-CD2 3.66Å; A473-L553 HydrophobicContact CB-CB 4.14Å; A473-L553 HydrophobicContact CB-CD2 3.42Å; A473-L553 VanDerWaalsContact CB-CD2 3.42Å; A473-L553 HydrophobicContact CB-CG 4.4Å; A473-L553 VanDerWaalsContact O-CD2 3.28Å; A473-L553 WeakPolarHBondContact O-CD2 3.5Å; A473-Y582 HydrophobicContact CB-CE1 4.4Å; A473-Y582 HydrophobicContact CB-CE2 4.13Å; A473-Y582 VanDerWaalsContact CB-OH 3.24Å; A473-Y582 WeakPolarHBondContact CB-OH 3.12Å; A473-I584 HydrophobicContact CB-CG1 4.36Å
474	V	98	Very high	93.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.4	176.4	-176.7	0	0	0	0	108.4	I472 F476 M530 A532 Y582 N583 V587 I601 T605 V606 S609	I472-V474 HydrophobicContact CG2-CG2 4.17Å; V474-F476 HydrophobicContact CG1-CD2 4.22Å; V474-F476 HydrophobicContact CG1-CE2 3.87Å; V474-M530 HydrophobicContact CG1-CE 4.29Å; V474-A532 HydrophobicContact CG2-CB 4.39Å; V474-Y582 WeakPolarHBondContact O-CA 3.1Å; V474-N583 PolarHBondContact N-O 2.96Å; V474-N583 PolarHBondContact O-N 3.42Å; V474-V587 HydrophobicContact CG2-CG1 4.12Å; V474-I601 HydrophobicContact CG1-CD1 4.4Å; V474-I601 HydrophobicContact CG2-CD1 3.92Å; V474-T605 HydrophobicContact CG2-CG2 4.14Å; V474-V606 HydrophobicContact CG2-CG2 4.29Å; V474-S609 PolarHBondContact O-OG 2.93Å
475	L	97.7	Very high	93.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.9	-179.4	172.5	137.8	0	0	0	110.3	A477 M530 A531 L553 A557 L560 I580 G581 Y582	L475-A477 HydrophobicContact CD2-CB 3.99Å; L475-M530 WeakPolarHBondContact O-CA 3.17Å; L475-A531 HydrophobicContact CD2-CB 4.33Å; L475-A531 PolarHBondContact N-O 3.17Å; L475-A531 PolarHBondContact O-N 3.3Å; L475-L553 HydrophobicContact CB-CD1 4.18Å; L475-L553 HydrophobicContact CB-CD2 3.8Å; L475-L553 HydrophobicContact CB-CG 4.02Å; L475-A557 HydrophobicContact CD1-CB 3.32Å; L475-L560 HydrophobicContact CD2-CD1 3.8Å; L475-I580 HydrophobicContact CD1-CG2 3.47Å; L475-I580 VanDerWaalsContact CD1-CG2 3.47Å; L475-I580 HydrophobicContact CG-CG2 3.84Å; L475-G581 WeakPolarHBondContact CA-O 3.47Å; L475-Y582 HydrophobicContact CB-CD2 4.43Å; L475-Y582 HydrophobicContact CD1-CD2 4.29Å
476	F	98	Very high	93.8	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.044	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.1	165.7	-76.9	-98.3	0	0	0	108.6	V474 I525 T528 M530 I580 G581 V606 Y613	V474-F476 HydrophobicContact CG1-CD2 4.22Å; V474-F476 HydrophobicContact CG1-CE2 3.87Å; F476-I525 HydrophobicContact CE1-CD1 4.29Å; F476-T528 HydrophobicContact CB-CG2 4.38Å; F476-T528 HydrophobicContact CD1-CG2 3.83Å; F476-M530 HydrophobicContact CD1-CB 4.39Å; F476-M530 HydrophobicContact CD1-CG 4.4Å; F476-M530 HydrophobicContact CE1-CB 4.22Å; F476-M530 HydrophobicContact CE1-CG 3.96Å; F476-M530 HydrophobicContact CE1-SD 3.83Å; F476-M530 HydrophobicContact CE2-CE 4.25Å; F476-M530 HydrophobicContact CE2-CG 4.25Å; F476-M530 HydrophobicContact CE2-SD 4.32Å; F476-M530 HydrophobicContact CZ-CE 3.9Å; F476-M530 HydrophobicContact CZ-CG 3.89Å; F476-M530 HydrophobicContact CZ-SD 3.55Å; F476-M530 VanDerWaalsContact CZ-SD 3.55Å; F476-I580 CarbonylContact O-C 3.54Å; F476-I580 VanDerWaalsContact O-CA 3.31Å; F476-I580 WeakPolarHBondContact O-CA 3.37Å; F476-G581 PolarHBondContact N-O 3.27Å; F476-G581 PolarHBondContact O-N 3.1Å; F476-V606 HydrophobicContact CE2-CG1 3.95Å; F476-V606 HydrophobicContact CZ-CG1 3.89Å; F476-Y613 HydrophobicContact CB-CD1 4.33Å; F476-Y613 HydrophobicContact CB-CG 4.26Å
477	A	97.4	Very high	93.7	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.6	174.3	0	0	0	0	0	108.9	L475 T528 Y529 L560 M578 K579 I580	L475-A477 HydrophobicContact CD2-CB 3.99Å; A477-T528 CarbonylContact O-C 3.6Å; A477-T528 VanDerWaalsContact O-CA 3.28Å; A477-T528 WeakPolarHBondContact O-CA 3.48Å; A477-Y529 PolarHBondContact N-O 2.81Å; A477-Y529 PolarHBondContact O-N 3.25Å; A477-L560 HydrophobicContact CB-CD1 3.94Å; A477-M578 HydrophobicContact CB-CG 4.36Å; A477-M578 HydrophobicContact CB-SD 3.72Å; A477-K579 CarbonylContact C-O 3.26Å; A477-K579 WeakPolarHBondContact CA-O 3.47Å; A477-I580 HydrophobicContact CB-CD1 4.39Å; A477-I580 HydrophobicContact CB-CG1 3.93Å
478	S	96.6	Very high	93.6	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.9	177.7	-162	0	0	0	0	113	P527 T528 M578 K579 Y613	S478-P527 WeakPolarHBondContact CA-O 3.38Å; S478-P527 PolarHBondContact OG-O 2.98Å; S478-T528 VanDerWaalsContact CB-OG1 3.31Å; S478-T528 WeakPolarHBondContact CB-OG1 3.24Å; S478-T528 PolarHBondContact OG-OG1 3.2Å; S478-M578 CarbonylContact O-C 2.94Å; S478-M578 VanDerWaalsContact O-CA 3.31Å; S478-M578 WeakPolarHBondContact O-CA 3.35Å; S478-K579 PolarHBondContact N-O 3.44Å; S478-K579 PolarHBondContact O-N 3.27Å; S478-Y613 WeakPolarHBondContact CB-OH 3.4Å; S478-Y613 PolarHBondContact OG-OH 3.39Å
479	I	95.9	Very high	93.5	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123.6	172.1	-51.5	162.1	0	0	0	108.5	W482 L500 L503 P527 F576	I479-W482 HydrophobicContact CB-CB 4.3Å; I479-W482 HydrophobicContact CG2-CB 4.12Å; I479-L500 HydrophobicContact CD1-CD1 3.91Å; I479-L503 HydrophobicContact CD1-CD2 3.32Å; I479-L503 HydrophobicContact CG1-CD2 4.22Å; I479-P527 HydrophobicContact CB-CB 4.16Å; I479-P527 HydrophobicContact CD1-CB 4.36Å; I479-P527 PolarHBondContact N-O 3.47Å; I479-F576 HydrophobicContact CG2-CB 4Å; I479-F576 HydrophobicContact CG2-CD1 3.45Å; I479-F576 VanDerWaalsContact CG2-CD1 3.45Å; I479-F576 HydrophobicContact CG2-CE1 4.25Å; I479-F576 HydrophobicContact CG2-CG 4Å
480	V	93.2	Very high	93.2	Very high	39 Å²	39	56 Å²	56	24%	0.236	27%	0.27	C	S	.	.	S	Bend	trans	-82.7	-45.1	-171.5	-177.1	0	0	0	0	111.8	W482 I577 K579 K618	V480-W482 VanDerWaalsContact C-N 3.27Å; V480-W482 PolarHBondContact O-N 3.01Å; V480-I577 WeakPolarHBondContact CG2-O 3.4Å; V480-I577 PolarHBondContact N-O 2.98Å; V480-K579 HydrophobicContact CG2-CB 4.08Å; V480-K579 HydrophobicContact CG2-CD 3.46Å; V480-K579 VanDerWaalsContact CG2-CD 3.46Å; V480-K579 HydrophobicContact CG2-CG 3.4Å; V480-K618 HydrophobicContact CG1-CD 4.31Å; V480-K618 HydrophobicContact CG1-CG 4.27Å; V480-K618 HydrophobicContact CG2-CG 4.38Å
481	N	92.8	Very high	93	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.037	26%	0.258	C	S	.	.	S	Bend	trans	-91.9	20.6	-177	58.6	-24	0	0	0	112.7	N483 E484 M485 F574 E575 F576 I577	N481-N483 VanDerWaalsContact C-N 3.27Å; N481-N483 PolarHBondContact O-N 2.92Å; N481-E484 HydrophobicContact CB-CB 4.43Å; N481-E484 HydrophobicContact CB-CG 4.37Å; N481-E484 WeakPolarHBondContact O-CB 3.39Å; N481-E484 PolarHBondContact O-N 3.38Å; N481-E484 VanDerWaalsContact O-N 3.14Å; N481-M485 PolarHBondContact O-N 3.46Å; N481-F574 HydrophobicContact CB-CZ 4.13Å; N481-F574 WeakPolarHBondContact ND2-CE1 3.44Å; N481-F574 VanDerWaalsContact ND2-CZ 3.26Å; N481-F574 WeakPolarHBondContact ND2-CZ 3.17Å; N481-E575 PolarHBondContact ND2-O 3.47Å; N481-F576 WeakPolarHBondContact OD1-CA 3.29Å; N481-I577 PolarHBondContact OD1-N 2.96Å
482	W	91.8	Very high	92.8	Very high	19 Å²	19	53.3 Å²	53.3	7%	0.072	27%	0.27	C	S	.	.	H	α-helix	trans	-56	-43.5	174.6	176.1	-105.4	0	0	0	112	I479 V480 E484 M485 Y486 F496 L500 P527 F576	I479-W482 HydrophobicContact CB-CB 4.3Å; I479-W482 HydrophobicContact CG2-CB 4.12Å; V480-W482 VanDerWaalsContact C-N 3.27Å; V480-W482 PolarHBondContact O-N 3.01Å; W482-E484 PolarHBondContact O-N 2.96Å; W482-M485 HydrophobicContact CH2-SD 4.3Å; W482-M485 HydrophobicContact CZ3-SD 3.95Å; W482-M485 PolarHBondContact O-N 3.27Å; W482-M485 VanDerWaalsContact O-N 3.16Å; W482-Y486 HydrophobicContact CZ2-CD2 4.07Å; W482-Y486 WeakPolarHBondContact O-CB 3.28Å; W482-Y486 PolarHBondContact O-N 3.47Å; W482-F496 HydrophobicContact CH2-CB 4.18Å; W482-F496 WeakPolarHBondContact CH2-O 3.49Å; W482-F496 HydrophobicContact CZ2-CB 4.47Å; W482-L500 HydrophobicContact CE3-CD1 4.33Å; W482-L500 HydrophobicContact CH2-CB 3.58Å; W482-L500 HydrophobicContact CH2-CD2 4.25Å; W482-L500 HydrophobicContact CH2-CG 4.32Å; W482-L500 HydrophobicContact CZ2-CB 4.13Å; W482-L500 HydrophobicContact CZ2-CD2 3.97Å; W482-L500 HydrophobicContact CZ3-CB 3.93Å; W482-L500 HydrophobicContact CZ3-CD1 4.22Å; W482-P527 HydrophobicContact CB-CB 3.87Å; W482-P527 HydrophobicContact CB-CG 4.02Å; W482-P527 HydrophobicContact CD2-CB 4.29Å; W482-P527 HydrophobicContact CG-CB 3.75Å; W482-P527 HydrophobicContact CG-CG 3.98Å; W482-F576 AromaticContact CE3-CE1 3.89Å; W482-F576 HydrophobicContact CE3-CE1 3.89Å; W482-F576 HydrophobicContact CE3-CZ 4.22Å; W482-F576 HydrophobicContact CZ3-CE1 4.19Å; W482-F576 HydrophobicContact CZ3-CZ 4.04Å
483	N	91.1	Very high	92.6	Very high	134 Å²	134	53.3 Å²	53.3	72%	0.717	27%	0.27	S	S	*	.	H	α-helix	trans	-68.4	-21.2	-179.4	-64.2	-16.9	0	0	0	113.5	N481	N481-N483 VanDerWaalsContact C-N 3.27Å; N481-N483 PolarHBondContact O-N 2.92Å
484	E	91.2	Very high	92.4	Very high	140 Å²	140	62 Å²	62	65%	0.654	30%	0.303	S	S	*	.	H	α-helix	trans	-78	-28.3	176.2	-63.6	171.4	-162.2	0	0	111	N481 W482 F574	N481-E484 HydrophobicContact CB-CB 4.43Å; N481-E484 HydrophobicContact CB-CG 4.37Å; N481-E484 WeakPolarHBondContact O-CB 3.39Å; N481-E484 PolarHBondContact O-N 3.38Å; N481-E484 VanDerWaalsContact O-N 3.14Å; W482-E484 PolarHBondContact O-N 2.96Å; E484-F574 HydrophobicContact CB-CZ 4.48Å
485	M	87.7	Confident	92	Very high	33 Å²	33	64.4 Å²	64.4	16%	0.163	31%	0.314	C	S	.	.	H	α-helix	trans	-90.3	-33.8	-179.2	-174.2	-92.9	-174.4	0	0	112.3	N481 W482 E487 F496 V499 F574 F576	N481-M485 PolarHBondContact O-N 3.46Å; W482-M485 HydrophobicContact CH2-SD 4.3Å; W482-M485 HydrophobicContact CZ3-SD 3.95Å; W482-M485 PolarHBondContact O-N 3.27Å; W482-M485 VanDerWaalsContact O-N 3.16Å; M485-E487 PolarHBondContact O-N 3.34Å; M485-F496 HydrophobicContact CE-CD1 3.32Å; M485-F496 HydrophobicContact CE-CE1 3.67Å; M485-F496 HydrophobicContact CG-CD1 4.44Å; M485-F496 HydrophobicContact CG-CE1 4.34Å; M485-F496 WeakPolarHBondContact O-CD1 3.47Å; M485-F496 WeakPolarHBondContact O-CE1 3.11Å; M485-F496 WeakPolarHBondContact O-CZ 3.4Å; M485-F496 HydrophobicContact SD-CD1 3.21Å; M485-F496 WeakPolarHBondContact SD-CD1 3.46Å; M485-F496 HydrophobicContact SD-CE1 3.65Å; M485-F496 HydrophobicContact SD-CG 4.28Å; M485-V499 HydrophobicContact CE-CB 4.26Å; M485-V499 HydrophobicContact CE-CG1 4.08Å; M485-V499 HydrophobicContact CE-CG2 4.29Å; M485-F574 HydrophobicContact CB-CD1 4.34Å; M485-F574 HydrophobicContact CB-CE1 3.76Å; M485-F574 HydrophobicContact CB-CE2 4.01Å; M485-F574 HydrophobicContact CB-CZ 3.58Å; M485-F574 HydrophobicContact CG-CD1 4.16Å; M485-F574 HydrophobicContact CG-CE1 4.06Å; M485-F574 HydrophobicContact CG-CG 4.47Å; M485-F574 HydrophobicContact CG-CZ 4.27Å; M485-F576 HydrophobicContact CB-CE1 4.02Å; M485-F576 HydrophobicContact CB-CZ 4.49Å; M485-F576 HydrophobicContact CE-CZ 3.98Å; M485-F576 HydrophobicContact CG-CE1 3.98Å; M485-F576 HydrophobicContact CG-CZ 3.95Å; M485-F576 HydrophobicContact SD-CE1 4.2Å; M485-F576 HydrophobicContact SD-CZ 3.84Å
486	Y	91	Very high	91.7	Very high	81 Å²	81	65.9 Å²	65.9	32%	0.318	32%	0.32	S	S	.	.			trans	-69.4	121.9	-178.2	178.5	-98.1	0	0	0	112.9	W482 E488 F496	W482-Y486 HydrophobicContact CZ2-CD2 4.07Å; W482-Y486 WeakPolarHBondContact O-CB 3.28Å; W482-Y486 PolarHBondContact O-N 3.47Å; Y486-E488 HydrophobicContact CE1-CB 4.07Å; Y486-F496 HydrophobicContact CD2-CB 3.9Å; Y486-F496 HydrophobicContact CD2-CG 4.39Å; Y486-F496 HydrophobicContact CE2-CB 4.45Å
487	E	90.3	Very high	91.5	Very high	102 Å²	102	70 Å²	70	48%	0.477	34%	0.342	S	S	.	.			trans	-129.2	112.3	174.8	-177.4	178.6	174.8	0	0	111.2	M485 T489 F496	M485-E487 PolarHBondContact O-N 3.34Å; E487-T489 VanDerWaalsContact C-N 3.32Å; E487-T489 VanDerWaalsContact CD-OG1 3.25Å; E487-T489 WeakPolarHBondContact CG-OG1 3.37Å; E487-T489 PolarHBondContact O-N 3.32Å; E487-T489 PolarHBondContact OE1-OG1 3.27Å; E487-F496 HydrophobicContact CB-CE2 3.59Å; E487-F496 HydrophobicContact CB-CZ 3.76Å; E487-F496 VanDerWaalsContact O-CD2 3.26Å; E487-F496 WeakPolarHBondContact O-CD2 3.25Å; E487-F496 WeakPolarHBondContact O-CE2 3.32Å
488	E	90.6	Very high	91.3	Very high	135 Å²	135	75.7 Å²	75.7	63%	0.631	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.5	-178.6	-168.4	171.4	-165	0	0	112.7	Y486 Y490 G492 G493	Y486-E488 HydrophobicContact CE1-CB 4.07Å; E488-Y490 PolarHBondContact O-N 2.9Å; E488-G492 CarbonylContact O-C 3.48Å; E488-G492 WeakPolarHBondContact O-CA 3.41Å; E488-G492 PolarHBondContact O-N 3.46Å; E488-G493 PolarHBondContact O-N 3.42Å
489	T	90.9	Very high	91.1	Very high	121 Å²	121	77.1 Å²	77.1	74%	0.742	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.6	178.6	29.2	0	0	0	0	112.9	E487	E487-T489 VanDerWaalsContact C-N 3.32Å; E487-T489 VanDerWaalsContact CD-OG1 3.25Å; E487-T489 WeakPolarHBondContact CG-OG1 3.37Å; E487-T489 PolarHBondContact O-N 3.32Å; E487-T489 PolarHBondContact OE1-OG1 3.27Å
490	Y	87.7	Confident	91	Very high	128 Å²	128	77.9 Å²	77.9	50%	0.502	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	112.9	176.8	-172	-104.4	0	0	0	111	E488 G492 G493 E495 F496	E488-Y490 PolarHBondContact O-N 2.9Å; Y490-G492 PolarHBondContact O-N 3.29Å; Y490-G493 PolarHBondContact O-N 3.5Å; Y490-E495 HydrophobicContact CD1-CB 4.33Å; Y490-E495 HydrophobicContact CD1-CG 4.26Å; Y490-E495 HydrophobicContact CE1-CB 4.16Å; Y490-E495 HydrophobicContact CE1-CG 3.84Å; Y490-F496 HydrophobicContact CD1-CE2 4.3Å
491	E	87.3	Confident	91.1	Very high	116 Å²	116	80.9 Å²	80.9	54%	0.542	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	48.3	26.8	-179.6	-58.4	-155.7	155.3	0	0	115.7	G493 R494 E495	E491-G493 VanDerWaalsContact C-N 3.3Å; E491-G493 PolarHBondContact O-N 3.15Å; E491-R494 WeakPolarHBondContact O-CD 3.38Å; E491-R494 WeakPolarHBondContact O-CG 3.23Å; E491-E495 HydrophobicContact CB-CG 4.25Å; E491-E495 HydrophobicContact CG-CG 4.4Å; E491-E495 WeakPolarHBondContact OE2-CG 3.37Å
492	G	88.9	Confident	91.3	Very high	48 Å²	48	85.1 Å²	85.1	50%	0.495	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	69.8	24.9	-176.9	0	0	0	0	0	113.6	E488 Y490 R494	E488-G492 CarbonylContact O-C 3.48Å; E488-G492 WeakPolarHBondContact O-CA 3.41Å; E488-G492 PolarHBondContact O-N 3.46Å; Y490-G492 PolarHBondContact O-N 3.29Å; G492-R494 VanDerWaalsContact C-N 3.27Å; G492-R494 PolarHBondContact O-N 2.98Å
493	G	90.1	Very high	91.5	Very high	0 Å²	0	84.3 Å²	84.3	0%	0	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	78.3	3.2	-179.7	0	0	0	0	0	115.2	E488 Y490 E491 E495 F496 L497	E488-G493 PolarHBondContact O-N 3.42Å; Y490-G493 PolarHBondContact O-N 3.5Å; E491-G493 VanDerWaalsContact C-N 3.3Å; E491-G493 PolarHBondContact O-N 3.15Å; G493-E495 PolarHBondContact O-N 3.35Å; G493-F496 WeakPolarHBondContact O-CB 3.2Å; G493-F496 PolarHBondContact O-N 3.25Å; G493-L497 PolarHBondContact O-N 3.37Å; G493-L497 VanDerWaalsContact O-N 3.12Å
494	R	91.5	Very high	91.7	Very high	182 Å²	182	78.7 Å²	78.7	69%	0.687	38%	0.378	S	S	*	.	H	α-helix	trans	-65.7	-40.1	-171.8	-69.2	177.5	-179.7	-161.8	-0.5	113.4	E491 G492 F496 L497 R498	E491-R494 WeakPolarHBondContact O-CD 3.38Å; E491-R494 WeakPolarHBondContact O-CG 3.23Å; G492-R494 VanDerWaalsContact C-N 3.27Å; G492-R494 PolarHBondContact O-N 2.98Å; R494-F496 VanDerWaalsContact C-N 3.33Å; R494-L497 PolarHBondContact O-N 3.43Å; R494-R498 PolarHBondContact O-N 3.02Å
495	E	90.8	Very high	91.9	Very high	51 Å²	51	74.1 Å²	74.1	24%	0.238	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-40.6	-180	-61.2	-59.1	105.4	0	0	110.7	Y490 E491 G493 R498 V499	Y490-E495 HydrophobicContact CD1-CB 4.33Å; Y490-E495 HydrophobicContact CD1-CG 4.26Å; Y490-E495 HydrophobicContact CE1-CB 4.16Å; Y490-E495 HydrophobicContact CE1-CG 3.84Å; E491-E495 HydrophobicContact CB-CG 4.25Å; E491-E495 HydrophobicContact CG-CG 4.4Å; E491-E495 WeakPolarHBondContact OE2-CG 3.37Å; G493-E495 PolarHBondContact O-N 3.35Å; E495-R498 WeakPolarHBondContact O-CB 3.45Å; E495-R498 PolarHBondContact O-N 2.88Å; E495-R498 VanDerWaalsContact O-N 3.13Å; E495-R498 IonicContact OE1-CZ 3.4Å; E495-R498 IonicContact OE1-NH1 3.27Å; E495-R498 PolarHBondContact OE1-NH1 3.38Å; E495-R498 IonicContact OE1-NH2 2.67Å; E495-R498 PolarHBondContact OE1-NH2 3.32Å; E495-R498 IonicContact OE2-CZ 3.42Å; E495-R498 IonicContact OE2-NH1 2.82Å; E495-R498 PolarHBondContact OE2-NH1 3.5Å; E495-R498 IonicContact OE2-NH2 3.44Å; E495-V499 PolarHBondContact O-N 3.18Å; E495-V499 VanDerWaalsContact O-N 3.1Å
496	F	91.9	Very high	92.3	Very high	30 Å²	30	75.3 Å²	75.3	13%	0.132	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-47	173	-62.3	-66.6	0	0	0	111.9	W482 M485 Y486 E487 Y490 G493 R494 R498 V499 L500	W482-F496 HydrophobicContact CH2-CB 4.18Å; W482-F496 WeakPolarHBondContact CH2-O 3.49Å; W482-F496 HydrophobicContact CZ2-CB 4.47Å; M485-F496 HydrophobicContact CE-CD1 3.32Å; M485-F496 HydrophobicContact CE-CE1 3.67Å; M485-F496 HydrophobicContact CG-CD1 4.44Å; M485-F496 HydrophobicContact CG-CE1 4.34Å; M485-F496 WeakPolarHBondContact O-CD1 3.47Å; M485-F496 WeakPolarHBondContact O-CE1 3.11Å; M485-F496 WeakPolarHBondContact O-CZ 3.4Å; M485-F496 HydrophobicContact SD-CD1 3.21Å; M485-F496 WeakPolarHBondContact SD-CD1 3.46Å; M485-F496 HydrophobicContact SD-CE1 3.65Å; M485-F496 HydrophobicContact SD-CG 4.28Å; Y486-F496 HydrophobicContact CD2-CB 3.9Å; Y486-F496 HydrophobicContact CD2-CG 4.39Å; Y486-F496 HydrophobicContact CE2-CB 4.45Å; E487-F496 HydrophobicContact CB-CE2 3.59Å; E487-F496 HydrophobicContact CB-CZ 3.76Å; E487-F496 VanDerWaalsContact O-CD2 3.26Å; E487-F496 WeakPolarHBondContact O-CD2 3.25Å; E487-F496 WeakPolarHBondContact O-CE2 3.32Å; Y490-F496 HydrophobicContact CD1-CE2 4.3Å; G493-F496 WeakPolarHBondContact O-CB 3.2Å; G493-F496 PolarHBondContact O-N 3.25Å; R494-F496 VanDerWaalsContact C-N 3.33Å; F496-R498 PolarHBondContact O-N 3.02Å; F496-V499 PolarHBondContact O-N 3.35Å; F496-V499 VanDerWaalsContact O-N 3.13Å; F496-L500 PolarHBondContact O-N 2.92Å
497	L	92.6	Very high	92.6	Very high	97 Å²	97	71.7 Å²	71.7	51%	0.508	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-29.4	175.5	-68.4	176.4	0	0	0	113	G493 R494 N501	G493-L497 PolarHBondContact O-N 3.37Å; G493-L497 VanDerWaalsContact O-N 3.12Å; R494-L497 PolarHBondContact O-N 3.43Å; L497-N501 WeakPolarHBondContact O-CB 3.18Å; L497-N501 PolarHBondContact O-N 2.91Å
498	R	93.3	Very high	92.9	Very high	121 Å²	121	69 Å²	69	46%	0.457	34%	0.343	S	S	.	.	H	α-helix	trans	-66.3	-47.1	172.3	-170.6	179.3	-56.2	119.5	15.7	111.6	R494 E495 F496 L500 N501 E502	R494-R498 PolarHBondContact O-N 3.02Å; E495-R498 WeakPolarHBondContact O-CB 3.45Å; E495-R498 PolarHBondContact O-N 2.88Å; E495-R498 VanDerWaalsContact O-N 3.13Å; E495-R498 IonicContact OE1-CZ 3.4Å; E495-R498 IonicContact OE1-NH1 3.27Å; E495-R498 PolarHBondContact OE1-NH1 3.38Å; E495-R498 IonicContact OE1-NH2 2.67Å; E495-R498 PolarHBondContact OE1-NH2 3.32Å; E495-R498 IonicContact OE2-CZ 3.42Å; E495-R498 IonicContact OE2-NH1 2.82Å; E495-R498 PolarHBondContact OE2-NH1 3.5Å; E495-R498 IonicContact OE2-NH2 3.44Å; F496-R498 PolarHBondContact O-N 3.02Å; R498-L500 VanDerWaalsContact C-N 3.29Å; R498-L500 PolarHBondContact O-N 3.39Å; R498-N501 WeakPolarHBondContact O-CB 3.3Å; R498-N501 PolarHBondContact O-N 2.96Å; R498-N501 VanDerWaalsContact O-N 3.09Å; R498-E502 WeakPolarHBondContact O-CG 3.35Å; R498-E502 PolarHBondContact O-N 3.22Å
499	V	93.1	Very high	93.1	Very high	31 Å²	31	67.3 Å²	67.3	19%	0.188	34%	0.338	C	S	.	.	H	α-helix	trans	-58.7	-42.6	175.7	177	0	0	0	0	110.8	M485 E495 F496 E502 L503 F567 F576	M485-V499 HydrophobicContact CE-CB 4.26Å; M485-V499 HydrophobicContact CE-CG1 4.08Å; M485-V499 HydrophobicContact CE-CG2 4.29Å; E495-V499 PolarHBondContact O-N 3.18Å; E495-V499 VanDerWaalsContact O-N 3.1Å; F496-V499 PolarHBondContact O-N 3.35Å; F496-V499 VanDerWaalsContact O-N 3.13Å; V499-E502 PolarHBondContact O-N 3.25Å; V499-L503 PolarHBondContact O-N 2.93Å; V499-F567 HydrophobicContact CG1-CE1 3.99Å; V499-F567 HydrophobicContact CG1-CZ 3.94Å; V499-F576 HydrophobicContact CG1-CE2 4.05Å; V499-F576 HydrophobicContact CG1-CZ 4.31Å
500	L	94.3	Very high	93.4	Very high	20 Å²	20	61.7 Å²	61.7	11%	0.105	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-42	174.9	-175.4	60.9	0	0	0	111.9	I479 W482 F496 R498 L503 I504	I479-L500 HydrophobicContact CD1-CD1 3.91Å; W482-L500 HydrophobicContact CE3-CD1 4.33Å; W482-L500 HydrophobicContact CH2-CB 3.58Å; W482-L500 HydrophobicContact CH2-CD2 4.25Å; W482-L500 HydrophobicContact CH2-CG 4.32Å; W482-L500 HydrophobicContact CZ2-CB 4.13Å; W482-L500 HydrophobicContact CZ2-CD2 3.97Å; W482-L500 HydrophobicContact CZ3-CB 3.93Å; W482-L500 HydrophobicContact CZ3-CD1 4.22Å; F496-L500 PolarHBondContact O-N 2.92Å; R498-L500 VanDerWaalsContact C-N 3.29Å; R498-L500 PolarHBondContact O-N 3.39Å; L500-L503 PolarHBondContact O-N 3.43Å; L500-I504 HydrophobicContact CD1-CG1 4.16Å; L500-I504 HydrophobicContact CG-CG1 4.3Å; L500-I504 WeakPolarHBondContact O-CB 3.21Å; L500-I504 WeakPolarHBondContact O-CG1 3.42Å; L500-I504 PolarHBondContact O-N 2.93Å
501	N	95.2	Very high	93.7	Very high	102 Å²	102	57.4 Å²	57.4	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-39.3	178.5	-173.2	83.2	0	0	0	112	L497 R498 S505	L497-N501 WeakPolarHBondContact O-CB 3.18Å; L497-N501 PolarHBondContact O-N 2.91Å; R498-N501 WeakPolarHBondContact O-CB 3.3Å; R498-N501 PolarHBondContact O-N 2.96Å; R498-N501 VanDerWaalsContact O-N 3.09Å; N501-S505 WeakPolarHBondContact O-CB 3.35Å; N501-S505 PolarHBondContact O-N 2.92Å; N501-S505 PolarHBondContact O-OG 3.45Å
502	E	95.7	Very high	93.9	Very high	97 Å²	97	58.4 Å²	58.4	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-51	173.7	-73.5	174.1	-176	0	0	110.5	R498 V499 I504 S505 D506 F567	R498-E502 WeakPolarHBondContact O-CG 3.35Å; R498-E502 PolarHBondContact O-N 3.22Å; V499-E502 PolarHBondContact O-N 3.25Å; E502-I504 PolarHBondContact O-N 3.06Å; E502-S505 WeakPolarHBondContact O-CB 3.32Å; E502-S505 PolarHBondContact O-N 3.35Å; E502-D506 PolarHBondContact O-N 3.36Å; E502-F567 HydrophobicContact CB-CE2 4.18Å; E502-F567 HydrophobicContact CB-CZ 4.45Å
503	L	95.6	Very high	94.1	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-41.4	178	178.3	59	0	0	0	113.5	I479 V499 L500 S505 D506 F507 L564 F567 F576	I479-L503 HydrophobicContact CD1-CD2 3.32Å; I479-L503 HydrophobicContact CG1-CD2 4.22Å; V499-L503 PolarHBondContact O-N 2.93Å; L500-L503 PolarHBondContact O-N 3.43Å; L503-S505 VanDerWaalsContact C-N 3.32Å; L503-D506 PolarHBondContact O-N 3.08Å; L503-F507 HydrophobicContact CD1-CE1 3.77Å; L503-F507 HydrophobicContact CD1-CE2 4.29Å; L503-F507 HydrophobicContact CD1-CZ 3.59Å; L503-F507 HydrophobicContact CD2-CZ 4.43Å; L503-F507 HydrophobicContact CG-CE1 4.45Å; L503-F507 HydrophobicContact CG-CE2 4.1Å; L503-F507 HydrophobicContact CG-CZ 3.89Å; L503-F507 WeakPolarHBondContact O-CG 3.22Å; L503-F507 PolarHBondContact O-N 3Å; L503-L564 HydrophobicContact CD1-CD1 3.72Å; L503-L564 HydrophobicContact CD2-CD1 3.75Å; L503-L564 HydrophobicContact CG-CD1 4.39Å; L503-F567 HydrophobicContact CB-CD1 4.48Å; L503-F567 HydrophobicContact CB-CD2 4.39Å; L503-F567 HydrophobicContact CB-CE1 4.13Å; L503-F567 HydrophobicContact CB-CE2 4.03Å; L503-F567 HydrophobicContact CB-CZ 3.89Å; L503-F567 HydrophobicContact CD1-CB 4.01Å; L503-F567 HydrophobicContact CD1-CD1 4Å; L503-F567 HydrophobicContact CD1-CD2 4.04Å; L503-F567 HydrophobicContact CD1-CE1 4.48Å; L503-F567 HydrophobicContact CD1-CG 3.75Å; L503-F576 HydrophobicContact CD2-CD2 4.46Å
504	I	96	Very high	94.2	Very high	17 Å²	17	67 Å²	67	9%	0.087	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-33.7	176.8	-64.5	-70.3	0	0	0	111.1	L500 E502 F507 D508 T524 Y529	L500-I504 HydrophobicContact CD1-CG1 4.16Å; L500-I504 HydrophobicContact CG-CG1 4.3Å; L500-I504 WeakPolarHBondContact O-CB 3.21Å; L500-I504 WeakPolarHBondContact O-CG1 3.42Å; L500-I504 PolarHBondContact O-N 2.93Å; E502-I504 PolarHBondContact O-N 3.06Å; I504-F507 HydrophobicContact CD1-CD2 4.17Å; I504-F507 WeakPolarHBondContact O-CB 3.22Å; I504-F507 PolarHBondContact O-N 3.33Å; I504-D508 PolarHBondContact O-N 3.44Å; I504-T524 HydrophobicContact CD1-CG2 4.25Å; I504-T524 HydrophobicContact CG2-CG2 3.99Å; I504-Y529 HydrophobicContact CD1-CD2 3.92Å; I504-Y529 HydrophobicContact CG2-CD2 4.43Å; I504-Y529 HydrophobicContact CG2-CE2 4.31Å
505	S	95.7	Very high	94.1	Very high	43 Å²	43	63.7 Å²	63.7	30%	0.301	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-42.2	174.8	-56.6	0	0	0	0	110.5	N501 E502 L503 F507 D508 D509	N501-S505 WeakPolarHBondContact O-CB 3.35Å; N501-S505 PolarHBondContact O-N 2.92Å; N501-S505 PolarHBondContact O-OG 3.45Å; E502-S505 WeakPolarHBondContact O-CB 3.32Å; E502-S505 PolarHBondContact O-N 3.35Å; L503-S505 VanDerWaalsContact C-N 3.32Å; S505-F507 PolarHBondContact O-N 3.22Å; S505-D508 PolarHBondContact O-N 3.09Å; S505-D509 PolarHBondContact O-N 3.41Å
506	D	96.4	Very high	94.2	Very high	59 Å²	59	61.6 Å²	61.6	32%	0.316	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-30.9	175.4	-65.7	-13.5	0	0	0	112.6	E502 L503 T563 F567	E502-D506 PolarHBondContact O-N 3.36Å; L503-D506 PolarHBondContact O-N 3.08Å; D506-T563 HydrophobicContact CB-CG2 3.72Å; D506-F567 VanDerWaalsContact OD2-CD2 3.3Å; D506-F567 WeakPolarHBondContact OD2-CD2 3.3Å
507	F	97.2	Very high	94.1	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-73	-36.7	171.2	-63.6	-18.4	0	0	0	112.8	L503 I504 S505 L510 Y529 L560 T563 M578	L503-F507 HydrophobicContact CD1-CE1 3.77Å; L503-F507 HydrophobicContact CD1-CE2 4.29Å; L503-F507 HydrophobicContact CD1-CZ 3.59Å; L503-F507 HydrophobicContact CD2-CZ 4.43Å; L503-F507 HydrophobicContact CG-CE1 4.45Å; L503-F507 HydrophobicContact CG-CE2 4.1Å; L503-F507 HydrophobicContact CG-CZ 3.89Å; L503-F507 WeakPolarHBondContact O-CG 3.22Å; L503-F507 PolarHBondContact O-N 3Å; I504-F507 HydrophobicContact CD1-CD2 4.17Å; I504-F507 WeakPolarHBondContact O-CB 3.22Å; I504-F507 PolarHBondContact O-N 3.33Å; S505-F507 PolarHBondContact O-N 3.22Å; F507-L510 WeakPolarHBondContact O-CB 3.46Å; F507-L510 PolarHBondContact O-N 3.14Å; F507-Y529 HydrophobicContact CB-CD2 4.32Å; F507-Y529 HydrophobicContact CB-CE2 3.95Å; F507-Y529 HydrophobicContact CD2-CD2 4.03Å; F507-Y529 HydrophobicContact CD2-CE2 4.5Å; F507-Y529 HydrophobicContact CD2-CG 4.33Å; F507-L560 HydrophobicContact CB-CD2 3.71Å; F507-L560 HydrophobicContact CD1-CD2 3.39Å; F507-L560 HydrophobicContact CD2-CD2 3.87Å; F507-L560 HydrophobicContact CE1-CD2 3.92Å; F507-L560 HydrophobicContact CE2-CD2 4.36Å; F507-L560 HydrophobicContact CG-CD2 3.37Å; F507-L560 HydrophobicContact CZ-CD2 4.39Å; F507-T563 HydrophobicContact CD1-CG2 3.86Å; F507-T563 HydrophobicContact CE1-CG2 3.95Å; F507-M578 HydrophobicContact CE1-CE 4.11Å; F507-M578 HydrophobicContact CE2-CE 3.77Å; F507-M578 HydrophobicContact CZ-CE 3.27Å
508	D	95.9	Very high	94	Very high	47 Å²	47	61.2 Å²	61.2	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-68.4	-37.4	176.9	-70.9	-16.7	0	0	0	111.3	I504 S505 L510 L511 K521 Y529	I504-D508 PolarHBondContact O-N 3.44Å; S505-D508 PolarHBondContact O-N 3.09Å; D508-L510 PolarHBondContact O-N 2.92Å; D508-L510 VanDerWaalsContact O-N 3.16Å; D508-L511 VanDerWaalsContact O-CB 3.32Å; D508-L511 WeakPolarHBondContact O-CB 3.38Å; D508-L511 PolarHBondContact O-N 3.47Å; D508-K521 VanDerWaalsContact OD1-CD 3.32Å; D508-K521 WeakPolarHBondContact OD1-CD 3.42Å; D508-K521 WeakPolarHBondContact OD1-CE 3.33Å; D508-K521 IonicContact OD1-NZ 2.98Å; D508-K521 PolarHBondContact OD1-NZ 3.29Å; D508-K521 IonicContact OD2-NZ 2.76Å; D508-K521 PolarHBondContact OD2-NZ 3.47Å; D508-Y529 VanDerWaalsContact OD1-CE2 3.31Å; D508-Y529 WeakPolarHBondContact OD1-CE2 3.15Å; D508-Y529 PolarHBondContact OD1-OH 2.89Å
509	D	96.1	Very high	94.1	Very high	99 Å²	99	55.8 Å²	55.8	53%	0.529	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-24.3	174.4	-75.4	-0.9	0	0	0	112.8	S505 L511	S505-D509 PolarHBondContact O-N 3.41Å; D509-L511 VanDerWaalsContact C-N 3.32Å
510	L	96.1	Very high	94.2	Very high	2 Å²	2	56 Å²	56	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-36.5	171.8	-64.8	177.2	0	0	0	111.3	F507 D508 D512 R513 F516 F556 A559 L560	F507-L510 WeakPolarHBondContact O-CB 3.46Å; F507-L510 PolarHBondContact O-N 3.14Å; D508-L510 PolarHBondContact O-N 2.92Å; D508-L510 VanDerWaalsContact O-N 3.16Å; L510-D512 PolarHBondContact O-N 3.4Å; L510-R513 VanDerWaalsContact CD2-CZ 3.41Å; L510-R513 WeakPolarHBondContact O-CB 3.29Å; L510-R513 WeakPolarHBondContact O-CG 3.39Å; L510-R513 PolarHBondContact O-N 3.17Å; L510-R513 VanDerWaalsContact O-N 3.1Å; L510-F516 VanDerWaalsContact O-CD2 3.24Å; L510-F516 WeakPolarHBondContact O-CD2 3.36Å; L510-F556 HydrophobicContact CB-CD2 4.32Å; L510-F556 HydrophobicContact CB-CE2 3.68Å; L510-F556 HydrophobicContact CD1-CE2 4.23Å; L510-A559 HydrophobicContact CD1-CB 4.02Å; L510-A559 HydrophobicContact CD2-CB 4.48Å; L510-L560 HydrophobicContact CD1-CD2 4.07Å
511	L	94	Very high	94.2	Very high	38 Å²	38	58.1 Å²	58.1	20%	0.199	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-22.5	-176.2	-63.5	171.6	0	0	0	113.3	D508 D509 R513 V519 K521 Y529 F556	D508-L511 VanDerWaalsContact O-CB 3.32Å; D508-L511 WeakPolarHBondContact O-CB 3.38Å; D508-L511 PolarHBondContact O-N 3.47Å; D509-L511 VanDerWaalsContact C-N 3.32Å; L511-R513 PolarHBondContact O-N 2.92Å; L511-V519 HydrophobicContact CD2-CB 3.98Å; L511-V519 HydrophobicContact CD2-CG1 3.63Å; L511-K521 HydrophobicContact CD1-CB 3.8Å; L511-Y529 WeakPolarHBondContact CD1-OH 3.49Å; L511-F556 HydrophobicContact CD2-CD2 4.32Å; L511-F556 HydrophobicContact CD2-CE2 3.54Å; L511-F556 HydrophobicContact CD2-CZ 3.68Å; L511-F556 HydrophobicContact CG-CE2 4.06Å; L511-F556 HydrophobicContact CG-CZ 4.15Å
512	D	91.8	Very high	94.2	Very high	138 Å²	138	54 Å²	54	74%	0.738	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15	176.2	-73.5	-18.7	0	0	0	113	L510	L510-D512 PolarHBondContact O-N 3.4Å
513	R	93.8	Very high	94.2	Very high	121 Å²	121	51.2 Å²	51.2	46%	0.457	26%	0.262	S	S	.	.	S	Bend	trans	-71.2	139.7	179.3	-59.2	-179.2	-174.9	-173.7	3.8	110.7	L510 L511 E515 F516	L510-R513 VanDerWaalsContact CD2-CZ 3.41Å; L510-R513 WeakPolarHBondContact O-CB 3.29Å; L510-R513 WeakPolarHBondContact O-CG 3.39Å; L510-R513 PolarHBondContact O-N 3.17Å; L510-R513 VanDerWaalsContact O-N 3.1Å; L511-R513 PolarHBondContact O-N 2.92Å; R513-E515 PolarHBondContact O-N 3.48Å; R513-E515 VanDerWaalsContact O-N 3.09Å; R513-F516 HydrophobicContact CB-CD2 3.97Å; R513-F516 HydrophobicContact CB-CE2 4.5Å; R513-F516 PolarHBondContact O-N 2.87Å
514	P	91.6	Very high	94.2	Very high	107 Å²	107	54.4 Å²	54.4	70%	0.695	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-61.1	-26.2	-177.3	24.8	-34.9	0	0	0	113.5	F516 I517	P514-F516 VanDerWaalsContact C-N 3.28Å; P514-F516 PolarHBondContact O-N 3.4Å; P514-I517 WeakPolarHBondContact O-CG2 3.23Å
515	E	90.1	Very high	94.1	Very high	112 Å²	112	57.8 Å²	57.8	52%	0.523	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-66.2	-29.2	177.5	-63.2	170.2	-141.4	0	0	112.7	R513	R513-E515 PolarHBondContact O-N 3.48Å; R513-E515 VanDerWaalsContact O-N 3.09Å
516	F	92.8	Very high	93.9	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.035	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-102.4	16.5	-176	-57	-52.8	0	0	0	113.2	L510 R513 P514 Q518 V519 E555 F556 A559	L510-F516 VanDerWaalsContact O-CD2 3.24Å; L510-F516 WeakPolarHBondContact O-CD2 3.36Å; R513-F516 HydrophobicContact CB-CD2 3.97Å; R513-F516 HydrophobicContact CB-CE2 4.5Å; R513-F516 PolarHBondContact O-N 2.87Å; P514-F516 VanDerWaalsContact C-N 3.28Å; P514-F516 PolarHBondContact O-N 3.4Å; F516-Q518 PolarHBondContact O-N 3.28Å; F516-V519 HydrophobicContact CB-CB 4.35Å; F516-V519 HydrophobicContact CB-CG2 4.17Å; F516-V519 HydrophobicContact CD1-CG2 4.33Å; F516-V519 WeakPolarHBondContact O-CB 3.23Å; F516-V519 PolarHBondContact O-N 3.06Å; F516-E555 HydrophobicContact CE1-CB 4.03Å; F516-F556 HydrophobicContact CB-CD2 4.37Å; F516-F556 HydrophobicContact CD1-CB 3.83Å; F516-F556 AromaticContact CD1-CD2 4Å; F516-F556 HydrophobicContact CD1-CD2 4Å; F516-F556 HydrophobicContact CD1-CG 4.41Å; F516-F556 HydrophobicContact CD2-CD2 4.07Å; F516-F556 HydrophobicContact CE1-CB 3.81Å; F516-F556 HydrophobicContact CE1-CD2 4.31Å; F516-F556 HydrophobicContact CE2-CD2 4.35Å; F516-F556 AromaticContact CG-CD2 3.88Å; F516-F556 HydrophobicContact CG-CD2 3.88Å; F516-F556 HydrophobicContact CZ-CB 4.49Å; F516-F556 HydrophobicContact CZ-CD2 4.47Å; F516-A559 HydrophobicContact CE2-CB 4.31Å; F516-A559 HydrophobicContact CZ-CB 3.97Å
517	I	90	Very high	93.8	Very high	91 Å²	91	56.9 Å²	56.9	47%	0.467	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.7	178.8	-158.8	163.9	0	0	0	113.9	P514 R539	P514-I517 WeakPolarHBondContact O-CG2 3.23Å; I517-R539 PolarHBondContact O-NH1 3.41Å
518	Q	90.6	Very high	93.7	Very high	27 Å²	27	57.5 Å²	57.5	13%	0.126	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.2	176	-66.9	-169.8	-35.9	0	0	113.6	F516 A533 G534 R539 S548 H549	F516-Q518 PolarHBondContact O-N 3.28Å; Q518-A533 VanDerWaalsContact O-CA 3.28Å; Q518-A533 WeakPolarHBondContact O-CA 3.28Å; Q518-A533 WeakPolarHBondContact O-CB 3.33Å; Q518-G534 PolarHBondContact O-N 3.39Å; Q518-R539 PolarHBondContact NE2-O 3.12Å; Q518-R539 VanDerWaalsContact NE2-O 3.17Å; Q518-S548 PolarHBondContact NE2-OG 3.48Å; Q518-S548 PolarHBondContact OE1-OG 3.21Å; Q518-H549 HydrophobicContact CB-CB 4.23Å; Q518-H549 VanDerWaalsContact OE1-CA 3.23Å; Q518-H549 VanDerWaalsContact OE1-N 3.12Å
519	V	94.9	Very high	93.8	Very high	8 Å²	8	55.3 Å²	55.3	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.2	179.6	-176.4	0	0	0	0	108.8	L511 F516 A531 A533 A552 L553 F556	L511-V519 HydrophobicContact CD2-CB 3.98Å; L511-V519 HydrophobicContact CD2-CG1 3.63Å; F516-V519 HydrophobicContact CB-CB 4.35Å; F516-V519 HydrophobicContact CB-CG2 4.17Å; F516-V519 HydrophobicContact CD1-CG2 4.33Å; F516-V519 WeakPolarHBondContact O-CB 3.23Å; F516-V519 PolarHBondContact O-N 3.06Å; V519-A531 HydrophobicContact CG1-CB 4.17Å; V519-A533 HydrophobicContact CG2-CB 4.31Å; V519-A552 HydrophobicContact CG2-CB 4.4Å; V519-L553 HydrophobicContact CG1-CD1 3.71Å; V519-L553 HydrophobicContact CG2-CD1 4.22Å; V519-F556 HydrophobicContact CG1-CD1 4.05Å; V519-F556 HydrophobicContact CG1-CD2 4.38Å; V519-F556 HydrophobicContact CG1-CE1 4.24Å; V519-F556 HydrophobicContact CG1-CG 4.12Å; V519-F556 HydrophobicContact CG2-CB 4.24Å; V519-F556 HydrophobicContact CG2-CG 4.47Å
520	E	94.4	Very high	93.9	Very high	35 Å²	35	50.8 Å²	50.8	16%	0.164	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.1	178.7	-64.9	-75.3	174.3	0	0	108.5	A531 A532 L535 R539	E520-A531 WeakPolarHBondContact O-CA 3.43Å; E520-A532 PolarHBondContact N-O 2.92Å; E520-A532 PolarHBondContact O-N 2.74Å; E520-L535 HydrophobicContact CB-CD1 4.16Å; E520-R539 IonicContact OE1-NH1 3.76Å
521	K	95.4	Very high	94	Very high	64 Å²	64	50.7 Å²	50.7	28%	0.278	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131	169.1	-176.5	-177.6	-172.7	170	0	109	D508 L511 Y529	D508-K521 VanDerWaalsContact OD1-CD 3.32Å; D508-K521 WeakPolarHBondContact OD1-CD 3.42Å; D508-K521 WeakPolarHBondContact OD1-CE 3.33Å; D508-K521 IonicContact OD1-NZ 2.98Å; D508-K521 PolarHBondContact OD1-NZ 3.29Å; D508-K521 IonicContact OD2-NZ 2.76Å; D508-K521 PolarHBondContact OD2-NZ 3.47Å; L511-K521 HydrophobicContact CD1-CB 3.8Å; K521-Y529 HydrophobicContact CD-CE2 4.15Å; K521-Y529 WeakPolarHBondContact CD-OH 3.35Å; K521-Y529 HydrophobicContact CG-CE1 4.4Å; K521-Y529 HydrophobicContact CG-CE2 4.4Å
522	I	95.4	Very high	94.1	Very high	15 Å²	15	48.9 Å²	48.9	8%	0.077	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-55.4	175.7	-53.1	-57	0	0	0	110	M530 A532 L535 Y599 D600 I601	I522-M530 HydrophobicContact CB-CB 4.48Å; I522-M530 HydrophobicContact CB-CE 4.19Å; I522-M530 HydrophobicContact CB-CG 4.01Å; I522-M530 HydrophobicContact CB-SD 4.07Å; I522-M530 HydrophobicContact CG1-CE 4.23Å; I522-M530 HydrophobicContact CG1-CG 4.35Å; I522-M530 HydrophobicContact CG2-CE 3.96Å; I522-M530 HydrophobicContact CG2-SD 3.97Å; I522-M530 PolarHBondContact N-O 2.97Å; I522-A532 HydrophobicContact CD1-CB 4.1Å; I522-A532 HydrophobicContact CG1-CB 4.08Å; I522-L535 HydrophobicContact CD1-CD1 3.65Å; I522-Y599 HydrophobicContact CD1-CE1 3.95Å; I522-D600 WeakPolarHBondContact CG2-OD1 3.44Å; I522-I601 HydrophobicContact CD1-CD1 4.29Å; I522-I601 HydrophobicContact CD1-CG1 4.44Å; I522-I601 HydrophobicContact CD1-CG2 4.29Å; I522-I601 HydrophobicContact CG1-CD1 4.11Å; I522-I601 HydrophobicContact CG1-CG1 4.32Å; I522-I601 HydrophobicContact CG2-CG1 4.34Å
523	K	94.7	Very high	94.3	Very high	39 Å²	39	42.3 Å²	42.3	17%	0.17	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	166.7	-177.3	66.7	-173.7	84.7	-170.3	0	111.6	I525 M530 Y598 D600	K523-I525 HydrophobicContact CD-CD1 3.83Å; K523-I525 HydrophobicContact CD-CG1 3.73Å; K523-I525 HydrophobicContact CG-CD1 4.26Å; K523-I525 HydrophobicContact CG-CG1 3.85Å; K523-M530 HydrophobicContact CD-SD 4.06Å; K523-M530 HydrophobicContact CG-CB 4.04Å; K523-M530 HydrophobicContact CG-SD 3.9Å; K523-M530 PolarHBondContact N-O 3.38Å; K523-M530 WeakPolarHBondContact O-CB 3.35Å; K523-M530 PolarHBondContact O-N 2.92Å; K523-Y598 WeakPolarHBondContact CB-OH 3.45Å; K523-Y598 WeakPolarHBondContact CD-OH 3.46Å; K523-Y598 WeakPolarHBondContact CE-OH 3.48Å; K523-Y598 PolarHBondContact NZ-OH 3.41Å; K523-D600 WeakPolarHBondContact CE-OD1 3.34Å; K523-D600 IonicContact NZ-OD1 2.73Å; K523-D600 PolarHBondContact NZ-OD1 3.34Å; K523-D600 IonicContact NZ-OD2 3.32Å; K523-D600 PolarHBondContact NZ-OD2 2.96Å
524	T	94.8	Very high	94.3	Very high	68 Å²	68	36.7 Å²	36.7	42%	0.417	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.9	164.3	52.1	0	0	0	0	109.3	I504 T528 Y529	I504-T524 HydrophobicContact CD1-CG2 4.25Å; I504-T524 HydrophobicContact CG2-CG2 3.99Å; T524-T528 CarbonylContact C-O 3.59Å; T524-T528 WeakPolarHBondContact CA-O 3.44Å; T524-Y529 HydrophobicContact CG2-CD2 3.93Å; T524-Y529 HydrophobicContact CG2-CE2 4.33Å
525	I	93.9	Very high	94.4	Very high	89 Å²	89	31.7 Å²	31.7	46%	0.456	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	92.2	179.1	-45.7	174.4	0	0	0	107.9	F476 K523 T528	F476-I525 HydrophobicContact CE1-CD1 4.29Å; K523-I525 HydrophobicContact CD-CD1 3.83Å; K523-I525 HydrophobicContact CD-CG1 3.73Å; K523-I525 HydrophobicContact CG-CD1 4.26Å; K523-I525 HydrophobicContact CG-CG1 3.85Å; I525-T528 PolarHBondContact N-O 2.96Å; I525-T528 VanDerWaalsContact O-CB 3.3Å; I525-T528 WeakPolarHBondContact O-CB 3.48Å; I525-T528 PolarHBondContact O-N 2.95Å
526	G	91.8	Very high	94.4	Very high	55 Å²	55	27.5 Å²	27.5	57%	0.567	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	-127.3	-170.8	0	0	0	0	0	110.7	T528	G526-T528 PolarHBondContact O-N 3.46Å
527	P	94.1	Very high	94	Very high	28 Å²	28	28.3 Å²	28.3	18%	0.182	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	6.9	175.5	35.2	-36.1	0	0	0	114	S478 I479 W482	S478-P527 WeakPolarHBondContact CA-O 3.38Å; S478-P527 PolarHBondContact OG-O 2.98Å; I479-P527 HydrophobicContact CB-CB 4.16Å; I479-P527 HydrophobicContact CD1-CB 4.36Å; I479-P527 PolarHBondContact N-O 3.47Å; W482-P527 HydrophobicContact CB-CB 3.87Å; W482-P527 HydrophobicContact CB-CG 4.02Å; W482-P527 HydrophobicContact CD2-CB 4.29Å; W482-P527 HydrophobicContact CG-CB 3.75Å; W482-P527 HydrophobicContact CG-CG 3.98Å
528	T	96.5	Very high	93.9	Very high	17 Å²	17	29 Å²	29	10%	0.104	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.4	-179.5	-52.7	0	0	0	0	111.4	F476 A477 S478 T524 I525 G526 Y613	F476-T528 HydrophobicContact CB-CG2 4.38Å; F476-T528 HydrophobicContact CD1-CG2 3.83Å; A477-T528 CarbonylContact O-C 3.6Å; A477-T528 VanDerWaalsContact O-CA 3.28Å; A477-T528 WeakPolarHBondContact O-CA 3.48Å; S478-T528 VanDerWaalsContact CB-OG1 3.31Å; S478-T528 WeakPolarHBondContact CB-OG1 3.24Å; S478-T528 PolarHBondContact OG-OG1 3.2Å; T524-T528 CarbonylContact C-O 3.59Å; T524-T528 WeakPolarHBondContact CA-O 3.44Å; I525-T528 PolarHBondContact N-O 2.96Å; I525-T528 VanDerWaalsContact O-CB 3.3Å; I525-T528 WeakPolarHBondContact O-CB 3.48Å; I525-T528 PolarHBondContact O-N 2.95Å; G526-T528 PolarHBondContact O-N 3.46Å; T528-Y613 HydrophobicContact CG2-CD1 4.39Å; T528-Y613 HydrophobicContact CG2-CE1 4.27Å
529	Y	97.6	Very high	93.6	Very high	1 Å²	1	31.8 Å²	31.8	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.5	173.2	-163	-88.6	0	0	0	110.8	A477 I504 F507 D508 L511 K521 T524 A531 F556	A477-Y529 PolarHBondContact N-O 2.81Å; A477-Y529 PolarHBondContact O-N 3.25Å; I504-Y529 HydrophobicContact CD1-CD2 3.92Å; I504-Y529 HydrophobicContact CG2-CD2 4.43Å; I504-Y529 HydrophobicContact CG2-CE2 4.31Å; F507-Y529 HydrophobicContact CB-CD2 4.32Å; F507-Y529 HydrophobicContact CB-CE2 3.95Å; F507-Y529 HydrophobicContact CD2-CD2 4.03Å; F507-Y529 HydrophobicContact CD2-CE2 4.5Å; F507-Y529 HydrophobicContact CD2-CG 4.33Å; D508-Y529 VanDerWaalsContact OD1-CE2 3.31Å; D508-Y529 WeakPolarHBondContact OD1-CE2 3.15Å; D508-Y529 PolarHBondContact OD1-OH 2.89Å; L511-Y529 WeakPolarHBondContact CD1-OH 3.49Å; K521-Y529 HydrophobicContact CD-CE2 4.15Å; K521-Y529 WeakPolarHBondContact CD-OH 3.35Å; K521-Y529 HydrophobicContact CG-CE1 4.4Å; K521-Y529 HydrophobicContact CG-CE2 4.4Å; T524-Y529 HydrophobicContact CG2-CD2 3.93Å; T524-Y529 HydrophobicContact CG2-CE2 4.33Å; Y529-A531 HydrophobicContact CD1-CB 4.39Å; Y529-A531 HydrophobicContact CE1-CB 4.1Å; Y529-F556 HydrophobicContact CE1-CE1 4.03Å; Y529-F556 HydrophobicContact CE1-CZ 4.1Å
530	M	97.7	Very high	93.2	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.8	179	-176.9	-176.1	172	0	0	110.4	V474 L475 F476 I522 K523 I601 V606	V474-M530 HydrophobicContact CG1-CE 4.29Å; L475-M530 WeakPolarHBondContact O-CA 3.17Å; F476-M530 HydrophobicContact CD1-CB 4.39Å; F476-M530 HydrophobicContact CD1-CG 4.4Å; F476-M530 HydrophobicContact CE1-CB 4.22Å; F476-M530 HydrophobicContact CE1-CG 3.96Å; F476-M530 HydrophobicContact CE1-SD 3.83Å; F476-M530 HydrophobicContact CE2-CE 4.25Å; F476-M530 HydrophobicContact CE2-CG 4.25Å; F476-M530 HydrophobicContact CE2-SD 4.32Å; F476-M530 HydrophobicContact CZ-CE 3.9Å; F476-M530 HydrophobicContact CZ-CG 3.89Å; F476-M530 HydrophobicContact CZ-SD 3.55Å; F476-M530 VanDerWaalsContact CZ-SD 3.55Å; I522-M530 HydrophobicContact CB-CB 4.48Å; I522-M530 HydrophobicContact CB-CE 4.19Å; I522-M530 HydrophobicContact CB-CG 4.01Å; I522-M530 HydrophobicContact CB-SD 4.07Å; I522-M530 HydrophobicContact CG1-CE 4.23Å; I522-M530 HydrophobicContact CG1-CG 4.35Å; I522-M530 HydrophobicContact CG2-CE 3.96Å; I522-M530 HydrophobicContact CG2-SD 3.97Å; I522-M530 PolarHBondContact N-O 2.97Å; K523-M530 HydrophobicContact CD-SD 4.06Å; K523-M530 HydrophobicContact CG-CB 4.04Å; K523-M530 HydrophobicContact CG-SD 3.9Å; K523-M530 PolarHBondContact N-O 3.38Å; K523-M530 WeakPolarHBondContact O-CB 3.35Å; K523-M530 PolarHBondContact O-N 2.92Å; M530-I601 HydrophobicContact CE-CD1 3.74Å; M530-I601 HydrophobicContact CE-CG1 3.54Å; M530-V606 HydrophobicContact CE-CG1 3.68Å
531	A	97.5	Very high	92.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153.3	177	0	0	0	0	0	110.6	L475 V519 E520 Y529 L553 F556	L475-A531 HydrophobicContact CD2-CB 4.33Å; L475-A531 PolarHBondContact N-O 3.17Å; L475-A531 PolarHBondContact O-N 3.3Å; V519-A531 HydrophobicContact CG1-CB 4.17Å; E520-A531 WeakPolarHBondContact O-CA 3.43Å; Y529-A531 HydrophobicContact CD1-CB 4.39Å; Y529-A531 HydrophobicContact CE1-CB 4.1Å; A531-L553 HydrophobicContact CB-CD1 4.12Å; A531-F556 HydrophobicContact CB-CE1 4.07Å
532	A	97.4	Very high	92.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.3	173.7	0	0	0	0	0	110.5	I472 A473 V474 E520 I522 L535 I601	I472-A532 HydrophobicContact CG2-CB 4.19Å; A473-A532 CarbonylContact O-C 3.59Å; A473-A532 WeakPolarHBondContact O-CA 3.34Å; A473-A532 WeakPolarHBondContact O-CB 3.38Å; V474-A532 HydrophobicContact CG2-CB 4.39Å; E520-A532 PolarHBondContact N-O 2.92Å; E520-A532 PolarHBondContact O-N 2.74Å; I522-A532 HydrophobicContact CD1-CB 4.1Å; I522-A532 HydrophobicContact CG1-CB 4.08Å; A532-L535 HydrophobicContact CB-CD1 3.85Å; A532-L535 HydrophobicContact CB-CG 4.47Å; A532-I601 HydrophobicContact CB-CD1 3.7Å
533	A	96.2	Very high	91.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	144.2	178.9	0	0	0	0	0	112.3	I472 A473 Q518 V519 H549 L553	I472-A533 WeakPolarHBondContact CG2-O 3.49Å; A473-A533 PolarHBondContact N-O 3.34Å; A473-A533 PolarHBondContact O-N 3.33Å; Q518-A533 VanDerWaalsContact O-CA 3.28Å; Q518-A533 WeakPolarHBondContact O-CA 3.28Å; Q518-A533 WeakPolarHBondContact O-CB 3.33Å; V519-A533 HydrophobicContact CG2-CB 4.31Å; A533-H549 HydrophobicContact CB-CB 4.2Å; A533-H549 VanDerWaalsContact CB-O 3.23Å; A533-H549 WeakPolarHBondContact CB-O 3.37Å; A533-H549 PolarHBondContact O-CD2 3.05Å; A533-L553 HydrophobicContact CB-CB 3.7Å; A533-L553 HydrophobicContact CB-CD1 4.26Å; A533-L553 HydrophobicContact CB-CD2 4.29Å; A533-L553 HydrophobicContact CB-CG 4.31Å
534	G	93	Very high	91	Very high	4 Å²	4	53 Å²	53	4%	0.041	27%	0.272	C	S	.	.			trans	91.1	15.6	-179.3	0	0	0	0	0	114.4	Q518 N536 R540	Q518-G534 PolarHBondContact O-N 3.39Å; G534-N536 VanDerWaalsContact C-N 3.34Å; G534-R540 PolarHBondContact O-NE 3.34Å; G534-R540 PolarHBondContact O-NH2 2.93Å
535	L	93.1	Very high	90.6	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.272	C	S	.	.			trans	-71	-26.7	177.7	-71.5	162.1	0	0	0	113.5	H469 I472 E520 I522 A532 P537 V587 A589 Y599 I601	H469-L535 PolarHBondContact CE1-O 2.97Å; H469-L535 PolarHBondContact NE2-O 3.47Å; I472-L535 HydrophobicContact CD1-CB 4.44Å; I472-L535 HydrophobicContact CD1-CD2 3.27Å; I472-L535 HydrophobicContact CD1-CG 3.8Å; E520-L535 HydrophobicContact CB-CD1 4.16Å; I522-L535 HydrophobicContact CD1-CD1 3.65Å; A532-L535 HydrophobicContact CB-CD1 3.85Å; A532-L535 HydrophobicContact CB-CG 4.47Å; L535-P537 VanDerWaalsContact O-CD 3.25Å; L535-P537 WeakPolarHBondContact O-CD 3.33Å; L535-V587 HydrophobicContact CD2-CG2 4.43Å; L535-A589 HydrophobicContact CD2-CB 4.1Å; L535-Y599 HydrophobicContact CD1-CE1 4.29Å; L535-Y599 WeakPolarHBondContact CD1-OH 3.32Å; L535-I601 HydrophobicContact CD1-CG2 4.24Å; L535-I601 HydrophobicContact CD2-CG2 3.75Å
536	N	91	Very high	90.2	Very high	24 Å²	24	53.5 Å²	53.5	13%	0.128	27%	0.274	C	S	.	.			trans	-87.4	110.3	177.8	-175.5	-31.2	0	0	0	111.1	G534 E538 R539 R540	G534-N536 VanDerWaalsContact C-N 3.34Å; N536-E538 VanDerWaalsContact C-N 3.35Å; N536-E538 PolarHBondContact O-N 3.48Å; N536-E538 PolarHBondContact OD1-N 2.98Å; N536-R539 HydrophobicContact CB-CB 4.08Å; N536-R539 HydrophobicContact CB-CG 4.21Å; N536-R539 PolarHBondContact O-N 3.38Å; N536-R539 PolarHBondContact OD1-N 3.33Å; N536-R539 VanDerWaalsContact OD1-N 3.12Å; N536-R540 PolarHBondContact O-N 2.95Å; N536-R540 VanDerWaalsContact O-N 3.14Å
537	P	85.1	Confident	90.1	Very high	26 Å²	26	54.1 Å²	54.1	17%	0.169	26%	0.26	C	S	.	.	H	α-helix	trans	-66.4	-33.2	-177.5	26.2	-33.9	0	0	0	113	L535 R540 R541	L535-P537 VanDerWaalsContact O-CD 3.25Å; L535-P537 WeakPolarHBondContact O-CD 3.33Å; P537-R540 PolarHBondContact O-N 3.42Å; P537-R541 WeakPolarHBondContact O-CG 3.36Å; P537-R541 PolarHBondContact O-N 3.31Å; P537-R541 VanDerWaalsContact O-N 3.07Å
538	E	86.2	Confident	90	Very high	104 Å²	104	53.9 Å²	53.9	49%	0.486	26%	0.259	S	S	.	.	H	α-helix	trans	-68.4	-43.5	178.7	-62.8	-54.7	145.7	0	0	111.1	N536 R540 R541 L542	N536-E538 VanDerWaalsContact C-N 3.35Å; N536-E538 PolarHBondContact O-N 3.48Å; N536-E538 PolarHBondContact OD1-N 2.98Å; E538-R540 VanDerWaalsContact C-N 3.26Å; E538-R540 PolarHBondContact O-N 3.5Å; E538-R541 PolarHBondContact O-N 2.91Å; E538-R541 IonicContact OE1-CZ 2.8Å; E538-R541 IonicContact OE1-NH1 3.79Å; E538-R541 PolarHBondContact OE1-NH1 3.36Å; E538-R541 IonicContact OE2-NH1 2.81Å; E538-R541 PolarHBondContact OE2-NH1 2.89Å; E538-L542 WeakPolarHBondContact O-CG 3.47Å; E538-L542 PolarHBondContact O-N 3.39Å; E538-L542 VanDerWaalsContact O-N 3.16Å
539	R	85.2	Confident	89.9	Confident	86 Å²	86	53.1 Å²	53.1	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-62.9	-33.2	173.9	-72.5	-175.6	178	167.2	2.4	112.2	I517 Q518 E520 N536 S543	I517-R539 PolarHBondContact O-NH1 3.41Å; Q518-R539 PolarHBondContact NE2-O 3.12Å; Q518-R539 VanDerWaalsContact NE2-O 3.17Å; E520-R539 IonicContact OE1-NH1 3.76Å; N536-R539 HydrophobicContact CB-CB 4.08Å; N536-R539 HydrophobicContact CB-CG 4.21Å; N536-R539 PolarHBondContact O-N 3.38Å; N536-R539 PolarHBondContact OD1-N 3.33Å; N536-R539 VanDerWaalsContact OD1-N 3.12Å; R539-S543 PolarHBondContact O-N 3.03Å
540	R	85.4	Confident	89.7	Confident	68 Å²	68	53.1 Å²	53.1	26%	0.257	25%	0.254	S	S	.	.	H	α-helix	trans	-70	-33.2	176.9	-158.5	-166.7	-56.9	154.5	1	112.5	G534 N536 P537 E538 S543	G534-R540 PolarHBondContact O-NE 3.34Å; G534-R540 PolarHBondContact O-NH2 2.93Å; N536-R540 PolarHBondContact O-N 2.95Å; N536-R540 VanDerWaalsContact O-N 3.14Å; P537-R540 PolarHBondContact O-N 3.42Å; E538-R540 VanDerWaalsContact C-N 3.26Å; E538-R540 PolarHBondContact O-N 3.5Å; R540-S543 PolarHBondContact O-OG 2.64Å
541	R	85	Confident	89.6	Confident	180 Å²	180	54.2 Å²	54.2	68%	0.679	26%	0.258	S	S	*	.	H	α-helix	trans	-72.6	-33.3	175.6	-71.9	178	-172.2	150.1	4.9	112.7	P537 E538	P537-R541 WeakPolarHBondContact O-CG 3.36Å; P537-R541 PolarHBondContact O-N 3.31Å; P537-R541 VanDerWaalsContact O-N 3.07Å; E538-R541 PolarHBondContact O-N 2.91Å; E538-R541 IonicContact OE1-CZ 2.8Å; E538-R541 IonicContact OE1-NH1 3.79Å; E538-R541 PolarHBondContact OE1-NH1 3.36Å; E538-R541 IonicContact OE2-NH1 2.81Å; E538-R541 PolarHBondContact OE2-NH1 2.89Å
542	L	86.4	Confident	89.4	Confident	150 Å²	150	54.5 Å²	54.5	79%	0.785	26%	0.261	S	S	*	.	H	α-helix	trans	-78.6	-20.2	-179.4	-68.1	169.8	0	0	0	113.4	E538	E538-L542 WeakPolarHBondContact O-CG 3.47Å; E538-L542 PolarHBondContact O-N 3.39Å; E538-L542 VanDerWaalsContact O-N 3.16Å
543	S	83.3	Confident	89.4	Confident	28 Å²	28	54.5 Å²	54.5	20%	0.196	26%	0.261	C	S	.	.	S	Bend	trans	-70.3	138.7	178.8	45.4	0	0	0	0	112.9	R539 R540 H545 S548	R539-S543 PolarHBondContact O-N 3.03Å; R540-S543 PolarHBondContact O-OG 2.64Å; S543-H545 VanDerWaalsContact C-N 3.26Å; S543-H545 PolarHBondContact O-N 3.47Å; S543-S548 WeakPolarHBondContact CB-OG 3.5Å; S543-S548 PolarHBondContact OG-OG 3.14Å
544	M	80.6	Confident	89.4	Confident	182 Å²	182	54.5 Å²	54.5	90%	0.897	26%	0.261	S	S	*	.	S	Bend	trans	-61.7	-31.2	180	-69.5	-164.1	176.6	0	0	113.9
545	H	85.4	Confident	89.5	Confident	88 Å²	88	56.1 Å²	56.1	41%	0.407	27%	0.267	S	S	.	.	S	Bend	trans	-120.4	132.7	-178	-168.7	-95.6	0	0	0	110.1	S543 Y547 S548	S543-H545 VanDerWaalsContact C-N 3.26Å; S543-H545 PolarHBondContact O-N 3.47Å; H545-Y547 AromaticContact CE1-CD2 3.61Å; H545-Y547 PolarHBondContact ND1-N 3.1Å; H545-Y547 PolarHBondContact O-N 3.33Å; H545-Y547 VanDerWaalsContact O-N 3.09Å; H545-S548 WeakPolarHBondContact O-CB 3.25Å; H545-S548 PolarHBondContact O-N 2.73Å; H545-S548 PolarHBondContact O-OG 3.32Å
546	P	85.9	Confident	89.7	Confident	78 Å²	78	56 Å²	56	51%	0.506	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.1	-175.6	23.2	-34.4	0	0	0	113.3	H549	P546-H549 PolarHBondContact O-CE1 3.27Å; P546-H549 PolarHBondContact O-ND1 3.27Å
547	Y	89.9	Confident	90	Very high	69 Å²	69	54.9 Å²	54.9	27%	0.271	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	12.7	-178.9	-51.6	-45.2	0	0	0	113.8	M471 H545 H549 L550 Y551 R630	M471-Y547 HydrophobicContact CE-CD1 4.49Å; M471-Y547 HydrophobicContact CE-CE1 3.68Å; M471-Y547 HydrophobicContact SD-CD1 3.39Å; M471-Y547 WeakPolarHBondContact SD-CD1 3.31Å; M471-Y547 HydrophobicContact SD-CE1 3.15Å; M471-Y547 WeakPolarHBondContact SD-CE1 3.39Å; H545-Y547 AromaticContact CE1-CD2 3.61Å; H545-Y547 PolarHBondContact ND1-N 3.1Å; H545-Y547 PolarHBondContact O-N 3.33Å; H545-Y547 VanDerWaalsContact O-N 3.09Å; Y547-H549 PolarHBondContact O-N 3.08Å; Y547-L550 HydrophobicContact CD1-CD1 3.95Å; Y547-L550 HydrophobicContact CG-CD1 4.09Å; Y547-L550 WeakPolarHBondContact O-CB 3.45Å; Y547-L550 PolarHBondContact O-N 3.46Å; Y547-Y551 WeakPolarHBondContact O-CD2 3.36Å; Y547-R630 PolarHBondContact OH-NH1 3.42Å; Y547-R630 VanDerWaalsContact OH-NH1 3.15Å
548	S	92.1	Very high	90.5	Very high	22 Å²	22	55.2 Å²	55.2	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-53.3	-40.4	-178.5	65	0	0	0	0	112.9	Q518 S543 H545 L550 Y551 A552	Q518-S548 PolarHBondContact NE2-OG 3.48Å; Q518-S548 PolarHBondContact OE1-OG 3.21Å; S543-S548 WeakPolarHBondContact CB-OG 3.5Å; S543-S548 PolarHBondContact OG-OG 3.14Å; H545-S548 WeakPolarHBondContact O-CB 3.25Å; H545-S548 PolarHBondContact O-N 2.73Å; H545-S548 PolarHBondContact O-OG 3.32Å; S548-L550 VanDerWaalsContact C-N 3.27Å; S548-L550 PolarHBondContact O-N 3.4Å; S548-Y551 PolarHBondContact O-N 2.98Å; S548-A552 PolarHBondContact O-N 2.95Å
549	H	93	Very high	91	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-29.9	-179.4	62.1	-82.3	0	0	0	112.8	M471 Q518 A533 P546 Y547 L553	M471-H549 PolarHBondContact O-NE2 3.37Å; Q518-H549 HydrophobicContact CB-CB 4.23Å; Q518-H549 VanDerWaalsContact OE1-CA 3.23Å; Q518-H549 VanDerWaalsContact OE1-N 3.12Å; A533-H549 HydrophobicContact CB-CB 4.2Å; A533-H549 VanDerWaalsContact CB-O 3.23Å; A533-H549 WeakPolarHBondContact CB-O 3.37Å; A533-H549 PolarHBondContact O-CD2 3.05Å; P546-H549 PolarHBondContact O-CE1 3.27Å; P546-H549 PolarHBondContact O-ND1 3.27Å; Y547-H549 PolarHBondContact O-N 3.08Å; H549-L553 PolarHBondContact O-N 3.5Å; H549-L553 VanDerWaalsContact O-N 3.13Å
550	L	95.2	Very high	91.5	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.2	-46.2	175.8	-50.9	-178.9	0	0	0	110.1	M471 A473 Y547 S548 L553 M554 Y582 I584 R630 L631	M471-L550 HydrophobicContact SD-CD1 4.11Å; A473-L550 HydrophobicContact CB-CD2 3.66Å; Y547-L550 HydrophobicContact CD1-CD1 3.95Å; Y547-L550 HydrophobicContact CG-CD1 4.09Å; Y547-L550 WeakPolarHBondContact O-CB 3.45Å; Y547-L550 PolarHBondContact O-N 3.46Å; S548-L550 VanDerWaalsContact C-N 3.27Å; S548-L550 PolarHBondContact O-N 3.4Å; L550-L553 PolarHBondContact O-N 2.78Å; L550-M554 PolarHBondContact O-N 3.16Å; L550-M554 VanDerWaalsContact O-N 3.17Å; L550-Y582 PolarHBondContact O-OH 3.01Å; L550-I584 HydrophobicContact CB-CD1 4.28Å; L550-I584 HydrophobicContact CD1-CD1 3.84Å; L550-I584 HydrophobicContact CD1-CG2 4.24Å; L550-I584 HydrophobicContact CD2-CD1 4.05Å; L550-I584 HydrophobicContact CD2-CG1 4.21Å; L550-I584 HydrophobicContact CD2-CG2 3.82Å; L550-I584 HydrophobicContact CG-CD1 4.28Å; L550-R630 HydrophobicContact CD1-CB 4.4Å; L550-L631 HydrophobicContact CB-CD2 4.1Å
551	Y	93.7	Very high	92	Very high	26 Å²	26	45.2 Å²	45.2	10%	0.102	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-42.3	175.5	-59.2	-75.6	0	0	0	111.6	Y547 S548 L553 M554 E555 R630 L631 S633 V634 Y635	Y547-Y551 WeakPolarHBondContact O-CD2 3.36Å; S548-Y551 PolarHBondContact O-N 2.98Å; Y551-L553 VanDerWaalsContact C-N 3.3Å; Y551-L553 PolarHBondContact O-N 3.22Å; Y551-M554 PolarHBondContact O-N 3.33Å; Y551-M554 VanDerWaalsContact O-N 3.08Å; Y551-E555 PolarHBondContact O-N 2.85Å; Y551-R630 PolarHBondContact OH-O 3.35Å; Y551-L631 HydrophobicContact CD1-CD2 3.76Å; Y551-L631 HydrophobicContact CE1-CD2 3.69Å; Y551-L631 HydrophobicContact CG-CD2 4.37Å; Y551-S633 PolarHBondContact OH-OG 2.89Å; Y551-V634 HydrophobicContact CD1-CB 4.12Å; Y551-V634 HydrophobicContact CD1-CG2 3.92Å; Y551-V634 HydrophobicContact CE1-CB 3.83Å; Y551-V634 HydrophobicContact CE1-CG2 3.45Å; Y551-V634 VanDerWaalsContact CE1-CG2 3.45Å; Y551-Y635 AromaticContact CD1-CE2 3.83Å; Y551-Y635 HydrophobicContact CD1-CE2 3.83Å; Y551-Y635 HydrophobicContact CE1-CE2 4.38Å
552	A	94.2	Very high	92.5	Very high	6 Å²	6	42.1 Å²	42.1	5%	0.05	22%	0.215	C	C	.	.	H	α-helix	trans	-57.7	-41.8	177.8	0	0	0	0	0	112.1	V519 S548 F556	V519-A552 HydrophobicContact CG2-CB 4.4Å; S548-A552 PolarHBondContact O-N 2.95Å; A552-F556 WeakPolarHBondContact O-CB 3.42Å; A552-F556 PolarHBondContact O-N 3.32Å
553	L	96.8	Very high	93	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.2	-31.7	176.1	-166.4	67	0	0	0	113.1	A473 L475 V519 A531 A533 H549 L550 Y551 F556 A557 Y582	A473-L553 HydrophobicContact CB-CB 4.14Å; A473-L553 HydrophobicContact CB-CD2 3.42Å; A473-L553 VanDerWaalsContact CB-CD2 3.42Å; A473-L553 HydrophobicContact CB-CG 4.4Å; A473-L553 VanDerWaalsContact O-CD2 3.28Å; A473-L553 WeakPolarHBondContact O-CD2 3.5Å; L475-L553 HydrophobicContact CB-CD1 4.18Å; L475-L553 HydrophobicContact CB-CD2 3.8Å; L475-L553 HydrophobicContact CB-CG 4.02Å; V519-L553 HydrophobicContact CG1-CD1 3.71Å; V519-L553 HydrophobicContact CG2-CD1 4.22Å; A531-L553 HydrophobicContact CB-CD1 4.12Å; A533-L553 HydrophobicContact CB-CB 3.7Å; A533-L553 HydrophobicContact CB-CD1 4.26Å; A533-L553 HydrophobicContact CB-CD2 4.29Å; A533-L553 HydrophobicContact CB-CG 4.31Å; H549-L553 PolarHBondContact O-N 3.5Å; H549-L553 VanDerWaalsContact O-N 3.13Å; L550-L553 PolarHBondContact O-N 2.78Å; Y551-L553 VanDerWaalsContact C-N 3.3Å; Y551-L553 PolarHBondContact O-N 3.22Å; L553-F556 HydrophobicContact CD1-CD1 4.21Å; L553-F556 WeakPolarHBondContact O-CB 3.23Å; L553-F556 PolarHBondContact O-N 3.47Å; L553-A557 PolarHBondContact O-N 2.95Å; L553-Y582 HydrophobicContact CB-CE2 3.88Å; L553-Y582 HydrophobicContact CD2-CD2 4.27Å; L553-Y582 HydrophobicContact CD2-CE2 3.75Å; L553-Y582 HydrophobicContact CG-CD2 4.4Å; L553-Y582 HydrophobicContact CG-CE2 3.81Å
554	M	96	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-70.9	-40.3	175.3	-173.9	57.8	70.9	0	0	111.4	L550 Y551 F556 A557 L558 Y582 I621 V623 L631 Y635 L657	L550-M554 PolarHBondContact O-N 3.16Å; L550-M554 VanDerWaalsContact O-N 3.17Å; Y551-M554 PolarHBondContact O-N 3.33Å; Y551-M554 VanDerWaalsContact O-N 3.08Å; M554-F556 VanDerWaalsContact C-N 3.31Å; M554-A557 VanDerWaalsContact O-CB 3.3Å; M554-A557 WeakPolarHBondContact O-CB 3.5Å; M554-A557 PolarHBondContact O-N 3.1Å; M554-A557 HydrophobicContact SD-CB 4.42Å; M554-L558 PolarHBondContact O-N 2.98Å; M554-L558 VanDerWaalsContact O-N 3.09Å; M554-Y582 HydrophobicContact CB-CE2 4.35Å; M554-Y582 HydrophobicContact CE-CD1 3.82Å; M554-Y582 HydrophobicContact CE-CD2 3.86Å; M554-Y582 HydrophobicContact CE-CE1 3.98Å; M554-Y582 HydrophobicContact CE-CE2 3.99Å; M554-Y582 HydrophobicContact CE-CG 3.77Å; M554-I621 HydrophobicContact CE-CG2 4.44Å; M554-I621 HydrophobicContact SD-CD1 4.49Å; M554-I621 HydrophobicContact SD-CG2 4.2Å; M554-V623 HydrophobicContact CE-CG1 3.81Å; M554-L631 HydrophobicContact CB-CD1 4.39Å; M554-L631 HydrophobicContact CE-CD1 3.4Å; M554-L631 HydrophobicContact CG-CD1 4.45Å; M554-Y635 HydrophobicContact CB-CE2 3.98Å; M554-Y635 HydrophobicContact CG-CD1 4.4Å; M554-Y635 HydrophobicContact CG-CD2 4.12Å; M554-Y635 HydrophobicContact CG-CE1 3.95Å; M554-Y635 HydrophobicContact CG-CE2 3.58Å; M554-Y635 HydrophobicContact CG-CG 4.49Å; M554-L657 HydrophobicContact SD-CD2 3.96Å
555	E	95.5	Very high	94.3	Very high	37 Å²	37	30.3 Å²	30.3	17%	0.173	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-38.1	170.9	-70.4	-55.4	141	0	0	111.6	F516 Y551 A557 L558 A559 Y635 R660	F516-E555 HydrophobicContact CE1-CB 4.03Å; Y551-E555 PolarHBondContact O-N 2.85Å; E555-A557 VanDerWaalsContact C-N 3.32Å; E555-A557 PolarHBondContact O-N 3.05Å; E555-L558 PolarHBondContact O-N 3.36Å; E555-A559 WeakPolarHBondContact O-CB 3.38Å; E555-A559 PolarHBondContact O-N 3.4Å; E555-Y635 WeakPolarHBondContact CG-OH 3.3Å; E555-Y635 WeakPolarHBondContact OE1-CE1 3.46Å; E555-Y635 PolarHBondContact OE1-OH 3.07Å; E555-R660 IonicContact OE1-NE 3.78Å; E555-R660 PolarHBondContact OE1-NE 3.28Å; E555-R660 IonicContact OE2-CZ 3.24Å; E555-R660 VanDerWaalsContact OE2-CZ 3.27Å; E555-R660 IonicContact OE2-NE 2.68Å; E555-R660 PolarHBondContact OE2-NE 3.33Å; E555-R660 IonicContact OE2-NH2 3.07Å; E555-R660 PolarHBondContact OE2-NH2 3.22Å
556	F	97.2	Very high	94.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-40.4	171.9	-174.1	-103.7	0	0	0	111.5	L510 L511 F516 V519 Y529 A531 A552 L553 M554 L558 A559 L560	L510-F556 HydrophobicContact CB-CD2 4.32Å; L510-F556 HydrophobicContact CB-CE2 3.68Å; L510-F556 HydrophobicContact CD1-CE2 4.23Å; L511-F556 HydrophobicContact CD2-CD2 4.32Å; L511-F556 HydrophobicContact CD2-CE2 3.54Å; L511-F556 HydrophobicContact CD2-CZ 3.68Å; L511-F556 HydrophobicContact CG-CE2 4.06Å; L511-F556 HydrophobicContact CG-CZ 4.15Å; F516-F556 HydrophobicContact CB-CD2 4.37Å; F516-F556 HydrophobicContact CD1-CB 3.83Å; F516-F556 AromaticContact CD1-CD2 4Å; F516-F556 HydrophobicContact CD1-CD2 4Å; F516-F556 HydrophobicContact CD1-CG 4.41Å; F516-F556 HydrophobicContact CD2-CD2 4.07Å; F516-F556 HydrophobicContact CE1-CB 3.81Å; F516-F556 HydrophobicContact CE1-CD2 4.31Å; F516-F556 HydrophobicContact CE2-CD2 4.35Å; F516-F556 AromaticContact CG-CD2 3.88Å; F516-F556 HydrophobicContact CG-CD2 3.88Å; F516-F556 HydrophobicContact CZ-CB 4.49Å; F516-F556 HydrophobicContact CZ-CD2 4.47Å; V519-F556 HydrophobicContact CG1-CD1 4.05Å; V519-F556 HydrophobicContact CG1-CD2 4.38Å; V519-F556 HydrophobicContact CG1-CE1 4.24Å; V519-F556 HydrophobicContact CG1-CG 4.12Å; V519-F556 HydrophobicContact CG2-CB 4.24Å; V519-F556 HydrophobicContact CG2-CG 4.47Å; Y529-F556 HydrophobicContact CE1-CE1 4.03Å; Y529-F556 HydrophobicContact CE1-CZ 4.1Å; A531-F556 HydrophobicContact CB-CE1 4.07Å; A552-F556 WeakPolarHBondContact O-CB 3.42Å; A552-F556 PolarHBondContact O-N 3.32Å; L553-F556 HydrophobicContact CD1-CD1 4.21Å; L553-F556 WeakPolarHBondContact O-CB 3.23Å; L553-F556 PolarHBondContact O-N 3.47Å; M554-F556 VanDerWaalsContact C-N 3.31Å; F556-L558 VanDerWaalsContact C-N 3.35Å; F556-L558 PolarHBondContact O-N 2.82Å; F556-A559 PolarHBondContact O-N 3.26Å; F556-L560 HydrophobicContact CD1-CD1 3.9Å; F556-L560 HydrophobicContact CD1-CG 4.15Å; F556-L560 HydrophobicContact CE1-CD1 3.67Å; F556-L560 HydrophobicContact CE1-CD2 4.06Å; F556-L560 HydrophobicContact CE1-CG 3.91Å; F556-L560 HydrophobicContact CZ-CD1 4.48Å; F556-L560 HydrophobicContact CZ-CD2 4.05Å; F556-L560 HydrophobicContact CZ-CG 4.29Å; F556-L560 WeakPolarHBondContact O-CG 3.37Å; F556-L560 PolarHBondContact O-N 3.28Å
557	A	97	Very high	95.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.6	-43.1	175.1	0	0	0	0	0	112.7	L475 L553 M554 E555 L560 Q561 I580 I621	L475-A557 HydrophobicContact CD1-CB 3.32Å; L553-A557 PolarHBondContact O-N 2.95Å; M554-A557 VanDerWaalsContact O-CB 3.3Å; M554-A557 WeakPolarHBondContact O-CB 3.5Å; M554-A557 PolarHBondContact O-N 3.1Å; M554-A557 HydrophobicContact SD-CB 4.42Å; E555-A557 VanDerWaalsContact C-N 3.32Å; E555-A557 PolarHBondContact O-N 3.05Å; A557-L560 PolarHBondContact O-N 3.05Å; A557-Q561 PolarHBondContact O-N 3.39Å; A557-I580 HydrophobicContact CB-CD1 4.22Å; A557-I580 HydrophobicContact CB-CG2 4.32Å; A557-I580 WeakPolarHBondContact O-CD1 3.3Å; A557-I621 HydrophobicContact CB-CD1 3.89Å; A557-I621 HydrophobicContact CB-CG1 4.45Å
558	L	96	Very high	95.4	Very high	33 Å²	33	23.9 Å²	23.9	17%	0.173	12%	0.123	C	C	.	.	H	α-helix	trans	-66.5	-41.6	175.4	-70.6	170.4	0	0	0	111.4	M554 E555 F556 L560 Q561 E562 I621 Y635 L657 R660	M554-L558 PolarHBondContact O-N 2.98Å; M554-L558 VanDerWaalsContact O-N 3.09Å; E555-L558 PolarHBondContact O-N 3.36Å; F556-L558 VanDerWaalsContact C-N 3.35Å; F556-L558 PolarHBondContact O-N 2.82Å; L558-L560 VanDerWaalsContact C-N 3.33Å; L558-L560 PolarHBondContact O-N 3.02Å; L558-Q561 PolarHBondContact O-N 3.01Å; L558-E562 PolarHBondContact O-N 3.04Å; L558-I621 HydrophobicContact CD2-CD1 3.88Å; L558-I621 HydrophobicContact CG-CD1 4.26Å; L558-Y635 HydrophobicContact CD1-CE1 4.16Å; L558-L657 HydrophobicContact CD1-CD2 4.46Å; L558-L657 HydrophobicContact CD2-CD2 3.72Å; L558-L657 HydrophobicContact CG-CD2 4.23Å; L558-R660 HydrophobicContact CD1-CG 4.2Å
559	A	96.4	Very high	95.5	Very high	8 Å²	8	30 Å²	30	7%	0.066	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-36.7	175.9	0	0	0	0	0	112.2	L510 F516 E555 F556 Q561 E562 T563	L510-A559 HydrophobicContact CD1-CB 4.02Å; L510-A559 HydrophobicContact CD2-CB 4.48Å; F516-A559 HydrophobicContact CE2-CB 4.31Å; F516-A559 HydrophobicContact CZ-CB 3.97Å; E555-A559 WeakPolarHBondContact O-CB 3.38Å; E555-A559 PolarHBondContact O-N 3.4Å; F556-A559 PolarHBondContact O-N 3.26Å; A559-Q561 VanDerWaalsContact C-N 3.33Å; A559-Q561 PolarHBondContact O-N 3.13Å; A559-E562 PolarHBondContact O-N 2.96Å; A559-T563 WeakPolarHBondContact O-CB 3.38Å; A559-T563 PolarHBondContact O-N 2.92Å; A559-T563 PolarHBondContact O-OG1 3.25Å; A559-T563 VanDerWaalsContact O-OG1 3.08Å
560	L	97.3	Very high	95.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-40.8	173.1	-73.1	173.7	0	0	0	112.2	L475 A477 F507 L510 F556 A557 L558 L564 M578 I580	L475-L560 HydrophobicContact CD2-CD1 3.8Å; A477-L560 HydrophobicContact CB-CD1 3.94Å; F507-L560 HydrophobicContact CB-CD2 3.71Å; F507-L560 HydrophobicContact CD1-CD2 3.39Å; F507-L560 HydrophobicContact CD2-CD2 3.87Å; F507-L560 HydrophobicContact CE1-CD2 3.92Å; F507-L560 HydrophobicContact CE2-CD2 4.36Å; F507-L560 HydrophobicContact CG-CD2 3.37Å; F507-L560 HydrophobicContact CZ-CD2 4.39Å; L510-L560 HydrophobicContact CD1-CD2 4.07Å; F556-L560 HydrophobicContact CD1-CD1 3.9Å; F556-L560 HydrophobicContact CD1-CG 4.15Å; F556-L560 HydrophobicContact CE1-CD1 3.67Å; F556-L560 HydrophobicContact CE1-CD2 4.06Å; F556-L560 HydrophobicContact CE1-CG 3.91Å; F556-L560 HydrophobicContact CZ-CD1 4.48Å; F556-L560 HydrophobicContact CZ-CD2 4.05Å; F556-L560 HydrophobicContact CZ-CG 4.29Å; F556-L560 WeakPolarHBondContact O-CG 3.37Å; F556-L560 PolarHBondContact O-N 3.28Å; A557-L560 PolarHBondContact O-N 3.05Å; L558-L560 VanDerWaalsContact C-N 3.33Å; L558-L560 PolarHBondContact O-N 3.02Å; L560-L564 WeakPolarHBondContact O-CB 3.12Å; L560-L564 PolarHBondContact O-N 2.97Å; L560-M578 HydrophobicContact CB-CE 4.39Å; L560-M578 HydrophobicContact CB-SD 4.26Å; L560-I580 HydrophobicContact CB-CD1 4.46Å
561	Q	95.9	Very high	95.1	Very high	39 Å²	39	38.6 Å²	38.6	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-65.6	-46	175.3	-62.6	-167.6	-69.7	0	0	111	A557 L558 A559 T563 L564 D565 I580 G619	A557-Q561 PolarHBondContact O-N 3.39Å; L558-Q561 PolarHBondContact O-N 3.01Å; A559-Q561 VanDerWaalsContact C-N 3.33Å; A559-Q561 PolarHBondContact O-N 3.13Å; Q561-T563 PolarHBondContact O-N 3.35Å; Q561-L564 PolarHBondContact O-N 3.21Å; Q561-D565 VanDerWaalsContact O-CG 3.27Å; Q561-D565 PolarHBondContact O-N 3.45Å; Q561-I580 HydrophobicContact CG-CD1 3.74Å; Q561-G619 PolarHBondContact NE2-O 3.41Å
562	E	95.4	Very high	94.7	Very high	116 Å²	116	44.9 Å²	44.9	54%	0.542	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-42.1	177.4	-176.1	179	-179.4	0	0	112.3	L558 A559 D565 N566	L558-E562 PolarHBondContact O-N 3.04Å; A559-E562 PolarHBondContact O-N 2.96Å; E562-D565 PolarHBondContact O-N 3.03Å; E562-N566 WeakPolarHBondContact O-CB 3.29Å; E562-N566 VanDerWaalsContact O-CG 3.26Å; E562-N566 PolarHBondContact O-N 3.43Å; E562-N566 PolarHBondContact O-ND2 2.85Å; E562-N566 VanDerWaalsContact O-ND2 3.14Å
563	T	96.1	Very high	94.2	Very high	19 Å²	19	50.9 Å²	50.9	12%	0.117	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-41.1	175.3	-64.9	0	0	0	0	111.2	D506 F507 A559 Q561 N566 F567	D506-T563 HydrophobicContact CB-CG2 3.72Å; F507-T563 HydrophobicContact CD1-CG2 3.86Å; F507-T563 HydrophobicContact CE1-CG2 3.95Å; A559-T563 WeakPolarHBondContact O-CB 3.38Å; A559-T563 PolarHBondContact O-N 2.92Å; A559-T563 PolarHBondContact O-OG1 3.25Å; A559-T563 VanDerWaalsContact O-OG1 3.08Å; Q561-T563 PolarHBondContact O-N 3.35Å; T563-N566 PolarHBondContact O-N 3.46Å; T563-F567 WeakPolarHBondContact O-CB 3.22Å; T563-F567 PolarHBondContact O-N 3.43Å
564	L	96.3	Very high	93.9	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-41.4	174.7	-173.9	67	0	0	0	112.1	L503 L560 Q561 N566 F567 N568 F576 M578	L503-L564 HydrophobicContact CD1-CD1 3.72Å; L503-L564 HydrophobicContact CD2-CD1 3.75Å; L503-L564 HydrophobicContact CG-CD1 4.39Å; L560-L564 WeakPolarHBondContact O-CB 3.12Å; L560-L564 PolarHBondContact O-N 2.97Å; Q561-L564 PolarHBondContact O-N 3.21Å; L564-N566 VanDerWaalsContact C-N 3.26Å; L564-N566 PolarHBondContact O-N 3.39Å; L564-F567 WeakPolarHBondContact O-CB 3.32Å; L564-F567 PolarHBondContact O-N 3.16Å; L564-N568 WeakPolarHBondContact O-CB 3.31Å; L564-N568 VanDerWaalsContact O-CG 3.26Å; L564-N568 PolarHBondContact O-N 3.03Å; L564-N568 PolarHBondContact O-ND2 3.21Å; L564-F576 HydrophobicContact CD1-CB 3.76Å; L564-F576 HydrophobicContact CD2-CB 4.31Å; L564-F576 WeakPolarHBondContact CD2-O 3.48Å; L564-F576 HydrophobicContact CG-CB 4.36Å; L564-M578 HydrophobicContact CB-CE 4.23Å; L564-M578 HydrophobicContact CD2-CB 3.48Å; L564-M578 VanDerWaalsContact CD2-CB 3.48Å; L564-M578 HydrophobicContact CD2-CE 3.98Å
565	D	95.3	Very high	93.8	Very high	88 Å²	88	59.7 Å²	59.7	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-35.8	176.7	-69.6	-16.5	0	0	0	111.3	Q561 E562 K569	Q561-D565 VanDerWaalsContact O-CG 3.27Å; Q561-D565 PolarHBondContact O-N 3.45Å; E562-D565 PolarHBondContact O-N 3.03Å; D565-K569 WeakPolarHBondContact O-CG 3.36Å; D565-K569 PolarHBondContact O-N 2.85Å
566	N	95.3	Very high	93.7	Very high	67 Å²	67	58.1 Å²	58.1	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-69.5	-44.7	173.2	-70.2	-33.7	0	0	0	111.6	E562 T563 L564 N568 K569	E562-N566 WeakPolarHBondContact O-CB 3.29Å; E562-N566 VanDerWaalsContact O-CG 3.26Å; E562-N566 PolarHBondContact O-N 3.43Å; E562-N566 PolarHBondContact O-ND2 2.85Å; E562-N566 VanDerWaalsContact O-ND2 3.14Å; T563-N566 PolarHBondContact O-N 3.46Å; L564-N566 VanDerWaalsContact C-N 3.26Å; L564-N566 PolarHBondContact O-N 3.39Å; N566-N568 VanDerWaalsContact C-N 3.28Å; N566-N568 PolarHBondContact O-N 2.99Å; N566-K569 WeakPolarHBondContact O-CB 3.49Å; N566-K569 PolarHBondContact O-N 3.37Å; N566-K569 PolarHBondContact OD1-NZ 3.37Å
567	F	94.8	Very high	93.6	Very high	17 Å²	17	60.7 Å²	60.7	8%	0.075	32%	0.315	C	S	.	.	H	α-helix	trans	-59.5	-39.7	175.8	-168.4	-93.7	0	0	0	112.2	V499 E502 L503 D506 T563 L564 K569 D570 L571 F576	V499-F567 HydrophobicContact CG1-CE1 3.99Å; V499-F567 HydrophobicContact CG1-CZ 3.94Å; E502-F567 HydrophobicContact CB-CE2 4.18Å; E502-F567 HydrophobicContact CB-CZ 4.45Å; L503-F567 HydrophobicContact CB-CD1 4.48Å; L503-F567 HydrophobicContact CB-CD2 4.39Å; L503-F567 HydrophobicContact CB-CE1 4.13Å; L503-F567 HydrophobicContact CB-CE2 4.03Å; L503-F567 HydrophobicContact CB-CZ 3.89Å; L503-F567 HydrophobicContact CD1-CB 4.01Å; L503-F567 HydrophobicContact CD1-CD1 4Å; L503-F567 HydrophobicContact CD1-CD2 4.04Å; L503-F567 HydrophobicContact CD1-CE1 4.48Å; L503-F567 HydrophobicContact CD1-CG 3.75Å; D506-F567 VanDerWaalsContact OD2-CD2 3.3Å; D506-F567 WeakPolarHBondContact OD2-CD2 3.3Å; T563-F567 WeakPolarHBondContact O-CB 3.22Å; T563-F567 PolarHBondContact O-N 3.43Å; L564-F567 WeakPolarHBondContact O-CB 3.32Å; L564-F567 PolarHBondContact O-N 3.16Å; F567-K569 PolarHBondContact O-N 3.21Å; F567-D570 PolarHBondContact O-N 3.17Å; F567-D570 VanDerWaalsContact O-N 3.09Å; F567-L571 HydrophobicContact CD1-CD1 3.84Å; F567-L571 HydrophobicContact CD1-CG 4.26Å; F567-L571 HydrophobicContact CE1-CD1 3.85Å; F567-L571 HydrophobicContact CE1-CD2 4.24Å; F567-L571 HydrophobicContact CE1-CG 4.16Å; F567-L571 PolarHBondContact O-N 3.45Å; F567-F576 HydrophobicContact CD1-CD2 4.22Å; F567-F576 HydrophobicContact CE1-CD2 4.18Å; F567-F576 HydrophobicContact CE1-CE2 4.01Å
568	N	94.7	Very high	93.6	Very high	17 Å²	17	61 Å²	61	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-63.5	-24.4	176.4	-77	-24.2	0	0	0	113.5	L564 N566 D570 L571 E575 F576	L564-N568 WeakPolarHBondContact O-CB 3.31Å; L564-N568 VanDerWaalsContact O-CG 3.26Å; L564-N568 PolarHBondContact O-N 3.03Å; L564-N568 PolarHBondContact O-ND2 3.21Å; N566-N568 VanDerWaalsContact C-N 3.28Å; N566-N568 PolarHBondContact O-N 2.99Å; N568-D570 PolarHBondContact O-N 3.39Å; N568-L571 PolarHBondContact O-N 3.35Å; N568-E575 HydrophobicContact CB-CG 4.13Å; N568-E575 VanDerWaalsContact ND2-CG 3.32Å; N568-E575 WeakPolarHBondContact ND2-CG 3.43Å; N568-F576 PolarHBondContact ND2-O 3.23Å; N568-F576 WeakPolarHBondContact OD1-CB 3.39Å; N568-F576 PolarHBondContact OD1-N 3.48Å
569	K	93.4	Very high	93.6	Very high	151 Å²	151	61.1 Å²	61.1	66%	0.657	32%	0.316	S	S	*	.	H	α-helix	trans	-69.6	-26	175.2	-66.3	165.7	-168.3	164.4	0	112.2	D565 N566 F567	D565-K569 WeakPolarHBondContact O-CG 3.36Å; D565-K569 PolarHBondContact O-N 2.85Å; N566-K569 WeakPolarHBondContact O-CB 3.49Å; N566-K569 PolarHBondContact O-N 3.37Å; N566-K569 PolarHBondContact OD1-NZ 3.37Å; F567-K569 PolarHBondContact O-N 3.21Å
570	D	91	Very high	93.6	Very high	137 Å²	137	60.7 Å²	60.7	73%	0.733	31%	0.312	S	S	*	.	H	α-helix	trans	-86.1	-17.2	179.2	-62.5	-29.3	0	0	0	112	F567 N568	F567-D570 PolarHBondContact O-N 3.17Å; F567-D570 VanDerWaalsContact O-N 3.09Å; N568-D570 PolarHBondContact O-N 3.39Å
571	L	89.4	Confident	93.6	Very high	45 Å²	45	60.7 Å²	60.7	24%	0.236	31%	0.312	C	S	.	.	S	Bend	trans	-83.2	129.6	176.8	-66.5	171.7	0	0	0	111.9	F567 N568 F574 F576	F567-L571 HydrophobicContact CD1-CD1 3.84Å; F567-L571 HydrophobicContact CD1-CG 4.26Å; F567-L571 HydrophobicContact CE1-CD1 3.85Å; F567-L571 HydrophobicContact CE1-CD2 4.24Å; F567-L571 HydrophobicContact CE1-CG 4.16Å; F567-L571 PolarHBondContact O-N 3.45Å; N568-L571 PolarHBondContact O-N 3.35Å; L571-F574 WeakPolarHBondContact CB-O 3.3Å; L571-F576 HydrophobicContact CD1-CD2 3.4Å; L571-F576 HydrophobicContact CD1-CE2 3.44Å; L571-F576 VanDerWaalsContact CD1-CE2 3.44Å; L571-F576 HydrophobicContact CD1-CG 4.47Å
572	L	85.7	Confident	93.7	Very high	158 Å²	158	58.9 Å²	58.9	83%	0.827	30%	0.304	S	S	*	.	S	Bend	trans	-85.9	127.7	172.2	-62.7	171.5	0	0	0	109.5	F574	L572-F574 PolarHBondContact O-N 2.92Å; L572-F574 VanDerWaalsContact O-N 3.11Å
573	S	83.2	Confident	93.8	Very high	133 Å²	133	53.5 Å²	53.5	93%	0.93	28%	0.279	S	S	*	.	S	Bend	trans	64.1	7.2	170	67.8	0	0	0	0	117.9
574	F	90.2	Very high	93.8	Very high	59 Å²	59	52.9 Å²	52.9	26%	0.259	28%	0.275	S	S	.	.			trans	-141	138.2	175.6	-164.3	-90.2	0	0	0	111	N481 E484 M485 L571 L572 F576	N481-F574 HydrophobicContact CB-CZ 4.13Å; N481-F574 WeakPolarHBondContact ND2-CE1 3.44Å; N481-F574 VanDerWaalsContact ND2-CZ 3.26Å; N481-F574 WeakPolarHBondContact ND2-CZ 3.17Å; E484-F574 HydrophobicContact CB-CZ 4.48Å; M485-F574 HydrophobicContact CB-CD1 4.34Å; M485-F574 HydrophobicContact CB-CE1 3.76Å; M485-F574 HydrophobicContact CB-CE2 4.01Å; M485-F574 HydrophobicContact CB-CZ 3.58Å; M485-F574 HydrophobicContact CG-CD1 4.16Å; M485-F574 HydrophobicContact CG-CE1 4.06Å; M485-F574 HydrophobicContact CG-CG 4.47Å; M485-F574 HydrophobicContact CG-CZ 4.27Å; L571-F574 WeakPolarHBondContact CB-O 3.3Å; L572-F574 PolarHBondContact O-N 2.92Å; L572-F574 VanDerWaalsContact O-N 3.11Å; F574-F576 HydrophobicContact CD1-CD1 4.08Å; F574-F576 HydrophobicContact CD1-CE1 4Å; F574-F576 HydrophobicContact CD1-CG 4.43Å; F574-F576 HydrophobicContact CD1-CZ 4.31Å; F574-F576 AromaticContact CE1-CD1 3.49Å; F574-F576 HydrophobicContact CE1-CD1 3.49Å; F574-F576 VanDerWaalsContact CE1-CD1 3.49Å; F574-F576 AromaticContact CE1-CE1 3.51Å; F574-F576 HydrophobicContact CE1-CE1 3.51Å; F574-F576 HydrophobicContact CE1-CG 4.2Å; F574-F576 HydrophobicContact CE1-CZ 4.25Å
575	E	93	Very high	93.8	Very high	126 Å²	126	53 Å²	53	59%	0.589	28%	0.277	S	S	*	.			trans	-124.3	116.3	179.4	-173.5	-175.5	169.9	0	0	109	N481 N568	N481-E575 PolarHBondContact ND2-O 3.47Å; N568-E575 HydrophobicContact CB-CG 4.13Å; N568-E575 VanDerWaalsContact ND2-CG 3.32Å; N568-E575 WeakPolarHBondContact ND2-CG 3.43Å
576	F	95	Very high	93.8	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.018	28%	0.279	C	S	.	.			trans	-72	135.9	174.5	-73.5	-58.9	0	0	0	110.8	I479 N481 W482 M485 V499 L503 L564 F567 N568 L571 F574	I479-F576 HydrophobicContact CG2-CB 4Å; I479-F576 HydrophobicContact CG2-CD1 3.45Å; I479-F576 VanDerWaalsContact CG2-CD1 3.45Å; I479-F576 HydrophobicContact CG2-CE1 4.25Å; I479-F576 HydrophobicContact CG2-CG 4Å; N481-F576 WeakPolarHBondContact OD1-CA 3.29Å; W482-F576 AromaticContact CE3-CE1 3.89Å; W482-F576 HydrophobicContact CE3-CE1 3.89Å; W482-F576 HydrophobicContact CE3-CZ 4.22Å; W482-F576 HydrophobicContact CZ3-CE1 4.19Å; W482-F576 HydrophobicContact CZ3-CZ 4.04Å; M485-F576 HydrophobicContact CB-CE1 4.02Å; M485-F576 HydrophobicContact CB-CZ 4.49Å; M485-F576 HydrophobicContact CE-CZ 3.98Å; M485-F576 HydrophobicContact CG-CE1 3.98Å; M485-F576 HydrophobicContact CG-CZ 3.95Å; M485-F576 HydrophobicContact SD-CE1 4.2Å; M485-F576 HydrophobicContact SD-CZ 3.84Å; V499-F576 HydrophobicContact CG1-CE2 4.05Å; V499-F576 HydrophobicContact CG1-CZ 4.31Å; L503-F576 HydrophobicContact CD2-CD2 4.46Å; L564-F576 HydrophobicContact CD1-CB 3.76Å; L564-F576 HydrophobicContact CD2-CB 4.31Å; L564-F576 WeakPolarHBondContact CD2-O 3.48Å; L564-F576 HydrophobicContact CG-CB 4.36Å; F567-F576 HydrophobicContact CD1-CD2 4.22Å; F567-F576 HydrophobicContact CE1-CD2 4.18Å; F567-F576 HydrophobicContact CE1-CE2 4.01Å; N568-F576 PolarHBondContact ND2-O 3.23Å; N568-F576 WeakPolarHBondContact OD1-CB 3.39Å; N568-F576 PolarHBondContact OD1-N 3.48Å; L571-F576 HydrophobicContact CD1-CD2 3.4Å; L571-F576 HydrophobicContact CD1-CE2 3.44Å; L571-F576 VanDerWaalsContact CD1-CE2 3.44Å; L571-F576 HydrophobicContact CD1-CG 4.47Å; F574-F576 HydrophobicContact CD1-CD1 4.08Å; F574-F576 HydrophobicContact CD1-CE1 4Å; F574-F576 HydrophobicContact CD1-CG 4.43Å; F574-F576 HydrophobicContact CD1-CZ 4.31Å; F574-F576 AromaticContact CE1-CD1 3.49Å; F574-F576 HydrophobicContact CE1-CD1 3.49Å; F574-F576 VanDerWaalsContact CE1-CD1 3.49Å; F574-F576 AromaticContact CE1-CE1 3.51Å; F574-F576 HydrophobicContact CE1-CE1 3.51Å; F574-F576 HydrophobicContact CE1-CG 4.2Å; F574-F576 HydrophobicContact CE1-CZ 4.25Å
577	I	95.1	Very high	93.9	Very high	53 Å²	53	49.6 Å²	49.6	27%	0.272	26%	0.263	S	S	.	.			trans	-115	122.8	179.6	-53.6	168.9	0	0	0	109.1	V480 N481 K618	V480-I577 WeakPolarHBondContact CG2-O 3.4Å; V480-I577 PolarHBondContact N-O 2.98Å; N481-I577 PolarHBondContact OD1-N 2.96Å; I577-K618 HydrophobicContact CG2-CB 3.8Å; I577-K618 HydrophobicContact CG2-CG 4.43Å
578	M	95.3	Very high	94	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	147.4	178.4	-173.3	-178	-66	0	0	112.6	A477 S478 F507 L560 L564 I580 G619	A477-M578 HydrophobicContact CB-CG 4.36Å; A477-M578 HydrophobicContact CB-SD 3.72Å; S478-M578 CarbonylContact O-C 2.94Å; S478-M578 VanDerWaalsContact O-CA 3.31Å; S478-M578 WeakPolarHBondContact O-CA 3.35Å; F507-M578 HydrophobicContact CE1-CE 4.11Å; F507-M578 HydrophobicContact CE2-CE 3.77Å; F507-M578 HydrophobicContact CZ-CE 3.27Å; L560-M578 HydrophobicContact CB-CE 4.39Å; L560-M578 HydrophobicContact CB-SD 4.26Å; L564-M578 HydrophobicContact CB-CE 4.23Å; L564-M578 HydrophobicContact CD2-CB 3.48Å; L564-M578 VanDerWaalsContact CD2-CB 3.48Å; L564-M578 HydrophobicContact CD2-CE 3.98Å; M578-I580 HydrophobicContact CG-CD1 4.48Å; M578-I580 HydrophobicContact CG-CG1 3.87Å; M578-I580 HydrophobicContact SD-CD1 3.61Å; M578-I580 HydrophobicContact SD-CG1 3.59Å; M578-I580 VanDerWaalsContact SD-CG1 3.59Å; M578-G619 VanDerWaalsContact O-CA 3.25Å; M578-G619 WeakPolarHBondContact O-CA 3.35Å; M578-G619 PolarHBondContact O-N 3.06Å
579	K	96.3	Very high	94.1	Very high	36 Å²	36	50.4 Å²	50.4	16%	0.157	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.3	160.9	-72.9	173	-174.6	-160.4	0	108.8	A477 S478 V480 Y613 G616 V617 K618	A477-K579 CarbonylContact C-O 3.26Å; A477-K579 WeakPolarHBondContact CA-O 3.47Å; S478-K579 PolarHBondContact N-O 3.44Å; S478-K579 PolarHBondContact O-N 3.27Å; V480-K579 HydrophobicContact CG2-CB 4.08Å; V480-K579 HydrophobicContact CG2-CD 3.46Å; V480-K579 VanDerWaalsContact CG2-CD 3.46Å; V480-K579 HydrophobicContact CG2-CG 3.4Å; K579-Y613 HydrophobicContact CB-CD2 3.61Å; K579-Y613 HydrophobicContact CB-CE2 3.78Å; K579-Y613 HydrophobicContact CD-CE2 4.31Å; K579-Y613 WeakPolarHBondContact O-CD2 3.41Å; K579-G616 WeakPolarHBondContact CD-O 3.35Å; K579-G616 WeakPolarHBondContact CE-O 3.31Å; K579-G616 PolarHBondContact NZ-O 2.82Å; K579-V617 WeakPolarHBondContact CG-O 3.39Å; K579-K618 VanDerWaalsContact CE-CG 3.43Å
580	I	97.7	Very high	94.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.6	177	-56.9	-176.8	0	0	0	109.3	L475 F476 A477 A557 L560 Q561 M578 R620 I621 Q622	L475-I580 HydrophobicContact CD1-CG2 3.47Å; L475-I580 VanDerWaalsContact CD1-CG2 3.47Å; L475-I580 HydrophobicContact CG-CG2 3.84Å; F476-I580 CarbonylContact O-C 3.54Å; F476-I580 VanDerWaalsContact O-CA 3.31Å; F476-I580 WeakPolarHBondContact O-CA 3.37Å; A477-I580 HydrophobicContact CB-CD1 4.39Å; A477-I580 HydrophobicContact CB-CG1 3.93Å; A557-I580 HydrophobicContact CB-CD1 4.22Å; A557-I580 HydrophobicContact CB-CG2 4.32Å; A557-I580 WeakPolarHBondContact O-CD1 3.3Å; L560-I580 HydrophobicContact CB-CD1 4.46Å; Q561-I580 HydrophobicContact CG-CD1 3.74Å; M578-I580 HydrophobicContact CG-CD1 4.48Å; M578-I580 HydrophobicContact CG-CG1 3.87Å; M578-I580 HydrophobicContact SD-CD1 3.61Å; M578-I580 HydrophobicContact SD-CG1 3.59Å; M578-I580 VanDerWaalsContact SD-CG1 3.59Å; I580-R620 PolarHBondContact N-O 3.02Å; I580-I621 HydrophobicContact CB-CB 4.34Å; I580-I621 HydrophobicContact CB-CG1 3.81Å; I580-I621 HydrophobicContact CB-CG2 4.4Å; I580-I621 HydrophobicContact CD1-CD1 4.42Å; I580-I621 HydrophobicContact CD1-CG1 3.89Å; I580-I621 HydrophobicContact CG1-CG1 4.27Å; I580-I621 HydrophobicContact CG2-CG1 4.15Å; I580-I621 HydrophobicContact CG2-CG2 4.17Å; I580-Q622 PolarHBondContact O-N 3.33Å
581	G	97.2	Very high	94.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.3	171.2	0	0	0	0	0	110.4	L475 F476 S609 Q622	L475-G581 WeakPolarHBondContact CA-O 3.47Å; F476-G581 PolarHBondContact N-O 3.27Å; F476-G581 PolarHBondContact O-N 3.1Å; G581-S609 PolarHBondContact O-OG 2.91Å; G581-Q622 WeakPolarHBondContact CA-O 3.32Å
582	Y	97.8	Very high	94.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.7	-176	-176.5	-77	0	0	0	110.4	A473 V474 L475 L550 L553 M554 I584 Q622 V623 S624 A627 L631	A473-Y582 HydrophobicContact CB-CE1 4.4Å; A473-Y582 HydrophobicContact CB-CE2 4.13Å; A473-Y582 VanDerWaalsContact CB-OH 3.24Å; A473-Y582 WeakPolarHBondContact CB-OH 3.12Å; V474-Y582 WeakPolarHBondContact O-CA 3.1Å; L475-Y582 HydrophobicContact CB-CD2 4.43Å; L475-Y582 HydrophobicContact CD1-CD2 4.29Å; L550-Y582 PolarHBondContact O-OH 3.01Å; L553-Y582 HydrophobicContact CB-CE2 3.88Å; L553-Y582 HydrophobicContact CD2-CD2 4.27Å; L553-Y582 HydrophobicContact CD2-CE2 3.75Å; L553-Y582 HydrophobicContact CG-CD2 4.4Å; L553-Y582 HydrophobicContact CG-CE2 3.81Å; M554-Y582 HydrophobicContact CB-CE2 4.35Å; M554-Y582 HydrophobicContact CE-CD1 3.82Å; M554-Y582 HydrophobicContact CE-CD2 3.86Å; M554-Y582 HydrophobicContact CE-CE1 3.98Å; M554-Y582 HydrophobicContact CE-CE2 3.99Å; M554-Y582 HydrophobicContact CE-CG 3.77Å; Y582-I584 HydrophobicContact CD1-CG1 4.37Å; Y582-I584 HydrophobicContact CE1-CD1 3.77Å; Y582-I584 HydrophobicContact CE1-CG1 3.52Å; Y582-Q622 PolarHBondContact N-O 3.35Å; Y582-V623 HydrophobicContact CD1-CG1 4.44Å; Y582-V623 WeakPolarHBondContact O-CA 3.49Å; Y582-S624 PolarHBondContact O-N 3.43Å; Y582-A627 HydrophobicContact CD1-CB 3.75Å; Y582-A627 HydrophobicContact CE1-CB 3.91Å; Y582-L631 HydrophobicContact CD1-CD1 4.38Å; Y582-L631 HydrophobicContact CE1-CD1 3.64Å
583	N	97	Very high	94.4	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.5	176.8	-170.9	36.7	0	0	0	111.3	V474 T605 I608 S624	V474-N583 PolarHBondContact N-O 2.96Å; V474-N583 PolarHBondContact O-N 3.42Å; N583-T605 WeakPolarHBondContact ND2-CA 3.29Å; N583-T605 PolarHBondContact ND2-O 3.5Å; N583-I608 HydrophobicContact CB-CG2 4.4Å; N583-I608 WeakPolarHBondContact ND2-CB 3.4Å; N583-I608 WeakPolarHBondContact ND2-CG2 3.4Å; N583-S624 WeakPolarHBondContact OD1-CB 3.22Å; N583-S624 PolarHBondContact OD1-OG 2.88Å
584	I	96.8	Very high	94.3	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.8	178	-55.3	175.8	0	0	0	108.2	M471 I472 A473 L550 Y582 Q626 A627 R630 L631	M471-I584 HydrophobicContact CG-CG2 4.01Å; I472-I584 WeakPolarHBondContact O-CA 3.33Å; A473-I584 HydrophobicContact CB-CG1 4.36Å; L550-I584 HydrophobicContact CB-CD1 4.28Å; L550-I584 HydrophobicContact CD1-CD1 3.84Å; L550-I584 HydrophobicContact CD1-CG2 4.24Å; L550-I584 HydrophobicContact CD2-CD1 4.05Å; L550-I584 HydrophobicContact CD2-CG1 4.21Å; L550-I584 HydrophobicContact CD2-CG2 3.82Å; L550-I584 HydrophobicContact CG-CD1 4.28Å; Y582-I584 HydrophobicContact CD1-CG1 4.37Å; Y582-I584 HydrophobicContact CE1-CD1 3.77Å; Y582-I584 HydrophobicContact CE1-CG1 3.52Å; I584-Q626 PolarHBondContact O-OE1 3.39Å; I584-A627 HydrophobicContact CD1-CB 3.9Å; I584-A627 HydrophobicContact CG1-CB 3.86Å; I584-R630 HydrophobicContact CD1-CB 4.1Å; I584-L631 HydrophobicContact CD1-CD1 4.37Å; I584-L631 HydrophobicContact CD1-CG 4.3Å
585	G	95.4	Very high	94	Very high	6 Å²	6	38.7 Å²	38.7	6%	0.062	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-170.9	176.1	0	0	0	0	0	113	E470 I472 T605	E470-G585 CarbonylContact O-C 3.49Å; I472-G585 PolarHBondContact N-O 2.94Å; I472-G585 PolarHBondContact O-N 3.33Å; G585-T605 VanDerWaalsContact CA-OG1 3.27Å; G585-T605 WeakPolarHBondContact CA-OG1 3.4Å
586	P	96.5	Very high	93.7	Very high	81 Å²	81	41.4 Å²	41.4	53%	0.526	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	143.6	178.9	30.4	-34.8	0	0	0	111.7	H469 E470 T605	H469-P586 CarbonylContact O-C 3.43Å; H469-P586 VanDerWaalsContact O-CA 3.24Å; H469-P586 WeakPolarHBondContact O-CA 3.2Å; E470-P586 VanDerWaalsContact O-CA 3.25Å; E470-P586 WeakPolarHBondContact O-CA 3.36Å; P586-T605 WeakPolarHBondContact CD-OG1 3.37Å; P586-T605 VanDerWaalsContact O-CB 3.31Å; P586-T605 WeakPolarHBondContact O-CB 3.43Å; P586-T605 PolarHBondContact O-OG1 3.32Å
587	V	97.1	Very high	93.3	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.2	172.9	-59	0	0	0	0	110.6	H469 I472 V474 L535 W602 T605 V606	H469-V587 HydrophobicContact CB-CG2 4.34Å; H469-V587 PolarHBondContact N-O 3.36Å; H469-V587 PolarHBondContact O-N 2.86Å; I472-V587 HydrophobicContact CB-CG2 3.83Å; I472-V587 HydrophobicContact CD1-CG2 3.54Å; I472-V587 HydrophobicContact CG1-CG2 3.94Å; I472-V587 HydrophobicContact CG2-CG2 3.95Å; V474-V587 HydrophobicContact CG2-CG1 4.12Å; L535-V587 HydrophobicContact CD2-CG2 4.43Å; V587-W602 CarbonylContact C-O 3.42Å; V587-W602 WeakPolarHBondContact CA-O 3.27Å; V587-T605 HydrophobicContact CG1-CG2 4.15Å; V587-V606 HydrophobicContact CG1-CG2 3.9Å
588	T	96.4	Very high	93	Very high	50 Å²	50	46.6 Å²	46.6	31%	0.307	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.3	169.4	-58.4	0	0	0	0	108.1	E467 N468 I601 W602	E467-T588 CarbonylContact O-C 3.55Å; E467-T588 WeakPolarHBondContact O-CA 3.19Å; N468-T588 WeakPolarHBondContact OD1-CB 3.06Å; N468-T588 VanDerWaalsContact OD1-CG2 3.28Å; N468-T588 WeakPolarHBondContact OD1-CG2 3.44Å; N468-T588 PolarHBondContact OD1-OG1 3.38Å; T588-I601 CarbonylContact O-C 3.58Å; T588-I601 WeakPolarHBondContact O-CA 3.09Å; T588-W602 PolarHBondContact N-O 2.97Å; T588-W602 PolarHBondContact O-N 2.96Å
589	A	95.8	Very high	93	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	144.8	171.6	0	0	0	0	0	110	Y465 S466 E467 L535 Y599 I601	Y465-A589 HydrophobicContact CE1-CB 4.23Å; S466-A589 WeakPolarHBondContact CA-O 3.34Å; E467-A589 PolarHBondContact N-O 2.68Å; E467-A589 PolarHBondContact O-N 3.43Å; L535-A589 HydrophobicContact CD2-CB 4.1Å; A589-Y599 HydrophobicContact CB-CE2 4.14Å; A589-I601 HydrophobicContact CB-CG2 4Å
590	G	94.2	Very high	92.9	Very high	5 Å²	5	45.6 Å²	45.6	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	161.3	179.2	0	0	0	0	0	113	Y465 D600	Y465-G590 WeakPolarHBondContact O-CA 3.27Å; G590-D600 PolarHBondContact N-O 3.2Å; G590-D600 PolarHBondContact O-N 3.47Å
591	V	93.7	Very high	92.9	Very high	26 Å²	26	45.7 Å²	45.7	16%	0.158	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.1	173.1	178.3	0	0	0	0	109	I451 V455 L459 Y465 L597 Y598 Y599	I451-V591 HydrophobicContact CD1-CG1 4.44Å; V455-V591 HydrophobicContact CG1-CG2 3.58Å; L459-V591 HydrophobicContact CD1-CG2 4.24Å; Y465-V591 HydrophobicContact CD1-CG2 4.15Å; Y465-V591 HydrophobicContact CG-CG2 4.48Å; Y465-V591 PolarHBondContact O-N 2.76Å; V591-L597 HydrophobicContact CG1-CB 4.23Å; V591-L597 HydrophobicContact CG1-CD2 3.8Å; V591-Y598 WeakPolarHBondContact CA-O 3.43Å; V591-Y599 HydrophobicContact CG2-CD2 3.94Å
592	I	91	Very high	92.8	Very high	98 Å²	98	50.3 Å²	50.3	50%	0.503	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	145.4	176.9	-64	-175.8	0	0	0	109.9	Y598 W602	I592-Y598 PolarHBondContact N-O 3.02Å; I592-Y598 PolarHBondContact O-N 3.46Å; I592-W602 HydrophobicContact CD1-CH2 3.37Å; I592-W602 HydrophobicContact CD1-CZ2 3.23Å; I592-W602 HydrophobicContact CD1-CZ3 4.41Å; I592-W602 HydrophobicContact CG1-CH2 3.6Å; I592-W602 HydrophobicContact CG1-CZ2 3.99Å
593	G	87.1	Confident	92.6	Very high	43 Å²	43	51.7 Å²	51.7	44%	0.443	29%	0.289	S	S	.	.			trans	97.7	166.4	176.3	0	0	0	0	0	112.9	L597	G593-L597 VanDerWaalsContact O-CD2 3.31Å; G593-L597 WeakPolarHBondContact O-CD2 3.18Å
594	T	82.7	Confident	92.4	Very high	133 Å²	133	57.4 Å²	57.4	82%	0.816	32%	0.319	S	S	*	.	S	Bend	trans	-124.6	-35.8	177	52.3	0	0	0	0	111.6
595	T	82.8	Confident	92.4	Very high	133 Å²	133	57.4 Å²	57.4	82%	0.816	32%	0.32	S	S	*	.	S	Bend	trans	-98.9	-40.9	177.9	53.6	0	0	0	0	112.6
596	K	86.1	Confident	92.4	Very high	183 Å²	183	57.8 Å²	57.8	80%	0.796	32%	0.321	S	S	*	.	S	Bend	trans	-114.5	90.3	171.9	-65.3	-175	-179.7	-176.8	0	107.5
597	L	88	Confident	92.3	Very high	70 Å²	70	58.8 Å²	58.8	37%	0.366	32%	0.322	S	S	.	.			trans	-68.5	135.4	178.6	-64.7	166.8	0	0	0	109.3	I451 V591 G593	I451-L597 HydrophobicContact CD1-CB 3.99Å; I451-L597 HydrophobicContact CD1-CD1 3.94Å; V591-L597 HydrophobicContact CG1-CB 4.23Å; V591-L597 HydrophobicContact CG1-CD2 3.8Å; G593-L597 VanDerWaalsContact O-CD2 3.31Å; G593-L597 WeakPolarHBondContact O-CD2 3.18Å
598	Y	88.4	Confident	92.2	Very high	95 Å²	95	59.9 Å²	59.9	37%	0.373	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	115.1	179.1	-172.9	-111.8	0	0	0	109.6	K523 V591 I592 D600	K523-Y598 WeakPolarHBondContact CB-OH 3.45Å; K523-Y598 WeakPolarHBondContact CD-OH 3.46Å; K523-Y598 WeakPolarHBondContact CE-OH 3.48Å; K523-Y598 PolarHBondContact NZ-OH 3.41Å; V591-Y598 WeakPolarHBondContact CA-O 3.43Å; I592-Y598 PolarHBondContact N-O 3.02Å; I592-Y598 PolarHBondContact O-N 3.46Å; Y598-D600 HydrophobicContact CD1-CB 3.82Å; Y598-D600 HydrophobicContact CE1-CB 3.52Å
599	Y	94.3	Very high	92.2	Very high	8 Å²	8	57.5 Å²	57.5	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.2	171.8	176.9	-101.3	0	0	0	109.8	P452 V455 Y465 I522 L535 A589 V591	P452-Y599 HydrophobicContact CG-CD1 3.7Å; P452-Y599 HydrophobicContact CG-CE1 3.69Å; P452-Y599 HydrophobicContact CG-CG 4.14Å; V455-Y599 HydrophobicContact CG1-CD2 4.44Å; V455-Y599 HydrophobicContact CG2-CD2 4.03Å; V455-Y599 HydrophobicContact CG2-CE2 3.68Å; Y465-Y599 HydrophobicContact CE1-CE2 4.01Å; I522-Y599 HydrophobicContact CD1-CE1 3.95Å; L535-Y599 HydrophobicContact CD1-CE1 4.29Å; L535-Y599 WeakPolarHBondContact CD1-OH 3.32Å; A589-Y599 HydrophobicContact CB-CE2 4.14Å; V591-Y599 HydrophobicContact CG2-CD2 3.94Å
600	D	95.6	Very high	92.1	Very high	14 Å²	14	59.8 Å²	59.8	8%	0.075	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	167.2	-179.2	-166.8	20.6	0	0	0	111.6	I522 K523 G590 Y598 W602	I522-D600 WeakPolarHBondContact CG2-OD1 3.44Å; K523-D600 WeakPolarHBondContact CE-OD1 3.34Å; K523-D600 IonicContact NZ-OD1 2.73Å; K523-D600 PolarHBondContact NZ-OD1 3.34Å; K523-D600 IonicContact NZ-OD2 3.32Å; K523-D600 PolarHBondContact NZ-OD2 2.96Å; G590-D600 PolarHBondContact N-O 3.2Å; G590-D600 PolarHBondContact O-N 3.47Å; Y598-D600 HydrophobicContact CD1-CB 3.82Å; Y598-D600 HydrophobicContact CE1-CB 3.52Å; D600-W602 HydrophobicContact CB-CH2 3.53Å; D600-W602 HydrophobicContact CB-CZ2 3.5Å; D600-W602 HydrophobicContact CB-CZ3 4.22Å; D600-W602 VanDerWaalsContact O-CZ3 3.28Å; D600-W602 WeakPolarHBondContact O-CZ3 3.39Å
601	I	96.7	Very high	92.1	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.4	179.3	60.7	171.5	0	0	0	110.7	V474 I522 M530 A532 L535 T588 A589 V606	V474-I601 HydrophobicContact CG1-CD1 4.4Å; V474-I601 HydrophobicContact CG2-CD1 3.92Å; I522-I601 HydrophobicContact CD1-CD1 4.29Å; I522-I601 HydrophobicContact CD1-CG1 4.44Å; I522-I601 HydrophobicContact CD1-CG2 4.29Å; I522-I601 HydrophobicContact CG1-CD1 4.11Å; I522-I601 HydrophobicContact CG1-CG1 4.32Å; I522-I601 HydrophobicContact CG2-CG1 4.34Å; M530-I601 HydrophobicContact CE-CD1 3.74Å; M530-I601 HydrophobicContact CE-CG1 3.54Å; A532-I601 HydrophobicContact CB-CD1 3.7Å; L535-I601 HydrophobicContact CD1-CG2 4.24Å; L535-I601 HydrophobicContact CD2-CG2 3.75Å; T588-I601 CarbonylContact O-C 3.58Å; T588-I601 WeakPolarHBondContact O-CA 3.09Å; A589-I601 HydrophobicContact CB-CG2 4Å; I601-V606 HydrophobicContact CD1-CG2 3.99Å; I601-V606 HydrophobicContact CG1-CG2 3.93Å
602	W	95.4	Very high	92.1	Very high	96 Å²	96	63.9 Å²	63.9	36%	0.364	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	157.2	179.3	-60.1	-84.2	0	0	0	111.4	V587 T588 I592 D600	V587-W602 CarbonylContact C-O 3.42Å; V587-W602 WeakPolarHBondContact CA-O 3.27Å; T588-W602 PolarHBondContact N-O 2.97Å; T588-W602 PolarHBondContact O-N 2.96Å; I592-W602 HydrophobicContact CD1-CH2 3.37Å; I592-W602 HydrophobicContact CD1-CZ2 3.23Å; I592-W602 HydrophobicContact CD1-CZ3 4.41Å; I592-W602 HydrophobicContact CG1-CH2 3.6Å; I592-W602 HydrophobicContact CG1-CZ2 3.99Å; D600-W602 HydrophobicContact CB-CH2 3.53Å; D600-W602 HydrophobicContact CB-CZ2 3.5Å; D600-W602 HydrophobicContact CB-CZ3 4.22Å; D600-W602 VanDerWaalsContact O-CZ3 3.28Å; D600-W602 WeakPolarHBondContact O-CZ3 3.39Å
603	G	94	Very high	92.2	Very high	29 Å²	29	61.5 Å²	61.5	30%	0.299	33%	0.325	S	S	.	.	S	Bend	trans	141.7	164.5	175.8	0	0	0	0	0	112	T605 V606 N607	G603-T605 PolarHBondContact O-N 3.07Å; G603-V606 WeakPolarHBondContact O-CB 3.43Å; G603-V606 PolarHBondContact O-N 3.31Å; G603-N607 PolarHBondContact O-N 3.46Å
604	D	93.5	Very high	92.5	Very high	123 Å²	123	62.2 Å²	62.2	66%	0.658	32%	0.323	S	S	*	.	H	α-helix	trans	-60.9	-29.8	178.9	-67.4	-32	0	0	0	112	V606 N607 I608	D604-V606 VanDerWaalsContact C-N 3.3Å; D604-V606 PolarHBondContact O-N 3.21Å; D604-N607 PolarHBondContact O-N 3.42Å; D604-I608 WeakPolarHBondContact O-CB 3.48Å; D604-I608 VanDerWaalsContact O-CG1 3.27Å; D604-I608 WeakPolarHBondContact O-CG1 3.41Å; D604-I608 PolarHBondContact O-N 3.49Å
605	T	95.5	Very high	93	Very high	7 Å²	7	58 Å²	58	4%	0.043	30%	0.297	C	S	.	.	H	α-helix	trans	-55.4	-44.2	173.7	-54.2	0	0	0	0	112.3	V474 N583 G585 P586 V587 G603 S609	V474-T605 HydrophobicContact CG2-CG2 4.14Å; N583-T605 WeakPolarHBondContact ND2-CA 3.29Å; N583-T605 PolarHBondContact ND2-O 3.5Å; G585-T605 VanDerWaalsContact CA-OG1 3.27Å; G585-T605 WeakPolarHBondContact CA-OG1 3.4Å; P586-T605 WeakPolarHBondContact CD-OG1 3.37Å; P586-T605 VanDerWaalsContact O-CB 3.31Å; P586-T605 WeakPolarHBondContact O-CB 3.43Å; P586-T605 PolarHBondContact O-OG1 3.32Å; V587-T605 HydrophobicContact CG1-CG2 4.15Å; G603-T605 PolarHBondContact O-N 3.07Å; T605-S609 WeakPolarHBondContact O-CB 3.5Å; T605-S609 PolarHBondContact O-N 3.06Å
606	V	95.9	Very high	93.4	Very high	14 Å²	14	51.9 Å²	51.9	9%	0.085	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-43.9	179	-178.2	0	0	0	0	110.2	V474 F476 M530 V587 I601 G603 D604 S609 S610	V474-V606 HydrophobicContact CG2-CG2 4.29Å; F476-V606 HydrophobicContact CE2-CG1 3.95Å; F476-V606 HydrophobicContact CZ-CG1 3.89Å; M530-V606 HydrophobicContact CE-CG1 3.68Å; V587-V606 HydrophobicContact CG1-CG2 3.9Å; I601-V606 HydrophobicContact CD1-CG2 3.99Å; I601-V606 HydrophobicContact CG1-CG2 3.93Å; G603-V606 WeakPolarHBondContact O-CB 3.43Å; G603-V606 PolarHBondContact O-N 3.31Å; D604-V606 VanDerWaalsContact C-N 3.3Å; D604-V606 PolarHBondContact O-N 3.21Å; V606-S609 WeakPolarHBondContact O-CB 3.41Å; V606-S609 PolarHBondContact O-N 3.47Å; V606-S610 PolarHBondContact O-N 3.33Å
607	N	94.6	Very high	93.8	Very high	102 Å²	102	45.7 Å²	45.7	55%	0.545	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-47.3	177.5	-72.3	-28.4	0	0	0	111.6	G603 D604 S610 R611	G603-N607 PolarHBondContact O-N 3.46Å; D604-N607 PolarHBondContact O-N 3.42Å; N607-S610 PolarHBondContact O-N 3.35Å; N607-R611 VanDerWaalsContact O-CG 3.29Å; N607-R611 WeakPolarHBondContact O-CG 3.36Å; N607-R611 PolarHBondContact O-N 2.98Å
608	I	94.6	Very high	94.2	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.138	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-42.8	176.6	-66.6	162.8	0	0	0	110.1	N583 D604 S610 R611 M612 V648 M652	N583-I608 HydrophobicContact CB-CG2 4.4Å; N583-I608 WeakPolarHBondContact ND2-CB 3.4Å; N583-I608 WeakPolarHBondContact ND2-CG2 3.4Å; D604-I608 WeakPolarHBondContact O-CB 3.48Å; D604-I608 VanDerWaalsContact O-CG1 3.27Å; D604-I608 WeakPolarHBondContact O-CG1 3.41Å; D604-I608 PolarHBondContact O-N 3.49Å; I608-S610 VanDerWaalsContact C-N 3.35Å; I608-S610 PolarHBondContact O-N 3.5Å; I608-R611 CarbonylContact O-C 3.55Å; I608-R611 WeakPolarHBondContact O-CA 3.39Å; I608-R611 WeakPolarHBondContact O-CB 3.27Å; I608-R611 PolarHBondContact O-N 3.04Å; I608-R611 VanDerWaalsContact O-N 3.1Å; I608-M612 HydrophobicContact CG2-CE 4.44Å; I608-M612 HydrophobicContact CG2-CG 4.46Å; I608-M612 WeakPolarHBondContact O-CG 3.31Å; I608-M612 PolarHBondContact O-N 3.45Å; I608-V648 HydrophobicContact CD1-CG2 4.42Å; I608-M652 HydrophobicContact CD1-CE 4.21Å; I608-M652 HydrophobicContact CG2-CE 4.1Å; I608-M652 HydrophobicContact CG2-SD 4.18Å
609	S	95.4	Very high	94.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-42.8	176.8	-160.2	0	0	0	0	112.5	V474 G581 T605 V606 R611 M612 Y613	V474-S609 PolarHBondContact O-OG 2.93Å; G581-S609 PolarHBondContact O-OG 2.91Å; T605-S609 WeakPolarHBondContact O-CB 3.5Å; T605-S609 PolarHBondContact O-N 3.06Å; V606-S609 WeakPolarHBondContact O-CB 3.41Å; V606-S609 PolarHBondContact O-N 3.47Å; S609-R611 VanDerWaalsContact C-N 3.29Å; S609-R611 PolarHBondContact O-N 3.43Å; S609-M612 WeakPolarHBondContact O-CB 3.5Å; S609-M612 PolarHBondContact O-N 2.94Å; S609-Y613 PolarHBondContact O-N 3.44Å
610	S	94.7	Very high	94.5	Very high	47 Å²	47	47.9 Å²	47.9	33%	0.329	25%	0.254	S	S	.	.	H	α-helix	trans	-61.4	-39.5	174.8	-178.6	0	0	0	0	111.3	V606 N607 I608 Y613 S614	V606-S610 PolarHBondContact O-N 3.33Å; N607-S610 PolarHBondContact O-N 3.35Å; I608-S610 VanDerWaalsContact C-N 3.35Å; I608-S610 PolarHBondContact O-N 3.5Å; S610-Y613 PolarHBondContact O-N 3.15Å; S610-S614 PolarHBondContact O-N 2.93Å
611	R	93.9	Very high	94.6	Very high	118 Å²	118	47.3 Å²	47.3	45%	0.445	25%	0.251	S	S	.	.	H	α-helix	trans	-66.5	-38.1	174.8	-65.3	-68.5	178.5	-160	-4.9	112.7	N607 I608 S609 Y613 S614 T615 I645	N607-R611 VanDerWaalsContact O-CG 3.29Å; N607-R611 WeakPolarHBondContact O-CG 3.36Å; N607-R611 PolarHBondContact O-N 2.98Å; I608-R611 CarbonylContact O-C 3.55Å; I608-R611 WeakPolarHBondContact O-CA 3.39Å; I608-R611 WeakPolarHBondContact O-CB 3.27Å; I608-R611 PolarHBondContact O-N 3.04Å; I608-R611 VanDerWaalsContact O-N 3.1Å; S609-R611 VanDerWaalsContact C-N 3.29Å; S609-R611 PolarHBondContact O-N 3.43Å; R611-Y613 VanDerWaalsContact C-N 3.3Å; R611-Y613 PolarHBondContact O-N 3.24Å; R611-S614 WeakPolarHBondContact CA-OG 3.38Å; R611-S614 PolarHBondContact O-N 3.32Å; R611-S614 PolarHBondContact O-OG 3.13Å; R611-T615 PolarHBondContact O-N 3.47Å; R611-T615 PolarHBondContact O-OG1 3.46Å; R611-I645 HydrophobicContact CB-CG2 4.14Å; R611-I645 HydrophobicContact CG-CG2 4.03Å
612	M	94.7	Very high	94.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.8	-41.4	175.3	-68.6	-56.8	94.1	0	0	111.9	I608 S609 G616 Q622 I645 V654	I608-M612 HydrophobicContact CG2-CE 4.44Å; I608-M612 HydrophobicContact CG2-CG 4.46Å; I608-M612 WeakPolarHBondContact O-CG 3.31Å; I608-M612 PolarHBondContact O-N 3.45Å; S609-M612 WeakPolarHBondContact O-CB 3.5Å; S609-M612 PolarHBondContact O-N 2.94Å; M612-G616 WeakPolarHBondContact O-CA 3.25Å; M612-G616 PolarHBondContact O-N 3.07Å; M612-G616 VanDerWaalsContact O-N 3.1Å; M612-Q622 HydrophobicContact CB-CG 4.4Å; M612-Q622 PolarHBondContact O-NE2 3.41Å; M612-Q622 HydrophobicContact SD-CG 4.02Å; M612-Q622 PolarHBondContact SD-NE2 3.41Å; M612-Q622 VanDerWaalsContact SD-NE2 3.39Å; M612-I645 HydrophobicContact CE-CD1 3.3Å; M612-I645 HydrophobicContact CE-CG1 4.24Å; M612-V654 HydrophobicContact CE-CG1 3.66Å; M612-V654 HydrophobicContact SD-CB 4.41Å; M612-V654 HydrophobicContact SD-CG1 3.62Å
613	Y	93	Very high	94.7	Very high	48 Å²	48	42.6 Å²	42.6	19%	0.188	23%	0.233	C	C	.	.	H	α-helix	trans	-69.2	-48.6	174.7	150.6	-115.5	0	0	0	111.2	F476 S478 T528 K579 S609 S610 R611 T615 G616	F476-Y613 HydrophobicContact CB-CD1 4.33Å; F476-Y613 HydrophobicContact CB-CG 4.26Å; S478-Y613 WeakPolarHBondContact CB-OH 3.4Å; S478-Y613 PolarHBondContact OG-OH 3.39Å; T528-Y613 HydrophobicContact CG2-CD1 4.39Å; T528-Y613 HydrophobicContact CG2-CE1 4.27Å; K579-Y613 HydrophobicContact CB-CD2 3.61Å; K579-Y613 HydrophobicContact CB-CE2 3.78Å; K579-Y613 HydrophobicContact CD-CE2 4.31Å; K579-Y613 WeakPolarHBondContact O-CD2 3.41Å; S609-Y613 PolarHBondContact O-N 3.44Å; S610-Y613 PolarHBondContact O-N 3.15Å; R611-Y613 VanDerWaalsContact C-N 3.3Å; R611-Y613 PolarHBondContact O-N 3.24Å; Y613-T615 VanDerWaalsContact C-N 3.28Å; Y613-T615 PolarHBondContact O-N 2.99Å; Y613-G616 WeakPolarHBondContact O-CA 3.34Å; Y613-G616 PolarHBondContact O-N 3.21Å
614	S	92.8	Very high	94.8	Very high	58 Å²	58	41.2 Å²	41.2	41%	0.406	22%	0.219	S	C	.	.	H	α-helix	trans	-61.4	-35.8	-175.2	70.4	0	0	0	0	113.3	S610 R611 G616	S610-S614 PolarHBondContact O-N 2.93Å; R611-S614 WeakPolarHBondContact CA-OG 3.38Å; R611-S614 PolarHBondContact O-N 3.32Å; R611-S614 PolarHBondContact O-OG 3.13Å; S614-G616 VanDerWaalsContact C-N 3.35Å
615	T	93	Very high	94.8	Very high	45 Å²	45	41.5 Å²	41.5	28%	0.276	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-2.9	176.1	59.6	0	0	0	0	112.4	R611 Y613 Q622 R640 I643	R611-T615 PolarHBondContact O-N 3.47Å; R611-T615 PolarHBondContact O-OG1 3.46Å; Y613-T615 VanDerWaalsContact C-N 3.28Å; Y613-T615 PolarHBondContact O-N 2.99Å; T615-Q622 PolarHBondContact OG1-NE2 2.98Å; T615-Q622 VanDerWaalsContact OG1-NE2 3.07Å; T615-R640 PolarHBondContact O-NH1 3.33Å; T615-R640 PolarHBondContact O-NH2 3.05Å; T615-I643 HydrophobicContact CG2-CG2 4.2Å
616	G	92.1	Very high	94.7	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.031	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-56.1	150.1	-175.6	0	0	0	0	0	115.7	K579 M612 Y613 S614 Q622 R640	K579-G616 WeakPolarHBondContact CD-O 3.35Å; K579-G616 WeakPolarHBondContact CE-O 3.31Å; K579-G616 PolarHBondContact NZ-O 2.82Å; M612-G616 WeakPolarHBondContact O-CA 3.25Å; M612-G616 PolarHBondContact O-N 3.07Å; M612-G616 VanDerWaalsContact O-N 3.1Å; Y613-G616 WeakPolarHBondContact O-CA 3.34Å; Y613-G616 PolarHBondContact O-N 3.21Å; S614-G616 VanDerWaalsContact C-N 3.35Å; G616-Q622 VanDerWaalsContact CA-OE1 3.25Å; G616-R640 VanDerWaalsContact C-NH1 3.29Å
617	V	94.2	Very high	94.6	Very high	53 Å²	53	45.9 Å²	45.9	32%	0.321	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-81.3	135.1	169.4	-176.5	0	0	0	0	108.9	K579 G619 R620 L656	K579-V617 WeakPolarHBondContact CG-O 3.39Å; V617-G619 PolarHBondContact O-N 3.11Å; V617-R620 HydrophobicContact CB-CB 4.23Å; V617-R620 HydrophobicContact CB-CG 4.25Å; V617-R620 HydrophobicContact CG1-CG 4.13Å; V617-R620 PolarHBondContact O-N 3.35Å; V617-L656 HydrophobicContact CB-CD1 4.39Å; V617-L656 HydrophobicContact CB-CD2 4.32Å; V617-L656 HydrophobicContact CG2-CD1 3.78Å; V617-L656 HydrophobicContact CG2-CD2 4.08Å
618	K	95.1	Very high	94.6	Very high	108 Å²	108	42.6 Å²	42.6	47%	0.47	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	132.2	176	-68	-170.4	-174.8	-169.9	0	110.5	V480 I577 K579 R620	V480-K618 HydrophobicContact CG1-CD 4.31Å; V480-K618 HydrophobicContact CG1-CG 4.27Å; V480-K618 HydrophobicContact CG2-CG 4.38Å; I577-K618 HydrophobicContact CG2-CB 3.8Å; I577-K618 HydrophobicContact CG2-CG 4.43Å; K579-K618 VanDerWaalsContact CE-CG 3.43Å; K618-R620 VanDerWaalsContact C-N 3.28Å; K618-R620 PolarHBondContact O-N 3.32Å
619	G	93.9	Very high	94.6	Very high	35 Å²	35	45.3 Å²	45.3	36%	0.361	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	5.5	178	0	0	0	0	0	115.5	Q561 M578 V617	Q561-G619 PolarHBondContact NE2-O 3.41Å; M578-G619 VanDerWaalsContact O-CA 3.25Å; M578-G619 WeakPolarHBondContact O-CA 3.35Å; M578-G619 PolarHBondContact O-N 3.06Å; V617-G619 PolarHBondContact O-N 3.11Å
620	R	95.8	Very high	94.5	Very high	76 Å²	76	50.6 Å²	50.6	29%	0.287	25%	0.245	S	C	.	.	S	Bend	trans	-126	154	-175.2	-54.1	-65.3	-66.9	-80	-5.6	111.4	I580 V617 K618 E638 L656 L657	I580-R620 PolarHBondContact N-O 3.02Å; V617-R620 HydrophobicContact CB-CB 4.23Å; V617-R620 HydrophobicContact CB-CG 4.25Å; V617-R620 HydrophobicContact CG1-CG 4.13Å; V617-R620 PolarHBondContact O-N 3.35Å; K618-R620 VanDerWaalsContact C-N 3.28Å; K618-R620 PolarHBondContact O-N 3.32Å; R620-E638 IonicContact CZ-OE1 2.71Å; R620-E638 VanDerWaalsContact CZ-OE1 3.24Å; R620-E638 IonicContact NH1-OE1 3.93Å; R620-E638 PolarHBondContact NH1-OE1 3.06Å; R620-E638 VanDerWaalsContact NH1-OE1 3.07Å; R620-E638 IonicContact NH2-OE1 3.14Å; R620-E638 PolarHBondContact NH2-OE1 3.43Å; R620-E638 IonicContact NH2-OE2 2.84Å; R620-L656 HydrophobicContact CB-CD2 4.13Å; R620-L657 PolarHBondContact NH2-O 2.97Å
621	I	97.3	Very high	94.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.8	171.4	-63	157.8	0	0	0	108.4	M554 A557 L558 I580 V623 L656 L657	M554-I621 HydrophobicContact CE-CG2 4.44Å; M554-I621 HydrophobicContact SD-CD1 4.49Å; M554-I621 HydrophobicContact SD-CG2 4.2Å; A557-I621 HydrophobicContact CB-CD1 3.89Å; A557-I621 HydrophobicContact CB-CG1 4.45Å; L558-I621 HydrophobicContact CD2-CD1 3.88Å; L558-I621 HydrophobicContact CG-CD1 4.26Å; I580-I621 HydrophobicContact CB-CB 4.34Å; I580-I621 HydrophobicContact CB-CG1 3.81Å; I580-I621 HydrophobicContact CB-CG2 4.4Å; I580-I621 HydrophobicContact CD1-CD1 4.42Å; I580-I621 HydrophobicContact CD1-CG1 3.89Å; I580-I621 HydrophobicContact CG1-CG1 4.27Å; I580-I621 HydrophobicContact CG2-CG1 4.15Å; I580-I621 HydrophobicContact CG2-CG2 4.17Å; I621-V623 HydrophobicContact CG2-CG1 3.99Å; I621-L656 WeakPolarHBondContact O-CA 3.11Å; I621-L657 HydrophobicContact CB-CB 3.99Å; I621-L657 HydrophobicContact CB-CD2 4.38Å; I621-L657 HydrophobicContact CD1-CD2 3.61Å; I621-L657 HydrophobicContact CG2-CB 4.44Å; I621-L657 PolarHBondContact O-N 2.97Å
622	Q	97.5	Very high	94.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.3	172.6	-177.8	171.8	-46.8	0	0	110.4	I580 G581 Y582 M612 T615 G616 V654 F655 L656	I580-Q622 PolarHBondContact O-N 3.33Å; G581-Q622 WeakPolarHBondContact CA-O 3.32Å; Y582-Q622 PolarHBondContact N-O 3.35Å; M612-Q622 HydrophobicContact CB-CG 4.4Å; M612-Q622 PolarHBondContact O-NE2 3.41Å; M612-Q622 HydrophobicContact SD-CG 4.02Å; M612-Q622 PolarHBondContact SD-NE2 3.41Å; M612-Q622 VanDerWaalsContact SD-NE2 3.39Å; T615-Q622 PolarHBondContact OG1-NE2 2.98Å; T615-Q622 VanDerWaalsContact OG1-NE2 3.07Å; G616-Q622 VanDerWaalsContact CA-OE1 3.25Å; Q622-V654 HydrophobicContact CG-CB 4.26Å; Q622-F655 CarbonylContact C-O 3.38Å; Q622-F655 WeakPolarHBondContact CA-O 3.36Å; Q622-L656 HydrophobicContact CB-CD2 3.89Å; Q622-L656 HydrophobicContact CG-CD2 4.32Å
623	V	96.9	Very high	94.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	149	-179	-49	0	0	0	0	110.9	M554 Y582 I621 A627 K628 F637 F655	M554-V623 HydrophobicContact CE-CG1 3.81Å; Y582-V623 HydrophobicContact CD1-CG1 4.44Å; Y582-V623 WeakPolarHBondContact O-CA 3.49Å; I621-V623 HydrophobicContact CG2-CG1 3.99Å; V623-A627 HydrophobicContact CB-CB 4.1Å; V623-K628 HydrophobicContact CG2-CB 4.15Å; V623-F637 HydrophobicContact CB-CE1 4.27Å; V623-F637 HydrophobicContact CG1-CD1 4.39Å; V623-F637 HydrophobicContact CG1-CE1 3.75Å; V623-F637 HydrophobicContact CG2-CD1 3.55Å; V623-F637 HydrophobicContact CG2-CE1 3.56Å; V623-F637 HydrophobicContact CG2-CG 4.43Å; V623-F637 HydrophobicContact CG2-CZ 4.42Å; V623-F655 HydrophobicContact CG2-CB 3.72Å; V623-F655 PolarHBondContact N-O 3.29Å; V623-F655 PolarHBondContact O-N 3.49Å
624	S	95.4	Very high	94	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	162.3	170	70.3	0	0	0	0	111.8	Y582 N583 Q626 A627 K628	Y582-S624 PolarHBondContact O-N 3.43Å; N583-S624 WeakPolarHBondContact OD1-CB 3.22Å; N583-S624 PolarHBondContact OD1-OG 2.88Å; S624-Q626 VanDerWaalsContact C-N 3.29Å; S624-Q626 PolarHBondContact O-N 2.99Å; S624-A627 PolarHBondContact O-N 3.38Å; S624-A627 VanDerWaalsContact O-N 3.15Å; S624-A627 WeakPolarHBondContact OG-CB 3.41Å; S624-A627 PolarHBondContact OG-N 2.89Å; S624-K628 PolarHBondContact O-N 2.93Å
625	R	94.2	Very high	94.1	Very high	129 Å²	129	45.3 Å²	45.3	49%	0.487	22%	0.224	S	C	.	.	H	α-helix	trans	-53.3	-44.8	171.8	-174.7	169.7	179.6	167.3	-6.3	113	A627 K628 D629 D653 F655	R625-A627 VanDerWaalsContact C-N 3.31Å; R625-A627 PolarHBondContact O-N 2.93Å; R625-K628 WeakPolarHBondContact O-CB 3.37Å; R625-K628 PolarHBondContact O-N 3.5Å; R625-D629 VanDerWaalsContact O-CG 3.26Å; R625-D629 PolarHBondContact O-N 3.16Å; R625-D653 IonicContact CZ-OD2 3.67Å; R625-D653 PolarHBondContact N-O 3.48Å; R625-D653 IonicContact NH1-OD2 2.74Å; R625-D653 PolarHBondContact NH1-OD2 3.21Å; R625-F655 HydrophobicContact CB-CE2 3.9Å; R625-F655 HydrophobicContact CG-CE2 4.05Å
626	Q	92.9	Very high	94.1	Very high	112 Å²	112	45.2 Å²	45.2	52%	0.523	22%	0.222	S	C	.	.	H	α-helix	trans	-62	-39.6	178.8	-64.7	-176.6	13.4	0	0	112	I584 S624 R630	I584-Q626 PolarHBondContact O-OE1 3.39Å; S624-Q626 VanDerWaalsContact C-N 3.29Å; S624-Q626 PolarHBondContact O-N 2.99Å; Q626-R630 WeakPolarHBondContact O-CG 3.45Å; Q626-R630 PolarHBondContact O-N 3.39Å
627	A	94.9	Very high	94.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.1	-43.8	176.2	0	0	0	0	0	111.9	Y582 I584 V623 S624 R625 D629 R630 L631	Y582-A627 HydrophobicContact CD1-CB 3.75Å; Y582-A627 HydrophobicContact CE1-CB 3.91Å; I584-A627 HydrophobicContact CD1-CB 3.9Å; I584-A627 HydrophobicContact CG1-CB 3.86Å; V623-A627 HydrophobicContact CB-CB 4.1Å; S624-A627 PolarHBondContact O-N 3.38Å; S624-A627 VanDerWaalsContact O-N 3.15Å; S624-A627 WeakPolarHBondContact OG-CB 3.41Å; S624-A627 PolarHBondContact OG-N 2.89Å; R625-A627 VanDerWaalsContact C-N 3.31Å; R625-A627 PolarHBondContact O-N 2.93Å; A627-D629 PolarHBondContact O-N 3.03Å; A627-R630 PolarHBondContact O-N 3.09Å; A627-L631 VanDerWaalsContact O-CB 3.31Å; A627-L631 WeakPolarHBondContact O-CB 3.4Å; A627-L631 WeakPolarHBondContact O-CG 3.37Å; A627-L631 PolarHBondContact O-N 3.23Å
628	K	94.8	Very high	94.4	Very high	33 Å²	33	47.4 Å²	47.4	14%	0.143	23%	0.227	C	C	.	.	H	α-helix	trans	-55.1	-50.7	174.9	178.1	-89.9	178.6	-167.7	0	111	V623 S624 R625 R630 L631 E632 F637 F655	V623-K628 HydrophobicContact CG2-CB 4.15Å; S624-K628 PolarHBondContact O-N 2.93Å; R625-K628 WeakPolarHBondContact O-CB 3.37Å; R625-K628 PolarHBondContact O-N 3.5Å; K628-R630 PolarHBondContact O-N 3.41Å; K628-R630 VanDerWaalsContact O-N 3.17Å; K628-L631 PolarHBondContact O-N 3.02Å; K628-L631 VanDerWaalsContact O-N 3.15Å; K628-E632 WeakPolarHBondContact CE-OE1 3.48Å; K628-E632 IonicContact NZ-OE1 2.63Å; K628-E632 PolarHBondContact NZ-OE1 3.11Å; K628-E632 IonicContact NZ-OE2 3.13Å; K628-E632 PolarHBondContact NZ-OE2 3.41Å; K628-E632 VanDerWaalsContact O-CB 3.27Å; K628-E632 WeakPolarHBondContact O-CB 3.48Å; K628-E632 PolarHBondContact O-N 3.36Å; K628-F637 HydrophobicContact CB-CD2 4.34Å; K628-F637 HydrophobicContact CB-CG 4.43Å; K628-F637 HydrophobicContact CG-CB 3.97Å; K628-F637 HydrophobicContact CG-CD2 3.75Å; K628-F637 HydrophobicContact CG-CE2 4.44Å; K628-F637 HydrophobicContact CG-CG 3.9Å; K628-F655 HydrophobicContact CB-CB 4.49Å; K628-F655 HydrophobicContact CB-CD2 3.98Å; K628-F655 HydrophobicContact CB-CE2 4.45Å; K628-F655 HydrophobicContact CB-CG 4.17Å; K628-F655 HydrophobicContact CD-CE1 4.48Å; K628-F655 HydrophobicContact CD-CZ 4.5Å; K628-F655 HydrophobicContact CG-CD1 4.15Å; K628-F655 HydrophobicContact CG-CD2 4.2Å; K628-F655 HydrophobicContact CG-CE1 4.45Å; K628-F655 HydrophobicContact CG-CG 4.03Å
629	D	94.1	Very high	94.4	Very high	85 Å²	85	47.9 Å²	47.9	46%	0.455	23%	0.229	S	C	.	.	H	α-helix	trans	-61.7	-28.7	-175.6	-66.2	-20.3	0	0	0	112.6	R625 A627	R625-D629 VanDerWaalsContact O-CG 3.26Å; R625-D629 PolarHBondContact O-N 3.16Å; A627-D629 PolarHBondContact O-N 3.03Å
630	R	92.7	Very high	94.3	Very high	111 Å²	111	50.2 Å²	50.2	42%	0.419	23%	0.227	S	C	.	.	H	α-helix	trans	-86.7	-29.1	178	-63.2	-63.1	-178.1	165.7	-0.8	113.7	Y547 L550 Y551 I584 Q626 A627 K628	Y547-R630 PolarHBondContact OH-NH1 3.42Å; Y547-R630 VanDerWaalsContact OH-NH1 3.15Å; L550-R630 HydrophobicContact CD1-CB 4.4Å; Y551-R630 PolarHBondContact OH-O 3.35Å; I584-R630 HydrophobicContact CD1-CB 4.1Å; Q626-R630 WeakPolarHBondContact O-CG 3.45Å; Q626-R630 PolarHBondContact O-N 3.39Å; A627-R630 PolarHBondContact O-N 3.09Å; K628-R630 PolarHBondContact O-N 3.41Å; K628-R630 VanDerWaalsContact O-N 3.17Å
631	L	93.6	Very high	94.1	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-100.9	-9.3	-173.7	-67.3	179.4	0	0	0	113.5	L550 Y551 M554 Y582 I584 A627 K628 S633 V634 Y635 F637	L550-L631 HydrophobicContact CB-CD2 4.1Å; Y551-L631 HydrophobicContact CD1-CD2 3.76Å; Y551-L631 HydrophobicContact CE1-CD2 3.69Å; Y551-L631 HydrophobicContact CG-CD2 4.37Å; M554-L631 HydrophobicContact CB-CD1 4.39Å; M554-L631 HydrophobicContact CE-CD1 3.4Å; M554-L631 HydrophobicContact CG-CD1 4.45Å; Y582-L631 HydrophobicContact CD1-CD1 4.38Å; Y582-L631 HydrophobicContact CE1-CD1 3.64Å; I584-L631 HydrophobicContact CD1-CD1 4.37Å; I584-L631 HydrophobicContact CD1-CG 4.3Å; A627-L631 VanDerWaalsContact O-CB 3.31Å; A627-L631 WeakPolarHBondContact O-CB 3.4Å; A627-L631 WeakPolarHBondContact O-CG 3.37Å; A627-L631 PolarHBondContact O-N 3.23Å; K628-L631 PolarHBondContact O-N 3.02Å; K628-L631 VanDerWaalsContact O-N 3.15Å; L631-S633 PolarHBondContact O-N 3.34Å; L631-V634 PolarHBondContact O-N 3.4Å; L631-Y635 HydrophobicContact CB-CD2 4.02Å; L631-Y635 HydrophobicContact CD2-CE2 4.32Å; L631-Y635 PolarHBondContact O-N 2.98Å; L631-Y635 VanDerWaalsContact O-N 3.07Å; L631-F637 HydrophobicContact CB-CE2 3.87Å; L631-F637 HydrophobicContact CB-CZ 3.76Å; L631-F637 HydrophobicContact CD1-CZ 4.42Å
632	E	92.1	Very high	93.9	Very high	82 Å²	82	54.7 Å²	54.7	38%	0.383	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.3	-179.2	180	166.9	-140.7	0	0	113.5	K628 V634 K661	K628-E632 WeakPolarHBondContact CE-OE1 3.48Å; K628-E632 IonicContact NZ-OE1 2.63Å; K628-E632 PolarHBondContact NZ-OE1 3.11Å; K628-E632 IonicContact NZ-OE2 3.13Å; K628-E632 PolarHBondContact NZ-OE2 3.41Å; K628-E632 VanDerWaalsContact O-CB 3.27Å; K628-E632 WeakPolarHBondContact O-CB 3.48Å; K628-E632 PolarHBondContact O-N 3.36Å; E632-V634 VanDerWaalsContact C-N 3.3Å; E632-V634 PolarHBondContact O-N 3.41Å; E632-K661 WeakPolarHBondContact O-CE 3.43Å; E632-K661 PolarHBondContact O-NZ 3.19Å
633	S	89.7	Confident	93.5	Very high	67 Å²	67	56 Å²	56	47%	0.469	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.5	175	55.4	0	0	0	0	113.5	Y551 L631	Y551-S633 PolarHBondContact OH-OG 2.89Å; L631-S633 PolarHBondContact O-N 3.34Å
634	V	90.8	Very high	93.2	Very high	10 Å²	10	62.7 Å²	62.7	6%	0.061	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-23.5	-172.6	-179.9	0	0	0	0	112.4	Y551 L631 E632 K661	Y551-V634 HydrophobicContact CD1-CB 4.12Å; Y551-V634 HydrophobicContact CD1-CG2 3.92Å; Y551-V634 HydrophobicContact CE1-CB 3.83Å; Y551-V634 HydrophobicContact CE1-CG2 3.45Å; Y551-V634 VanDerWaalsContact CE1-CG2 3.45Å; L631-V634 PolarHBondContact O-N 3.4Å; E632-V634 VanDerWaalsContact C-N 3.3Å; E632-V634 PolarHBondContact O-N 3.41Å; V634-K661 VanDerWaalsContact O-CB 3.29Å; V634-K661 WeakPolarHBondContact O-CB 3.39Å; V634-K661 PolarHBondContact O-N 3.44Å
635	Y	94.3	Very high	92.6	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.5	-174.4	-55.7	-80	0	0	0	112.9	Y551 M554 E555 L558 L631 F637 L657 R660 K661	Y551-Y635 AromaticContact CD1-CE2 3.83Å; Y551-Y635 HydrophobicContact CD1-CE2 3.83Å; Y551-Y635 HydrophobicContact CE1-CE2 4.38Å; M554-Y635 HydrophobicContact CB-CE2 3.98Å; M554-Y635 HydrophobicContact CG-CD1 4.4Å; M554-Y635 HydrophobicContact CG-CD2 4.12Å; M554-Y635 HydrophobicContact CG-CE1 3.95Å; M554-Y635 HydrophobicContact CG-CE2 3.58Å; M554-Y635 HydrophobicContact CG-CG 4.49Å; E555-Y635 WeakPolarHBondContact CG-OH 3.3Å; E555-Y635 WeakPolarHBondContact OE1-CE1 3.46Å; E555-Y635 PolarHBondContact OE1-OH 3.07Å; L558-Y635 HydrophobicContact CD1-CE1 4.16Å; L631-Y635 HydrophobicContact CB-CD2 4.02Å; L631-Y635 HydrophobicContact CD2-CE2 4.32Å; L631-Y635 PolarHBondContact O-N 2.98Å; L631-Y635 VanDerWaalsContact O-N 3.07Å; Y635-F637 HydrophobicContact CG-CZ 4.5Å; Y635-L657 HydrophobicContact CD1-CD1 3.98Å; Y635-L657 HydrophobicContact CG-CD1 3.97Å; Y635-R660 HydrophobicContact CD1-CG 4.18Å; Y635-R660 HydrophobicContact CE1-CG 4.02Å; Y635-K661 WeakPolarHBondContact O-CE 3.26Å
636	D	94.6	Very high	92.1	Very high	43 Å²	43	65.9 Å²	65.9	23%	0.23	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133	170.7	-74.5	-33.2	0	0	0	110.1	K658 Q659 K661	D636-K658 HydrophobicContact CB-CB 4.25Å; D636-K658 PolarHBondContact O-N 2.77Å; D636-Q659 HydrophobicContact CB-CG 3.88Å; D636-Q659 PolarHBondContact N-O 3.01Å; D636-Q659 WeakPolarHBondContact OD2-CG 3.17Å; D636-Q659 PolarHBondContact OD2-NE2 2.8Å; D636-K661 WeakPolarHBondContact OD1-CE 3.34Å; D636-K661 VanDerWaalsContact OD1-CG 3.29Å; D636-K661 WeakPolarHBondContact OD1-CG 3.28Å; D636-K661 IonicContact OD1-NZ 2.7Å
637	F	95.7	Very high	91.4	Very high	35 Å²	35	64.2 Å²	64.2	15%	0.154	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.8	178.9	-63.2	-80.2	0	0	0	110.9	V623 K628 L631 Y635 F655 L656 L657	V623-F637 HydrophobicContact CB-CE1 4.27Å; V623-F637 HydrophobicContact CG1-CD1 4.39Å; V623-F637 HydrophobicContact CG1-CE1 3.75Å; V623-F637 HydrophobicContact CG2-CD1 3.55Å; V623-F637 HydrophobicContact CG2-CE1 3.56Å; V623-F637 HydrophobicContact CG2-CG 4.43Å; V623-F637 HydrophobicContact CG2-CZ 4.42Å; K628-F637 HydrophobicContact CB-CD2 4.34Å; K628-F637 HydrophobicContact CB-CG 4.43Å; K628-F637 HydrophobicContact CG-CB 3.97Å; K628-F637 HydrophobicContact CG-CD2 3.75Å; K628-F637 HydrophobicContact CG-CE2 4.44Å; K628-F637 HydrophobicContact CG-CG 3.9Å; L631-F637 HydrophobicContact CB-CE2 3.87Å; L631-F637 HydrophobicContact CB-CZ 3.76Å; L631-F637 HydrophobicContact CD1-CZ 4.42Å; Y635-F637 HydrophobicContact CG-CZ 4.5Å; F637-F655 HydrophobicContact CB-CB 4.14Å; F637-L656 CarbonylContact C-O 3.52Å; F637-L656 VanDerWaalsContact CA-O 3.28Å; F637-L656 WeakPolarHBondContact CA-O 3.26Å; F637-L657 HydrophobicContact CD1-CB 4.4Å; F637-L657 HydrophobicContact CD1-CD1 4.09Å; F637-L657 HydrophobicContact CE1-CB 4.25Å; F637-L657 HydrophobicContact CE1-CD1 3.57Å; F637-L657 HydrophobicContact CZ-CD1 3.99Å
638	E	95.6	Very high	90.9	Very high	67 Å²	67	66.4 Å²	66.4	31%	0.313	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.7	170.2	64.6	-172.1	-175.6	0	0	110	R620 R640 F655 L656	R620-E638 IonicContact CZ-OE1 2.71Å; R620-E638 VanDerWaalsContact CZ-OE1 3.24Å; R620-E638 IonicContact NH1-OE1 3.93Å; R620-E638 PolarHBondContact NH1-OE1 3.06Å; R620-E638 VanDerWaalsContact NH1-OE1 3.07Å; R620-E638 IonicContact NH2-OE1 3.14Å; R620-E638 PolarHBondContact NH2-OE1 3.43Å; R620-E638 IonicContact NH2-OE2 2.84Å; E638-R640 PolarHBondContact O-N 3.24Å; E638-F655 CarbonylContact O-C 3.54Å; E638-F655 WeakPolarHBondContact O-CA 3.45Å; E638-L656 HydrophobicContact CG-CB 3.67Å; E638-L656 HydrophobicContact CG-CD1 4.45Å; E638-L656 PolarHBondContact N-O 2.89Å; E638-L656 PolarHBondContact O-N 2.78Å; E638-L656 WeakPolarHBondContact OE1-CD1 3.48Å
639	F	95.9	Very high	90.1	Very high	117 Å²	117	72.8 Å²	72.8	51%	0.513	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	128.7	171.2	176.8	-98.5	0	0	0	108.6	D653 F655	F639-D653 HydrophobicContact CE2-CB 3.92Å; F639-F655 HydrophobicContact CB-CD1 4.2Å; F639-F655 HydrophobicContact CB-CE1 4.09Å; F639-F655 HydrophobicContact CD2-CD1 4.41Å; F639-F655 AromaticContact CD2-CE1 3.9Å; F639-F655 HydrophobicContact CD2-CE1 3.9Å; F639-F655 HydrophobicContact CD2-CZ 4.11Å
640	R	91.7	Very high	89.4	Confident	84 Å²	84	71.8 Å²	71.8	32%	0.317	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-66.1	-179.8	172.2	-171.5	170.8	164.1	1.2	110.9	T615 G616 E638 V654 L656	T615-R640 PolarHBondContact O-NH1 3.33Å; T615-R640 PolarHBondContact O-NH2 3.05Å; G616-R640 VanDerWaalsContact C-NH1 3.29Å; E638-R640 PolarHBondContact O-N 3.24Å; R640-V654 HydrophobicContact CB-CG2 4.08Å; R640-V654 HydrophobicContact CG-CG2 4.29Å; R640-V654 PolarHBondContact N-O 3.46Å; R640-L656 HydrophobicContact CB-CD1 4.11Å; R640-L656 HydrophobicContact CB-CG 4.01Å; R640-L656 HydrophobicContact CG-CD1 4.18Å; R640-L656 HydrophobicContact CG-CG 4.42Å
641	D	91.4	Very high	89.1	Confident	93 Å²	93	67 Å²	67	50%	0.497	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	169.2	-176.5	-152.9	-10.9	0	0	0	109.2	I643 V654	D641-I643 HydrophobicContact CB-CG1 4.21Å; D641-V654 WeakPolarHBondContact O-CG2 3.08Å; D641-V654 PolarHBondContact O-N 3.36Å
642	H	92.6	Very high	89	Confident	80 Å²	80	68.1 Å²	68.1	37%	0.37	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	107.2	166.1	-173.3	84.1	0	0	0	108.5	G650 G651 D653	H642-G650 PolarHBondContact CE1-O 3.04Å; H642-G650 PolarHBondContact NE2-O 2.86Å; H642-G651 WeakPolarHBondContact NE2-CA 3.34Å; H642-D653 IonicContact CE1-OD1 3.96Å; H642-D653 IonicContact CG-OD1 2.68Å; H642-D653 IonicContact ND1-OD1 2.83Å; H642-D653 PolarHBondContact ND1-OD1 3.36Å
643	I	90.5	Very high	89.1	Confident	28 Å²	28	65.9 Å²	65.9	14%	0.144	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.6	-173.1	-61.9	-179.8	0	0	0	110	T615 D641 I645 G651 M652 V654	T615-I643 HydrophobicContact CG2-CG2 4.2Å; D641-I643 HydrophobicContact CB-CG1 4.21Å; I643-I645 PolarHBondContact O-N 3.03Å; I643-I645 VanDerWaalsContact O-N 3.13Å; I643-G651 WeakPolarHBondContact O-CA 3.47Å; I643-M652 PolarHBondContact N-O 3.33Å; I643-M652 PolarHBondContact O-N 3.39Å; I643-V654 HydrophobicContact CB-CG1 4.44Å; I643-V654 HydrophobicContact CB-CG2 4.46Å; I643-V654 HydrophobicContact CD1-CB 4.46Å; I643-V654 HydrophobicContact CD1-CG1 4.3Å; I643-V654 HydrophobicContact CD1-CG2 3.42Å; I643-V654 VanDerWaalsContact CD1-CG2 3.42Å; I643-V654 HydrophobicContact CG1-CG2 3.71Å
644	D	89	Confident	89.4	Confident	139 Å²	139	62.7 Å²	62.7	74%	0.743	35%	0.345	S	S	*	.			trans	-68.4	107	171.5	-71.8	-30.2	0	0	0	110.8
645	I	84.1	Confident	89.6	Confident	11 Å²	11	63.5 Å²	63.5	6%	0.056	35%	0.348	C	S	.	.			trans	-101.1	122.4	175.7	-56.1	175.9	0	0	0	108.7	R611 M612 I643 G647 V648 M652	R611-I645 HydrophobicContact CB-CG2 4.14Å; R611-I645 HydrophobicContact CG-CG2 4.03Å; M612-I645 HydrophobicContact CE-CD1 3.3Å; M612-I645 HydrophobicContact CE-CG1 4.24Å; I643-I645 PolarHBondContact O-N 3.03Å; I643-I645 VanDerWaalsContact O-N 3.13Å; I645-G647 PolarHBondContact O-N 3.36Å; I645-G647 VanDerWaalsContact O-N 3.13Å; I645-V648 HydrophobicContact CB-CB 4.41Å; I645-V648 HydrophobicContact CB-CG2 4.31Å; I645-V648 HydrophobicContact CG2-CG2 4.27Å; I645-V648 PolarHBondContact O-N 3.39Å; I645-M652 HydrophobicContact CD1-CB 3.55Å; I645-M652 HydrophobicContact CD1-CE 4.35Å; I645-M652 HydrophobicContact CD1-CG 4.24Å; I645-M652 HydrophobicContact CD1-SD 3.88Å; I645-M652 HydrophobicContact CG1-CB 4.3Å
646	K	83.3	Confident	89.8	Confident	185 Å²	185	63.9 Å²	63.9	80%	0.804	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	121	174	-175.6	-179.3	-179.4	-179.8	0	110.7
647	G	78.1	Confident	89.8	Confident	78 Å²	78	62.3 Å²	62.3	80%	0.804	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	-4.6	179.1	0	0	0	0	0	114.6	I645	I645-G647 PolarHBondContact O-N 3.36Å; I645-G647 VanDerWaalsContact O-N 3.13Å
648	V	83.4	Confident	89.7	Confident	45 Å²	45	67 Å²	67	27%	0.273	36%	0.362	S	S	.	.	S	Bend	trans	-113.2	110	171.1	-175.1	0	0	0	0	107.7	I608 I645 G650 G651 M652	I608-V648 HydrophobicContact CD1-CG2 4.42Å; I645-V648 HydrophobicContact CB-CB 4.41Å; I645-V648 HydrophobicContact CB-CG2 4.31Å; I645-V648 HydrophobicContact CG2-CG2 4.27Å; I645-V648 PolarHBondContact O-N 3.39Å; V648-G650 PolarHBondContact O-N 3.47Å; V648-G651 WeakPolarHBondContact CG1-O 3.45Å; V648-G651 PolarHBondContact O-N 2.7Å; V648-M652 HydrophobicContact CG2-CE 4.31Å
649	D	78.6	Confident	89.4	Confident	168 Å²	168	68.2 Å²	68.2	90%	0.898	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	123.2	-179.8	-68.4	-29.5	0	0	0	110.2
650	G	80	Confident	89.2	Confident	64 Å²	64	68.7 Å²	68.7	66%	0.66	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	27.8	-180	0	0	0	0	0	114.5	H642 V648	H642-G650 PolarHBondContact CE1-O 3.04Å; H642-G650 PolarHBondContact NE2-O 2.86Å; V648-G650 PolarHBondContact O-N 3.47Å
651	G	87.2	Confident	88.9	Confident	10 Å²	10	67.9 Å²	67.9	10%	0.103	37%	0.365	C	S	.	.			trans	68.3	-172.1	171.4	0	0	0	0	0	114.4	H642 I643 V648	H642-G651 WeakPolarHBondContact NE2-CA 3.34Å; I643-G651 WeakPolarHBondContact O-CA 3.47Å; V648-G651 WeakPolarHBondContact CG1-O 3.45Å; V648-G651 PolarHBondContact O-N 2.7Å
652	M	91.1	Very high	87.5	Confident	23 Å²	23	72 Å²	72	11%	0.113	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	137.8	178.1	-176.8	-178	-72.1	0	0	110.8	I608 I643 I645 V648 V654	I608-M652 HydrophobicContact CD1-CE 4.21Å; I608-M652 HydrophobicContact CG2-CE 4.1Å; I608-M652 HydrophobicContact CG2-SD 4.18Å; I643-M652 PolarHBondContact N-O 3.33Å; I643-M652 PolarHBondContact O-N 3.39Å; I645-M652 HydrophobicContact CD1-CB 3.55Å; I645-M652 HydrophobicContact CD1-CE 4.35Å; I645-M652 HydrophobicContact CD1-CG 4.24Å; I645-M652 HydrophobicContact CD1-SD 3.88Å; I645-M652 HydrophobicContact CG1-CB 4.3Å; V648-M652 HydrophobicContact CG2-CE 4.31Å; M652-V654 PolarHBondContact O-N 2.98Å
653	D	93.8	Very high	85.5	Confident	36 Å²	36	75.7 Å²	75.7	19%	0.193	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	121.4	168.3	-57.8	-28.9	0	0	0	109.7	R625 F639 H642 F655	R625-D653 IonicContact CZ-OD2 3.67Å; R625-D653 PolarHBondContact N-O 3.48Å; R625-D653 IonicContact NH1-OD2 2.74Å; R625-D653 PolarHBondContact NH1-OD2 3.21Å; F639-D653 HydrophobicContact CE2-CB 3.92Å; H642-D653 IonicContact CE1-OD1 3.96Å; H642-D653 IonicContact CG-OD1 2.68Å; H642-D653 IonicContact ND1-OD1 2.83Å; H642-D653 PolarHBondContact ND1-OD1 3.36Å; D653-F655 HydrophobicContact CB-CE2 3.88Å; D653-F655 HydrophobicContact CB-CZ 4.19Å
654	V	95	Very high	83.3	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.3	177.3	-62.4	0	0	0	0	110.8	M612 Q622 R640 D641 I643 M652	M612-V654 HydrophobicContact CE-CG1 3.66Å; M612-V654 HydrophobicContact SD-CB 4.41Å; M612-V654 HydrophobicContact SD-CG1 3.62Å; Q622-V654 HydrophobicContact CG-CB 4.26Å; R640-V654 HydrophobicContact CB-CG2 4.08Å; R640-V654 HydrophobicContact CG-CG2 4.29Å; R640-V654 PolarHBondContact N-O 3.46Å; D641-V654 WeakPolarHBondContact O-CG2 3.08Å; D641-V654 PolarHBondContact O-N 3.36Å; I643-V654 HydrophobicContact CB-CG1 4.44Å; I643-V654 HydrophobicContact CB-CG2 4.46Å; I643-V654 HydrophobicContact CD1-CB 4.46Å; I643-V654 HydrophobicContact CD1-CG1 4.3Å; I643-V654 HydrophobicContact CD1-CG2 3.42Å; I643-V654 VanDerWaalsContact CD1-CG2 3.42Å; I643-V654 HydrophobicContact CG1-CG2 3.71Å; M652-V654 PolarHBondContact O-N 2.98Å
655	F	96.9	Very high	80.9	Confident	26 Å²	26	79.3 Å²	79.3	11%	0.114	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.4	-178	-58.6	-97.6	0	0	0	110.1	Q622 V623 R625 K628 F637 E638 F639 D653	Q622-F655 CarbonylContact C-O 3.38Å; Q622-F655 WeakPolarHBondContact CA-O 3.36Å; V623-F655 HydrophobicContact CG2-CB 3.72Å; V623-F655 PolarHBondContact N-O 3.29Å; V623-F655 PolarHBondContact O-N 3.49Å; R625-F655 HydrophobicContact CB-CE2 3.9Å; R625-F655 HydrophobicContact CG-CE2 4.05Å; K628-F655 HydrophobicContact CB-CB 4.49Å; K628-F655 HydrophobicContact CB-CD2 3.98Å; K628-F655 HydrophobicContact CB-CE2 4.45Å; K628-F655 HydrophobicContact CB-CG 4.17Å; K628-F655 HydrophobicContact CD-CE1 4.48Å; K628-F655 HydrophobicContact CD-CZ 4.5Å; K628-F655 HydrophobicContact CG-CD1 4.15Å; K628-F655 HydrophobicContact CG-CD2 4.2Å; K628-F655 HydrophobicContact CG-CE1 4.45Å; K628-F655 HydrophobicContact CG-CG 4.03Å; F637-F655 HydrophobicContact CB-CB 4.14Å; E638-F655 CarbonylContact O-C 3.54Å; E638-F655 WeakPolarHBondContact O-CA 3.45Å; F639-F655 HydrophobicContact CB-CD1 4.2Å; F639-F655 HydrophobicContact CB-CE1 4.09Å; F639-F655 HydrophobicContact CD2-CD1 4.41Å; F639-F655 AromaticContact CD2-CE1 3.9Å; F639-F655 HydrophobicContact CD2-CE1 3.9Å; F639-F655 HydrophobicContact CD2-CZ 4.11Å; D653-F655 HydrophobicContact CB-CE2 3.88Å; D653-F655 HydrophobicContact CB-CZ 4.19Å
656	L	96.8	Very high	79	Confident	9 Å²	9	81.7 Å²	81.7	5%	0.047	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.9	171.5	-60.2	167.5	0	0	0	109.3	V617 R620 I621 Q622 F637 E638 R640 K658	V617-L656 HydrophobicContact CB-CD1 4.39Å; V617-L656 HydrophobicContact CB-CD2 4.32Å; V617-L656 HydrophobicContact CG2-CD1 3.78Å; V617-L656 HydrophobicContact CG2-CD2 4.08Å; R620-L656 HydrophobicContact CB-CD2 4.13Å; I621-L656 WeakPolarHBondContact O-CA 3.11Å; Q622-L656 HydrophobicContact CB-CD2 3.89Å; Q622-L656 HydrophobicContact CG-CD2 4.32Å; F637-L656 CarbonylContact C-O 3.52Å; F637-L656 VanDerWaalsContact CA-O 3.28Å; F637-L656 WeakPolarHBondContact CA-O 3.26Å; E638-L656 HydrophobicContact CG-CB 3.67Å; E638-L656 HydrophobicContact CG-CD1 4.45Å; E638-L656 PolarHBondContact N-O 2.89Å; E638-L656 PolarHBondContact O-N 2.78Å; E638-L656 WeakPolarHBondContact OE1-CD1 3.48Å; R640-L656 HydrophobicContact CB-CD1 4.11Å; R640-L656 HydrophobicContact CB-CG 4.01Å; R640-L656 HydrophobicContact CG-CD1 4.18Å; R640-L656 HydrophobicContact CG-CG 4.42Å; L656-K658 PolarHBondContact O-N 3.25Å
657	L	96.1	Very high	76.7	Confident	11 Å²	11	84.4 Å²	84.4	6%	0.058	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.3	170.8	-174.5	69.2	0	0	0	109.4	M554 L558 R620 I621 Y635 F637	M554-L657 HydrophobicContact SD-CD2 3.96Å; L558-L657 HydrophobicContact CD1-CD2 4.46Å; L558-L657 HydrophobicContact CD2-CD2 3.72Å; L558-L657 HydrophobicContact CG-CD2 4.23Å; R620-L657 PolarHBondContact NH2-O 2.97Å; I621-L657 HydrophobicContact CB-CB 3.99Å; I621-L657 HydrophobicContact CB-CD2 4.38Å; I621-L657 HydrophobicContact CD1-CD2 3.61Å; I621-L657 HydrophobicContact CG2-CB 4.44Å; I621-L657 PolarHBondContact O-N 2.97Å; Y635-L657 HydrophobicContact CD1-CD1 3.98Å; Y635-L657 HydrophobicContact CG-CD1 3.97Å; F637-L657 HydrophobicContact CD1-CB 4.4Å; F637-L657 HydrophobicContact CD1-CD1 4.09Å; F637-L657 HydrophobicContact CE1-CB 4.25Å; F637-L657 HydrophobicContact CE1-CD1 3.57Å; F637-L657 HydrophobicContact CZ-CD1 3.99Å
658	K	92.2	Very high	75.1	Confident	132 Å²	132	84.4 Å²	84.4	57%	0.574	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	-57.6	177.6	-174.3	177.8	179.7	178.5	0	111.5	D636 L656	D636-K658 HydrophobicContact CB-CB 4.25Å; D636-K658 PolarHBondContact O-N 2.77Å; L656-K658 PolarHBondContact O-N 3.25Å
659	Q	90.5	Very high	73.1	Confident	94 Å²	94	88.7 Å²	88.7	44%	0.439	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	164.4	-177.2	60.8	-176.8	6.5	0	0	111.3	D636	D636-Q659 HydrophobicContact CB-CG 3.88Å; D636-Q659 PolarHBondContact N-O 3.01Å; D636-Q659 WeakPolarHBondContact OD2-CG 3.17Å; D636-Q659 PolarHBondContact OD2-NE2 2.8Å
660	R	91.1	Very high	70.7	Confident	126 Å²	126	89.6 Å²	89.6	48%	0.475	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	134	165.4	-62.5	-179.6	176.8	132.8	0.3	109	E555 L558 Y635 Q662	E555-R660 IonicContact OE1-NE 3.78Å; E555-R660 PolarHBondContact OE1-NE 3.28Å; E555-R660 IonicContact OE2-CZ 3.24Å; E555-R660 VanDerWaalsContact OE2-CZ 3.27Å; E555-R660 IonicContact OE2-NE 2.68Å; E555-R660 PolarHBondContact OE2-NE 3.33Å; E555-R660 IonicContact OE2-NH2 3.07Å; E555-R660 PolarHBondContact OE2-NH2 3.22Å; L558-R660 HydrophobicContact CD1-CG 4.2Å; Y635-R660 HydrophobicContact CD1-CG 4.18Å; Y635-R660 HydrophobicContact CE1-CG 4.02Å; R660-Q662 PolarHBondContact O-N 3.18Å
661	K	86.1	Confident	68.5	Low	67 Å²	67	91.8 Å²	91.8	29%	0.291	44%	0.444	S	S	.	.			trans	-68	115.6	170.6	-71.1	179	169.8	-178.9	0	107.8	E632 V634 Y635 D636 N663 M664	E632-K661 WeakPolarHBondContact O-CE 3.43Å; E632-K661 PolarHBondContact O-NZ 3.19Å; V634-K661 VanDerWaalsContact O-CB 3.29Å; V634-K661 WeakPolarHBondContact O-CB 3.39Å; V634-K661 PolarHBondContact O-N 3.44Å; Y635-K661 WeakPolarHBondContact O-CE 3.26Å; D636-K661 WeakPolarHBondContact OD1-CE 3.34Å; D636-K661 VanDerWaalsContact OD1-CG 3.29Å; D636-K661 WeakPolarHBondContact OD1-CG 3.28Å; D636-K661 IonicContact OD1-NZ 2.7Å; K661-N663 PolarHBondContact O-N 3.31Å; K661-M664 PolarHBondContact O-N 3.48Å
662	Q	61.3	Low	66	Low	179 Å²	179	98.9 Å²	98.9	84%	0.836	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-8.7	-172.2	-67.3	-178.8	-3.8	0	0	115.1	R660	R660-Q662 PolarHBondContact O-N 3.18Å
663	N	51.1	Low	63.3	Low	158 Å²	158	105.5 Å²	105.5	85%	0.845	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-0.5	-174	-70.7	-11.6	0	0	0	115.8	K661	K661-N663 PolarHBondContact O-N 3.31Å
664	M	44.7	Very low	60.8	Low	125 Å²	125	111.6 Å²	111.6	62%	0.616	54%	0.541	S	S	*	.			trans	-146.8	84.9	170.8	-76.2	-172.1	-172.6	0	0	110	K661 P666	K661-M664 PolarHBondContact O-N 3.48Å; M664-P666 VanDerWaalsContact O-CD 3.28Å; M664-P666 WeakPolarHBondContact O-CD 3.3Å
665	T	37.7	Very low	57.9	Low	118 Å²	118	119.2 Å²	119.2	72%	0.724	58%	0.581	S	S	*	*			trans	-67.7	116.6	146.9	26.2	0	0	0	0	105.7	R667	T665-R667 VanDerWaalsContact C-N 3.35Å; T665-R667 PolarHBondContact O-N 3.46Å
666	P	43.2	Very low	55.9	Low	62 Å²	62	120.7 Å²	120.7	40%	0.403	60%	0.604	S	S	.	*			trans	-60.7	111.3	162	-7.5	23.5	0	0	0	104.1	M664 L668	M664-P666 VanDerWaalsContact O-CD 3.28Å; M664-P666 WeakPolarHBondContact O-CD 3.3Å; P666-L668 HydrophobicContact CB-CD1 4.31Å; P666-L668 PolarHBondContact O-N 3.17Å
667	R	35.6	Very low	53.4	Low	241 Å²	241	130.2 Å²	130.2	91%	0.909	67%	0.666	S	S	*	*			trans	-61.2	78.8	159.2	-75.5	-177	176.9	178.8	-0.6	106	T665 Q669	T665-R667 VanDerWaalsContact C-N 3.35Å; T665-R667 PolarHBondContact O-N 3.46Å; R667-Q669 PolarHBondContact O-N 3.34Å
668	L	45.4	Very low	51.3	Low	79 Å²	79	136.2 Å²	136.2	41%	0.414	70%	0.697	S	S	.	*			trans	-69.2	84.1	161.8	-101.3	145.2	0	0	0	105.3	P666	P666-L668 HydrophobicContact CB-CD1 4.31Å; P666-L668 PolarHBondContact O-N 3.17Å
669	Q	39.7	Very low	49.1	Very low	134 Å²	134	136.4 Å²	136.4	63%	0.626	70%	0.703	S	S	*	*			trans	48.7	90.8	153.9	-70.7	160	-31.4	0	0	116.2	R667 P671	R667-Q669 PolarHBondContact O-N 3.34Å; Q669-P671 WeakPolarHBondContact O-CD 3.41Å
670	K	28.7	Very low	46.8	Very low	187 Å²	187	138.8 Å²	138.8	81%	0.813	72%	0.718	S	S	*	*			trans	-59.4	123.9	143.7	-157.4	177	-173.6	-170.8	0	106.5	L672	K670-L672 PolarHBondContact O-N 3.21Å
671	P	33.7	Very low	44.2	Very low	111 Å²	111	139.5 Å²	139.5	72%	0.721	73%	0.732	S	S	*	*			trans	-57	137.2	177.2	-20.5	30.9	0	0	0	109.6	Q669 E673	Q669-P671 WeakPolarHBondContact O-CD 3.41Å; P671-E673 PolarHBondContact O-N 3.43Å
672	L	35.4	Very low	41.6	Very low	158 Å²	158	144.1 Å²	144.1	83%	0.827	76%	0.76	S	S	*	*			trans	-60.1	107	167.3	-101.6	99.4	0	0	0	108.1	K670 L674	K670-L672 PolarHBondContact O-N 3.21Å; L672-L674 PolarHBondContact O-N 3.39Å
673	E	34.9	Very low	40.3	Very low	162 Å²	162	141.7 Å²	141.7	76%	0.757	76%	0.755	S	S	*	*			trans	-63.6	108.6	155.8	-76.1	173.6	153.4	0	0	106.8	P671 D675	P671-E673 PolarHBondContact O-N 3.43Å; E673-D675 VanDerWaalsContact C-N 3.26Å; E673-D675 PolarHBondContact O-N 2.81Å
674	L	39.7	Very low	39.5	Very low	165 Å²	165	140.6 Å²	140.6	86%	0.864	75%	0.748	S	S	*	*			trans	-73.1	86.1	164.4	-94.8	126.6	0	0	0	107.7	L672 G676	L672-L674 PolarHBondContact O-N 3.39Å; L674-G676 PolarHBondContact O-N 3.22Å
675	D	36.1	Very low	39.1	Very low	159 Å²	159	141.8 Å²	141.8	85%	0.85	76%	0.758	S	S	*	*			trans	-72.4	107.5	155.9	-86.9	-19.6	0	0	0	108	E673	E673-D675 VanDerWaalsContact C-N 3.26Å; E673-D675 PolarHBondContact O-N 2.81Å
676	G	54.1	Low	39.2	Very low	57 Å²	57	143.8 Å²	143.8	59%	0.588	76%	0.761	S	S	*	*			trans	-116.5	156.5	160.4	0	0	0	0	0	108.9	L674	L674-G676 PolarHBondContact O-N 3.22Å
677	P	44.3	Very low	38.9	Very low	210 Å²	210	151.2 Å²	151.2	100%	1.364	79%	0.794	S	S	*	*			trans	-61	0	-161.1	27.8	-36.8	0	0	0	115.8

Retrieved 677 of 677 residues in 310.6 ms (Link to these results)

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