A0A075B7A9_HUMAN Loading...

MAGE family member A9B

AlphaFold DB , UniProt , Accession A0A075B7A9, Species HUMAN (Homo sapiens, Human), Gene MAGEA9B, Length 195 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39	Very low	54.3	Low	240 Å²	240	161.5 Å²	161.5	100%	1.182	83%	0.833	S	S	*	*				0	109.9	0	31.7	-138.2	-118.9	0	0	107.2
2	S	50.1	Low	53.7	Low	110 Å²	110	157.8 Å²	157.8	77%	0.769	83%	0.826	S	S	*	*			cis	-156.5	152.5	4.3	-70.9	0	0	0	0	108.2
3	L	60.5	Low	53.6	Low	162 Å²	162	158.2 Å²	158.2	85%	0.848	83%	0.83	S	S	*	*			trans	-71.6	152.3	166.3	-68	156.4	0	0	0	109.5
4	E	58.1	Low	53.6	Low	178 Å²	178	158 Å²	158	83%	0.832	82%	0.823	S	S	*	*			trans	167.6	101.4	147.3	-91.3	154.4	108	0	0	108.7
5	Q	53.4	Low	53.3	Low	192 Å²	192	158.6 Å²	158.6	90%	0.897	83%	0.827	S	S	*	*				53.6	117.3	98.2	-72.7	-160.6	49.2	0	0	115.8
6	R	53.9	Low	53	Low	226 Å²	226	156.6 Å²	156.6	85%	0.853	82%	0.817	S	S	*	*				163.9	109.8	119.3	-174.8	166.2	-169.4	-114.8	2.7	112.1
7	S	63.8	Low	52.6	Low	113 Å²	113	157.1 Å²	157.1	79%	0.79	81%	0.814	S	S	*	*			trans	-69.2	151.5	156.1	-62	0	0	0	0	110.6
8	P	61.8	Low	52.3	Low	107 Å²	107	154.2 Å²	154.2	70%	0.695	82%	0.817	S	S	*	*			trans	-123.7	123.3	139.1	25.2	-8.8	0	0	0	111.5
9	H	53.5	Low	52.1	Low	162 Å²	162	153.8 Å²	153.8	75%	0.75	81%	0.81	S	S	*	*			trans	-45.4	126	163.3	-161.4	43.3	0	0	0	112.7
10	C	40.8	Very low	51.7	Low	124 Å²	124	150.2 Å²	150.2	84%	0.838	81%	0.812	S	S	*	*			trans	-108	120.6	157.1	-77.1	0	0	0	0	108.1
11	K	62.3	Low	51.5	Low	163 Å²	163	150.1 Å²	150.1	71%	0.709	81%	0.806	S	S	*	*			trans	-73.2	148.9	175.2	-60.7	175.2	175.6	179.8	0	109.7
12	P	47.4	Very low	51.9	Low	116 Å²	116	145.9 Å²	145.9	75%	0.753	79%	0.788	S	S	*	*			trans	-80	129.1	153.2	31.5	-25.9	0	0	0	108.5	E14	P12-E14 PolarHBondContact O-N 3.37Å
13	D	51.8	Low	51.8	Low	163 Å²	163	149.4 Å²	149.4	87%	0.872	80%	0.797	S	S	*	*			trans	-78.1	113.4	158.7	-91.6	-63.6	0	0	0	107.2
14	E	53.7	Low	50.8	Low	156 Å²	156	144.2 Å²	144.2	73%	0.729	78%	0.783	S	S	*	*			trans	-68.7	123.6	154.9	-78.9	171.4	90.1	0	0	107.5	P12	P12-E14 PolarHBondContact O-N 3.37Å
15	D	48.8	Very low	50	Low	167 Å²	167	144.5 Å²	144.5	89%	0.893	79%	0.79	S	S	*	*			trans	-127.4	107.3	149	-117.4	-15.9	0	0	0	108
16	L	49.6	Very low	49.7	Very low	126 Å²	126	144.4 Å²	144.4	66%	0.66	79%	0.791	S	S	*	*			trans	-82.5	158.2	171.4	-79.6	162.7	0	0	0	109.7
17	E	45.8	Very low	48.9	Very low	166 Å²	166	136.9 Å²	136.9	78%	0.776	78%	0.784	S	S	*	*			trans	72.5	109.2	153.5	-78.1	175.1	85.7	0	0	119.9
18	A	46.4	Very low	48	Very low	105 Å²	105	135.7 Å²	135.7	87%	0.868	78%	0.781	S	S	*	*				-146.1	94.1	121.1	0	0	0	0	0	109.7
19	Q	48.9	Very low	46.8	Very low	146 Å²	146	139.6 Å²	139.6	68%	0.682	79%	0.79	S	S	*	*			trans	-65.7	124.6	160.6	-178.6	174.1	6.2	0	0	108.3	E21	Q19-E21 HydrophobicContact CG-CG 4.43Å; Q19-E21 WeakPolarHBondContact CG-OE1 3.46Å; Q19-E21 PolarHBondContact NE2-OE1 3.26Å
20	G	45.1	Very low	45.9	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	79%	0.794	S	S	*	*			trans	-133.3	75.3	175.9	0	0	0	0	0	109.2
21	E	47.8	Very low	46.4	Very low	149 Å²	149	138.9 Å²	138.9	70%	0.696	78%	0.783	S	S	*	*			trans	-79.6	125.2	168.8	50.9	-163.8	129.7	0	0	109.6	Q19	Q19-E21 HydrophobicContact CG-CG 4.43Å; Q19-E21 WeakPolarHBondContact CG-OE1 3.46Å; Q19-E21 PolarHBondContact NE2-OE1 3.26Å
22	D	45.5	Very low	44.9	Very low	152 Å²	152	137.6 Å²	137.6	81%	0.813	79%	0.789	S	S	*	*			trans	-125.9	85.7	165.2	-170.7	41	0	0	0	108.4
23	L	49.5	Very low	44.3	Very low	183 Å²	183	134.9 Å²	134.9	96%	0.958	78%	0.782	S	S	*	*			trans	-109.8	101.2	158.2	-83.5	169.3	0	0	0	106.3
24	G	39.9	Very low	44	Very low	53 Å²	53	135.6 Å²	135.6	55%	0.546	78%	0.78	S	S	.	*			trans	-163.4	96.8	175.8	0	0	0	0	0	112.2
25	L	41.3	Very low	43.5	Very low	185 Å²	185	136 Å²	136	97%	0.969	78%	0.782	S	S	*	*				-178	104.4	124.6	-94.2	159	0	0	0	110.6
26	M	45.2	Very low	43.1	Very low	189 Å²	189	135.9 Å²	135.9	93%	0.931	78%	0.776	S	S	*	*			trans	-111.9	130.4	160.1	-168.5	81.2	159.4	0	0	107
27	G	39.1	Very low	42.7	Very low	69 Å²	69	137.4 Å²	137.4	71%	0.711	78%	0.78	S	S	*	*			trans	-166.1	97	163.9	0	0	0	0	0	107.2
28	A	42.9	Very low	42	Very low	88 Å²	88	135.3 Å²	135.3	73%	0.727	78%	0.779	S	S	*	*				64	125.1	97.3	0	0	0	0	0	111.6
29	Q	36.8	Very low	41.5	Very low	189 Å²	189	136.1 Å²	136.1	88%	0.883	77%	0.773	S	S	*	*			cis	-165.3	157	21.2	-108.5	172.1	-95.9	0	0	109.8
30	E	35.1	Very low	40.8	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	78%	0.777	S	S	*	*			trans	-48.8	-174	157.8	-110.8	-164.7	131.4	0	0	115.5
31	P	51.3	Low	40.6	Very low	94 Å²	94	135.5 Å²	135.5	61%	0.61	77%	0.772	S	S	*	*			cis	-140.8	-171.8	-23.3	29.5	-5.1	0	0	0	114.8
32	T	31.6	Very low	40.1	Very low	135 Å²	135	132.9 Å²	132.9	83%	0.828	77%	0.77	S	S	*	*			trans	108.8	127.5	137.7	-42	0	0	0	0	121
33	G	33.5	Very low	39.9	Very low	59 Å²	59	132.4 Å²	132.4	61%	0.608	77%	0.767	S	S	*	*			trans	120.5	94.1	155.5	0	0	0	0	0	113.2
34	E	45.4	Very low	39.1	Very low	179 Å²	179	129.1 Å²	129.1	84%	0.836	76%	0.76	S	S	*	*				53.4	126.2	83.2	-63.8	-170.9	134	0	0	110.9
35	E	43.4	Very low	39.2	Very low	163 Å²	163	135.9 Å²	135.9	76%	0.762	77%	0.774	S	S	*	*			cis	-164.9	162.4	41.9	-69.1	-179.5	140	0	0	113.3
36	E	40.2	Very low	38.9	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	77%	0.773	S	S	*	*			trans	62.1	114.3	145.4	-73.2	-177.1	158.8	0	0	122.2
37	E	42.9	Very low	38.8	Very low	158 Å²	158	136.2 Å²	136.2	74%	0.738	77%	0.769	S	S	*	*				72	117.6	77.2	-163.7	-179.9	147.3	0	0	114.1
38	T	29.4	Very low	38.5	Very low	122 Å²	122	141.8 Å²	141.8	75%	0.748	78%	0.776	S	S	*	*				-179.1	113	127	28.8	0	0	0	0	111.8
39	T	37.1	Very low	38.6	Very low	121 Å²	121	142.9 Å²	142.9	74%	0.742	77%	0.773	S	S	*	*			trans	50.8	124.8	132.3	63.3	0	0	0	0	121.7
40	S	34.9	Very low	38.4	Very low	109 Å²	109	139 Å²	139	76%	0.762	77%	0.768	S	S	*	*				142.2	104	119.6	-170	0	0	0	0	110.5
41	S	40.1	Very low	38.5	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	77%	0.767	S	S	*	*				59.1	127.2	90.6	-134	0	0	0	0	112.4
42	S	38	Very low	38.1	Very low	93 Å²	93	136.1 Å²	136.1	65%	0.65	78%	0.782	S	S	*	*			cis	-168	157.5	16.9	-94.3	0	0	0	0	110.8
43	D	39.8	Very low	38.1	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	78%	0.78	S	S	*	*			trans	30.1	138.2	142.1	-65.2	-83.2	0	0	0	121.4
44	S	33.3	Very low	38.7	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	79%	0.793	S	S	*	*				-163.8	142.9	69.7	-50.5	0	0	0	0	113.4
45	K	42.2	Very low	38.3	Very low	195 Å²	195	133.4 Å²	133.4	85%	0.848	79%	0.791	S	S	*	*			trans	-50.7	163.5	154	-98.9	171.3	168.3	177.1	0	111.5
46	E	35.6	Very low	38.7	Very low	200 Å²	200	130.3 Å²	130.3	94%	0.935	79%	0.788	S	S	*	*				-167.7	145.5	104.8	-61.1	-140.8	151.5	0	0	110.7
47	E	42.1	Very low	39.3	Very low	181 Å²	181	127.8 Å²	127.8	85%	0.846	79%	0.786	S	S	*	*			trans	-113.9	132.2	179.4	178.7	-163.6	151.7	0	0	106.5
48	E	33.8	Very low	39.2	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.864	79%	0.789	S	S	*	*			trans	-155.6	138.4	158.3	-147.5	-156.8	131.6	0	0	113.3
49	V	44.8	Very low	40	Very low	111 Å²	111	129.4 Å²	129.4	67%	0.673	80%	0.795	S	S	*	*			trans	-94	137.5	174.1	155.3	0	0	0	0	109.5
50	S	32.6	Very low	40.6	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	79%	0.794	S	S	*	*				171.8	130.8	128.4	-81.9	0	0	0	0	116.3
51	A	37.3	Very low	41.2	Very low	99 Å²	99	129.3 Å²	129.3	82%	0.818	80%	0.797	S	S	*	*			trans	24.3	139.6	140.2	0	0	0	0	0	124.5
52	A	41.2	Very low	41.4	Very low	110 Å²	110	133.4 Å²	133.4	91%	0.909	80%	0.804	S	S	*	*			trans	79.9	94.9	150.3	0	0	0	0	0	118.8
53	G	31.5	Very low	42	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	81%	0.813	S	S	*	*			trans	-160.1	97.5	162.3	0	0	0	0	0	110.4	S55	G53-S55 PolarHBondContact O-N 2.99Å
54	S	46	Very low	41.9	Very low	126 Å²	126	129.5 Å²	129.5	88%	0.881	81%	0.812	S	S	*	*			trans	-60.8	121.6	170.5	175.7	0	0	0	0	110.3
55	S	38.7	Very low	42.9	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	81%	0.809	S	S	*	*			trans	-158.7	111.3	148.9	-177.9	0	0	0	0	108.6	G53	G53-S55 PolarHBondContact O-N 2.99Å
56	S	51.4	Low	43.3	Very low	99 Å²	99	124.9 Å²	124.9	69%	0.692	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-46.5	140.6	175.3	-47.1	0	0	0	0	112.5
57	P	52.2	Low	43.9	Very low	113 Å²	113	120.9 Å²	120.9	73%	0.734	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.4	142.9	163.6	27.5	-30.4	0	0	0	109.1	Q59	P57-Q59 PolarHBondContact O-N 2.93Å
58	P	41.8	Very low	44.3	Very low	125 Å²	125	115.7 Å²	115.7	81%	0.812	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62.3	130.3	-179.2	26.6	-31.4	0	0	0	108.4	S60	P58-S60 PolarHBondContact O-N 2.75Å
59	Q	45.6	Very low	45.2	Very low	188 Å²	188	112.4 Å²	112.4	88%	0.879	77%	0.774	S	S	*	*			trans	-47.3	113.6	174.3	-67.5	-179.1	-74.8	0	0	109	P57	P57-Q59 PolarHBondContact O-N 2.93Å
60	S	48.9	Very low	45.6	Very low	103 Å²	103	111.7 Å²	111.7	72%	0.72	77%	0.774	S	S	*	*			trans	-45.9	125.5	158.8	36.1	0	0	0	0	108.1	P58 Q62	P58-S60 PolarHBondContact O-N 2.75Å; S60-Q62 PolarHBondContact O-N 3.06Å
61	P	47.9	Very low	46.2	Very low	126 Å²	126	110.8 Å²	110.8	82%	0.818	76%	0.764	S	S	*	*			trans	-59.5	113.3	171.3	-18.3	30.5	0	0	0	107	G63	P61-G63 PolarHBondContact O-N 3.18Å
62	Q	43.9	Very low	46.9	Very low	192 Å²	192	108 Å²	108	90%	0.897	73%	0.733	S	S	*	*			trans	-34	113.4	167.1	-128.9	169.4	-37.8	0	0	108.8	S60 G64	S60-Q62 PolarHBondContact O-N 3.06Å; Q62-G64 PolarHBondContact O-N 3.1Å
63	G	50.8	Low	47.3	Very low	81 Å²	81	106.7 Å²	106.7	84%	0.835	71%	0.705	S	S	*	*			trans	-62.4	84.9	170.6	0	0	0	0	0	109	P61 A65	P61-G63 PolarHBondContact O-N 3.18Å; G63-A65 PolarHBondContact O-N 3.45Å
64	G	38.3	Very low	48.4	Very low	71 Å²	71	108.2 Å²	108.2	73%	0.732	70%	0.699	S	S	*	*			trans	-71.5	98	160.7	0	0	0	0	0	107.4	Q62	Q62-G64 PolarHBondContact O-N 3.1Å
65	A	55	Low	48.6	Very low	90 Å²	90	104.7 Å²	104.7	74%	0.744	67%	0.67	S	S	*	*			trans	-53	164.2	137.5	0	0	0	0	0	107.4	G63	G63-A65 PolarHBondContact O-N 3.45Å
66	S	50.2	Low	49.2	Very low	123 Å²	123	103.7 Å²	103.7	86%	0.86	65%	0.649	S	S	*	*			trans	88.8	52.6	153.2	-145.5	0	0	0	0	117.8
67	S	47	Very low	49.2	Very low	117 Å²	117	103.4 Å²	103.4	82%	0.818	65%	0.647	S	S	*	*	S	Bend	trans	-108.8	60	139.5	-169.8	0	0	0	0	107.8
68	S	51.9	Low	48.9	Very low	71 Å²	71	105.3 Å²	105.3	50%	0.497	65%	0.646	S	S	.	*			trans	39.2	79.2	172.6	-162.2	0	0	0	0	115.8	S70 V71	S68-S70 CarbonylContact O-C 3.33Å; S68-S70 VanDerWaalsContact O-C 3.24Å; S68-S70 WeakPolarHBondContact O-CA 3.34Å; S68-S70 PolarHBondContact O-N 3.12Å; S68-S70 VanDerWaalsContact O-N 3.12Å; S68-V71 PolarHBondContact O-N 2.95Å
69	I	53.2	Low	48.8	Very low	116 Å²	116	109.2 Å²	109.2	60%	0.595	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-36.2	111.2	-170.7	-60	168	0	0	0	114.1	V71 Y72 Y73	I69-V71 PolarHBondContact O-N 3.45Å; I69-Y72 WeakPolarHBondContact O-CA 2.87Å; I69-Y72 PolarHBondContact O-N 2.76Å; I69-Y73 HydrophobicContact CG2-CE2 4.29Å
70	S	52.3	Low	48.7	Very low	96 Å²	96	108.1 Å²	108.1	67%	0.671	65%	0.651	S	S	*	*	G	3₁₀ helix		-83.9	69.6	-80	180	0	0	0	0	111.2	S68	S68-S70 CarbonylContact O-C 3.33Å; S68-S70 VanDerWaalsContact O-C 3.24Å; S68-S70 WeakPolarHBondContact O-CA 3.34Å; S68-S70 PolarHBondContact O-N 3.12Å; S68-S70 VanDerWaalsContact O-N 3.12Å
71	V	46.2	Very low	48.5	Very low	90 Å²	90	112.9 Å²	112.9	55%	0.545	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	65.1	60.5	-157.7	-54.5	0	0	0	0	113.4	S68 I69 Y73 T74 L75	S68-V71 PolarHBondContact O-N 2.95Å; I69-V71 PolarHBondContact O-N 3.45Å; V71-Y73 PolarHBondContact O-N 3.43Å; V71-T74 CarbonylContact O-C 3.24Å; V71-T74 WeakPolarHBondContact O-CA 3.14Å; V71-T74 PolarHBondContact O-N 3.11Å; V71-L75 PolarHBondContact O-N 3.09Å
72	Y	51.8	Low	48.3	Very low	40 Å²	40	110.5 Å²	110.5	16%	0.157	66%	0.659	C	S	.	*	T	Hydrogen-bonded Turn	trans	71.8	-49.9	173.8	-95.3	-80.5	0	0	0	121	I69 L100 E101 F104	I69-Y72 WeakPolarHBondContact O-CA 2.87Å; I69-Y72 PolarHBondContact O-N 2.76Å; Y72-L100 HydrophobicContact CD1-CG 4.18Å; Y72-L100 HydrophobicContact CD2-CB 4.22Å; Y72-L100 HydrophobicContact CD2-CD2 3.55Å; Y72-L100 HydrophobicContact CD2-CG 3.69Å; Y72-L100 HydrophobicContact CE2-CG 4.45Å; Y72-L100 HydrophobicContact CG-CD2 3.54Å; Y72-L100 HydrophobicContact CG-CG 3.55Å; Y72-E101 HydrophobicContact CE2-CB 3.9Å; Y72-E101 WeakPolarHBondContact OH-CA 3.17Å; Y72-E101 WeakPolarHBondContact OH-CB 3.16Å; Y72-E101 WeakPolarHBondContact OH-CG 3.42Å; Y72-F104 HydrophobicContact CD1-CB 3.67Å; Y72-F104 HydrophobicContact CD1-CD1 4.4Å; Y72-F104 HydrophobicContact CD1-CD2 4.2Å; Y72-F104 AromaticContact CD1-CG 3.83Å; Y72-F104 HydrophobicContact CD1-CG 3.83Å; Y72-F104 HydrophobicContact CE1-CB 3.26Å; Y72-F104 AromaticContact CE1-CD1 3.61Å; Y72-F104 HydrophobicContact CE1-CD1 3.61Å; Y72-F104 HydrophobicContact CE1-CD2 4.2Å; Y72-F104 AromaticContact CE1-CG 3.41Å; Y72-F104 HydrophobicContact CE1-CG 3.41Å; Y72-F104 VanDerWaalsContact CE1-CG 3.41Å
73	Y	49.8	Very low	48.3	Very low	84 Å²	84	107.2 Å²	107.2	33%	0.329	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-165.1	37.1	142.3	-120.3	-83.2	0	0	0	107.3	I69 V71 R144	I69-Y73 HydrophobicContact CG2-CE2 4.29Å; V71-Y73 PolarHBondContact O-N 3.43Å; Y73-R144 WeakPolarHBondContact OH-CD 3.48Å; Y73-R144 PolarHBondContact OH-NE 3.13Å; Y73-R144 PolarHBondContact OH-NH1 2.93Å
74	T	54.6	Low	48.2	Very low	109 Å²	109	108.6 Å²	108.6	67%	0.669	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	92	33.3	-162.4	-25.2	0	0	0	0	115.2	V71	V71-T74 CarbonylContact O-C 3.24Å; V71-T74 WeakPolarHBondContact O-CA 3.14Å; V71-T74 PolarHBondContact O-N 3.11Å
75	L	48.2	Very low	48.7	Very low	53 Å²	53	109.9 Å²	109.9	28%	0.277	65%	0.653	S	S	.	*	S	Bend	trans	68.7	49.6	-165	-149.4	78.6	0	0	0	111.4	V71 S77 Q78 V95 L100	V71-L75 PolarHBondContact O-N 3.09Å; L75-S77 PolarHBondContact O-N 3.31Å; L75-Q78 HydrophobicContact CD2-CG 4.43Å; L75-Q78 PolarHBondContact O-N 3.29Å; L75-V95 HydrophobicContact CD1-CB 4.08Å; L75-V95 HydrophobicContact CD1-CG1 4.15Å; L75-V95 HydrophobicContact CD2-CB 4.26Å; L75-V95 HydrophobicContact CD2-CG2 4.07Å; L75-L100 HydrophobicContact CD1-CD2 3.4Å; L75-L100 VanDerWaalsContact CD1-CD2 3.4Å; L75-L100 HydrophobicContact CG-CD2 4.36Å
76	W	51.3	Low	48.2	Very low	90 Å²	90	113.7 Å²	113.7	34%	0.341	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	51.4	7.3	-178.8	-153.8	-96.6	0	0	0	118.7	F104 N141 Y142	W76-F104 HydrophobicContact CE3-CD2 4.28Å; W76-F104 HydrophobicContact CH2-CD2 4.22Å; W76-F104 HydrophobicContact CH2-CE2 4.04Å; W76-F104 AromaticContact CZ3-CD2 3.59Å; W76-F104 HydrophobicContact CZ3-CD2 3.59Å; W76-F104 AromaticContact CZ3-CE2 3.63Å; W76-F104 HydrophobicContact CZ3-CE2 3.63Å; W76-N141 HydrophobicContact CZ2-CB 4.49Å; W76-Y142 AromaticContact CH2-CD1 3.83Å; W76-Y142 HydrophobicContact CH2-CD1 3.83Å; W76-Y142 AromaticContact CH2-CE1 3.23Å; W76-Y142 HydrophobicContact CH2-CE1 3.23Å; W76-Y142 HydrophobicContact CH2-CE2 4.28Å; W76-Y142 AromaticContact CH2-CZ 3.47Å; W76-Y142 VanDerWaalsContact CH2-CZ 3.47Å; W76-Y142 HydrophobicContact CZ2-CD1 4.43Å; W76-Y142 AromaticContact CZ2-CE1 3.64Å; W76-Y142 HydrophobicContact CZ2-CE1 3.64Å; W76-Y142 AromaticContact CZ2-CE2 3.91Å; W76-Y142 HydrophobicContact CZ2-CE2 3.91Å; W76-Y142 AromaticContact CZ2-CZ 3.31Å; W76-Y142 WeakPolarHBondContact CZ2-OH 3.21Å; W76-Y142 HydrophobicContact CZ3-CE1 4.19Å
77	S	51.9	Low	48.2	Very low	93 Å²	93	114.8 Å²	114.8	65%	0.65	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.2	36.6	-170.5	-37.5	0	0	0	0	113.8	L75 F79	L75-S77 PolarHBondContact O-N 3.31Å; S77-F79 PolarHBondContact O-N 3.08Å
78	Q	47.1	Very low	48	Very low	154 Å²	154	117.6 Å²	117.6	72%	0.72	65%	0.647	S	S	*	*	S	Bend	trans	33.5	62.8	178.1	-67.9	-144.5	102.8	0	0	115.2	L75	L75-Q78 HydrophobicContact CD2-CG 4.43Å; L75-Q78 PolarHBondContact O-N 3.29Å
79	F	39	Very low	48.3	Very low	207 Å²	207	123.1 Å²	123.1	91%	0.908	67%	0.665	S	S	*	*	S	Bend	trans	58.7	99	178.1	-81.8	-102.9	0	0	0	114.6	S77 E81	S77-F79 PolarHBondContact O-N 3.08Å; F79-E81 PolarHBondContact O-N 3.3Å
80	D	43.5	Very low	48	Very low	164 Å²	164	126.3 Å²	126.3	88%	0.877	68%	0.677	S	S	*	*	S	Bend	trans	-23.4	112.4	174.8	-108.3	-33.2	0	0	0	116.4	G82	D80-G82 PolarHBondContact O-N 3.13Å
81	E	45	Very low	47.8	Very low	204 Å²	204	126.8 Å²	126.8	95%	0.953	68%	0.678	S	S	*	*	S	Bend	trans	-2.7	91.4	176.1	-160	145.2	-165.2	0	0	120.1	F79	F79-E81 PolarHBondContact O-N 3.3Å
82	G	43	Very low	48.2	Very low	75 Å²	75	128.6 Å²	128.6	77%	0.773	70%	0.695	S	S	*	*			trans	177.6	74.1	169.9	0	0	0	0	0	116.7	D80	D80-G82 PolarHBondContact O-N 3.13Å
83	S	43.9	Very low	48.6	Very low	123 Å²	123	131.8 Å²	131.8	86%	0.86	72%	0.723	S	S	*	*			trans	-150.3	92.5	152.6	-158.5	0	0	0	0	110.2
84	S	49.3	Very low	49.5	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	75%	0.745	S	S	*	*			trans	-78.4	117	165.4	176.6	0	0	0	0	108.3
85	S	49.1	Very low	50.1	Low	98 Å²	98	130.6 Å²	130.6	69%	0.685	73%	0.729	S	S	*	*			trans	57.6	113.8	153.9	55.7	0	0	0	0	117.9
86	Q	44.2	Very low	51.9	Low	169 Å²	169	132.5 Å²	132.5	79%	0.79	74%	0.739	S	S	*	*				-167.9	138.1	99.5	-167	155.5	12.4	0	0	110.2
87	E	49.7	Very low	53.4	Low	147 Å²	147	132.8 Å²	132.8	69%	0.687	75%	0.753	S	S	*	*			trans	-47.6	140.7	172.1	58.7	-129.5	116.4	0	0	113.7
88	E	42.2	Very low	55	Low	175 Å²	175	131.1 Å²	131.1	82%	0.818	75%	0.745	S	S	*	*			trans	172.9	146.7	137.6	-81.6	-45.3	127.1	0	0	108.1
89	E	58.8	Low	56.8	Low	187 Å²	187	129.2 Å²	129.2	87%	0.874	74%	0.736	S	S	*	*			trans	-68.4	159.4	-168.5	-60.4	-178	129.7	0	0	115.7
90	E	48	Very low	59.1	Low	184 Å²	184	120.4 Å²	120.4	86%	0.86	70%	0.698	S	S	*	*			trans	86.2	154.1	170.1	-74.9	-137.3	126	0	0	121.3
91	P	47.1	Very low	61.2	Low	106 Å²	106	117.4 Å²	117.4	69%	0.688	68%	0.679	S	S	*	*				-107.6	155.7	-53.4	35.7	-23.9	0	0	0	109.8	S93	P91-S93 PolarHBondContact O-N 3.13Å
92	S	54.3	Low	63.3	Low	128 Å²	128	113.8 Å²	113.8	90%	0.895	66%	0.66	S	S	*	*			trans	-58.6	102.2	179.2	-53.2	0	0	0	0	111.8	S94	S92-S94 PolarHBondContact O-N 2.97Å
93	S	60	Low	65.5	Low	107 Å²	107	115.5 Å²	115.5	75%	0.748	65%	0.649	S	S	*	*			trans	-65.1	96.1	171.6	174.7	0	0	0	0	109.2	P91 V95	P91-S93 PolarHBondContact O-N 3.13Å; S93-V95 PolarHBondContact O-N 2.87Å; S93-V95 VanDerWaalsContact O-N 3.13Å
94	S	68.5	Low	67.6	Low	114 Å²	114	110.4 Å²	110.4	80%	0.797	61%	0.611	S	S	*	*			trans	-70.7	103.6	168.7	68	0	0	0	0	107.9	S92 D96	S92-S94 PolarHBondContact O-N 2.97Å; S94-D96 PolarHBondContact O-N 2.89Å
95	V	69.1	Low	69.6	Low	53 Å²	53	109.2 Å²	109.2	32%	0.321	59%	0.594	S	S	.	*			trans	-59.3	125.5	174.9	174.4	0	0	0	0	109.4	L75 S93 P97 L100	L75-V95 HydrophobicContact CD1-CB 4.08Å; L75-V95 HydrophobicContact CD1-CG1 4.15Å; L75-V95 HydrophobicContact CD2-CB 4.26Å; L75-V95 HydrophobicContact CD2-CG2 4.07Å; S93-V95 PolarHBondContact O-N 2.87Å; S93-V95 VanDerWaalsContact O-N 3.13Å; V95-P97 WeakPolarHBondContact O-CD 3.11Å; V95-L100 HydrophobicContact CG1-CB 4.42Å
96	D	84.3	Confident	71.7	Confident	93 Å²	93	107.6 Å²	107.6	50%	0.497	58%	0.575	S	S	.	*			trans	-65.4	123.4	177.1	176.5	10.5	0	0	0	110.2	S94 A98 Q99 L100	S94-D96 PolarHBondContact O-N 2.89Å; D96-A98 PolarHBondContact O-N 2.76Å; D96-A98 VanDerWaalsContact O-N 3.13Å; D96-A98 PolarHBondContact OD1-N 3.06Å; D96-A98 VanDerWaalsContact OD1-N 3.1Å; D96-Q99 HydrophobicContact CB-CB 4.3Å; D96-Q99 PolarHBondContact O-N 2.95Å; D96-Q99 VanDerWaalsContact O-N 3.08Å; D96-L100 PolarHBondContact O-N 2.91Å
97	P	82.6	Confident	74.1	Confident	97 Å²	97	100.5 Å²	100.5	63%	0.63	55%	0.545	S	S	*	.	H	α-helix	trans	-50	-35.8	176.1	-29	35.2	0	0	0	114.5	V95 L100 E101	V95-P97 WeakPolarHBondContact O-CD 3.11Å; P97-L100 PolarHBondContact O-N 3.19Å; P97-E101 PolarHBondContact O-N 3.41Å; P97-E101 VanDerWaalsContact O-N 3.09Å
98	A	86.2	Confident	76.3	Confident	58 Å²	58	94.4 Å²	94.4	48%	0.479	52%	0.517	S	S	.	.	H	α-helix	trans	-69	-36.7	-179.3	0	0	0	0	0	112.5	D96 E101 F102	D96-A98 PolarHBondContact O-N 2.76Å; D96-A98 VanDerWaalsContact O-N 3.13Å; D96-A98 PolarHBondContact OD1-N 3.06Å; D96-A98 VanDerWaalsContact OD1-N 3.1Å; A98-E101 PolarHBondContact O-N 2.97Å; A98-F102 PolarHBondContact O-N 2.99Å; A98-F102 VanDerWaalsContact O-N 3.11Å
99	Q	85.6	Confident	78.8	Confident	113 Å²	113	91.8 Å²	91.8	53%	0.528	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-41	177	-175.2	178.6	58.6	0	0	111.1	D96 E101 F102 M103	D96-Q99 HydrophobicContact CB-CB 4.3Å; D96-Q99 PolarHBondContact O-N 2.95Å; D96-Q99 VanDerWaalsContact O-N 3.08Å; Q99-E101 VanDerWaalsContact C-N 3.34Å; Q99-F102 PolarHBondContact O-N 3.3Å; Q99-M103 WeakPolarHBondContact O-CG 3.32Å; Q99-M103 PolarHBondContact O-N 2.99Å
100	L	86.6	Confident	80.7	Confident	23 Å²	23	88 Å²	88	12%	0.12	49%	0.489	C	S	.	.	H	α-helix	trans	-66.6	-37.8	178.5	-170.9	63.8	0	0	0	112.3	Y72 L75 V95 D96 P97 M103 F104	Y72-L100 HydrophobicContact CD1-CG 4.18Å; Y72-L100 HydrophobicContact CD2-CB 4.22Å; Y72-L100 HydrophobicContact CD2-CD2 3.55Å; Y72-L100 HydrophobicContact CD2-CG 3.69Å; Y72-L100 HydrophobicContact CE2-CG 4.45Å; Y72-L100 HydrophobicContact CG-CD2 3.54Å; Y72-L100 HydrophobicContact CG-CG 3.55Å; L75-L100 HydrophobicContact CD1-CD2 3.4Å; L75-L100 VanDerWaalsContact CD1-CD2 3.4Å; L75-L100 HydrophobicContact CG-CD2 4.36Å; V95-L100 HydrophobicContact CG1-CB 4.42Å; D96-L100 PolarHBondContact O-N 2.91Å; P97-L100 PolarHBondContact O-N 3.19Å; L100-M103 PolarHBondContact O-N 3.49Å; L100-F104 WeakPolarHBondContact O-CB 3.47Å; L100-F104 PolarHBondContact O-N 3.34Å
101	E	87.6	Confident	83	Confident	101 Å²	101	81 Å²	81	47%	0.472	46%	0.456	S	S	.	.	H	α-helix	trans	-60.1	-46.9	172.7	174.4	161.1	-158	0	0	112.2	Y72 P97 A98 Q99 M103 F104 Q105	Y72-E101 HydrophobicContact CE2-CB 3.9Å; Y72-E101 WeakPolarHBondContact OH-CA 3.17Å; Y72-E101 WeakPolarHBondContact OH-CB 3.16Å; Y72-E101 WeakPolarHBondContact OH-CG 3.42Å; P97-E101 PolarHBondContact O-N 3.41Å; P97-E101 VanDerWaalsContact O-N 3.09Å; A98-E101 PolarHBondContact O-N 2.97Å; Q99-E101 VanDerWaalsContact C-N 3.34Å; E101-M103 PolarHBondContact O-N 3.19Å; E101-F104 PolarHBondContact O-N 3.47Å; E101-Q105 WeakPolarHBondContact O-CG 3.38Å; E101-Q105 PolarHBondContact O-N 2.68Å
102	F	88.7	Confident	85.5	Confident	128 Å²	128	76.8 Å²	76.8	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-58.5	-48.5	175.6	177.5	-97.8	0	0	0	112	A98 Q99 F104 Q105 E106	A98-F102 PolarHBondContact O-N 2.99Å; A98-F102 VanDerWaalsContact O-N 3.11Å; Q99-F102 PolarHBondContact O-N 3.3Å; F102-F104 VanDerWaalsContact C-N 3.29Å; F102-F104 PolarHBondContact O-N 3.38Å; F102-Q105 PolarHBondContact O-N 3.02Å; F102-E106 HydrophobicContact CD1-CG 4.3Å; F102-E106 HydrophobicContact CE1-CG 3.76Å; F102-E106 HydrophobicContact CE2-CG 4.17Å; F102-E106 HydrophobicContact CZ-CG 3.68Å; F102-E106 PolarHBondContact O-N 3.2Å
103	M	89.5	Confident	87.6	Confident	111 Å²	111	72.9 Å²	72.9	55%	0.547	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-40.3	179.1	-70.7	-179.9	70.1	0	0	112.4	Q99 L100 E101 E106 A107	Q99-M103 WeakPolarHBondContact O-CG 3.32Å; Q99-M103 PolarHBondContact O-N 2.99Å; L100-M103 PolarHBondContact O-N 3.49Å; E101-M103 PolarHBondContact O-N 3.19Å; M103-E106 PolarHBondContact O-N 3.4Å; M103-A107 WeakPolarHBondContact O-CB 3.09Å; M103-A107 PolarHBondContact O-N 2.77Å
104	F	89.1	Confident	89.4	Confident	15 Å²	15	72 Å²	72	7%	0.066	39%	0.387	C	S	.	.	H	α-helix	trans	-67	-41.3	177.4	177	-101.9	0	0	0	112.4	Y72 W76 L100 E101 F102 E106 A107 L108 Y142 Y145	Y72-F104 HydrophobicContact CD1-CB 3.67Å; Y72-F104 HydrophobicContact CD1-CD1 4.4Å; Y72-F104 HydrophobicContact CD1-CD2 4.2Å; Y72-F104 AromaticContact CD1-CG 3.83Å; Y72-F104 HydrophobicContact CD1-CG 3.83Å; Y72-F104 HydrophobicContact CE1-CB 3.26Å; Y72-F104 AromaticContact CE1-CD1 3.61Å; Y72-F104 HydrophobicContact CE1-CD1 3.61Å; Y72-F104 HydrophobicContact CE1-CD2 4.2Å; Y72-F104 AromaticContact CE1-CG 3.41Å; Y72-F104 HydrophobicContact CE1-CG 3.41Å; Y72-F104 VanDerWaalsContact CE1-CG 3.41Å; W76-F104 HydrophobicContact CE3-CD2 4.28Å; W76-F104 HydrophobicContact CH2-CD2 4.22Å; W76-F104 HydrophobicContact CH2-CE2 4.04Å; W76-F104 AromaticContact CZ3-CD2 3.59Å; W76-F104 HydrophobicContact CZ3-CD2 3.59Å; W76-F104 AromaticContact CZ3-CE2 3.63Å; W76-F104 HydrophobicContact CZ3-CE2 3.63Å; L100-F104 WeakPolarHBondContact O-CB 3.47Å; L100-F104 PolarHBondContact O-N 3.34Å; E101-F104 PolarHBondContact O-N 3.47Å; F102-F104 VanDerWaalsContact C-N 3.29Å; F102-F104 PolarHBondContact O-N 3.38Å; F104-E106 VanDerWaalsContact C-N 3.33Å; F104-E106 PolarHBondContact O-N 3Å; F104-A107 PolarHBondContact O-N 3.24Å; F104-L108 HydrophobicContact CD1-CD1 4.07Å; F104-L108 HydrophobicContact CD1-CG 4.35Å; F104-L108 HydrophobicContact CE1-CD1 3.35Å; F104-L108 HydrophobicContact CE1-CD2 4.43Å; F104-L108 HydrophobicContact CE1-CG 3.82Å; F104-L108 HydrophobicContact CE2-CD2 4.37Å; F104-L108 HydrophobicContact CE2-CG 4.29Å; F104-L108 HydrophobicContact CZ-CD1 3.66Å; F104-L108 HydrophobicContact CZ-CD2 3.89Å; F104-L108 HydrophobicContact CZ-CG 3.74Å; F104-L108 PolarHBondContact O-N 2.92Å; F104-Y142 HydrophobicContact CD2-CE1 4.36Å; F104-Y142 HydrophobicContact CE2-CD1 4.19Å; F104-Y142 AromaticContact CE2-CE1 3.95Å; F104-Y142 HydrophobicContact CE2-CE1 3.95Å; F104-Y145 HydrophobicContact CE1-CE1 4.09Å; F104-Y145 HydrophobicContact CE2-CD2 4.3Å; F104-Y145 AromaticContact CE2-CE2 3.79Å; F104-Y145 HydrophobicContact CE2-CE2 3.79Å; F104-Y145 HydrophobicContact CZ-CD1 4.06Å; F104-Y145 AromaticContact CZ-CD2 3.87Å; F104-Y145 HydrophobicContact CZ-CD2 3.87Å; F104-Y145 AromaticContact CZ-CE1 3.62Å; F104-Y145 HydrophobicContact CZ-CE1 3.62Å; F104-Y145 AromaticContact CZ-CE2 3.4Å; F104-Y145 HydrophobicContact CZ-CE2 3.4Å; F104-Y145 VanDerWaalsContact CZ-CE2 3.4Å; F104-Y145 HydrophobicContact CZ-CG 4.17Å; F104-Y145 AromaticContact CZ-CZ 3.26Å
105	Q	91.5	Very high	90.8	Very high	86 Å²	86	66.6 Å²	66.6	40%	0.402	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-42.5	175	-68.6	-65.8	-14.9	0	0	111.4	E101 F102 A107 L108 K109	E101-Q105 WeakPolarHBondContact O-CG 3.38Å; E101-Q105 PolarHBondContact O-N 2.68Å; F102-Q105 PolarHBondContact O-N 3.02Å; Q105-A107 VanDerWaalsContact C-N 3.34Å; Q105-L108 PolarHBondContact O-N 3.34Å; Q105-K109 WeakPolarHBondContact O-CG 3.47Å; Q105-K109 PolarHBondContact O-N 3.38Å
106	E	93.1	Very high	92.2	Very high	65 Å²	65	64.5 Å²	64.5	30%	0.304	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-41.8	173.5	-71.6	-55.3	123.7	0	0	111.8	F102 M103 F104 L108 K109 L110	F102-E106 HydrophobicContact CD1-CG 4.3Å; F102-E106 HydrophobicContact CE1-CG 3.76Å; F102-E106 HydrophobicContact CE2-CG 4.17Å; F102-E106 HydrophobicContact CZ-CG 3.68Å; F102-E106 PolarHBondContact O-N 3.2Å; M103-E106 PolarHBondContact O-N 3.4Å; F104-E106 VanDerWaalsContact C-N 3.33Å; F104-E106 PolarHBondContact O-N 3Å; E106-L108 VanDerWaalsContact C-N 3.33Å; E106-L108 PolarHBondContact O-N 2.82Å; E106-K109 WeakPolarHBondContact O-CB 3.4Å; E106-K109 PolarHBondContact O-N 2.99Å; E106-K109 VanDerWaalsContact O-N 3.16Å; E106-K109 IonicContact OE1-NZ 3.93Å; E106-K109 PolarHBondContact OE1-NZ 3.46Å; E106-L110 WeakPolarHBondContact O-CG 3.18Å; E106-L110 PolarHBondContact O-N 3Å
107	A	93.8	Very high	92.9	Very high	19 Å²	19	66.5 Å²	66.5	16%	0.157	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-38.7	176.2	0	0	0	0	0	112.7	M103 F104 Q105 L110 K111 Y142	M103-A107 WeakPolarHBondContact O-CB 3.09Å; M103-A107 PolarHBondContact O-N 2.77Å; F104-A107 PolarHBondContact O-N 3.24Å; Q105-A107 VanDerWaalsContact C-N 3.34Å; A107-L110 PolarHBondContact O-N 3.06Å; A107-K111 WeakPolarHBondContact O-CG 3.32Å; A107-K111 PolarHBondContact O-N 3.3Å; A107-Y142 HydrophobicContact CB-CE1 4.12Å; A107-Y142 VanDerWaalsContact CB-OH 3.29Å; A107-Y142 WeakPolarHBondContact CB-OH 3.41Å
108	L	95.3	Very high	93.7	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.099	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-42.5	172.6	-73.5	-176.9	0	0	0	112	F104 Q105 E106 L110 K111 V112 Y142 Y145 I149	F104-L108 HydrophobicContact CD1-CD1 4.07Å; F104-L108 HydrophobicContact CD1-CG 4.35Å; F104-L108 HydrophobicContact CE1-CD1 3.35Å; F104-L108 HydrophobicContact CE1-CD2 4.43Å; F104-L108 HydrophobicContact CE1-CG 3.82Å; F104-L108 HydrophobicContact CE2-CD2 4.37Å; F104-L108 HydrophobicContact CE2-CG 4.29Å; F104-L108 HydrophobicContact CZ-CD1 3.66Å; F104-L108 HydrophobicContact CZ-CD2 3.89Å; F104-L108 HydrophobicContact CZ-CG 3.74Å; F104-L108 PolarHBondContact O-N 2.92Å; Q105-L108 PolarHBondContact O-N 3.34Å; E106-L108 VanDerWaalsContact C-N 3.33Å; E106-L108 PolarHBondContact O-N 2.82Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 3.08Å; L108-K111 PolarHBondContact O-N 2.74Å; L108-V112 WeakPolarHBondContact O-CG2 3.32Å; L108-V112 PolarHBondContact O-N 3.45Å; L108-Y142 HydrophobicContact CD2-CD1 3.84Å; L108-Y142 HydrophobicContact CD2-CE1 4.39Å; L108-Y145 HydrophobicContact CD2-CD1 4.44Å; L108-Y145 HydrophobicContact CD2-CD2 4.37Å; L108-Y145 HydrophobicContact CD2-CG 3.96Å; L108-I149 HydrophobicContact CD2-CD1 3.97Å; L108-I149 HydrophobicContact CD2-CG1 4.13Å
109	K	96.1	Very high	94.2	Very high	120 Å²	120	61.1 Å²	61.1	52%	0.522	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-42.7	175.5	-69.8	173.3	-170.9	170.9	0	111.5	Q105 E106 K111 V112 A113	Q105-K109 WeakPolarHBondContact O-CG 3.47Å; Q105-K109 PolarHBondContact O-N 3.38Å; E106-K109 WeakPolarHBondContact O-CB 3.4Å; E106-K109 PolarHBondContact O-N 2.99Å; E106-K109 VanDerWaalsContact O-N 3.16Å; E106-K109 IonicContact OE1-NZ 3.93Å; E106-K109 PolarHBondContact OE1-NZ 3.46Å; K109-K111 VanDerWaalsContact C-N 3.34Å; K109-K111 PolarHBondContact O-N 2.98Å; K109-V112 WeakPolarHBondContact O-CB 3.44Å; K109-V112 PolarHBondContact O-N 2.9Å; K109-A113 PolarHBondContact O-N 3.19Å
110	L	97	Very high	94.8	Very high	109 Å²	109	57.6 Å²	57.6	57%	0.571	28%	0.283	S	S	*	.	H	α-helix	trans	-60	-44.4	174.6	-70.5	172.3	0	0	0	111.2	E106 A107 L108 V112 A113 E114	E106-L110 WeakPolarHBondContact O-CG 3.18Å; E106-L110 PolarHBondContact O-N 3Å; A107-L110 PolarHBondContact O-N 3.06Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 3.08Å; L110-V112 VanDerWaalsContact C-N 3.31Å; L110-V112 PolarHBondContact O-N 3.22Å; L110-A113 PolarHBondContact O-N 3.46Å; L110-E114 WeakPolarHBondContact O-CG 3.4Å; L110-E114 PolarHBondContact O-N 3.04Å
111	K	97.6	Very high	95.3	Very high	37 Å²	37	61.9 Å²	61.9	16%	0.161	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-34.6	177.2	-68.3	-70.9	154.3	-158.9	0	113.2	A107 L108 K109 E114 L115 V138 Y142 I149	A107-K111 WeakPolarHBondContact O-CG 3.32Å; A107-K111 PolarHBondContact O-N 3.3Å; L108-K111 PolarHBondContact O-N 2.74Å; K109-K111 VanDerWaalsContact C-N 3.34Å; K109-K111 PolarHBondContact O-N 2.98Å; K111-E114 WeakPolarHBondContact CD-OE2 3.47Å; K111-E114 WeakPolarHBondContact CE-OE2 3.2Å; K111-E114 IonicContact NZ-OE1 3.38Å; K111-E114 IonicContact NZ-OE2 2.74Å; K111-E114 PolarHBondContact NZ-OE2 3.48Å; K111-L115 WeakPolarHBondContact O-CB 3.16Å; K111-L115 PolarHBondContact O-N 3.35Å; K111-V138 VanDerWaalsContact CD-O 3.26Å; K111-V138 WeakPolarHBondContact CD-O 3.44Å; K111-V138 PolarHBondContact NZ-O 3.07Å; K111-Y142 HydrophobicContact CD-CD2 3.85Å; K111-Y142 HydrophobicContact CD-CE2 4.19Å; K111-Y142 HydrophobicContact CG-CD2 3.79Å; K111-Y142 HydrophobicContact CG-CE2 4.05Å; K111-Y142 HydrophobicContact CG-CG 4.09Å; K111-I149 HydrophobicContact CB-CD1 3.85Å; K111-I149 HydrophobicContact CB-CG1 4.28Å; K111-I149 HydrophobicContact CB-CG2 4.2Å; K111-I149 HydrophobicContact CG-CD1 4.49Å
112	V	98.5	Very high	95.8	Very high	16 Å²	16	57.7 Å²	57.7	10%	0.097	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-49.5	171.6	171.8	0	0	0	0	110.5	L108 K109 L110 E114 L115 V116 I149 K152 A153 F156	L108-V112 WeakPolarHBondContact O-CG2 3.32Å; L108-V112 PolarHBondContact O-N 3.45Å; K109-V112 WeakPolarHBondContact O-CB 3.44Å; K109-V112 PolarHBondContact O-N 2.9Å; L110-V112 VanDerWaalsContact C-N 3.31Å; L110-V112 PolarHBondContact O-N 3.22Å; V112-E114 PolarHBondContact O-N 2.86Å; V112-L115 PolarHBondContact O-N 3.16Å; V112-V116 WeakPolarHBondContact O-CG2 3.29Å; V112-V116 PolarHBondContact O-N 2.96Å; V112-I149 HydrophobicContact CG2-CB 4.39Å; V112-I149 HydrophobicContact CG2-CG2 4.11Å; V112-K152 HydrophobicContact CG1-CB 3.99Å; V112-K152 HydrophobicContact CG2-CB 3.86Å; V112-A153 HydrophobicContact CG1-CB 4.46Å; V112-F156 HydrophobicContact CG1-CD2 3.81Å; V112-F156 HydrophobicContact CG1-CE2 4.03Å
113	A	98.3	Very high	96.1	Very high	47 Å²	47	55.4 Å²	55.4	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-44.5	179.8	0	0	0	0	0	112.4	K109 L110 L115 V116 H117	K109-A113 PolarHBondContact O-N 3.19Å; L110-A113 PolarHBondContact O-N 3.46Å; A113-L115 VanDerWaalsContact C-N 3.32Å; A113-L115 PolarHBondContact O-N 3.01Å; A113-V116 PolarHBondContact O-N 2.91Å; A113-H117 PolarHBondContact O-CD2 3.22Å; A113-H117 PolarHBondContact O-N 3Å
114	E	98.3	Very high	96.3	Very high	89 Å²	89	59.9 Å²	59.9	42%	0.416	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-41.8	175.2	-73	178.1	169.3	0	0	111.7	L110 K111 V112 H117 F118 V138	L110-E114 WeakPolarHBondContact O-CG 3.4Å; L110-E114 PolarHBondContact O-N 3.04Å; K111-E114 WeakPolarHBondContact CD-OE2 3.47Å; K111-E114 WeakPolarHBondContact CE-OE2 3.2Å; K111-E114 IonicContact NZ-OE1 3.38Å; K111-E114 IonicContact NZ-OE2 2.74Å; K111-E114 PolarHBondContact NZ-OE2 3.48Å; V112-E114 PolarHBondContact O-N 2.86Å; E114-H117 PolarHBondContact O-N 3.38Å; E114-F118 WeakPolarHBondContact O-CB 3.37Å; E114-F118 PolarHBondContact O-N 2.91Å; E114-V138 HydrophobicContact CB-CG1 3.67Å
115	L	98.7	Very high	96.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-40.7	178.1	-178.1	62.7	0	0	0	111.3	K111 V112 A113 H117 F118 L119 M134 V138 I139 I149 F150 A153	K111-L115 WeakPolarHBondContact O-CB 3.16Å; K111-L115 PolarHBondContact O-N 3.35Å; V112-L115 PolarHBondContact O-N 3.16Å; A113-L115 VanDerWaalsContact C-N 3.32Å; A113-L115 PolarHBondContact O-N 3.01Å; L115-H117 VanDerWaalsContact C-N 3.33Å; L115-H117 PolarHBondContact O-N 3.41Å; L115-F118 HydrophobicContact CD1-CD1 4.1Å; L115-F118 PolarHBondContact O-N 3.31Å; L115-L119 HydrophobicContact CD1-CD1 4.43Å; L115-L119 HydrophobicContact CD1-CG 4.21Å; L115-L119 HydrophobicContact CG-CD1 4.03Å; L115-L119 HydrophobicContact CG-CG 4.27Å; L115-L119 WeakPolarHBondContact O-CB 3.42Å; L115-L119 VanDerWaalsContact O-CG 3.23Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.26Å; L115-M134 HydrophobicContact CD1-CB 4.14Å; L115-M134 HydrophobicContact CD1-CG 3.78Å; L115-M134 HydrophobicContact CD1-SD 3.81Å; L115-M134 HydrophobicContact CD2-SD 4.41Å; L115-V138 HydrophobicContact CB-CG1 4.07Å; L115-I139 HydrophobicContact CD2-CD1 4.02Å; L115-I149 HydrophobicContact CB-CG2 4.35Å; L115-I149 HydrophobicContact CD2-CG2 4.07Å; L115-F150 HydrophobicContact CD2-CB 4.39Å; L115-F150 HydrophobicContact CD2-CD2 4.14Å; L115-A153 HydrophobicContact CB-CB 4.06Å; L115-A153 HydrophobicContact CD2-CB 3.53Å; L115-A153 HydrophobicContact CG-CB 3.82Å
116	V	98.6	Very high	96.8	Very high	8 Å²	8	66.8 Å²	66.8	5%	0.048	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-45.8	174.4	168.5	0	0	0	0	110.9	V112 A113 F118 L119 L120 A153 F156 M157 F161	V112-V116 WeakPolarHBondContact O-CG2 3.29Å; V112-V116 PolarHBondContact O-N 2.96Å; A113-V116 PolarHBondContact O-N 2.91Å; V116-F118 PolarHBondContact O-N 2.92Å; V116-L119 PolarHBondContact O-N 3.38Å; V116-L120 HydrophobicContact CG1-CD1 4.01Å; V116-L120 WeakPolarHBondContact O-CG 3.45Å; V116-L120 PolarHBondContact O-N 3.27Å; V116-A153 HydrophobicContact CG2-CB 3.82Å; V116-F156 HydrophobicContact CG2-CB 3.85Å; V116-M157 HydrophobicContact CG1-SD 4.04Å; V116-F161 HydrophobicContact CG1-CD2 4.23Å; V116-F161 HydrophobicContact CG1-CE2 3.53Å; V116-F161 HydrophobicContact CG1-CZ 4.15Å
117	H	98.3	Very high	96.9	Very high	136 Å²	136	68.5 Å²	68.5	63%	0.63	32%	0.324	S	S	*	.	H	α-helix	trans	-62.5	-42.8	177.2	-81	-134.7	0	0	0	112.2	A113 E114 L115 L120 H121	A113-H117 PolarHBondContact O-CD2 3.22Å; A113-H117 PolarHBondContact O-N 3Å; E114-H117 PolarHBondContact O-N 3.38Å; L115-H117 VanDerWaalsContact C-N 3.33Å; L115-H117 PolarHBondContact O-N 3.41Å; H117-L120 PolarHBondContact O-N 2.88Å; H117-H121 PolarHBondContact O-N 3.11Å
118	F	98.4	Very high	97.1	Very high	42 Å²	42	70.9 Å²	70.9	18%	0.184	34%	0.338	C	S	.	.	H	α-helix	trans	-61.6	-43.8	176	176.7	-103.8	0	0	0	112.1	E114 L115 V116 H121 K122 V129 E133 M134 V138	E114-F118 WeakPolarHBondContact O-CB 3.37Å; E114-F118 PolarHBondContact O-N 2.91Å; L115-F118 HydrophobicContact CD1-CD1 4.1Å; L115-F118 PolarHBondContact O-N 3.31Å; V116-F118 PolarHBondContact O-N 2.92Å; F118-H121 WeakPolarHBondContact O-CB 3.42Å; F118-H121 PolarHBondContact O-N 3.35Å; F118-K122 HydrophobicContact CE1-CG 4.31Å; F118-K122 HydrophobicContact CZ-CG 4.29Å; F118-K122 PolarHBondContact O-N 2.79Å; F118-V129 HydrophobicContact CD1-CG2 4.41Å; F118-V129 HydrophobicContact CE1-CG2 3.5Å; F118-V129 VanDerWaalsContact CE1-CG2 3.5Å; F118-V129 HydrophobicContact CZ-CG2 4.21Å; F118-E133 HydrophobicContact CZ-CB 4.49Å; F118-M134 HydrophobicContact CD1-CG 4.4Å; F118-M134 HydrophobicContact CE1-CG 4.01Å; F118-V138 HydrophobicContact CB-CG2 3.82Å; F118-V138 HydrophobicContact CD1-CG2 4.33Å; F118-V138 HydrophobicContact CD2-CG2 4.31Å; F118-V138 HydrophobicContact CG-CG2 3.91Å
119	L	98.2	Very high	97.2	Very high	0 Å²	0	70 Å²	70	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.7	-45.7	176	-73.3	176.5	0	0	0	111.4	L115 V116 H121 K122 Y123 V129 M134 A153 M157 V165 L177	L115-L119 HydrophobicContact CD1-CD1 4.43Å; L115-L119 HydrophobicContact CD1-CG 4.21Å; L115-L119 HydrophobicContact CG-CD1 4.03Å; L115-L119 HydrophobicContact CG-CG 4.27Å; L115-L119 WeakPolarHBondContact O-CB 3.42Å; L115-L119 VanDerWaalsContact O-CG 3.23Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.26Å; V116-L119 PolarHBondContact O-N 3.38Å; L119-H121 VanDerWaalsContact C-N 3.25Å; L119-H121 PolarHBondContact O-N 3.31Å; L119-K122 PolarHBondContact O-N 3.05Å; L119-K122 VanDerWaalsContact O-N 3.14Å; L119-Y123 PolarHBondContact O-N 3.14Å; L119-V129 HydrophobicContact CD2-CG1 3.85Å; L119-V129 HydrophobicContact CD2-CG2 4.49Å; L119-M134 HydrophobicContact CD2-SD 4.47Å; L119-A153 HydrophobicContact CD1-CB 4.33Å; L119-M157 HydrophobicContact CB-CE 3.97Å; L119-M157 HydrophobicContact CB-CG 4.28Å; L119-M157 HydrophobicContact CB-SD 3.81Å; L119-M157 HydrophobicContact CD1-CG 3.9Å; L119-M157 HydrophobicContact CD1-SD 4.49Å; L119-V165 HydrophobicContact CD1-CG2 4.18Å; L119-L177 HydrophobicContact CB-CD2 3.83Å; L119-L177 HydrophobicContact CD2-CD1 4.49Å; L119-L177 HydrophobicContact CD2-CD2 4.19Å; L119-L177 WeakPolarHBondContact O-CD2 3.45Å
120	L	97.3	Very high	97.3	Very high	39 Å²	39	66.1 Å²	66.1	20%	0.204	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-39	173.7	-78.2	164.5	0	0	0	112.5	V116 H117 Y123 R124 M157 F161	V116-L120 HydrophobicContact CG1-CD1 4.01Å; V116-L120 WeakPolarHBondContact O-CG 3.45Å; V116-L120 PolarHBondContact O-N 3.27Å; H117-L120 PolarHBondContact O-N 2.88Å; L120-Y123 WeakPolarHBondContact O-CB 3.19Å; L120-Y123 PolarHBondContact O-N 3.37Å; L120-R124 WeakPolarHBondContact O-CG 3.39Å; L120-R124 PolarHBondContact O-N 3.01Å; L120-M157 HydrophobicContact CD2-CE 4.2Å; L120-M157 HydrophobicContact CD2-SD 4.41Å; L120-M157 HydrophobicContact CG-CE 4.24Å; L120-M157 HydrophobicContact CG-SD 4Å; L120-F161 HydrophobicContact CD1-CD1 4.05Å; L120-F161 HydrophobicContact CD1-CD2 4.45Å; L120-F161 HydrophobicContact CD1-CE1 3.63Å; L120-F161 HydrophobicContact CD1-CE2 4.08Å; L120-F161 HydrophobicContact CD1-CG 4.44Å; L120-F161 HydrophobicContact CD1-CZ 3.65Å; L120-F161 HydrophobicContact CD2-CB 4.3Å; L120-F161 HydrophobicContact CD2-CD1 3.71Å; L120-F161 HydrophobicContact CD2-CE1 4.15Å; L120-F161 HydrophobicContact CD2-CG 3.93Å; L120-F161 HydrophobicContact CG-CD1 4.45Å; L120-F161 HydrophobicContact CG-CE1 4.49Å
121	H	97.3	Very high	97.4	Very high	112 Å²	112	64.1 Å²	64.1	52%	0.519	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-50.9	174.5	-178.7	69.6	0	0	0	111.2	H117 F118 L119 Y123 R124 V125	H117-H121 PolarHBondContact O-N 3.11Å; F118-H121 WeakPolarHBondContact O-CB 3.42Å; F118-H121 PolarHBondContact O-N 3.35Å; L119-H121 VanDerWaalsContact C-N 3.25Å; L119-H121 PolarHBondContact O-N 3.31Å; H121-Y123 VanDerWaalsContact C-N 3.28Å; H121-Y123 PolarHBondContact O-N 3.27Å; H121-R124 WeakPolarHBondContact O-CB 3.44Å; H121-R124 PolarHBondContact O-N 3.36Å; H121-V125 WeakPolarHBondContact O-CG2 3.5Å; H121-V125 PolarHBondContact O-N 2.83Å; H121-V125 VanDerWaalsContact O-N 3.08Å
122	K	97.4	Very high	97.4	Very high	14 Å²	14	65.5 Å²	65.5	6%	0.061	32%	0.324	C	S	.	.	H	α-helix	trans	-56	-40.4	175.6	-75.9	-73.9	-169.5	167.3	0	112.5	F118 L119 V125 K126 E127 P128 V129 E133 L177	F118-K122 HydrophobicContact CE1-CG 4.31Å; F118-K122 HydrophobicContact CZ-CG 4.29Å; F118-K122 PolarHBondContact O-N 2.79Å; L119-K122 PolarHBondContact O-N 3.05Å; L119-K122 VanDerWaalsContact O-N 3.14Å; K122-V125 WeakPolarHBondContact O-CG2 3.23Å; K122-V125 PolarHBondContact O-N 3.19Å; K122-K126 PolarHBondContact O-N 3.2Å; K122-E127 HydrophobicContact CD-CB 3.89Å; K122-E127 IonicContact NZ-OE2 2.98Å; K122-E127 PolarHBondContact NZ-OE2 2.94Å; K122-E127 PolarHBondContact O-N 3.29Å; K122-E127 VanDerWaalsContact O-N 3.08Å; K122-P128 PolarHBondContact NZ-O 3.49Å; K122-V129 HydrophobicContact CD-CB 4.39Å; K122-V129 HydrophobicContact CG-CB 4.18Å; K122-V129 HydrophobicContact CG-CG2 4.43Å; K122-E133 IonicContact NZ-OE1 3.12Å; K122-E133 PolarHBondContact NZ-OE1 3.17Å; K122-E133 VanDerWaalsContact NZ-OE1 3.12Å; K122-L177 HydrophobicContact CB-CD1 4.06Å
123	Y	95.9	Very high	97.4	Very high	79 Å²	79	68.1 Å²	68.1	31%	0.31	34%	0.335	S	S	.	.	H	α-helix	trans	-59.9	-46	173.6	177.1	-108.1	0	0	0	112.4	L119 L120 H121 V125 K126 T163 L177 T179	L119-Y123 PolarHBondContact O-N 3.14Å; L120-Y123 WeakPolarHBondContact O-CB 3.19Å; L120-Y123 PolarHBondContact O-N 3.37Å; H121-Y123 VanDerWaalsContact C-N 3.28Å; H121-Y123 PolarHBondContact O-N 3.27Å; Y123-V125 PolarHBondContact O-N 2.83Å; Y123-K126 PolarHBondContact O-N 3.01Å; Y123-K126 VanDerWaalsContact O-N 3.15Å; Y123-T163 HydrophobicContact CD2-CG2 3.97Å; Y123-T163 HydrophobicContact CE2-CG2 4.2Å; Y123-T163 HydrophobicContact CG-CG2 4.46Å; Y123-L177 HydrophobicContact CD2-CB 3.78Å; Y123-L177 HydrophobicContact CG-CB 4.39Å; Y123-T179 PolarHBondContact OH-OG1 2.99Å
124	R	94.1	Very high	97.4	Very high	206 Å²	206	65.9 Å²	65.9	78%	0.777	32%	0.317	S	S	*	.	H	α-helix	trans	-65	-39	-179.5	-71.1	179.1	73.3	132.9	6.8	113	L120 H121 K126	L120-R124 WeakPolarHBondContact O-CG 3.39Å; L120-R124 PolarHBondContact O-N 3.01Å; H121-R124 WeakPolarHBondContact O-CB 3.44Å; H121-R124 PolarHBondContact O-N 3.36Å; R124-K126 VanDerWaalsContact C-N 3.25Å
125	V	95.8	Very high	97.4	Very high	69 Å²	69	63.2 Å²	63.2	42%	0.418	31%	0.306	S	S	.	.	H	α-helix	trans	-83.6	-2.5	176.9	-58.5	0	0	0	0	113	H121 K122 Y123 E127	H121-V125 WeakPolarHBondContact O-CG2 3.5Å; H121-V125 PolarHBondContact O-N 2.83Å; H121-V125 VanDerWaalsContact O-N 3.08Å; K122-V125 WeakPolarHBondContact O-CG2 3.23Å; K122-V125 PolarHBondContact O-N 3.19Å; Y123-V125 PolarHBondContact O-N 2.83Å; V125-E127 VanDerWaalsContact C-N 3.26Å; V125-E127 HydrophobicContact CB-CG 4.45Å; V125-E127 HydrophobicContact CG2-CB 3.92Å; V125-E127 HydrophobicContact CG2-CG 3.76Å; V125-E127 PolarHBondContact O-N 3.28Å
126	K	94.3	Very high	97.3	Very high	176 Å²	176	70.1 Å²	70.1	77%	0.765	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	38.2	-179.2	-57.6	-173.1	176.6	-174.9	0	113.2	K122 Y123 R124	K122-K126 PolarHBondContact O-N 3.2Å; Y123-K126 PolarHBondContact O-N 3.01Å; Y123-K126 VanDerWaalsContact O-N 3.15Å; R124-K126 VanDerWaalsContact C-N 3.25Å
127	E	96.6	Very high	97.1	Very high	102 Å²	102	72.5 Å²	72.5	48%	0.477	36%	0.355	S	S	.	.			trans	-101.3	145.4	176.6	-73.2	-175.9	178.6	0	0	111.8	K122 V125	K122-E127 HydrophobicContact CD-CB 3.89Å; K122-E127 IonicContact NZ-OE2 2.98Å; K122-E127 PolarHBondContact NZ-OE2 2.94Å; K122-E127 PolarHBondContact O-N 3.29Å; K122-E127 VanDerWaalsContact O-N 3.08Å; V125-E127 VanDerWaalsContact C-N 3.26Å; V125-E127 HydrophobicContact CB-CG 4.45Å; V125-E127 HydrophobicContact CG2-CB 3.92Å; V125-E127 HydrophobicContact CG2-CG 3.76Å; V125-E127 PolarHBondContact O-N 3.28Å
128	P	97.1	Very high	97	Very high	69 Å²	69	66.6 Å²	66.6	45%	0.448	33%	0.328	S	S	.	.			trans	-65.2	160.9	165.4	30.3	-33.7	0	0	0	110.8	K122 Y175 I176	K122-P128 PolarHBondContact NZ-O 3.49Å; P128-Y175 WeakPolarHBondContact CA-O 3.5Å; P128-I176 HydrophobicContact CB-CG2 4.42Å
129	V	98.2	Very high	96.7	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.6	177.7	61.6	0	0	0	0	109.6	F118 L119 K122 M134 Y175 L177	F118-V129 HydrophobicContact CD1-CG2 4.41Å; F118-V129 HydrophobicContact CE1-CG2 3.5Å; F118-V129 VanDerWaalsContact CE1-CG2 3.5Å; F118-V129 HydrophobicContact CZ-CG2 4.21Å; L119-V129 HydrophobicContact CD2-CG1 3.85Å; L119-V129 HydrophobicContact CD2-CG2 4.49Å; K122-V129 HydrophobicContact CD-CB 4.39Å; K122-V129 HydrophobicContact CG-CB 4.18Å; K122-V129 HydrophobicContact CG-CG2 4.43Å; V129-M134 HydrophobicContact CG1-CE 4.23Å; V129-M134 HydrophobicContact CG2-CE 4.04Å; V129-M134 HydrophobicContact CG2-CG 3.73Å; V129-M134 HydrophobicContact CG2-SD 4.37Å; V129-Y175 PolarHBondContact N-O 3.35Å; V129-Y175 WeakPolarHBondContact O-CD2 3.41Å; V129-Y175 PolarHBondContact O-N 2.98Å; V129-L177 HydrophobicContact CG1-CD1 3.92Å
130	T	98.4	Very high	96.4	Very high	39 Å²	39	70.6 Å²	70.6	24%	0.239	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	154.8	177.3	64	0	0	0	0	111.5	A132 E133 M134 H173	T130-A132 PolarHBondContact O-N 2.95Å; T130-E133 PolarHBondContact N-OE2 3.08Å; T130-E133 PolarHBondContact O-N 3.14Å; T130-E133 WeakPolarHBondContact OG1-CB 3.29Å; T130-E133 VanDerWaalsContact OG1-CG 3.25Å; T130-E133 WeakPolarHBondContact OG1-CG 3.44Å; T130-E133 PolarHBondContact OG1-N 3.48Å; T130-E133 PolarHBondContact OG1-OE2 2.98Å; T130-M134 PolarHBondContact O-N 3.17Å; T130-M134 VanDerWaalsContact O-N 3.13Å; T130-H173 CarbonylContact C-O 3.57Å; T130-H173 WeakPolarHBondContact CA-O 3.49Å
131	K	98.3	Very high	96.2	Very high	67 Å²	67	74.4 Å²	74.4	29%	0.291	37%	0.366	S	S	.	.	H	α-helix	trans	-55.8	-38.4	170.2	179.3	172	178.7	-177.5	0	112.3	M134 L135 F146 H173 Y175	K131-M134 PolarHBondContact O-N 2.99Å; K131-L135 HydrophobicContact CG-CD1 3.93Å; K131-L135 HydrophobicContact CG-CG 4.38Å; K131-L135 WeakPolarHBondContact O-CB 3.4Å; K131-L135 VanDerWaalsContact O-CG 3.23Å; K131-L135 WeakPolarHBondContact O-CG 3.36Å; K131-L135 PolarHBondContact O-N 3.49Å; K131-F146 HydrophobicContact CB-CZ 4.33Å; K131-F146 HydrophobicContact CD-CD1 4.42Å; K131-F146 HydrophobicContact CD-CE1 3.89Å; K131-F146 HydrophobicContact CD-CZ 4.13Å; K131-F146 HydrophobicContact CG-CE1 3.94Å; K131-F146 HydrophobicContact CG-CE2 4.06Å; K131-F146 HydrophobicContact CG-CZ 3.68Å; K131-H173 HydrophobicContact CB-CB 3.61Å; K131-H173 HydrophobicContact CD-CB 4.19Å; K131-H173 PolarHBondContact N-O 3.02Å; K131-Y175 HydrophobicContact CB-CE2 4.28Å
132	A	98	Very high	95.9	Very high	65 Å²	65	70.2 Å²	70.2	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-48.3	178.4	0	0	0	0	0	111.6	T130 M134 L135 E136	T130-A132 PolarHBondContact O-N 2.95Å; A132-M134 PolarHBondContact O-N 3.38Å; A132-L135 PolarHBondContact O-N 3.25Å; A132-E136 WeakPolarHBondContact O-CB 3.36Å; A132-E136 PolarHBondContact O-N 2.86Å
133	E	98	Very high	95.7	Very high	71 Å²	71	75.7 Å²	75.7	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-43.9	176.5	-74.1	168	119.2	0	0	112.1	F118 K122 T130 L135 E136 S137	F118-E133 HydrophobicContact CZ-CB 4.49Å; K122-E133 IonicContact NZ-OE1 3.12Å; K122-E133 PolarHBondContact NZ-OE1 3.17Å; K122-E133 VanDerWaalsContact NZ-OE1 3.12Å; T130-E133 PolarHBondContact N-OE2 3.08Å; T130-E133 PolarHBondContact O-N 3.14Å; T130-E133 WeakPolarHBondContact OG1-CB 3.29Å; T130-E133 VanDerWaalsContact OG1-CG 3.25Å; T130-E133 WeakPolarHBondContact OG1-CG 3.44Å; T130-E133 PolarHBondContact OG1-N 3.48Å; T130-E133 PolarHBondContact OG1-OE2 2.98Å; E133-L135 VanDerWaalsContact C-N 3.31Å; E133-L135 PolarHBondContact O-N 2.88Å; E133-E136 PolarHBondContact O-N 3.36Å; E133-S137 VanDerWaalsContact O-CB 3.31Å; E133-S137 WeakPolarHBondContact O-CB 3.39Å; E133-S137 PolarHBondContact O-N 3.33Å; E133-S137 PolarHBondContact O-OG 3.45Å
134	M	98.3	Very high	95.6	Very high	0 Å²	0	81.3 Å²	81.3	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-62	-39.6	178	-68.5	-176.2	-107.1	0	0	112.1	L115 F118 L119 V129 T130 K131 A132 V138 I139 F146 F150 Y175	L115-M134 HydrophobicContact CD1-CB 4.14Å; L115-M134 HydrophobicContact CD1-CG 3.78Å; L115-M134 HydrophobicContact CD1-SD 3.81Å; L115-M134 HydrophobicContact CD2-SD 4.41Å; F118-M134 HydrophobicContact CD1-CG 4.4Å; F118-M134 HydrophobicContact CE1-CG 4.01Å; L119-M134 HydrophobicContact CD2-SD 4.47Å; V129-M134 HydrophobicContact CG1-CE 4.23Å; V129-M134 HydrophobicContact CG2-CE 4.04Å; V129-M134 HydrophobicContact CG2-CG 3.73Å; V129-M134 HydrophobicContact CG2-SD 4.37Å; T130-M134 PolarHBondContact O-N 3.17Å; T130-M134 VanDerWaalsContact O-N 3.13Å; K131-M134 PolarHBondContact O-N 2.99Å; A132-M134 PolarHBondContact O-N 3.38Å; M134-V138 PolarHBondContact O-N 3.41Å; M134-V138 VanDerWaalsContact O-N 3.14Å; M134-I139 PolarHBondContact O-N 3Å; M134-F146 HydrophobicContact CB-CE2 4.02Å; M134-F146 HydrophobicContact CE-CZ 4.48Å; M134-F146 HydrophobicContact SD-CE2 4.15Å; M134-F146 HydrophobicContact SD-CZ 4.39Å; M134-F150 HydrophobicContact CE-CD2 4.16Å; M134-F150 HydrophobicContact CE-CE2 3.71Å; M134-F150 HydrophobicContact SD-CD2 3.66Å; M134-F150 HydrophobicContact SD-CE2 3.72Å; M134-Y175 HydrophobicContact CE-CD2 3.47Å; M134-Y175 VanDerWaalsContact CE-CD2 3.47Å; M134-Y175 HydrophobicContact CE-CE2 3.68Å; M134-Y175 HydrophobicContact CE-CG 4.4Å
135	L	97.5	Very high	95.7	Very high	34 Å²	34	73.4 Å²	73.4	18%	0.178	36%	0.361	C	S	.	.	H	α-helix	trans	-69.4	-36	177.6	-71.2	171.8	0	0	0	112.4	K131 A132 E133 I139 K140 K143 F146	K131-L135 HydrophobicContact CG-CD1 3.93Å; K131-L135 HydrophobicContact CG-CG 4.38Å; K131-L135 WeakPolarHBondContact O-CB 3.4Å; K131-L135 VanDerWaalsContact O-CG 3.23Å; K131-L135 WeakPolarHBondContact O-CG 3.36Å; K131-L135 PolarHBondContact O-N 3.49Å; A132-L135 PolarHBondContact O-N 3.25Å; E133-L135 VanDerWaalsContact C-N 3.31Å; E133-L135 PolarHBondContact O-N 2.88Å; L135-I139 HydrophobicContact CD2-CB 4.3Å; L135-I139 HydrophobicContact CD2-CG2 4.1Å; L135-I139 CarbonylContact O-C 3.58Å; L135-K140 VanDerWaalsContact O-CA 3.23Å; L135-K140 WeakPolarHBondContact O-CA 3.23Å; L135-K140 PolarHBondContact O-N 2.91Å; L135-K140 VanDerWaalsContact O-N 3.07Å; L135-K143 HydrophobicContact CD2-CB 3.98Å; L135-K143 HydrophobicContact CD2-CG 4.02Å; L135-F146 HydrophobicContact CD2-CB 3.81Å; L135-F146 HydrophobicContact CD2-CD2 3.57Å; L135-F146 HydrophobicContact CD2-CE2 4.48Å; L135-F146 HydrophobicContact CD2-CG 3.91Å; L135-F146 HydrophobicContact CG-CD2 4.01Å; L135-F146 HydrophobicContact CG-CE2 4.47Å
136	E	96.8	Very high	95.7	Very high	145 Å²	145	70.7 Å²	70.7	68%	0.678	34%	0.343	S	S	*	.	H	α-helix	trans	-83.6	-34.2	-178	-175.2	169.5	-161.4	0	0	113	A132 E133 K140	A132-E136 WeakPolarHBondContact O-CB 3.36Å; A132-E136 PolarHBondContact O-N 2.86Å; E133-E136 PolarHBondContact O-N 3.36Å; E136-K140 WeakPolarHBondContact O-CD 3.42Å; E136-K140 WeakPolarHBondContact O-CE 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.5Å
137	S	94.2	Very high	95.9	Very high	58 Å²	58	66.6 Å²	66.6	41%	0.406	34%	0.335	S	S	.	.	H	α-helix	trans	-88.6	-45.7	-176.8	58.2	0	0	0	0	112.9	E133	E133-S137 VanDerWaalsContact O-CB 3.31Å; E133-S137 WeakPolarHBondContact O-CB 3.39Å; E133-S137 PolarHBondContact O-N 3.33Å; E133-S137 PolarHBondContact O-OG 3.45Å
138	V	96.1	Very high	95.9	Very high	11 Å²	11	65.8 Å²	65.8	7%	0.067	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-49	-169.5	-179.7	0	0	0	0	112.3	K111 E114 L115 F118 M134 K140	K111-V138 VanDerWaalsContact CD-O 3.26Å; K111-V138 WeakPolarHBondContact CD-O 3.44Å; K111-V138 PolarHBondContact NZ-O 3.07Å; E114-V138 HydrophobicContact CB-CG1 3.67Å; L115-V138 HydrophobicContact CB-CG1 4.07Å; F118-V138 HydrophobicContact CB-CG2 3.82Å; F118-V138 HydrophobicContact CD1-CG2 4.33Å; F118-V138 HydrophobicContact CD2-CG2 4.31Å; F118-V138 HydrophobicContact CG-CG2 3.91Å; M134-V138 PolarHBondContact O-N 3.41Å; M134-V138 VanDerWaalsContact O-N 3.14Å; V138-K140 PolarHBondContact O-N 2.93Å
139	I	93.8	Very high	95.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.316	C	S	.	.			trans	-98.3	22.3	-165.3	-56.7	169.9	0	0	0	111.9	L115 M134 L135 N141 Y142 K143 F146 I149	L115-I139 HydrophobicContact CD2-CD1 4.02Å; M134-I139 PolarHBondContact O-N 3Å; L135-I139 HydrophobicContact CD2-CB 4.3Å; L135-I139 HydrophobicContact CD2-CG2 4.1Å; L135-I139 CarbonylContact O-C 3.58Å; I139-N141 PolarHBondContact O-N 2.84Å; I139-N141 VanDerWaalsContact O-N 3.11Å; I139-Y142 VanDerWaalsContact CG2-C 3.48Å; I139-Y142 VanDerWaalsContact CG2-O 3.32Å; I139-Y142 WeakPolarHBondContact CG2-O 3.34Å; I139-Y142 CarbonylContact O-C 3.59Å; I139-Y142 PolarHBondContact O-N 2.79Å; I139-K143 PolarHBondContact O-N 3.31Å; I139-F146 HydrophobicContact CD1-CD2 3.62Å; I139-F146 HydrophobicContact CD1-CE2 4.11Å; I139-F146 HydrophobicContact CG2-CB 4.4Å; I139-I149 HydrophobicContact CD1-CB 4.14Å; I139-I149 HydrophobicContact CD1-CG2 3.65Å; I139-I149 HydrophobicContact CG1-CD1 4.39Å; I139-I149 HydrophobicContact CG1-CG2 4.1Å; I139-I149 HydrophobicContact CG2-CD1 3.88Å
140	K	92.1	Very high	95.9	Very high	126 Å²	126	64 Å²	64	55%	0.548	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.8	-57.1	-172.9	-69.4	179	179.2	178.3	0	114.9	L135 E136 V138 K143	L135-K140 VanDerWaalsContact O-CA 3.23Å; L135-K140 WeakPolarHBondContact O-CA 3.23Å; L135-K140 PolarHBondContact O-N 2.91Å; L135-K140 VanDerWaalsContact O-N 3.07Å; E136-K140 WeakPolarHBondContact O-CD 3.42Å; E136-K140 WeakPolarHBondContact O-CE 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.5Å; V138-K140 PolarHBondContact O-N 2.93Å; K140-K143 WeakPolarHBondContact O-CE 3.36Å; K140-K143 VanDerWaalsContact O-CG 3.29Å; K140-K143 WeakPolarHBondContact O-CG 3.41Å
141	N	91.2	Very high	95.9	Very high	119 Å²	119	64 Å²	64	64%	0.636	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-4.3	-176	-54.4	66.7	0	0	0	113	W76 I139	W76-N141 HydrophobicContact CZ2-CB 4.49Å; I139-N141 PolarHBondContact O-N 2.84Å; I139-N141 VanDerWaalsContact O-N 3.11Å
142	Y	92.6	Very high	95.9	Very high	25 Å²	25	65.4 Å²	65.4	10%	0.098	34%	0.335	C	S	.	.			trans	-116.3	23.1	-171.6	-63.4	-95.5	0	0	0	112	W76 F104 A107 L108 K111 I139 R144 Y145 F146	W76-Y142 AromaticContact CH2-CD1 3.83Å; W76-Y142 HydrophobicContact CH2-CD1 3.83Å; W76-Y142 AromaticContact CH2-CE1 3.23Å; W76-Y142 HydrophobicContact CH2-CE1 3.23Å; W76-Y142 HydrophobicContact CH2-CE2 4.28Å; W76-Y142 AromaticContact CH2-CZ 3.47Å; W76-Y142 VanDerWaalsContact CH2-CZ 3.47Å; W76-Y142 HydrophobicContact CZ2-CD1 4.43Å; W76-Y142 AromaticContact CZ2-CE1 3.64Å; W76-Y142 HydrophobicContact CZ2-CE1 3.64Å; W76-Y142 AromaticContact CZ2-CE2 3.91Å; W76-Y142 HydrophobicContact CZ2-CE2 3.91Å; W76-Y142 AromaticContact CZ2-CZ 3.31Å; W76-Y142 WeakPolarHBondContact CZ2-OH 3.21Å; W76-Y142 HydrophobicContact CZ3-CE1 4.19Å; F104-Y142 HydrophobicContact CD2-CE1 4.36Å; F104-Y142 HydrophobicContact CE2-CD1 4.19Å; F104-Y142 AromaticContact CE2-CE1 3.95Å; F104-Y142 HydrophobicContact CE2-CE1 3.95Å; A107-Y142 HydrophobicContact CB-CE1 4.12Å; A107-Y142 VanDerWaalsContact CB-OH 3.29Å; A107-Y142 WeakPolarHBondContact CB-OH 3.41Å; L108-Y142 HydrophobicContact CD2-CD1 3.84Å; L108-Y142 HydrophobicContact CD2-CE1 4.39Å; K111-Y142 HydrophobicContact CD-CD2 3.85Å; K111-Y142 HydrophobicContact CD-CE2 4.19Å; K111-Y142 HydrophobicContact CG-CD2 3.79Å; K111-Y142 HydrophobicContact CG-CE2 4.05Å; K111-Y142 HydrophobicContact CG-CG 4.09Å; I139-Y142 VanDerWaalsContact CG2-C 3.48Å; I139-Y142 VanDerWaalsContact CG2-O 3.32Å; I139-Y142 WeakPolarHBondContact CG2-O 3.34Å; I139-Y142 CarbonylContact O-C 3.59Å; I139-Y142 PolarHBondContact O-N 2.79Å; Y142-R144 PolarHBondContact O-N 3.28Å; Y142-R144 VanDerWaalsContact O-N 3.08Å; Y142-Y145 HydrophobicContact CD1-CD2 4.35Å; Y142-Y145 CarbonylContact O-C 3.49Å; Y142-Y145 WeakPolarHBondContact O-CA 3.38Å; Y142-Y145 WeakPolarHBondContact O-CB 3.47Å; Y142-Y145 PolarHBondContact O-N 3.22Å; Y142-F146 PolarHBondContact O-N 2.98Å
143	K	93.4	Very high	96	Very high	128 Å²	128	62.3 Å²	62.3	56%	0.557	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-53.5	-36.4	-172.1	-55.7	-169.4	179.7	-178.5	0	113.8	L135 I139 K140 Y145 F146	L135-K143 HydrophobicContact CD2-CB 3.98Å; L135-K143 HydrophobicContact CD2-CG 4.02Å; I139-K143 PolarHBondContact O-N 3.31Å; K140-K143 WeakPolarHBondContact O-CE 3.36Å; K140-K143 VanDerWaalsContact O-CG 3.29Å; K140-K143 WeakPolarHBondContact O-CG 3.41Å; K143-Y145 VanDerWaalsContact C-N 3.26Å; K143-Y145 PolarHBondContact O-N 3.39Å; K143-F146 WeakPolarHBondContact O-CB 3.32Å; K143-F146 PolarHBondContact O-N 3.03Å
144	R	93.3	Very high	96	Very high	198 Å²	198	60.1 Å²	60.1	75%	0.747	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-68.1	-25.6	177.3	-64.1	-161.6	-169	-174.7	6.3	113.3	Y73 Y142 F146	Y73-R144 WeakPolarHBondContact OH-CD 3.48Å; Y73-R144 PolarHBondContact OH-NE 3.13Å; Y73-R144 PolarHBondContact OH-NH1 2.93Å; Y142-R144 PolarHBondContact O-N 3.28Å; Y142-R144 VanDerWaalsContact O-N 3.08Å; R144-F146 VanDerWaalsContact C-N 3.32Å
145	Y	95.5	Very high	95.9	Very high	40 Å²	40	64.5 Å²	64.5	16%	0.157	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-92.2	5.2	177.3	-58	-77.7	0	0	0	112.5	F104 L108 Y142 K143 P147 V148 I149	F104-Y145 HydrophobicContact CE1-CE1 4.09Å; F104-Y145 HydrophobicContact CE2-CD2 4.3Å; F104-Y145 AromaticContact CE2-CE2 3.79Å; F104-Y145 HydrophobicContact CE2-CE2 3.79Å; F104-Y145 HydrophobicContact CZ-CD1 4.06Å; F104-Y145 AromaticContact CZ-CD2 3.87Å; F104-Y145 HydrophobicContact CZ-CD2 3.87Å; F104-Y145 AromaticContact CZ-CE1 3.62Å; F104-Y145 HydrophobicContact CZ-CE1 3.62Å; F104-Y145 AromaticContact CZ-CE2 3.4Å; F104-Y145 HydrophobicContact CZ-CE2 3.4Å; F104-Y145 VanDerWaalsContact CZ-CE2 3.4Å; F104-Y145 HydrophobicContact CZ-CG 4.17Å; F104-Y145 AromaticContact CZ-CZ 3.26Å; L108-Y145 HydrophobicContact CD2-CD1 4.44Å; L108-Y145 HydrophobicContact CD2-CD2 4.37Å; L108-Y145 HydrophobicContact CD2-CG 3.96Å; Y142-Y145 HydrophobicContact CD1-CD2 4.35Å; Y142-Y145 CarbonylContact O-C 3.49Å; Y142-Y145 WeakPolarHBondContact O-CA 3.38Å; Y142-Y145 WeakPolarHBondContact O-CB 3.47Å; Y142-Y145 PolarHBondContact O-N 3.22Å; K143-Y145 VanDerWaalsContact C-N 3.26Å; K143-Y145 PolarHBondContact O-N 3.39Å; Y145-P147 VanDerWaalsContact C-CD 3.46Å; Y145-P147 VanDerWaalsContact C-N 3.33Å; Y145-V148 PolarHBondContact O-N 3.07Å; Y145-I149 WeakPolarHBondContact O-CG1 3.27Å; Y145-I149 PolarHBondContact O-N 3.43Å
146	F	96.7	Very high	95.9	Very high	11 Å²	11	67.3 Å²	67.3	5%	0.048	33%	0.334	C	S	.	.	H	α-helix	trans	-48.8	-47.7	176.7	174.9	-88.7	0	0	0	112.9	K131 M134 L135 I139 Y142 K143 R144 V148 I149 F150	K131-F146 HydrophobicContact CB-CZ 4.33Å; K131-F146 HydrophobicContact CD-CD1 4.42Å; K131-F146 HydrophobicContact CD-CE1 3.89Å; K131-F146 HydrophobicContact CD-CZ 4.13Å; K131-F146 HydrophobicContact CG-CE1 3.94Å; K131-F146 HydrophobicContact CG-CE2 4.06Å; K131-F146 HydrophobicContact CG-CZ 3.68Å; M134-F146 HydrophobicContact CB-CE2 4.02Å; M134-F146 HydrophobicContact CE-CZ 4.48Å; M134-F146 HydrophobicContact SD-CE2 4.15Å; M134-F146 HydrophobicContact SD-CZ 4.39Å; L135-F146 HydrophobicContact CD2-CB 3.81Å; L135-F146 HydrophobicContact CD2-CD2 3.57Å; L135-F146 HydrophobicContact CD2-CE2 4.48Å; L135-F146 HydrophobicContact CD2-CG 3.91Å; L135-F146 HydrophobicContact CG-CD2 4.01Å; L135-F146 HydrophobicContact CG-CE2 4.47Å; I139-F146 HydrophobicContact CD1-CD2 3.62Å; I139-F146 HydrophobicContact CD1-CE2 4.11Å; I139-F146 HydrophobicContact CG2-CB 4.4Å; Y142-F146 PolarHBondContact O-N 2.98Å; K143-F146 WeakPolarHBondContact O-CB 3.32Å; K143-F146 PolarHBondContact O-N 3.03Å; R144-F146 VanDerWaalsContact C-N 3.32Å; F146-V148 VanDerWaalsContact C-N 3.26Å; F146-V148 PolarHBondContact O-N 3.41Å; F146-I149 PolarHBondContact O-N 2.88Å; F146-F150 HydrophobicContact CD1-CB 4.28Å; F146-F150 HydrophobicContact CD2-CB 4.47Å; F146-F150 HydrophobicContact CE1-CB 3.88Å; F146-F150 HydrophobicContact CE1-CD1 4.29Å; F146-F150 HydrophobicContact CE1-CG 4Å; F146-F150 HydrophobicContact CE2-CB 4.08Å; F146-F150 HydrophobicContact CE2-CD2 4.31Å; F146-F150 HydrophobicContact CE2-CG 4.35Å; F146-F150 HydrophobicContact CZ-CB 3.76Å; F146-F150 HydrophobicContact CZ-CD1 4.31Å; F146-F150 AromaticContact CZ-CD2 3.84Å; F146-F150 HydrophobicContact CZ-CD2 3.84Å; F146-F150 AromaticContact CZ-CG 3.71Å; F146-F150 HydrophobicContact CZ-CG 3.71Å; F146-F150 WeakPolarHBondContact O-CB 3.26Å; F146-F150 PolarHBondContact O-N 3.42Å
147	P	97.1	Very high	95.9	Very high	90 Å²	90	60.4 Å²	60.4	58%	0.584	30%	0.301	S	S	*	.	H	α-helix	trans	-59.8	-36.8	-179	-24.2	35.2	0	0	0	113.3	Y145 G151	Y145-P147 VanDerWaalsContact C-CD 3.46Å; Y145-P147 VanDerWaalsContact C-N 3.33Å; P147-G151 PolarHBondContact O-N 2.98Å
148	V	97.1	Very high	96	Very high	86 Å²	86	62.6 Å²	62.6	52%	0.521	31%	0.305	S	S	.	.	H	α-helix	trans	-73	-48.3	179	179.5	0	0	0	0	110.6	Y145 F146 K152	Y145-V148 PolarHBondContact O-N 3.07Å; F146-V148 VanDerWaalsContact C-N 3.26Å; F146-V148 PolarHBondContact O-N 3.41Å; V148-K152 WeakPolarHBondContact O-CB 3.49Å; V148-K152 WeakPolarHBondContact O-CG 3.09Å; V148-K152 PolarHBondContact O-N 3.17Å
149	I	98.1	Very high	95.9	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-49	-179.5	-64.8	163.3	0	0	0	110.2	L108 K111 V112 L115 I139 Y145 F146 K152 A153	L108-I149 HydrophobicContact CD2-CD1 3.97Å; L108-I149 HydrophobicContact CD2-CG1 4.13Å; K111-I149 HydrophobicContact CB-CD1 3.85Å; K111-I149 HydrophobicContact CB-CG1 4.28Å; K111-I149 HydrophobicContact CB-CG2 4.2Å; K111-I149 HydrophobicContact CG-CD1 4.49Å; V112-I149 HydrophobicContact CG2-CB 4.39Å; V112-I149 HydrophobicContact CG2-CG2 4.11Å; L115-I149 HydrophobicContact CB-CG2 4.35Å; L115-I149 HydrophobicContact CD2-CG2 4.07Å; I139-I149 HydrophobicContact CD1-CB 4.14Å; I139-I149 HydrophobicContact CD1-CG2 3.65Å; I139-I149 HydrophobicContact CG1-CD1 4.39Å; I139-I149 HydrophobicContact CG1-CG2 4.1Å; I139-I149 HydrophobicContact CG2-CD1 3.88Å; Y145-I149 WeakPolarHBondContact O-CG1 3.27Å; Y145-I149 PolarHBondContact O-N 3.43Å; F146-I149 PolarHBondContact O-N 2.88Å; I149-K152 PolarHBondContact O-N 3.29Å; I149-A153 VanDerWaalsContact O-CB 3.32Å; I149-A153 WeakPolarHBondContact O-CB 3.18Å; I149-A153 PolarHBondContact O-N 3.29Å
150	F	98.5	Very high	95.9	Very high	31 Å²	31	72.4 Å²	72.4	14%	0.136	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-49.8	178.5	-178.4	-107.9	0	0	0	111.2	L115 M134 F146 K152 A153 S154 V165 Y175	L115-F150 HydrophobicContact CD2-CB 4.39Å; L115-F150 HydrophobicContact CD2-CD2 4.14Å; M134-F150 HydrophobicContact CE-CD2 4.16Å; M134-F150 HydrophobicContact CE-CE2 3.71Å; M134-F150 HydrophobicContact SD-CD2 3.66Å; M134-F150 HydrophobicContact SD-CE2 3.72Å; F146-F150 HydrophobicContact CD1-CB 4.28Å; F146-F150 HydrophobicContact CD2-CB 4.47Å; F146-F150 HydrophobicContact CE1-CB 3.88Å; F146-F150 HydrophobicContact CE1-CD1 4.29Å; F146-F150 HydrophobicContact CE1-CG 4Å; F146-F150 HydrophobicContact CE2-CB 4.08Å; F146-F150 HydrophobicContact CE2-CD2 4.31Å; F146-F150 HydrophobicContact CE2-CG 4.35Å; F146-F150 HydrophobicContact CZ-CB 3.76Å; F146-F150 HydrophobicContact CZ-CD1 4.31Å; F146-F150 AromaticContact CZ-CD2 3.84Å; F146-F150 HydrophobicContact CZ-CD2 3.84Å; F146-F150 AromaticContact CZ-CG 3.71Å; F146-F150 HydrophobicContact CZ-CG 3.71Å; F146-F150 WeakPolarHBondContact O-CB 3.26Å; F146-F150 PolarHBondContact O-N 3.42Å; F150-K152 VanDerWaalsContact C-N 3.34Å; F150-K152 PolarHBondContact O-N 3.24Å; F150-A153 PolarHBondContact O-N 2.76Å; F150-S154 WeakPolarHBondContact O-CB 3.4Å; F150-S154 PolarHBondContact O-N 2.87Å; F150-S154 PolarHBondContact O-OG 3.32Å; F150-S154 VanDerWaalsContact O-OG 3.05Å; F150-V165 HydrophobicContact CE2-CG1 4.05Å; F150-V165 HydrophobicContact CZ-CG1 3.86Å; F150-Y175 HydrophobicContact CE1-CE1 4.22Å; F150-Y175 AromaticContact CZ-CD1 3.95Å; F150-Y175 HydrophobicContact CZ-CD1 3.95Å; F150-Y175 AromaticContact CZ-CE1 3.8Å; F150-Y175 HydrophobicContact CZ-CE1 3.8Å; F150-Y175 HydrophobicContact CZ-CE2 4.42Å; F150-Y175 HydrophobicContact CZ-CG 4.37Å
151	G	98.3	Very high	95.9	Very high	37 Å²	37	70.5 Å²	70.5	38%	0.381	35%	0.352	S	S	.	.	H	α-helix	trans	-57.8	-44.5	179	0	0	0	0	0	112.9	P147 S154 E155	P147-G151 PolarHBondContact O-N 2.98Å; G151-S154 PolarHBondContact O-N 3.14Å; G151-E155 WeakPolarHBondContact O-CB 3.35Å; G151-E155 PolarHBondContact O-N 3.26Å
152	K	98.5	Very high	96	Very high	97 Å²	97	66.1 Å²	66.1	42%	0.422	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-41.1	176.9	-75	-74.5	160.5	-157.5	0	112.6	V112 V148 I149 F150 E155 F156	V112-K152 HydrophobicContact CG1-CB 3.99Å; V112-K152 HydrophobicContact CG2-CB 3.86Å; V148-K152 WeakPolarHBondContact O-CB 3.49Å; V148-K152 WeakPolarHBondContact O-CG 3.09Å; V148-K152 PolarHBondContact O-N 3.17Å; I149-K152 PolarHBondContact O-N 3.29Å; F150-K152 VanDerWaalsContact C-N 3.34Å; F150-K152 PolarHBondContact O-N 3.24Å; K152-E155 IonicContact NZ-OE1 3.94Å; K152-E155 IonicContact NZ-OE2 2.68Å; K152-E155 PolarHBondContact NZ-OE2 2.94Å; K152-E155 PolarHBondContact O-N 3.45Å; K152-F156 WeakPolarHBondContact O-CD2 3.45Å; K152-F156 PolarHBondContact O-N 2.74Å
153	A	98.6	Very high	96.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-44.6	175.8	0	0	0	0	0	111.3	V112 L115 V116 L119 I149 F150 E155 F156 M157	V112-A153 HydrophobicContact CG1-CB 4.46Å; L115-A153 HydrophobicContact CB-CB 4.06Å; L115-A153 HydrophobicContact CD2-CB 3.53Å; L115-A153 HydrophobicContact CG-CB 3.82Å; V116-A153 HydrophobicContact CG2-CB 3.82Å; L119-A153 HydrophobicContact CD1-CB 4.33Å; I149-A153 VanDerWaalsContact O-CB 3.32Å; I149-A153 WeakPolarHBondContact O-CB 3.18Å; I149-A153 PolarHBondContact O-N 3.29Å; F150-A153 PolarHBondContact O-N 2.76Å; A153-E155 VanDerWaalsContact C-N 3.34Å; A153-E155 PolarHBondContact O-N 3.44Å; A153-F156 PolarHBondContact O-N 3.11Å; A153-M157 VanDerWaalsContact O-CG 3.23Å; A153-M157 WeakPolarHBondContact O-CG 3.43Å; A153-M157 PolarHBondContact O-N 3.21Å
154	S	98.1	Very high	96.2	Very high	25 Å²	25	60.5 Å²	60.5	18%	0.175	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-40.9	175.6	-61.2	0	0	0	0	112.3	F150 G151 M157 Q158	F150-S154 WeakPolarHBondContact O-CB 3.4Å; F150-S154 PolarHBondContact O-N 2.87Å; F150-S154 PolarHBondContact O-OG 3.32Å; F150-S154 VanDerWaalsContact O-OG 3.05Å; G151-S154 PolarHBondContact O-N 3.14Å; S154-M157 PolarHBondContact O-N 2.86Å; S154-Q158 PolarHBondContact O-N 3.48Å
155	E	97.6	Very high	96.3	Very high	93 Å²	93	52.4 Å²	52.4	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-47.1	172.9	-176.9	-175.8	-179.9	0	0	111.1	G151 K152 A153 Q158 V159	G151-E155 WeakPolarHBondContact O-CB 3.35Å; G151-E155 PolarHBondContact O-N 3.26Å; K152-E155 IonicContact NZ-OE1 3.94Å; K152-E155 IonicContact NZ-OE2 2.68Å; K152-E155 PolarHBondContact NZ-OE2 2.94Å; K152-E155 PolarHBondContact O-N 3.45Å; A153-E155 VanDerWaalsContact C-N 3.34Å; A153-E155 PolarHBondContact O-N 3.44Å; E155-Q158 PolarHBondContact O-N 2.93Å; E155-V159 HydrophobicContact CG-CG2 4.37Å; E155-V159 WeakPolarHBondContact O-CB 3.35Å; E155-V159 WeakPolarHBondContact O-CG2 3.21Å; E155-V159 PolarHBondContact O-N 3.24Å
156	F	97.2	Very high	96.4	Very high	92 Å²	92	55.4 Å²	55.4	40%	0.404	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-43	176.1	-85.4	-63.2	0	0	0	112.9	V112 V116 K152 A153 Q158 V159 I160	V112-F156 HydrophobicContact CG1-CD2 3.81Å; V112-F156 HydrophobicContact CG1-CE2 4.03Å; V116-F156 HydrophobicContact CG2-CB 3.85Å; K152-F156 WeakPolarHBondContact O-CD2 3.45Å; K152-F156 PolarHBondContact O-N 2.74Å; A153-F156 PolarHBondContact O-N 3.11Å; F156-Q158 VanDerWaalsContact C-N 3.25Å; F156-Q158 PolarHBondContact O-N 3.22Å; F156-V159 PolarHBondContact O-N 3.28Å; F156-I160 HydrophobicContact CD1-CD1 3.4Å; F156-I160 VanDerWaalsContact CD1-CD1 3.4Å; F156-I160 HydrophobicContact CD1-CG1 3.94Å; F156-I160 HydrophobicContact CE1-CD1 3.72Å; F156-I160 WeakPolarHBondContact O-CB 3.47Å; F156-I160 PolarHBondContact O-N 2.9Å
157	M	96.9	Very high	96.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-56	-43.4	175.2	-71.1	-63.9	-62.2	0	0	110.8	V116 L119 L120 A153 S154 F161 G162 T163 V165 L177	V116-M157 HydrophobicContact CG1-SD 4.04Å; L119-M157 HydrophobicContact CB-CE 3.97Å; L119-M157 HydrophobicContact CB-CG 4.28Å; L119-M157 HydrophobicContact CB-SD 3.81Å; L119-M157 HydrophobicContact CD1-CG 3.9Å; L119-M157 HydrophobicContact CD1-SD 4.49Å; L120-M157 HydrophobicContact CD2-CE 4.2Å; L120-M157 HydrophobicContact CD2-SD 4.41Å; L120-M157 HydrophobicContact CG-CE 4.24Å; L120-M157 HydrophobicContact CG-SD 4Å; A153-M157 VanDerWaalsContact O-CG 3.23Å; A153-M157 WeakPolarHBondContact O-CG 3.43Å; A153-M157 PolarHBondContact O-N 3.21Å; S154-M157 PolarHBondContact O-N 2.86Å; M157-F161 CarbonylContact O-C 3.46Å; M157-F161 WeakPolarHBondContact O-CA 3.42Å; M157-F161 WeakPolarHBondContact O-CB 3.23Å; M157-F161 PolarHBondContact O-N 2.76Å; M157-F161 HydrophobicContact SD-CD2 4.32Å; M157-G162 PolarHBondContact O-N 2.68Å; M157-G162 VanDerWaalsContact O-N 3.14Å; M157-T163 CarbonylContact C-O 3.37Å; M157-T163 WeakPolarHBondContact CB-O 3.45Å; M157-T163 HydrophobicContact CE-CG2 3.76Å; M157-T163 PolarHBondContact O-N 2.89Å; M157-V165 HydrophobicContact CB-CG2 4.15Å; M157-V165 HydrophobicContact CG-CG2 4.2Å; M157-L177 HydrophobicContact CE-CD2 3.6Å
158	Q	95.4	Very high	96.4	Very high	104 Å²	104	58.8 Å²	58.8	49%	0.486	31%	0.312	S	S	.	.	H	α-helix	trans	-72.9	-51.7	179.5	-175.7	176.1	62.5	0	0	112.4	S154 E155 F156 G162 T163 D164	S154-Q158 PolarHBondContact O-N 3.48Å; E155-Q158 PolarHBondContact O-N 2.93Å; F156-Q158 VanDerWaalsContact C-N 3.25Å; F156-Q158 PolarHBondContact O-N 3.22Å; Q158-G162 WeakPolarHBondContact O-CA 3.23Å; Q158-G162 PolarHBondContact O-N 3.01Å; Q158-G162 VanDerWaalsContact O-N 3.08Å; Q158-T163 WeakPolarHBondContact CA-O 3.06Å; Q158-T163 PolarHBondContact N-O 3.34Å; Q158-T163 VanDerWaalsContact N-O 3.14Å; Q158-D164 PolarHBondContact NE2-OD1 3.19Å
159	V	94.6	Very high	96.5	Very high	110 Å²	110	58 Å²	58	67%	0.667	31%	0.305	S	S	*	.	H	α-helix	trans	-76.1	-40.9	-169.5	174.7	0	0	0	0	112.5	E155 F156	E155-V159 HydrophobicContact CG-CG2 4.37Å; E155-V159 WeakPolarHBondContact O-CB 3.35Å; E155-V159 WeakPolarHBondContact O-CG2 3.21Å; E155-V159 PolarHBondContact O-N 3.24Å; F156-V159 PolarHBondContact O-N 3.28Å
160	I	93.7	Very high	96.4	Very high	107 Å²	107	62 Å²	62	55%	0.549	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-42.8	-176.9	-60.1	-167.8	0	0	0	111.1	F156	F156-I160 HydrophobicContact CD1-CD1 3.4Å; F156-I160 VanDerWaalsContact CD1-CD1 3.4Å; F156-I160 HydrophobicContact CD1-CG1 3.94Å; F156-I160 HydrophobicContact CE1-CD1 3.72Å; F156-I160 WeakPolarHBondContact O-CB 3.47Å; F156-I160 PolarHBondContact O-N 2.9Å
161	F	91.7	Very high	96.3	Very high	87 Å²	87	65 Å²	65	38%	0.382	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-1.3	-172.3	-57.5	-81.7	0	0	0	113.6	V116 L120 M157 T163	V116-F161 HydrophobicContact CG1-CD2 4.23Å; V116-F161 HydrophobicContact CG1-CE2 3.53Å; V116-F161 HydrophobicContact CG1-CZ 4.15Å; L120-F161 HydrophobicContact CD1-CD1 4.05Å; L120-F161 HydrophobicContact CD1-CD2 4.45Å; L120-F161 HydrophobicContact CD1-CE1 3.63Å; L120-F161 HydrophobicContact CD1-CE2 4.08Å; L120-F161 HydrophobicContact CD1-CG 4.44Å; L120-F161 HydrophobicContact CD1-CZ 3.65Å; L120-F161 HydrophobicContact CD2-CB 4.3Å; L120-F161 HydrophobicContact CD2-CD1 3.71Å; L120-F161 HydrophobicContact CD2-CE1 4.15Å; L120-F161 HydrophobicContact CD2-CG 3.93Å; L120-F161 HydrophobicContact CG-CD1 4.45Å; L120-F161 HydrophobicContact CG-CE1 4.49Å; M157-F161 CarbonylContact O-C 3.46Å; M157-F161 WeakPolarHBondContact O-CA 3.42Å; M157-F161 WeakPolarHBondContact O-CB 3.23Å; M157-F161 PolarHBondContact O-N 2.76Å; M157-F161 HydrophobicContact SD-CD2 4.32Å; F161-T163 PolarHBondContact O-N 3.12Å; F161-T163 PolarHBondContact O-OG1 3.18Å; F161-T163 VanDerWaalsContact O-OG1 3.11Å
162	G	92.9	Very high	96.1	Very high	27 Å²	27	65.1 Å²	65.1	28%	0.278	36%	0.363	S	S	.	.			trans	56.2	36.6	-178.6	0	0	0	0	0	112	M157 Q158 T179 A180	M157-G162 PolarHBondContact O-N 2.68Å; M157-G162 VanDerWaalsContact O-N 3.14Å; Q158-G162 WeakPolarHBondContact O-CA 3.23Å; Q158-G162 PolarHBondContact O-N 3.01Å; Q158-G162 VanDerWaalsContact O-N 3.08Å; G162-T179 CarbonylContact O-C 3.03Å; G162-A180 WeakPolarHBondContact O-CB 3.44Å; G162-A180 PolarHBondContact O-N 3.48Å
163	T	94.7	Very high	96.1	Very high	3 Å²	3	64 Å²	64	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.9	-176	-58.3	0	0	0	0	110	Y123 M157 Q158 F161 L177 V178	Y123-T163 HydrophobicContact CD2-CG2 3.97Å; Y123-T163 HydrophobicContact CE2-CG2 4.2Å; Y123-T163 HydrophobicContact CG-CG2 4.46Å; M157-T163 CarbonylContact C-O 3.37Å; M157-T163 WeakPolarHBondContact CB-O 3.45Å; M157-T163 HydrophobicContact CE-CG2 3.76Å; M157-T163 PolarHBondContact O-N 2.89Å; Q158-T163 WeakPolarHBondContact CA-O 3.06Å; Q158-T163 PolarHBondContact N-O 3.34Å; Q158-T163 VanDerWaalsContact N-O 3.14Å; F161-T163 PolarHBondContact O-N 3.12Å; F161-T163 PolarHBondContact O-OG1 3.18Å; F161-T163 VanDerWaalsContact O-OG1 3.11Å; T163-L177 HydrophobicContact CG2-CB 3.95Å; T163-L177 HydrophobicContact CG2-CD2 4.32Å; T163-V178 CarbonylContact C-O 3.48Å; T163-V178 WeakPolarHBondContact CA-O 3.46Å
164	D	95	Very high	96.1	Very high	32 Å²	32	65 Å²	65	17%	0.171	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	136.1	173.8	-72.5	-18.1	0	0	0	110.7	Q158 K166 L177 V178	Q158-D164 PolarHBondContact NE2-OD1 3.19Å; D164-K166 HydrophobicContact CB-CG 4.12Å; D164-K166 WeakPolarHBondContact OD2-CE 3.37Å; D164-K166 IonicContact OD2-NZ 3.87Å; D164-L177 WeakPolarHBondContact O-CA 3.23Å; D164-V178 HydrophobicContact CB-CG2 3.86Å; D164-V178 PolarHBondContact N-O 3.15Å; D164-V178 PolarHBondContact O-N 2.98Å
165	V	97.1	Very high	96.1	Very high	28 Å²	28	64.7 Å²	64.7	17%	0.17	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	107.5	167.4	-174.9	0	0	0	0	107.7	L119 F150 M157 Y175	L119-V165 HydrophobicContact CD1-CG2 4.18Å; F150-V165 HydrophobicContact CE2-CG1 4.05Å; F150-V165 HydrophobicContact CZ-CG1 3.86Å; M157-V165 HydrophobicContact CB-CG2 4.15Å; M157-V165 HydrophobicContact CG-CG2 4.2Å; V165-Y175 HydrophobicContact CG1-CD1 4.24Å; V165-Y175 HydrophobicContact CG1-CG 4.24Å
166	K	96.4	Very high	96.1	Very high	103 Å²	103	63.3 Å²	63.3	45%	0.448	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.1	-175.2	-68.8	-172.6	178.9	174.2	0	111.3	D164 Y175 I176 V178	D164-K166 HydrophobicContact CB-CG 4.12Å; D164-K166 WeakPolarHBondContact OD2-CE 3.37Å; D164-K166 IonicContact OD2-NZ 3.87Å; K166-Y175 CarbonylContact O-C 3.48Å; K166-Y175 WeakPolarHBondContact O-CA 2.73Å; K166-I176 HydrophobicContact CB-CG1 4.16Å; K166-I176 PolarHBondContact N-O 2.62Å; K166-I176 PolarHBondContact O-N 3.08Å; K166-V178 HydrophobicContact CD-CG2 3.73Å; K166-V178 HydrophobicContact CG-CG2 4.17Å
167	E	97.7	Very high	96	Very high	91 Å²	91	59.8 Å²	59.8	43%	0.425	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.9	171	-164.4	166	-148.2	0	0	109.6	H173 S174 Y175	E167-H173 IonicContact OE1-ND1 2.68Å; E167-H173 PolarHBondContact OE1-ND1 3.4Å; E167-S174 WeakPolarHBondContact CA-O 3.31Å; E167-Y175 HydrophobicContact CB-CD1 3.68Å; E167-Y175 HydrophobicContact CB-CE1 3.61Å; E167-Y175 HydrophobicContact CG-CD1 4.04Å; E167-Y175 HydrophobicContact CG-CE1 3.68Å; E167-Y175 PolarHBondContact OE1-OH 2.85Å
168	V	97.3	Very high	95.9	Very high	80 Å²	80	61.8 Å²	61.8	49%	0.485	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-22.4	179.7	-67.8	0	0	0	0	112.4	S174 I176	V168-S174 WeakPolarHBondContact CG2-O 3.47Å; V168-S174 PolarHBondContact N-O 2.88Å; V168-I176 HydrophobicContact CG1-CB 4.35Å; V168-I176 HydrophobicContact CG1-CD1 3.67Å; V168-I176 HydrophobicContact CG1-CG1 3.61Å; V168-I176 HydrophobicContact CG1-CG2 3.97Å; V168-I176 HydrophobicContact CG2-CG2 3.96Å
169	D	97.4	Very high	95.7	Very high	69 Å²	69	59.1 Å²	59.1	37%	0.369	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	99.3	173.8	173.7	18.3	0	0	0	109.2	A171 G172 H173 S174	D169-A171 VanDerWaalsContact C-N 3.27Å; D169-A171 PolarHBondContact O-N 3.3Å; D169-A171 WeakPolarHBondContact OD1-CB 3.35Å; D169-A171 PolarHBondContact OD1-N 3.42Å; D169-G172 VanDerWaalsContact CG-N 3.29Å; D169-G172 PolarHBondContact OD1-N 3.33Å; D169-G172 VanDerWaalsContact OD1-N 3.17Å; D169-G172 VanDerWaalsContact OD2-CA 3.26Å; D169-G172 WeakPolarHBondContact OD2-CA 3.25Å; D169-G172 PolarHBondContact OD2-N 3.14Å; D169-H173 VanDerWaalsContact O-CA 3.27Å; D169-H173 WeakPolarHBondContact O-CA 3.41Å; D169-H173 PolarHBondContact O-N 2.95Å; D169-S174 PolarHBondContact N-O 2.97Å; D169-S174 PolarHBondContact O-N 2.85Å
170	P	96.4	Very high	95.1	Very high	86 Å²	86	54.4 Å²	54.4	56%	0.558	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.3	177.1	-23.4	34.8	0	0	0	114	H173	P170-H173 PolarHBondContact O-CE1 3.26Å; P170-H173 PolarHBondContact O-ND1 2.88Å
171	A	96.3	Very high	93.9	Very high	93 Å²	93	57 Å²	57	77%	0.769	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-42.1	-178.9	0	0	0	0	0	111.1	D169	D169-A171 VanDerWaalsContact C-N 3.27Å; D169-A171 PolarHBondContact O-N 3.3Å; D169-A171 WeakPolarHBondContact OD1-CB 3.35Å; D169-A171 PolarHBondContact OD1-N 3.42Å
172	G	95.6	Very high	92.4	Very high	40 Å²	40	56.1 Å²	56.1	41%	0.412	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.7	174.2	0	0	0	0	0	114.8	D169 S174	D169-G172 VanDerWaalsContact CG-N 3.29Å; D169-G172 PolarHBondContact OD1-N 3.33Å; D169-G172 VanDerWaalsContact OD1-N 3.17Å; D169-G172 VanDerWaalsContact OD2-CA 3.26Å; D169-G172 WeakPolarHBondContact OD2-CA 3.25Å; D169-G172 PolarHBondContact OD2-N 3.14Å; G172-S174 VanDerWaalsContact C-N 3.32Å; G172-S174 PolarHBondContact O-N 2.96Å
173	H	97.5	Very high	91	Very high	75 Å²	75	60.4 Å²	60.4	35%	0.347	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	53.7	-170.6	-60.9	-56.8	0	0	0	112	T130 K131 E167 D169 P170 Y175	T130-H173 CarbonylContact C-O 3.57Å; T130-H173 WeakPolarHBondContact CA-O 3.49Å; K131-H173 HydrophobicContact CB-CB 3.61Å; K131-H173 HydrophobicContact CD-CB 4.19Å; K131-H173 PolarHBondContact N-O 3.02Å; E167-H173 IonicContact OE1-ND1 2.68Å; E167-H173 PolarHBondContact OE1-ND1 3.4Å; D169-H173 VanDerWaalsContact O-CA 3.27Å; D169-H173 WeakPolarHBondContact O-CA 3.41Å; D169-H173 PolarHBondContact O-N 2.95Å; P170-H173 PolarHBondContact O-CE1 3.26Å; P170-H173 PolarHBondContact O-ND1 2.88Å; H173-Y175 HydrophobicContact CB-CE2 4.3Å; H173-Y175 WeakPolarHBondContact O-CD2 3.42Å; H173-Y175 WeakPolarHBondContact O-CE2 3.32Å
174	S	98.1	Very high	89.4	Confident	21 Å²	21	64.4 Å²	64.4	15%	0.147	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	137.2	179.6	-166.9	0	0	0	0	111.1	E167 V168 D169 G172	E167-S174 WeakPolarHBondContact CA-O 3.31Å; V168-S174 WeakPolarHBondContact CG2-O 3.47Å; V168-S174 PolarHBondContact N-O 2.88Å; D169-S174 PolarHBondContact N-O 2.97Å; D169-S174 PolarHBondContact O-N 2.85Å; G172-S174 VanDerWaalsContact C-N 3.32Å; G172-S174 PolarHBondContact O-N 2.96Å
175	Y	98.4	Very high	87.6	Confident	17 Å²	17	68.5 Å²	68.5	7%	0.067	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144	-174.3	-49.6	-92.6	0	0	0	110.9	P128 V129 K131 M134 F150 V165 K166 E167 H173	P128-Y175 WeakPolarHBondContact CA-O 3.5Å; V129-Y175 PolarHBondContact N-O 3.35Å; V129-Y175 WeakPolarHBondContact O-CD2 3.41Å; V129-Y175 PolarHBondContact O-N 2.98Å; K131-Y175 HydrophobicContact CB-CE2 4.28Å; M134-Y175 HydrophobicContact CE-CD2 3.47Å; M134-Y175 VanDerWaalsContact CE-CD2 3.47Å; M134-Y175 HydrophobicContact CE-CE2 3.68Å; M134-Y175 HydrophobicContact CE-CG 4.4Å; F150-Y175 HydrophobicContact CE1-CE1 4.22Å; F150-Y175 AromaticContact CZ-CD1 3.95Å; F150-Y175 HydrophobicContact CZ-CD1 3.95Å; F150-Y175 AromaticContact CZ-CE1 3.8Å; F150-Y175 HydrophobicContact CZ-CE1 3.8Å; F150-Y175 HydrophobicContact CZ-CE2 4.42Å; F150-Y175 HydrophobicContact CZ-CG 4.37Å; V165-Y175 HydrophobicContact CG1-CD1 4.24Å; V165-Y175 HydrophobicContact CG1-CG 4.24Å; K166-Y175 CarbonylContact O-C 3.48Å; K166-Y175 WeakPolarHBondContact O-CA 2.73Å; E167-Y175 HydrophobicContact CB-CD1 3.68Å; E167-Y175 HydrophobicContact CB-CE1 3.61Å; E167-Y175 HydrophobicContact CG-CD1 4.04Å; E167-Y175 HydrophobicContact CG-CE1 3.68Å; E167-Y175 PolarHBondContact OE1-OH 2.85Å; H173-Y175 HydrophobicContact CB-CE2 4.3Å; H173-Y175 WeakPolarHBondContact O-CD2 3.42Å; H173-Y175 WeakPolarHBondContact O-CE2 3.32Å
176	I	97.4	Very high	85.7	Confident	64 Å²	64	73.6 Å²	73.6	33%	0.328	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	155.3	168.2	64.9	172.8	0	0	0	110.2	P128 K166 V168 V178	P128-I176 HydrophobicContact CB-CG2 4.42Å; K166-I176 HydrophobicContact CB-CG1 4.16Å; K166-I176 PolarHBondContact N-O 2.62Å; K166-I176 PolarHBondContact O-N 3.08Å; V168-I176 HydrophobicContact CG1-CB 4.35Å; V168-I176 HydrophobicContact CG1-CD1 3.67Å; V168-I176 HydrophobicContact CG1-CG1 3.61Å; V168-I176 HydrophobicContact CG1-CG2 3.97Å; V168-I176 HydrophobicContact CG2-CG2 3.96Å; I176-V178 HydrophobicContact CD1-CG1 3.69Å; I176-V178 HydrophobicContact CG1-CG1 4Å
177	L	96.4	Very high	83.8	Confident	19 Å²	19	74 Å²	74	10%	0.099	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.4	176.9	-65.3	94.7	0	0	0	109.2	L119 K122 Y123 V129 M157 T163 D164	L119-L177 HydrophobicContact CB-CD2 3.83Å; L119-L177 HydrophobicContact CD2-CD1 4.49Å; L119-L177 HydrophobicContact CD2-CD2 4.19Å; L119-L177 WeakPolarHBondContact O-CD2 3.45Å; K122-L177 HydrophobicContact CB-CD1 4.06Å; Y123-L177 HydrophobicContact CD2-CB 3.78Å; Y123-L177 HydrophobicContact CG-CB 4.39Å; V129-L177 HydrophobicContact CG1-CD1 3.92Å; M157-L177 HydrophobicContact CE-CD2 3.6Å; T163-L177 HydrophobicContact CG2-CB 3.95Å; T163-L177 HydrophobicContact CG2-CD2 4.32Å; D164-L177 WeakPolarHBondContact O-CA 3.23Å
178	V	93.3	Very high	82.1	Confident	42 Å²	42	78.1 Å²	78.1	26%	0.255	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145	-176.4	-60	0	0	0	0	110.3	T163 D164 K166 I176 A180	T163-V178 CarbonylContact C-O 3.48Å; T163-V178 WeakPolarHBondContact CA-O 3.46Å; D164-V178 HydrophobicContact CB-CG2 3.86Å; D164-V178 PolarHBondContact N-O 3.15Å; D164-V178 PolarHBondContact O-N 2.98Å; K166-V178 HydrophobicContact CD-CG2 3.73Å; K166-V178 HydrophobicContact CG-CG2 4.17Å; I176-V178 HydrophobicContact CD1-CG1 3.69Å; I176-V178 HydrophobicContact CG1-CG1 4Å; V178-A180 PolarHBondContact O-N 3.46Å
179	T	91.6	Very high	80.4	Confident	47 Å²	47	82.7 Å²	82.7	29%	0.288	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	124.4	175.1	-39.6	0	0	0	0	109.9	Y123 G162 L183	Y123-T179 PolarHBondContact OH-OG1 2.99Å; G162-T179 CarbonylContact O-C 3.03Å; T179-L183 VanDerWaalsContact CG2-O 3.23Å; T179-L183 WeakPolarHBondContact CG2-O 3.5Å
180	A	81.8	Confident	78.5	Confident	12 Å²	12	82.8 Å²	82.8	10%	0.099	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-66.5	137	174.3	0	0	0	0	0	109.1	G162 V178 G182	G162-A180 WeakPolarHBondContact O-CB 3.44Å; G162-A180 PolarHBondContact O-N 3.48Å; V178-A180 PolarHBondContact O-N 3.46Å; A180-G182 VanDerWaalsContact C-N 3.34Å; A180-G182 PolarHBondContact O-N 3.08Å
181	L	68.6	Low	76.8	Confident	162 Å²	162	85.2 Å²	85.2	85%	0.848	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	65.4	19.3	173.4	-50.3	176.8	0	0	0	117.2	L183	L181-L183 HydrophobicContact CB-CG 4.39Å; L181-L183 PolarHBondContact O-N 3.05Å
182	G	60	Low	75	Confident	68 Å²	68	84.2 Å²	84.2	70%	0.701	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	67.9	16	173	0	0	0	0	0	114.5	A180 S184	A180-G182 VanDerWaalsContact C-N 3.34Å; A180-G182 PolarHBondContact O-N 3.08Å; G182-S184 PolarHBondContact O-N 3.04Å
183	L	65.2	Low	73.2	Confident	117 Å²	117	90.3 Å²	90.3	61%	0.613	55%	0.547	S	S	*	.			trans	-78.6	68.7	175.6	-58.6	177.5	0	0	0	109.7	T179 L181 C185	T179-L183 VanDerWaalsContact CG2-O 3.23Å; T179-L183 WeakPolarHBondContact CG2-O 3.5Å; L181-L183 HydrophobicContact CB-CG 4.39Å; L181-L183 PolarHBondContact O-N 3.05Å; L183-C185 PolarHBondContact O-N 2.67Å
184	S	60.5	Low	71.4	Confident	86 Å²	86	91.3 Å²	91.3	60%	0.601	56%	0.562	S	S	*	*			trans	-66	100.4	177.4	69.3	0	0	0	0	110	G182 D186	G182-S184 PolarHBondContact O-N 3.04Å; S184-D186 PolarHBondContact O-N 3.3Å
185	C	55.9	Low	69	Low	118 Å²	118	102.2 Å²	102.2	80%	0.797	61%	0.613	S	S	*	*			trans	-72.5	31	167.4	-67.3	0	0	0	0	112.2	L183 S187	L183-C185 PolarHBondContact O-N 2.67Å; C185-S187 PolarHBondContact O-N 3.21Å
186	D	58.5	Low	67.5	Low	135 Å²	135	106.5 Å²	106.5	72%	0.722	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-4.7	-175.6	-157.2	29.4	0	0	0	112.4	S184	S184-D186 PolarHBondContact O-N 3.3Å
187	S	56.4	Low	65.9	Low	111 Å²	111	108.7 Å²	108.7	78%	0.776	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	12.3	-167.2	62.1	0	0	0	0	116.2	C185	C185-S187 PolarHBondContact O-N 3.21Å
188	M	60.8	Low	64.2	Low	179 Å²	179	113.7 Å²	113.7	88%	0.882	69%	0.688	S	S	*	*	S	Bend	trans	-117.5	16.9	-175.7	-146.3	164.1	73.2	0	0	116
189	L	61.8	Low	62.5	Low	175 Å²	175	117.9 Å²	117.9	92%	0.916	71%	0.714	S	S	*	*			trans	-114.8	44.6	166.6	-79.3	153	0	0	0	110.4	D191	L189-D191 VanDerWaalsContact C-N 3.33Å; L189-D191 PolarHBondContact O-N 2.91Å
190	G	58.7	Low	60.7	Low	71 Å²	71	122.3 Å²	122.3	73%	0.732	74%	0.74	S	S	*	*			trans	-77.8	90.1	158.3	0	0	0	0	0	107.8	G192	G190-G192 PolarHBondContact O-N 2.85Å
191	D	60.9	Low	59.3	Low	138 Å²	138	129.7 Å²	129.7	74%	0.738	78%	0.783	S	S	*	*			trans	-62.9	92.3	165.1	-171.5	7	0	0	0	107.6	L189 H193	L189-D191 VanDerWaalsContact C-N 3.33Å; L189-D191 PolarHBondContact O-N 2.91Å; D191-H193 PolarHBondContact O-N 3.07Å; D191-H193 IonicContact OD1-CD2 3.81Å
192	G	56.8	Low	58.6	Low	72 Å²	72	127.4 Å²	127.4	74%	0.742	78%	0.778	S	S	*	*			trans	-73.5	61.5	171.5	0	0	0	0	0	110.1	G190 S194	G190-G192 PolarHBondContact O-N 2.85Å; G192-S194 PolarHBondContact O-N 3.47Å; G192-S194 VanDerWaalsContact O-N 3.07Å
193	H	58.5	Low	58.5	Low	168 Å²	168	131.9 Å²	131.9	78%	0.778	78%	0.784	S	S	*	*			trans	-78.2	81.6	160.5	-121.3	-66.5	0	0	0	107.7	D191	D191-H193 PolarHBondContact O-N 3.07Å; D191-H193 IonicContact OD1-CD2 3.81Å
194	S	59.3	Low	58	Low	95 Å²	95	133.2 Å²	133.2	66%	0.664	80%	0.798	S	S	*	*			trans	-119.4	104.5	169	-171.1	0	0	0	0	109.6	G192	G192-S194 PolarHBondContact O-N 3.47Å; G192-S194 VanDerWaalsContact O-N 3.07Å
195	M	47.7	Very low	57.7	Low	250 Å²	250	137.5 Å²	137.5	100%	1.232	82%	0.816	S	S	*	*			trans	80.9	0	165.8	-50.2	-159.2	-168.9	0	0	118.2

Retrieved 195 of 195 residues in 139.7 ms (Link to these results)

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