A0A087YDK4_POEFO Loading...

PRA1 family protein

AlphaFold DB , UniProt , Accession A0A087YDK4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 210 aa.

Structure Viewer

Loading PAE data...

(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	41.7	Very low	40	Very low	243 Å²	243	139.5 Å²	139.5	100%	1.197	86%	0.855	S	S	*	*				0	142.7	0	-77.6	166.3	120.8	0	0	108.1
2	S	38.2	Very low	39.6	Very low	121 Å²	121	140.3 Å²	140.3	85%	0.846	85%	0.85	S	S	*	*			trans	87.1	94.9	-173.5	-134.6	0	0	0	0	114.2
3	S	38.4	Very low	39.9	Very low	123 Å²	123	140.5 Å²	140.5	86%	0.86	85%	0.85	S	S	*	*				85.6	131.2	77.8	-167.4	0	0	0	0	110.4
4	G	36.7	Very low	39.5	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	83%	0.834	S	S	*	*			cis	-174.2	167.4	7.2	0	0	0	0	0	108.4
5	A	42.2	Very low	39.9	Very low	97 Å²	97	139.5 Å²	139.5	80%	0.802	83%	0.828	S	S	*	*			trans	-81.9	-155.1	-175.4	0	0	0	0	0	113.3
6	P	56.5	Low	39.6	Very low	122 Å²	122	138.9 Å²	138.9	79%	0.792	82%	0.82	S	S	*	*				-129.4	170.6	-78.8	36.6	-19.4	0	0	0	113.8
7	K	35.8	Very low	39.3	Very low	216 Å²	216	137.4 Å²	137.4	94%	0.939	82%	0.818	S	S	*	*			trans	176.6	131.7	157.2	-120.2	173.8	171.7	-179.4	0	107.5
8	G	34.6	Very low	39	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	82%	0.824	S	S	*	*			cis	127.5	109.2	17.8	0	0	0	0	0	106.8
9	E	41.7	Very low	38.7	Very low	204 Å²	204	139.3 Å²	139.3	95%	0.953	82%	0.823	S	S	*	*			trans	-162.3	125.9	151.9	-113.8	170	115.7	0	0	111.3
10	N	35.3	Very low	38.5	Very low	156 Å²	156	135.7 Å²	135.7	83%	0.834	82%	0.817	S	S	*	*			trans	-95.3	157.6	178.8	-75.2	-36.3	0	0	0	110.1
11	C	38.7	Very low	38.3	Very low	116 Å²	116	136.2 Å²	136.2	78%	0.784	82%	0.815	S	S	*	*			trans	155.6	105.9	142.2	-92.3	0	0	0	0	106.3
12	L	35.5	Very low	38.1	Very low	150 Å²	150	132.8 Å²	132.8	79%	0.785	80%	0.801	S	S	*	*			cis	46.3	83.9	45.5	-144.4	168.3	0	0	0	111.9
13	V	43.6	Very low	37.8	Very low	142 Å²	142	137.4 Å²	137.4	86%	0.861	81%	0.806	S	S	*	*			trans	-134.6	118.5	145.3	-173.2	0	0	0	0	108
14	D	34.2	Very low	37.5	Very low	115 Å²	115	134.5 Å²	134.5	62%	0.615	80%	0.796	S	S	*	*			trans	-84.5	155.4	176.5	-133.2	-52.5	0	0	0	110.2
15	M	45	Very low	37.7	Very low	152 Å²	152	136.3 Å²	136.3	75%	0.749	80%	0.795	S	S	*	*			trans	64.5	123	137.2	-93.2	169.6	125.9	0	0	123.8
16	D	34.8	Very low	37.5	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	80%	0.801	S	S	*	*				86.2	106.5	117.3	-136.7	-72.7	0	0	0	120.5
17	S	36.1	Very low	36.6	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	80%	0.801	S	S	*	*				166	105.3	127.8	-88.2	0	0	0	0	110.9
18	K	32.3	Very low	36.7	Very low	213 Å²	213	136.9 Å²	136.9	93%	0.926	80%	0.795	S	S	*	*				-161.8	93.7	125.4	-148.8	168.3	-177.2	-179.9	0	110.3
19	A	34.1	Very low	36.7	Very low	98 Å²	98	141 Å²	141	81%	0.81	80%	0.796	S	S	*	*			trans	-57	143.1	156.5	0	0	0	0	0	110
20	G	35.1	Very low	36.7	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	79%	0.785	S	S	*	*			trans	-172.3	74.3	178.3	0	0	0	0	0	108.8
21	D	33.1	Very low	36.7	Very low	147 Å²	147	134.9 Å²	134.9	79%	0.786	78%	0.781	S	S	*	*			trans	-2.7	128.8	155.7	-59.6	-71.1	0	0	0	117.4
22	L	38.8	Very low	36.6	Very low	171 Å²	171	132.6 Å²	132.6	90%	0.895	78%	0.777	S	S	*	*				171.3	89.4	113.2	-92.2	150	0	0	0	109.5
23	F	31.7	Very low	36.5	Very low	217 Å²	217	132.5 Å²	132.5	95%	0.952	78%	0.783	S	S	*	*			trans	-66.7	125.5	149.5	-94.4	-93.8	0	0	0	108.1
24	G	31.7	Very low	36.1	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	78%	0.784	S	S	*	*			trans	-152.5	112.4	165	0	0	0	0	0	108.2	E26	G24-E26 PolarHBondContact O-N 3.42Å
25	P	40.2	Very low	36	Very low	109 Å²	109	127.6 Å²	127.6	71%	0.708	79%	0.789	S	S	*	*			trans	-79.4	117.2	176.2	31.2	-27.7	0	0	0	107.9	D27	P25-D27 PolarHBondContact O-N 3.49Å
26	E	39.8	Very low	35.6	Very low	200 Å²	200	125.5 Å²	125.5	94%	0.935	79%	0.789	S	S	*	*			trans	-91.5	99.1	167	-111.9	168.3	84.6	0	0	109.1	G24 A28	G24-E26 PolarHBondContact O-N 3.42Å; E26-A28 PolarHBondContact O-N 3.49Å
27	D	36.4	Very low	35.7	Very low	149 Å²	149	123.6 Å²	123.6	80%	0.797	80%	0.8	S	S	*	*			trans	-59.6	103	167.6	-63.5	-59.4	0	0	0	110.6	P25	P25-D27 PolarHBondContact O-N 3.49Å
28	A	39	Very low	36	Very low	97 Å²	97	121.5 Å²	121.5	80%	0.802	79%	0.789	S	S	*	*			trans	-98.9	94.6	161.2	0	0	0	0	0	109.2	E26	E26-A28 PolarHBondContact O-N 3.49Å
29	H	33.9	Very low	36.4	Very low	152 Å²	152	115.2 Å²	115.2	70%	0.704	78%	0.777	S	S	*	*			trans	-46.9	130.5	170.8	176.3	33.8	0	0	0	112.7	T31	H29-T31 WeakPolarHBondContact NE2-CG2 3.49Å; H29-T31 PolarHBondContact O-N 3.47Å
30	P	42.1	Very low	36.6	Very low	110 Å²	110	113.7 Å²	113.7	71%	0.714	77%	0.771	S	S	*	*			trans	-83.2	111.2	166.7	32.3	-29.3	0	0	0	108.7	G32	P30-G32 PolarHBondContact O-N 3.21Å
31	T	35.1	Very low	37.2	Very low	121 Å²	121	116 Å²	116	74%	0.742	77%	0.771	S	S	*	*			trans	-85.5	107.1	159.8	33.8	0	0	0	0	107.9	H29	H29-T31 WeakPolarHBondContact NE2-CG2 3.49Å; H29-T31 PolarHBondContact O-N 3.47Å
32	G	36.2	Very low	37.8	Very low	69 Å²	69	115.7 Å²	115.7	71%	0.711	77%	0.769	S	S	*	*			trans	-71.2	148.2	178.1	0	0	0	0	0	112.5	P30	P30-G32 PolarHBondContact O-N 3.21Å
33	T	32.7	Very low	38.1	Very low	147 Å²	147	111.9 Å²	111.9	90%	0.902	76%	0.762	S	S	*	*			trans	-141.4	119.1	140.8	21.9	0	0	0	0	107
34	G	36.5	Very low	38.8	Very low	86 Å²	86	110.8 Å²	110.8	89%	0.887	76%	0.757	S	S	*	*			trans	-66	160.1	-171.8	0	0	0	0	0	114
35	G	32.1	Very low	39.8	Very low	69 Å²	69	114.6 Å²	114.6	71%	0.711	76%	0.762	S	S	*	*			trans	168.6	78.8	174.8	0	0	0	0	0	112.9
36	S	35	Very low	40.5	Very low	107 Å²	107	120.2 Å²	120.2	75%	0.748	77%	0.769	S	S	*	*			trans	66.4	96	147.5	-55.7	0	0	0	0	117.6	A38	S36-A38 PolarHBondContact O-N 2.79Å
37	G	37.3	Very low	41.4	Very low	91 Å²	91	117.3 Å²	117.3	94%	0.938	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	53.3	166.8	0	0	0	0	0	115.5
38	A	42.7	Very low	41.9	Very low	67 Å²	67	115 Å²	115	55%	0.554	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	-17.6	174.1	0	0	0	0	0	113.4	S36	S36-A38 PolarHBondContact O-N 2.79Å
39	A	40.6	Very low	42.4	Very low	82 Å²	82	120.6 Å²	120.6	68%	0.678	76%	0.758	S	S	*	*	S	Bend	trans	-84.4	-25	-174	0	0	0	0	0	114.5
40	G	39.3	Very low	43.4	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	76%	0.76	S	S	*	*	S	Bend	trans	-78.2	-19.6	-175	0	0	0	0	0	115.1
41	V	46.3	Very low	44.2	Very low	115 Å²	115	119.1 Å²	119.1	70%	0.697	77%	0.766	S	S	*	*	S	Bend	trans	-88	-19.5	-173.8	-138.2	0	0	0	0	112.4
42	L	45.9	Very low	45.3	Very low	141 Å²	141	115.4 Å²	115.4	74%	0.738	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-90.3	-12.1	178.7	-67.5	173.9	0	0	0	113.5	K44	L42-K44 PolarHBondContact O-N 3.27Å
43	A	45.1	Very low	46.4	Very low	91 Å²	91	117.9 Å²	117.9	75%	0.752	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-76	-1.9	175	0	0	0	0	0	113.5
44	K	47.2	Very low	47.8	Very low	195 Å²	195	114.1 Å²	114.1	85%	0.848	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-100.2	26.4	177.7	-147.9	171.5	-175.2	174	0	112.2	L42 W46	L42-K44 PolarHBondContact O-N 3.27Å; K44-W46 PolarHBondContact O-N 3.39Å
45	L	52	Low	49.2	Very low	143 Å²	143	114.3 Å²	114.3	75%	0.749	71%	0.709	S	S	*	*			trans	-84.2	107.1	168.6	-139.4	79.4	0	0	0	109.3	L47	L45-L47 PolarHBondContact O-N 2.98Å
46	W	54.9	Low	50.8	Low	226 Å²	226	113.1 Å²	113.1	86%	0.856	69%	0.693	S	S	*	*			trans	-50.9	92.8	178.3	-163	91	0	0	0	112.3	K44	K44-W46 PolarHBondContact O-N 3.39Å
47	L	59.3	Low	52.3	Low	140 Å²	140	114 Å²	114	73%	0.733	68%	0.683	S	S	*	*			trans	-116.7	118.7	164.5	-82.5	162.2	0	0	0	108	L45 K49	L45-L47 PolarHBondContact O-N 2.98Å; L47-K49 PolarHBondContact O-N 3.02Å
48	P	47.7	Very low	53.8	Low	99 Å²	99	114.4 Å²	114.4	64%	0.643	66%	0.66	S	S	*	*			trans	-62.4	111.5	176.5	12.6	-14.1	0	0	0	109.6	G50	P48-G50 PolarHBondContact O-N 3.08Å
49	K	49.4	Very low	54.9	Low	216 Å²	216	117.2 Å²	117.2	94%	0.939	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	36.1	178.6	-63.7	177.1	179.4	168.8	0	113	L47	L47-K49 PolarHBondContact O-N 3.02Å
50	G	53.6	Low	56.2	Low	72 Å²	72	119.6 Å²	119.6	74%	0.742	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-14.3	-178.8	0	0	0	0	0	114.5	P48	P48-G50 PolarHBondContact O-N 3.08Å
51	L	59	Low	57.4	Low	158 Å²	158	118.9 Å²	118.9	83%	0.827	63%	0.633	S	S	*	*	S	Bend	trans	-111.1	71.6	179.8	-156.8	75.1	0	0	0	109.1	V53	L51-V53 PolarHBondContact O-N 2.9Å
52	S	58.3	Low	58	Low	43 Å²	43	121.5 Å²	121.5	30%	0.301	63%	0.63	S	S	.	*			trans	-66.3	121.5	-176	70.6	0	0	0	0	109.7	S54 V55 A56	S52-S54 WeakPolarHBondContact CB-OG 3.43Å; S52-S54 PolarHBondContact O-N 2.85Å; S52-S54 VanDerWaalsContact O-N 3.08Å; S52-S54 PolarHBondContact OG-OG 3.01Å; S52-V55 PolarHBondContact O-N 2.81Å; S52-V55 WeakPolarHBondContact OG-CB 2.96Å; S52-V55 WeakPolarHBondContact OG-CG2 3.48Å; S52-V55 PolarHBondContact OG-N 3.32Å; S52-A56 PolarHBondContact O-N 3.19Å
53	V	59.4	Low	58.6	Low	122 Å²	122	120.2 Å²	120.2	74%	0.739	62%	0.615	S	S	*	*	H	α-helix	trans	-54.2	-27.1	172.8	176.5	0	0	0	0	110.2	L51 K57	L51-V53 PolarHBondContact O-N 2.9Å; V53-K57 WeakPolarHBondContact O-CA 3.48Å; V53-K57 WeakPolarHBondContact O-CB 2.97Å; V53-K57 PolarHBondContact O-N 2.98Å
54	S	62.2	Low	59.1	Low	68 Å²	68	124.4 Å²	124.4	48%	0.476	61%	0.612	S	S	.	*	H	α-helix	trans	-69.4	-45.3	171.1	53.4	0	0	0	0	113.8	S52 K57 E58	S52-S54 WeakPolarHBondContact CB-OG 3.43Å; S52-S54 PolarHBondContact O-N 2.85Å; S52-S54 VanDerWaalsContact O-N 3.08Å; S52-S54 PolarHBondContact OG-OG 3.01Å; S54-K57 PolarHBondContact O-N 2.73Å; S54-E58 VanDerWaalsContact O-CB 3.24Å; S54-E58 WeakPolarHBondContact O-CB 3.34Å; S54-E58 VanDerWaalsContact O-CG 3.23Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 3.34Å
55	V	66.8	Low	59.1	Low	90 Å²	90	122.7 Å²	122.7	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-67.8	-37.6	174.2	171.1	0	0	0	0	111	S52 W59	S52-V55 PolarHBondContact O-N 2.81Å; S52-V55 WeakPolarHBondContact OG-CB 2.96Å; S52-V55 WeakPolarHBondContact OG-CG2 3.48Å; S52-V55 PolarHBondContact OG-N 3.32Å; V55-W59 WeakPolarHBondContact O-CB 3.05Å; V55-W59 PolarHBondContact O-N 2.85Å
56	A	64.1	Low	58.9	Low	44 Å²	44	119.7 Å²	119.7	36%	0.364	60%	0.599	S	S	.	*	H	α-helix	trans	-64.9	-41.7	173.5	0	0	0	0	0	111.6	S52 W59 F60	S52-A56 PolarHBondContact O-N 3.19Å; A56-W59 PolarHBondContact O-N 3.04Å; A56-F60 WeakPolarHBondContact O-CB 3.26Å; A56-F60 PolarHBondContact O-N 2.82Å
57	K	68.2	Low	58.7	Low	124 Å²	124	111 Å²	111	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-69.2	-41.1	176.7	-178.1	-179.5	178.4	-60.5	0	111.9	V53 S54 F60 D61	V53-K57 WeakPolarHBondContact O-CA 3.48Å; V53-K57 WeakPolarHBondContact O-CB 2.97Å; V53-K57 PolarHBondContact O-N 2.98Å; S54-K57 PolarHBondContact O-N 2.73Å; K57-F60 CarbonylContact O-C 3.57Å; K57-F60 WeakPolarHBondContact O-CB 3.47Å; K57-F60 PolarHBondContact O-N 2.73Å; K57-D61 WeakPolarHBondContact CG-OD2 3.24Å; K57-D61 IonicContact NZ-OD2 3.98Å; K57-D61 PolarHBondContact NZ-OD2 3.06Å; K57-D61 VanDerWaalsContact O-CB 3.26Å; K57-D61 WeakPolarHBondContact O-CB 3.49Å; K57-D61 PolarHBondContact O-N 3.28Å
58	E	68.2	Low	58.4	Low	100 Å²	100	111.8 Å²	111.8	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-68.1	-37.8	174.3	-76.8	175.4	-159.1	0	0	111.7	S54 F60 D61 R62	S54-E58 VanDerWaalsContact O-CB 3.24Å; S54-E58 WeakPolarHBondContact O-CB 3.34Å; S54-E58 VanDerWaalsContact O-CG 3.23Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 3.34Å; E58-F60 VanDerWaalsContact C-N 3.34Å; E58-D61 PolarHBondContact O-N 2.85Å; E58-R62 WeakPolarHBondContact O-CB 3.13Å; E58-R62 WeakPolarHBondContact O-CG 3.47Å; E58-R62 PolarHBondContact O-N 3.21Å
59	W	64.9	Low	58.7	Low	127 Å²	127	111.4 Å²	111.4	48%	0.481	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-42.4	171	178.6	94.9	0	0	0	110.8	V55 A56 R63	V55-W59 WeakPolarHBondContact O-CB 3.05Å; V55-W59 PolarHBondContact O-N 2.85Å; A56-W59 PolarHBondContact O-N 3.04Å; W59-R63 WeakPolarHBondContact O-CB 3.48Å; W59-R63 PolarHBondContact O-N 2.95Å
60	F	67.6	Low	59	Low	131 Å²	131	106.9 Å²	106.9	58%	0.575	54%	0.537	S	S	*	.	H	α-helix	trans	-63.7	-47.3	174.4	-109.3	-87	0	0	0	111.7	A56 K57 E58 R63 R64	A56-F60 WeakPolarHBondContact O-CB 3.26Å; A56-F60 PolarHBondContact O-N 2.82Å; K57-F60 CarbonylContact O-C 3.57Å; K57-F60 WeakPolarHBondContact O-CB 3.47Å; K57-F60 PolarHBondContact O-N 2.73Å; E58-F60 VanDerWaalsContact C-N 3.34Å; F60-R63 CarbonylContact O-C 3.54Å; F60-R63 PolarHBondContact O-N 3.49Å; F60-R64 VanDerWaalsContact O-CB 3.29Å; F60-R64 WeakPolarHBondContact O-CB 3.38Å; F60-R64 PolarHBondContact O-N 3.29Å
61	D	66.1	Low	59	Low	51 Å²	51	107.2 Å²	107.2	27%	0.273	53%	0.533	S	S	.	.	H	α-helix	trans	-68.3	-38.3	-178.3	-73.4	-27	0	0	0	110.8	K57 E58 R64 M65	K57-D61 WeakPolarHBondContact CG-OD2 3.24Å; K57-D61 IonicContact NZ-OD2 3.98Å; K57-D61 PolarHBondContact NZ-OD2 3.06Å; K57-D61 VanDerWaalsContact O-CB 3.26Å; K57-D61 WeakPolarHBondContact O-CB 3.49Å; K57-D61 PolarHBondContact O-N 3.28Å; E58-D61 PolarHBondContact O-N 2.85Å; D61-R64 WeakPolarHBondContact O-CB 3.44Å; D61-R64 PolarHBondContact O-N 2.8Å; D61-M65 WeakPolarHBondContact O-CG 3.23Å; D61-M65 PolarHBondContact O-N 3.47Å
62	R	59.3	Low	58.8	Low	171 Å²	171	101.9 Å²	101.9	65%	0.645	51%	0.509	S	S	*	.	H	α-helix	trans	-66.1	-39.5	171.1	-72.1	172.3	-167	-86.8	2.2	111.9	E58 R64 M65 S66	E58-R62 WeakPolarHBondContact O-CB 3.13Å; E58-R62 WeakPolarHBondContact O-CG 3.47Å; E58-R62 PolarHBondContact O-N 3.21Å; R62-R64 VanDerWaalsContact C-N 3.34Å; R62-M65 PolarHBondContact O-N 3.31Å; R62-S66 PolarHBondContact O-N 2.95Å; R62-S66 VanDerWaalsContact O-N 3.09Å
63	R	56.5	Low	58.7	Low	113 Å²	113	100.5 Å²	100.5	43%	0.426	50%	0.498	S	S	.	.	H	α-helix	trans	-66.2	-35.5	171.1	-111.3	160.2	169.1	82	0.6	112.3	W59 F60 M65 S66 I67	W59-R63 WeakPolarHBondContact O-CB 3.48Å; W59-R63 PolarHBondContact O-N 2.95Å; F60-R63 CarbonylContact O-C 3.54Å; F60-R63 PolarHBondContact O-N 3.49Å; R63-M65 VanDerWaalsContact C-N 3.35Å; R63-S66 PolarHBondContact O-N 3.32Å; R63-S66 PolarHBondContact O-OG 3.05Å; R63-I67 VanDerWaalsContact O-CG1 3.24Å; R63-I67 WeakPolarHBondContact O-CG1 3.43Å; R63-I67 PolarHBondContact O-N 2.85Å; R63-I67 VanDerWaalsContact O-N 3.1Å
64	R	56.8	Low	58.5	Low	180 Å²	180	98.6 Å²	98.6	68%	0.679	49%	0.486	S	S	*	.	H	α-helix	trans	-67.5	-35.2	177.3	-146.2	177.1	-163.9	153.8	2.6	112	F60 D61 R62	F60-R64 VanDerWaalsContact O-CB 3.29Å; F60-R64 WeakPolarHBondContact O-CB 3.38Å; F60-R64 PolarHBondContact O-N 3.29Å; D61-R64 WeakPolarHBondContact O-CB 3.44Å; D61-R64 PolarHBondContact O-N 2.8Å; R62-R64 VanDerWaalsContact C-N 3.34Å
65	M	47.9	Very low	58.1	Low	159 Å²	159	99.3 Å²	99.3	78%	0.783	48%	0.484	S	S	*	.	H	α-helix	trans	-78.9	-24	174.3	-70	-163.2	-79.3	0	0	113.4	D61 R62 R63 I67	D61-M65 WeakPolarHBondContact O-CG 3.23Å; D61-M65 PolarHBondContact O-N 3.47Å; R62-M65 PolarHBondContact O-N 3.31Å; R63-M65 VanDerWaalsContact C-N 3.35Å; M65-I67 VanDerWaalsContact C-N 3.33Å
66	S	47.2	Very low	57.2	Low	79 Å²	79	101.2 Å²	101.2	55%	0.552	49%	0.487	S	S	*	.	S	Bend	trans	-83	-8.3	170.7	72.5	0	0	0	0	113.8	R62 R63 R68	R62-S66 PolarHBondContact O-N 2.95Å; R62-S66 VanDerWaalsContact O-N 3.09Å; R63-S66 PolarHBondContact O-N 3.32Å; R63-S66 PolarHBondContact O-OG 3.05Å; S66-R68 PolarHBondContact O-N 2.79Å; S66-R68 VanDerWaalsContact O-N 3.15Å
67	I	50.2	Low	56.5	Low	44 Å²	44	110 Å²	110	23%	0.226	51%	0.511	C	S	.	.	S	Bend	trans	-72.5	106.1	172.1	-75.6	160.6	0	0	0	107.1	R63 M65 W70 F105	R63-I67 VanDerWaalsContact O-CG1 3.24Å; R63-I67 WeakPolarHBondContact O-CG1 3.43Å; R63-I67 PolarHBondContact O-N 2.85Å; R63-I67 VanDerWaalsContact O-N 3.1Å; M65-I67 VanDerWaalsContact C-N 3.33Å; I67-W70 VanDerWaalsContact CG2-CD1 3.42Å; I67-F105 HydrophobicContact CD1-CE1 4.46Å; I67-F105 HydrophobicContact CD1-CE2 3.96Å; I67-F105 HydrophobicContact CD1-CZ 3.89Å; I67-F105 HydrophobicContact CG1-CD2 4.26Å; I67-F105 HydrophobicContact CG1-CE2 3.55Å; I67-F105 HydrophobicContact CG1-CZ 3.92Å
68	R	53.7	Low	55.7	Low	157 Å²	157	108 Å²	108	59%	0.592	50%	0.502	S	S	*	.			trans	-51.9	133.3	166.5	-78.6	-175.4	173.7	-165.2	-4.1	108.2	S66 W70	S66-R68 PolarHBondContact O-N 2.79Å; S66-R68 VanDerWaalsContact O-N 3.15Å; R68-W70 PolarHBondContact O-N 2.75Å; R68-W70 VanDerWaalsContact O-N 3.14Å
69	P	53.8	Low	55	Low	91 Å²	91	107.4 Å²	107.4	59%	0.591	50%	0.498	S	S	*	.			trans	-55	122.1	-169.9	17.6	-29.7	0	0	0	111.3	A71 S72	P69-A71 HydrophobicContact CB-CB 4.45Å; P69-A71 PolarHBondContact O-N 3.39Å; P69-S72 PolarHBondContact O-N 2.85Å; P69-S72 VanDerWaalsContact O-N 3.12Å; P69-S72 PolarHBondContact O-OG 3.26Å
70	W	55.9	Low	54.5	Low	121 Å²	121	103.6 Å²	103.6	46%	0.458	49%	0.491	S	S	.	.	H	α-helix	trans	-55.2	-18.7	174.8	-76.8	54.4	0	0	0	112.6	I67 R68 S72 F73 V74 I106	I67-W70 VanDerWaalsContact CG2-CD1 3.42Å; R68-W70 PolarHBondContact O-N 2.75Å; R68-W70 VanDerWaalsContact O-N 3.14Å; W70-S72 VanDerWaalsContact C-N 3.3Å; W70-S72 PolarHBondContact O-N 3.47Å; W70-F73 WeakPolarHBondContact O-CB 3.29Å; W70-F73 PolarHBondContact O-N 3.47Å; W70-F73 VanDerWaalsContact O-N 3.15Å; W70-V74 PolarHBondContact O-N 2.82Å; W70-I106 HydrophobicContact CH2-CG1 4.28Å
71	A	52.4	Low	53.3	Low	79 Å²	79	106.7 Å²	106.7	65%	0.653	50%	0.504	S	S	*	.	H	α-helix	trans	-58.4	-35	175.3	0	0	0	0	0	113.4	P69	P69-A71 HydrophobicContact CB-CB 4.45Å; P69-A71 PolarHBondContact O-N 3.39Å
72	S	54.7	Low	52.7	Low	46 Å²	46	105.7 Å²	105.7	32%	0.322	50%	0.501	S	S	.	.	H	α-helix	trans	-81.9	-22.2	176.3	74.8	0	0	0	0	113.1	P69 W70 R195	P69-S72 PolarHBondContact O-N 2.85Å; P69-S72 VanDerWaalsContact O-N 3.12Å; P69-S72 PolarHBondContact O-OG 3.26Å; W70-S72 VanDerWaalsContact C-N 3.3Å; W70-S72 PolarHBondContact O-N 3.47Å; S72-R195 PolarHBondContact O-NH2 2.93Å
73	F	57.2	Low	52.5	Low	14 Å²	14	108.3 Å²	108.3	6%	0.061	51%	0.511	C	S	.	.	H	α-helix	trans	-75.5	-33.6	176.7	-167.2	-98.8	0	0	0	111.4	W70 Y99 N102 Y103 I106 H191	W70-F73 WeakPolarHBondContact O-CB 3.29Å; W70-F73 PolarHBondContact O-N 3.47Å; W70-F73 VanDerWaalsContact O-N 3.15Å; F73-Y99 AromaticContact CD2-CD1 3.64Å; F73-Y99 HydrophobicContact CD2-CD1 3.64Å; F73-Y99 HydrophobicContact CD2-CD2 4.44Å; F73-Y99 HydrophobicContact CD2-CE1 4.28Å; F73-Y99 AromaticContact CD2-CG 3.74Å; F73-Y99 HydrophobicContact CD2-CG 3.74Å; F73-Y99 HydrophobicContact CE2-CD1 4.35Å; F73-Y99 HydrophobicContact CE2-CG 4.01Å; F73-N102 HydrophobicContact CD2-CB 4.1Å; F73-N102 HydrophobicContact CE2-CB 4.01Å; F73-N102 HydrophobicContact CZ-CB 4.43Å; F73-Y103 AromaticContact CE2-CD1 3.97Å; F73-Y103 HydrophobicContact CE2-CD1 3.97Å; F73-Y103 AromaticContact CE2-CE1 3.43Å; F73-Y103 HydrophobicContact CE2-CE1 3.43Å; F73-Y103 VanDerWaalsContact CE2-CE1 3.43Å; F73-Y103 HydrophobicContact CE2-CE2 4.25Å; F73-Y103 AromaticContact CE2-CZ 3.57Å; F73-Y103 AromaticContact CZ-CD1 3.68Å; F73-Y103 HydrophobicContact CZ-CD1 3.68Å; F73-Y103 AromaticContact CZ-CE1 3.22Å; F73-Y103 HydrophobicContact CZ-CE1 3.22Å; F73-Y103 AromaticContact CZ-CZ 3.88Å; F73-I106 HydrophobicContact CE1-CD1 3.93Å; F73-I106 HydrophobicContact CZ-CD1 4.04Å; F73-H191 AromaticContact CD1-NE2 3.84Å; F73-H191 AromaticContact CD2-NE2 3.9Å; F73-H191 AromaticContact CE1-CD2 3.93Å; F73-H191 AromaticContact CE1-NE2 3.65Å; F73-H191 AromaticContact CE2-CD2 3.87Å; F73-H191 AromaticContact CE2-NE2 3.73Å; F73-H191 AromaticContact CG-NE2 3.98Å; F73-H191 AromaticContact CZ-CD2 3.58Å; F73-H191 AromaticContact CZ-NE2 3.62Å; F73-H191 PolarHBondContact O-CE1 3.25Å; F73-H191 PolarHBondContact O-NE2 2.74Å
74	V	54.5	Low	52.9	Low	82 Å²	82	107.9 Å²	107.9	50%	0.497	52%	0.517	S	S	.	.	S	Bend	trans	-94.3	11.3	178	-175.4	0	0	0	0	112.2	W70 Q76	W70-V74 PolarHBondContact O-N 2.82Å; V74-Q76 VanDerWaalsContact C-N 3.34Å; V74-Q76 WeakPolarHBondContact O-CG 3.17Å; V74-Q76 PolarHBondContact O-N 3.48Å
75	D	53.8	Low	53.2	Low	82 Å²	82	108 Å²	108	44%	0.439	52%	0.523	S	S	.	.			trans	-75.7	90.3	175.3	-153.2	-12.6	0	0	0	110.4	R77	D75-R77 PolarHBondContact O-N 3.46Å; D75-R77 VanDerWaalsContact O-N 3.17Å; D75-R77 WeakPolarHBondContact OD1-CD 3.5Å; D75-R77 WeakPolarHBondContact OD1-CG 3.23Å
76	Q	48	Very low	54.1	Low	130 Å²	130	102.8 Å²	102.8	61%	0.607	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-71.5	-0.2	-176	-58.2	-163.9	-7.2	0	0	113.6	V74 K78 F79	V74-Q76 VanDerWaalsContact C-N 3.34Å; V74-Q76 WeakPolarHBondContact O-CG 3.17Å; V74-Q76 PolarHBondContact O-N 3.48Å; Q76-K78 PolarHBondContact O-N 3.33Å; Q76-F79 VanDerWaalsContact CA-CE2 3.44Å; Q76-F79 HydrophobicContact CB-CD2 3.71Å; Q76-F79 HydrophobicContact CB-CE2 3.38Å; Q76-F79 HydrophobicContact CB-CZ 4.43Å; Q76-F79 HydrophobicContact CG-CD2 4.37Å; Q76-F79 HydrophobicContact CG-CE2 3.54Å; Q76-F79 HydrophobicContact CG-CZ 4.31Å; Q76-F79 WeakPolarHBondContact O-CD2 3.44Å
77	R	50	Low	55	Low	228 Å²	228	100.9 Å²	100.9	86%	0.86	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-74.6	-12.6	-175.7	-66.7	178.1	129.3	-177.8	-3.2	113.9	D75	D75-R77 PolarHBondContact O-N 3.46Å; D75-R77 VanDerWaalsContact O-N 3.17Å; D75-R77 WeakPolarHBondContact OD1-CD 3.5Å; D75-R77 WeakPolarHBondContact OD1-CG 3.23Å
78	K	51.5	Low	55.8	Low	82 Å²	82	100.2 Å²	100.2	36%	0.357	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-108.4	34.9	178.9	-63.5	-166.9	178.6	-167.9	0	112.7	Q76 Q196 E198	Q76-K78 PolarHBondContact O-N 3.33Å; K78-Q196 HydrophobicContact CB-CB 4.26Å; K78-Q196 WeakPolarHBondContact O-CB 3.46Å; K78-Q196 PolarHBondContact O-N 3.37Å; K78-E198 IonicContact NZ-OE1 3.16Å; K78-E198 PolarHBondContact NZ-OE1 3.49Å; K78-E198 IonicContact NZ-OE2 2.75Å
79	F	52.3	Low	56.5	Low	88 Å²	88	96.5 Å²	96.5	39%	0.386	49%	0.486	S	S	.	.	B	Isolated β-bridge	trans	-87.8	120.6	173	-73.1	-50.9	0	0	0	110.3	Q76 F194	Q76-F79 VanDerWaalsContact CA-CE2 3.44Å; Q76-F79 HydrophobicContact CB-CD2 3.71Å; Q76-F79 HydrophobicContact CB-CE2 3.38Å; Q76-F79 HydrophobicContact CB-CZ 4.43Å; Q76-F79 HydrophobicContact CG-CD2 4.37Å; Q76-F79 HydrophobicContact CG-CE2 3.54Å; Q76-F79 HydrophobicContact CG-CZ 4.31Å; Q76-F79 WeakPolarHBondContact O-CD2 3.44Å; F79-F194 WeakPolarHBondContact CA-O 3.25Å; F79-F194 HydrophobicContact CD1-CB 3.54Å; F79-F194 WeakPolarHBondContact CD1-O 3.11Å; F79-F194 HydrophobicContact CE1-CB 3.78Å
80	S	54.3	Low	57.3	Low	48 Å²	48	96.7 Å²	96.7	34%	0.336	48%	0.479	S	S	.	.			trans	-139.9	142.9	175	-93.3	0	0	0	0	111.3	P82 F194 Q196	S80-P82 WeakPolarHBondContact O-CD 3.17Å; S80-F194 PolarHBondContact N-O 2.91Å; S80-Q196 PolarHBondContact OG-NE2 3.45Å
81	K	44.1	Very low	58	Low	195 Å²	195	92 Å²	92	85%	0.848	46%	0.461	S	S	*	.			trans	-70.8	121.6	-177.1	-146.6	176.7	-171.2	-180	0	109.2
82	P	53	Low	58.9	Low	30 Å²	30	90.1 Å²	90.1	20%	0.195	44%	0.442	C	S	.	.			trans	-65.7	145.3	178.5	27.9	-36.4	0	0	0	111.1	S80 L88	S80-P82 WeakPolarHBondContact O-CD 3.17Å; P82-L88 HydrophobicContact CB-CD1 3.91Å; P82-L88 HydrophobicContact CB-CD2 3.49Å; P82-L88 VanDerWaalsContact CB-CD2 3.49Å; P82-L88 HydrophobicContact CB-CG 3.43Å; P82-L88 VanDerWaalsContact CB-CG 3.43Å; P82-L88 HydrophobicContact CG-CD1 3.62Å; P82-L88 HydrophobicContact CG-CD2 3.37Å; P82-L88 HydrophobicContact CG-CG 3.59Å
83	R	55.2	Low	59.9	Low	226 Å²	226	91.4 Å²	91.4	85%	0.853	45%	0.448	S	S	*	.	S	Bend	trans	-85.6	-36.6	179.8	-129.6	165	68	149.5	-1	111.6
84	N	63.7	Low	60.6	Low	105 Å²	105	96.3 Å²	96.3	56%	0.561	47%	0.469	S	S	*	.			trans	-136.4	152.7	-175.1	-69.8	9.5	0	0	0	114	E87 L88	N84-E87 HydrophobicContact CB-CB 4.45Å; N84-L88 PolarHBondContact O-N 2.81Å; N84-L88 VanDerWaalsContact O-N 3.14Å
85	F	63.3	Low	61.5	Low	182 Å²	182	92.9 Å²	92.9	80%	0.798	45%	0.448	S	S	*	.	H	α-helix	trans	-68.4	-30.3	177.5	-80.3	-85.1	0	0	0	114.8	L88 C89	F85-L88 HydrophobicContact CD1-CD1 4.2Å; F85-L88 WeakPolarHBondContact O-CB 3.4Å; F85-L88 PolarHBondContact O-N 2.91Å; F85-C89 PolarHBondContact O-N 2.85Å; F85-C89 VanDerWaalsContact O-N 3.16Å
86	G	67.9	Low	62.4	Low	50 Å²	50	91.4 Å²	91.4	52%	0.515	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-43.2	175.5	0	0	0	0	0	112.2	L88 C89 Q90	G86-L88 VanDerWaalsContact C-N 3.31Å; G86-L88 PolarHBondContact O-N 2.81Å; G86-C89 PolarHBondContact O-N 3.36Å; G86-Q90 PolarHBondContact O-N 3.39Å
87	E	65.7	Low	63.6	Low	38 Å²	38	91.2 Å²	91.2	18%	0.178	44%	0.441	C	S	.	.	H	α-helix	trans	-64.3	-37.4	175.2	-162.4	-169	165.6	0	0	111.2	N84 C89 Q90 R91 L202	N84-E87 HydrophobicContact CB-CB 4.45Å; E87-C89 PolarHBondContact O-N 3.23Å; E87-Q90 PolarHBondContact O-N 2.98Å; E87-R91 WeakPolarHBondContact O-CB 3.32Å; E87-R91 WeakPolarHBondContact O-CD 3.23Å; E87-R91 WeakPolarHBondContact O-CG 3.39Å; E87-R91 PolarHBondContact O-N 3.31Å; E87-R91 IonicContact OE1-CZ 3.62Å; E87-R91 VanDerWaalsContact OE1-CZ 3.24Å; E87-R91 IonicContact OE1-NE 3.24Å; E87-R91 PolarHBondContact OE1-NE 2.96Å; E87-R91 VanDerWaalsContact OE1-NE 3.16Å; E87-R91 IonicContact OE1-NH2 3.82Å; E87-R91 PolarHBondContact OE1-NH2 3.32Å; E87-R91 IonicContact OE2-NH2 2.81Å; E87-L202 HydrophobicContact CG-CD1 4.14Å; E87-L202 HydrophobicContact CG-CD2 4.13Å; E87-L202 WeakPolarHBondContact OE1-CD2 3.27Å
88	L	66.8	Low	64.6	Low	31 Å²	31	83.8 Å²	83.8	16%	0.162	42%	0.42	C	S	.	.	H	α-helix	trans	-57.9	-46	172.2	-88.3	169.7	0	0	0	113.2	P82 N84 F85 G86 R91 V92 A193	P82-L88 HydrophobicContact CB-CD1 3.91Å; P82-L88 HydrophobicContact CB-CD2 3.49Å; P82-L88 VanDerWaalsContact CB-CD2 3.49Å; P82-L88 HydrophobicContact CB-CG 3.43Å; P82-L88 VanDerWaalsContact CB-CG 3.43Å; P82-L88 HydrophobicContact CG-CD1 3.62Å; P82-L88 HydrophobicContact CG-CD2 3.37Å; P82-L88 HydrophobicContact CG-CG 3.59Å; N84-L88 PolarHBondContact O-N 2.81Å; N84-L88 VanDerWaalsContact O-N 3.14Å; F85-L88 HydrophobicContact CD1-CD1 4.2Å; F85-L88 WeakPolarHBondContact O-CB 3.4Å; F85-L88 PolarHBondContact O-N 2.91Å; G86-L88 VanDerWaalsContact C-N 3.31Å; G86-L88 PolarHBondContact O-N 2.81Å; L88-R91 WeakPolarHBondContact O-CB 3.39Å; L88-R91 PolarHBondContact O-N 3.31Å; L88-V92 WeakPolarHBondContact O-CG2 3.28Å; L88-V92 PolarHBondContact O-N 3.3Å; L88-A193 HydrophobicContact CD2-CB 3.75Å
89	C	69.1	Low	65.5	Low	79 Å²	79	81.1 Å²	81.1	53%	0.534	41%	0.408	S	S	.	.	H	α-helix	trans	-65	-46	-178.8	-169.3	0	0	0	0	111.1	F85 G86 E87 R91 V92 V93	F85-C89 PolarHBondContact O-N 2.85Å; F85-C89 VanDerWaalsContact O-N 3.16Å; G86-C89 PolarHBondContact O-N 3.36Å; E87-C89 PolarHBondContact O-N 3.23Å; C89-R91 PolarHBondContact O-N 3.42Å; C89-V92 PolarHBondContact O-N 2.84Å; C89-V92 VanDerWaalsContact O-N 3.16Å; C89-V93 WeakPolarHBondContact O-CG2 3.32Å; C89-V93 PolarHBondContact O-N 3.48Å
90	Q	69.3	Low	66.5	Low	94 Å²	94	81.3 Å²	81.3	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-59.8	-37.9	173.6	-73.2	179.9	-30.5	0	0	111.5	G86 E87 V93 K94	G86-Q90 PolarHBondContact O-N 3.39Å; E87-Q90 PolarHBondContact O-N 2.98Å; Q90-V93 PolarHBondContact O-N 2.81Å; Q90-K94 PolarHBondContact O-N 3.41Å; Q90-K94 VanDerWaalsContact O-N 3.14Å
91	R	70.9	Confident	67.5	Low	22 Å²	22	82.4 Å²	82.4	8%	0.083	42%	0.421	C	S	.	.	H	α-helix	trans	-61.8	-42.8	174	-70	159.8	174.5	-140.1	5.1	114.1	E87 L88 C89 N95 L197	E87-R91 WeakPolarHBondContact O-CB 3.32Å; E87-R91 WeakPolarHBondContact O-CD 3.23Å; E87-R91 WeakPolarHBondContact O-CG 3.39Å; E87-R91 PolarHBondContact O-N 3.31Å; E87-R91 IonicContact OE1-CZ 3.62Å; E87-R91 VanDerWaalsContact OE1-CZ 3.24Å; E87-R91 IonicContact OE1-NE 3.24Å; E87-R91 PolarHBondContact OE1-NE 2.96Å; E87-R91 VanDerWaalsContact OE1-NE 3.16Å; E87-R91 IonicContact OE1-NH2 3.82Å; E87-R91 PolarHBondContact OE1-NH2 3.32Å; E87-R91 IonicContact OE2-NH2 2.81Å; L88-R91 WeakPolarHBondContact O-CB 3.39Å; L88-R91 PolarHBondContact O-N 3.31Å; C89-R91 PolarHBondContact O-N 3.42Å; R91-N95 VanDerWaalsContact O-CB 3.26Å; R91-N95 WeakPolarHBondContact O-CB 3.33Å; R91-N95 PolarHBondContact O-N 3Å; R91-N95 PolarHBondContact O-ND2 3.1Å; R91-L197 HydrophobicContact CB-CD1 3.56Å; R91-L197 HydrophobicContact CG-CB 4.2Å; R91-L197 HydrophobicContact CG-CD1 3.22Å; R91-L197 HydrophobicContact CG-CG 4.31Å
92	V	71.8	Confident	69.1	Low	40 Å²	40	73.3 Å²	73.3	24%	0.242	38%	0.381	C	S	.	.	H	α-helix	trans	-65.6	-49.2	177.4	172.4	0	0	0	0	110.6	L88 C89 K94 N95 V96 A192 A193	L88-V92 WeakPolarHBondContact O-CG2 3.28Å; L88-V92 PolarHBondContact O-N 3.3Å; C89-V92 PolarHBondContact O-N 2.84Å; C89-V92 VanDerWaalsContact O-N 3.16Å; V92-K94 PolarHBondContact O-N 3.39Å; V92-N95 PolarHBondContact O-N 2.91Å; V92-V96 HydrophobicContact CG1-CG2 4.05Å; V92-V96 VanDerWaalsContact O-CB 3.29Å; V92-V96 WeakPolarHBondContact O-CB 3.36Å; V92-V96 WeakPolarHBondContact O-CG2 3.43Å; V92-V96 PolarHBondContact O-N 3.16Å; V92-A192 HydrophobicContact CB-CB 4.37Å; V92-A192 HydrophobicContact CG1-CB 4.28Å; V92-A192 HydrophobicContact CG2-CB 4.13Å; V92-A193 HydrophobicContact CG2-CB 4.3Å
93	V	75.9	Confident	70.5	Confident	74 Å²	74	72.2 Å²	72.2	45%	0.448	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-51.4	-176.1	175	0	0	0	0	111.6	C89 Q90 N95 V96 E97	C89-V93 WeakPolarHBondContact O-CG2 3.32Å; C89-V93 PolarHBondContact O-N 3.48Å; Q90-V93 PolarHBondContact O-N 2.81Å; V93-N95 PolarHBondContact O-N 2.96Å; V93-V96 PolarHBondContact O-N 3.32Å; V93-E97 WeakPolarHBondContact O-CG 3.24Å; V93-E97 PolarHBondContact O-N 3.09Å
94	K	72.1	Confident	71.8	Confident	116 Å²	116	65 Å²	65	50%	0.504	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-43.9	180	-75.1	-71.6	-172.5	175.8	0	112.5	Q90 V92 V96 E97 V98 L197	Q90-K94 PolarHBondContact O-N 3.41Å; Q90-K94 VanDerWaalsContact O-N 3.14Å; V92-K94 PolarHBondContact O-N 3.39Å; K94-V96 VanDerWaalsContact C-N 3.33Å; K94-V96 PolarHBondContact O-N 2.87Å; K94-E97 PolarHBondContact O-N 3.03Å; K94-V98 VanDerWaalsContact O-CG2 3.28Å; K94-V98 WeakPolarHBondContact O-CG2 3.39Å; K94-V98 PolarHBondContact O-N 2.92Å; K94-L197 HydrophobicContact CB-CD1 4.35Å; K94-L197 HydrophobicContact CB-CD2 4.34Å
95	N	72.8	Confident	72.6	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.059	34%	0.342	C	S	.	.	H	α-helix	trans	-66.5	-36.2	177.7	-77.2	-53.2	0	0	0	111.9	R91 V92 V93 V98 Y99 Y103 A192 R195	R91-N95 VanDerWaalsContact O-CB 3.26Å; R91-N95 WeakPolarHBondContact O-CB 3.33Å; R91-N95 PolarHBondContact O-N 3Å; R91-N95 PolarHBondContact O-ND2 3.1Å; V92-N95 PolarHBondContact O-N 2.91Å; V93-N95 PolarHBondContact O-N 2.96Å; N95-V98 PolarHBondContact O-N 2.89Å; N95-Y99 WeakPolarHBondContact O-CD2 3.28Å; N95-Y99 PolarHBondContact O-N 3.47Å; N95-Y103 WeakPolarHBondContact O-CE2 3.4Å; N95-A192 HydrophobicContact CB-CB 4.11Å; N95-A192 PolarHBondContact ND2-O 3.46Å; N95-R195 PolarHBondContact ND2-O 2.97Å
96	V	73.1	Confident	73.6	Confident	50 Å²	50	56.3 Å²	56.3	30%	0.303	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-43	174.2	168.6	0	0	0	0	111.4	V92 V93 K94 N100 Y103 I188	V92-V96 HydrophobicContact CG1-CG2 4.05Å; V92-V96 VanDerWaalsContact O-CB 3.29Å; V92-V96 WeakPolarHBondContact O-CB 3.36Å; V92-V96 WeakPolarHBondContact O-CG2 3.43Å; V92-V96 PolarHBondContact O-N 3.16Å; V93-V96 PolarHBondContact O-N 3.32Å; K94-V96 VanDerWaalsContact C-N 3.33Å; K94-V96 PolarHBondContact O-N 2.87Å; V96-N100 WeakPolarHBondContact O-CA 3.33Å; V96-N100 WeakPolarHBondContact O-CB 3.48Å; V96-N100 PolarHBondContact O-N 3.41Å; V96-Y103 HydrophobicContact CB-CE2 4.45Å; V96-Y103 HydrophobicContact CG2-CD2 4.43Å; V96-Y103 HydrophobicContact CG2-CE2 4.18Å; V96-I188 HydrophobicContact CG2-CG2 3.95Å
97	E	73.1	Confident	74.4	Confident	126 Å²	126	56.9 Å²	56.9	59%	0.589	30%	0.301	S	S	*	.	H	α-helix	trans	-63.9	-44.5	176.2	-71.8	174.7	175.2	0	0	112.2	V93 K94 Y99	V93-E97 WeakPolarHBondContact O-CG 3.24Å; V93-E97 PolarHBondContact O-N 3.09Å; K94-E97 PolarHBondContact O-N 3.03Å; E97-Y99 PolarHBondContact O-N 3.48Å
98	V	69.9	Low	75.3	Confident	72 Å²	72	60 Å²	60	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-67.5	-35.6	-177.3	172.8	0	0	0	0	112.6	K94 N95	K94-V98 VanDerWaalsContact O-CG2 3.28Å; K94-V98 WeakPolarHBondContact O-CG2 3.39Å; K94-V98 PolarHBondContact O-N 2.92Å; N95-V98 PolarHBondContact O-N 2.89Å
99	Y	70.9	Confident	76.2	Confident	27 Å²	27	60.4 Å²	60.4	11%	0.106	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	21.4	-177.7	-59.3	-79.2	0	0	0	113.8	F73 N95 E97 S101 N102 Y103 R195	F73-Y99 AromaticContact CD2-CD1 3.64Å; F73-Y99 HydrophobicContact CD2-CD1 3.64Å; F73-Y99 HydrophobicContact CD2-CD2 4.44Å; F73-Y99 HydrophobicContact CD2-CE1 4.28Å; F73-Y99 AromaticContact CD2-CG 3.74Å; F73-Y99 HydrophobicContact CD2-CG 3.74Å; F73-Y99 HydrophobicContact CE2-CD1 4.35Å; F73-Y99 HydrophobicContact CE2-CG 4.01Å; N95-Y99 WeakPolarHBondContact O-CD2 3.28Å; N95-Y99 PolarHBondContact O-N 3.47Å; E97-Y99 PolarHBondContact O-N 3.48Å; Y99-S101 PolarHBondContact O-N 3.28Å; Y99-S101 VanDerWaalsContact O-N 3.1Å; Y99-N102 PolarHBondContact O-N 2.82Å; Y99-Y103 VanDerWaalsContact O-CD2 3.24Å; Y99-Y103 WeakPolarHBondContact O-CD2 3.28Å; Y99-Y103 PolarHBondContact O-N 3.19Å; Y99-Y103 VanDerWaalsContact O-N 3.07Å; Y99-R195 PolarHBondContact OH-NH1 3.5Å; Y99-R195 PolarHBondContact OH-NH2 3.16Å
100	N	74.6	Confident	77.1	Confident	92 Å²	92	58.6 Å²	58.6	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-48.9	-43.1	-176.5	-175.3	10.1	0	0	0	112.9	V96 N102 Y103 T104	V96-N100 WeakPolarHBondContact O-CA 3.33Å; V96-N100 WeakPolarHBondContact O-CB 3.48Å; V96-N100 PolarHBondContact O-N 3.41Å; N100-N102 PolarHBondContact O-N 2.81Å; N100-Y103 PolarHBondContact O-N 3.29Å; N100-T104 WeakPolarHBondContact O-CB 3.42Å; N100-T104 PolarHBondContact O-N 3.06Å; N100-T104 PolarHBondContact O-OG1 3.15Å; N100-T104 PolarHBondContact OD1-OG1 3.2Å
101	S	74.3	Confident	77.9	Confident	71 Å²	71	56.7 Å²	56.7	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-42.2	178	-53.4	0	0	0	0	112.9	Y99 T104 F105	Y99-S101 PolarHBondContact O-N 3.28Å; Y99-S101 VanDerWaalsContact O-N 3.1Å; S101-T104 WeakPolarHBondContact O-CB 3.49Å; S101-T104 PolarHBondContact O-N 3.42Å; S101-F105 WeakPolarHBondContact O-CD2 3.34Å; S101-F105 PolarHBondContact O-N 3.37Å; S101-F105 VanDerWaalsContact O-N 3.13Å
102	N	78.3	Confident	78.7	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-67.9	-42.9	179.3	-70.5	-12.2	0	0	0	111.3	F73 Y99 N100 T104 F105 I106	F73-N102 HydrophobicContact CD2-CB 4.1Å; F73-N102 HydrophobicContact CE2-CB 4.01Å; F73-N102 HydrophobicContact CZ-CB 4.43Å; Y99-N102 PolarHBondContact O-N 2.82Å; N100-N102 PolarHBondContact O-N 2.81Å; N102-T104 VanDerWaalsContact C-N 3.32Å; N102-T104 PolarHBondContact O-N 3.14Å; N102-F105 PolarHBondContact O-N 2.82Å; N102-I106 WeakPolarHBondContact O-CG1 3.34Å; N102-I106 PolarHBondContact O-N 3.44Å; N102-I106 VanDerWaalsContact O-N 3.07Å
103	Y	81.6	Confident	79.4	Confident	8 Å²	8	65.8 Å²	65.8	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-62.4	-38.4	174	-68.3	-44.1	0	0	0	112.8	F73 N95 V96 Y99 N100 F105 I106 F107 I188 H191	F73-Y103 AromaticContact CE2-CD1 3.97Å; F73-Y103 HydrophobicContact CE2-CD1 3.97Å; F73-Y103 AromaticContact CE2-CE1 3.43Å; F73-Y103 HydrophobicContact CE2-CE1 3.43Å; F73-Y103 VanDerWaalsContact CE2-CE1 3.43Å; F73-Y103 HydrophobicContact CE2-CE2 4.25Å; F73-Y103 AromaticContact CE2-CZ 3.57Å; F73-Y103 AromaticContact CZ-CD1 3.68Å; F73-Y103 HydrophobicContact CZ-CD1 3.68Å; F73-Y103 AromaticContact CZ-CE1 3.22Å; F73-Y103 HydrophobicContact CZ-CE1 3.22Å; F73-Y103 AromaticContact CZ-CZ 3.88Å; N95-Y103 WeakPolarHBondContact O-CE2 3.4Å; V96-Y103 HydrophobicContact CB-CE2 4.45Å; V96-Y103 HydrophobicContact CG2-CD2 4.43Å; V96-Y103 HydrophobicContact CG2-CE2 4.18Å; Y99-Y103 VanDerWaalsContact O-CD2 3.24Å; Y99-Y103 WeakPolarHBondContact O-CD2 3.28Å; Y99-Y103 PolarHBondContact O-N 3.19Å; Y99-Y103 VanDerWaalsContact O-N 3.07Å; N100-Y103 PolarHBondContact O-N 3.29Å; Y103-F105 VanDerWaalsContact C-N 3.33Å; Y103-F105 PolarHBondContact O-N 3.33Å; Y103-I106 PolarHBondContact O-N 3.48Å; Y103-F107 WeakPolarHBondContact O-CB 3.26Å; Y103-F107 PolarHBondContact O-N 3.43Å; Y103-I188 HydrophobicContact CD1-CB 4.1Å; Y103-I188 HydrophobicContact CD1-CD1 3.83Å; Y103-I188 HydrophobicContact CD1-CG1 3.59Å; Y103-I188 HydrophobicContact CD1-CG2 3.68Å; Y103-I188 HydrophobicContact CD2-CG2 4.28Å; Y103-I188 HydrophobicContact CE1-CB 4.19Å; Y103-I188 HydrophobicContact CE1-CG1 4.13Å; Y103-I188 HydrophobicContact CE1-CG2 3.65Å; Y103-I188 HydrophobicContact CE2-CG2 4.31Å; Y103-I188 HydrophobicContact CG-CD1 3.96Å; Y103-I188 HydrophobicContact CG-CG1 4.23Å; Y103-I188 HydrophobicContact CG-CG2 4Å; Y103-H191 PolarHBondContact OH-CD2 3Å
104	T	82.3	Confident	80	Confident	74 Å²	74	63.1 Å²	63.1	45%	0.454	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-39.7	174.3	-61.2	0	0	0	0	111.8	N100 S101 N102 L108	N100-T104 WeakPolarHBondContact O-CB 3.42Å; N100-T104 PolarHBondContact O-N 3.06Å; N100-T104 PolarHBondContact O-OG1 3.15Å; N100-T104 PolarHBondContact OD1-OG1 3.2Å; S101-T104 WeakPolarHBondContact O-CB 3.49Å; S101-T104 PolarHBondContact O-N 3.42Å; N102-T104 VanDerWaalsContact C-N 3.32Å; N102-T104 PolarHBondContact O-N 3.14Å; T104-L108 VanDerWaalsContact O-CB 3.31Å; T104-L108 WeakPolarHBondContact O-CB 3.19Å; T104-L108 PolarHBondContact O-N 3.27Å
105	F	81.9	Confident	80.6	Confident	69 Å²	69	59.7 Å²	59.7	30%	0.303	32%	0.317	S	S	.	.	H	α-helix	trans	-67.4	-41.8	175.2	-80.1	-69.7	0	0	0	112.8	I67 S101 N102 Y103 L108 G109	I67-F105 HydrophobicContact CD1-CE1 4.46Å; I67-F105 HydrophobicContact CD1-CE2 3.96Å; I67-F105 HydrophobicContact CD1-CZ 3.89Å; I67-F105 HydrophobicContact CG1-CD2 4.26Å; I67-F105 HydrophobicContact CG1-CE2 3.55Å; I67-F105 HydrophobicContact CG1-CZ 3.92Å; S101-F105 WeakPolarHBondContact O-CD2 3.34Å; S101-F105 PolarHBondContact O-N 3.37Å; S101-F105 VanDerWaalsContact O-N 3.13Å; N102-F105 PolarHBondContact O-N 2.82Å; Y103-F105 VanDerWaalsContact C-N 3.33Å; Y103-F105 PolarHBondContact O-N 3.33Å; F105-L108 PolarHBondContact O-N 3.5Å; F105-G109 PolarHBondContact O-N 3.48Å
106	I	83.4	Confident	81.3	Confident	36 Å²	36	64.7 Å²	64.7	19%	0.185	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-47.4	175	-65.7	169.4	0	0	0	109.9	W70 F73 N102 Y103 L108 G109 L110 V187	W70-I106 HydrophobicContact CH2-CG1 4.28Å; F73-I106 HydrophobicContact CE1-CD1 3.93Å; F73-I106 HydrophobicContact CZ-CD1 4.04Å; N102-I106 WeakPolarHBondContact O-CG1 3.34Å; N102-I106 PolarHBondContact O-N 3.44Å; N102-I106 VanDerWaalsContact O-N 3.07Å; Y103-I106 PolarHBondContact O-N 3.48Å; I106-L108 PolarHBondContact O-N 3.12Å; I106-G109 PolarHBondContact O-N 2.91Å; I106-L110 WeakPolarHBondContact O-CB 3.49Å; I106-L110 PolarHBondContact O-N 3.14Å; I106-V187 HydrophobicContact CG2-CG1 4.46Å
107	F	83.8	Confident	81.9	Confident	61 Å²	61	65.8 Å²	65.8	27%	0.268	35%	0.352	S	S	.	.	H	α-helix	trans	-57.4	-47.2	176.7	178.1	-117.1	0	0	0	111.9	Y103 G109 L110 I111 V180 F181 T184	Y103-F107 WeakPolarHBondContact O-CB 3.26Å; Y103-F107 PolarHBondContact O-N 3.43Å; F107-G109 PolarHBondContact O-N 3.42Å; F107-L110 WeakPolarHBondContact O-CB 3.42Å; F107-L110 PolarHBondContact O-N 2.88Å; F107-I111 HydrophobicContact CD1-CD1 3.91Å; F107-I111 HydrophobicContact CE1-CD1 3.51Å; F107-I111 HydrophobicContact CE2-CD1 4.19Å; F107-I111 HydrophobicContact CE2-CG1 4.44Å; F107-I111 HydrophobicContact CG-CD1 4.42Å; F107-I111 HydrophobicContact CZ-CD1 3.68Å; F107-I111 HydrophobicContact CZ-CG1 4.37Å; F107-I111 WeakPolarHBondContact O-CG1 3.48Å; F107-I111 PolarHBondContact O-N 3.01Å; F107-V180 HydrophobicContact CD2-CG1 4.26Å; F107-V180 HydrophobicContact CE2-CG1 3.92Å; F107-F181 HydrophobicContact CE2-CD1 4.45Å; F107-F181 HydrophobicContact CE2-CE1 4.26Å; F107-F181 HydrophobicContact CZ-CE1 4.25Å; F107-F181 HydrophobicContact CZ-CZ 4.31Å; F107-T184 HydrophobicContact CB-CG2 4.33Å; F107-T184 HydrophobicContact CD2-CG2 3.73Å; F107-T184 WeakPolarHBondContact CD2-OG1 3.29Å; F107-T184 HydrophobicContact CG-CG2 4.43Å
108	L	86.3	Confident	82.4	Confident	104 Å²	104	61.4 Å²	61.4	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-40.9	177.3	-174.1	63.2	0	0	0	112.1	T104 F105 I106 L110 I111 L112	T104-L108 VanDerWaalsContact O-CB 3.31Å; T104-L108 WeakPolarHBondContact O-CB 3.19Å; T104-L108 PolarHBondContact O-N 3.27Å; F105-L108 PolarHBondContact O-N 3.5Å; I106-L108 PolarHBondContact O-N 3.12Å; L108-L110 VanDerWaalsContact C-N 3.31Å; L108-L110 PolarHBondContact O-N 2.95Å; L108-I111 PolarHBondContact O-N 3.41Å; L108-L112 WeakPolarHBondContact O-CB 3.25Å; L108-L112 PolarHBondContact O-N 3.41Å
109	G	85.6	Confident	83.1	Confident	40 Å²	40	62.3 Å²	62.3	41%	0.412	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-39	173.4	0	0	0	0	0	112.3	F105 I106 F107 L112 Y113	F105-G109 PolarHBondContact O-N 3.48Å; I106-G109 PolarHBondContact O-N 2.91Å; F107-G109 PolarHBondContact O-N 3.42Å; G109-L112 PolarHBondContact O-N 3.01Å; G109-Y113 VanDerWaalsContact O-CB 3.26Å; G109-Y113 WeakPolarHBondContact O-CB 3.43Å; G109-Y113 PolarHBondContact O-N 2.98Å
110	L	87.1	Confident	83.8	Confident	40 Å²	40	67 Å²	67	21%	0.209	37%	0.367	C	S	.	.	H	α-helix	trans	-67.1	-41	176.7	-129.2	71.7	0	0	0	112.3	I106 F107 L108 Y113 C114 V180 A183 T184	I106-L110 WeakPolarHBondContact O-CB 3.49Å; I106-L110 PolarHBondContact O-N 3.14Å; F107-L110 WeakPolarHBondContact O-CB 3.42Å; F107-L110 PolarHBondContact O-N 2.88Å; L108-L110 VanDerWaalsContact C-N 3.31Å; L108-L110 PolarHBondContact O-N 2.95Å; L110-Y113 PolarHBondContact O-N 3.15Å; L110-C114 VanDerWaalsContact O-CB 3.31Å; L110-C114 WeakPolarHBondContact O-CB 3.1Å; L110-C114 PolarHBondContact O-N 3.13Å; L110-V180 HydrophobicContact CB-CG1 4.31Å; L110-A183 HydrophobicContact CD2-CB 3.58Å; L110-T184 VanDerWaalsContact CD2-OG1 3.27Å; L110-T184 WeakPolarHBondContact CD2-OG1 3.31Å
111	I	86.6	Confident	84.4	Confident	55 Å²	55	63.5 Å²	63.5	28%	0.282	35%	0.349	S	S	.	.	H	α-helix	trans	-60	-50.1	172.1	-68.2	168.7	0	0	0	109.9	F107 L108 Y113 C114 I115 V180	F107-I111 HydrophobicContact CD1-CD1 3.91Å; F107-I111 HydrophobicContact CE1-CD1 3.51Å; F107-I111 HydrophobicContact CE2-CD1 4.19Å; F107-I111 HydrophobicContact CE2-CG1 4.44Å; F107-I111 HydrophobicContact CG-CD1 4.42Å; F107-I111 HydrophobicContact CZ-CD1 3.68Å; F107-I111 HydrophobicContact CZ-CG1 4.37Å; F107-I111 WeakPolarHBondContact O-CG1 3.48Å; F107-I111 PolarHBondContact O-N 3.01Å; L108-I111 PolarHBondContact O-N 3.41Å; I111-Y113 VanDerWaalsContact C-N 3.34Å; I111-Y113 PolarHBondContact O-N 2.72Å; I111-C114 WeakPolarHBondContact O-CB 3.4Å; I111-C114 PolarHBondContact O-N 3.48Å; I111-C114 VanDerWaalsContact O-N 3.12Å; I111-I115 HydrophobicContact CG2-CD1 3.83Å; I111-I115 HydrophobicContact CG2-CG1 4.46Å; I111-I115 WeakPolarHBondContact O-CG1 3.38Å; I111-I115 PolarHBondContact O-N 3.23Å; I111-V180 HydrophobicContact CG1-CG1 3.81Å
112	L	87.4	Confident	85	Confident	100 Å²	100	64.1 Å²	64.1	52%	0.524	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-43.9	-179.6	-176.9	61.7	0	0	0	111.6	L108 G109 C114 I115 I116	L108-L112 WeakPolarHBondContact O-CB 3.25Å; L108-L112 PolarHBondContact O-N 3.41Å; G109-L112 PolarHBondContact O-N 3.01Å; L112-C114 VanDerWaalsContact C-N 3.3Å; L112-C114 PolarHBondContact O-N 2.96Å; L112-I115 PolarHBondContact O-N 3.38Å; L112-I116 HydrophobicContact CD1-CD1 4.07Å; L112-I116 HydrophobicContact CD1-CG1 4.47Å; L112-I116 HydrophobicContact CG-CD1 3.92Å; L112-I116 VanDerWaalsContact O-CG1 3.32Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.48Å
113	Y	87.6	Confident	85.5	Confident	153 Å²	153	68.9 Å²	68.9	60%	0.6	37%	0.37	S	S	*	.	H	α-helix	trans	-57.9	-43.5	173.5	175.3	-97.9	0	0	0	111.5	G109 L110 I111 I115 I116 S117	G109-Y113 VanDerWaalsContact O-CB 3.26Å; G109-Y113 WeakPolarHBondContact O-CB 3.43Å; G109-Y113 PolarHBondContact O-N 2.98Å; L110-Y113 PolarHBondContact O-N 3.15Å; I111-Y113 VanDerWaalsContact C-N 3.34Å; I111-Y113 PolarHBondContact O-N 2.72Å; Y113-I115 PolarHBondContact O-N 3.32Å; Y113-I116 PolarHBondContact O-N 2.9Å; Y113-S117 WeakPolarHBondContact O-CB 3.28Å; Y113-S117 PolarHBondContact O-N 3.44Å
114	C	86.9	Confident	85.7	Confident	18 Å²	18	68.7 Å²	68.7	12%	0.122	37%	0.371	C	S	.	.	H	α-helix	trans	-64.1	-40.7	178.1	-170.4	0	0	0	0	112.6	L110 I111 L112 S118 A176 V180	L110-C114 VanDerWaalsContact O-CB 3.31Å; L110-C114 WeakPolarHBondContact O-CB 3.1Å; L110-C114 PolarHBondContact O-N 3.13Å; I111-C114 WeakPolarHBondContact O-CB 3.4Å; I111-C114 PolarHBondContact O-N 3.48Å; I111-C114 VanDerWaalsContact O-N 3.12Å; L112-C114 VanDerWaalsContact C-N 3.3Å; L112-C114 PolarHBondContact O-N 2.96Å; C114-S118 WeakPolarHBondContact O-CB 3.41Å; C114-S118 PolarHBondContact O-N 3.38Å; C114-S118 VanDerWaalsContact O-N 3.15Å; C114-A176 VanDerWaalsContact SG-CB 3.53Å; C114-V180 HydrophobicContact CB-CG2 3.43Å; C114-V180 VanDerWaalsContact CB-CG2 3.43Å
115	I	85.9	Confident	86	Confident	43 Å²	43	68.8 Å²	68.8	22%	0.221	37%	0.368	C	S	.	.	H	α-helix	trans	-63	-43	176	-65.2	164.4	0	0	0	110.9	I111 L112 Y113 L121 L125	I111-I115 HydrophobicContact CG2-CD1 3.83Å; I111-I115 HydrophobicContact CG2-CG1 4.46Å; I111-I115 WeakPolarHBondContact O-CG1 3.38Å; I111-I115 PolarHBondContact O-N 3.23Å; L112-I115 PolarHBondContact O-N 3.38Å; Y113-I115 PolarHBondContact O-N 3.32Å; I115-L121 HydrophobicContact CB-CD2 4.35Å; I115-L121 HydrophobicContact CG1-CD2 3.84Å; I115-L125 HydrophobicContact CG2-CD2 4.14Å
116	I	86.1	Confident	86.3	Confident	116 Å²	116	68.2 Å²	68.2	60%	0.595	38%	0.376	S	S	*	.	H	α-helix	trans	-74.1	-38.7	-178.9	-64.2	167.5	0	0	0	111.3	L112 Y113 S118	L112-I116 HydrophobicContact CD1-CD1 4.07Å; L112-I116 HydrophobicContact CD1-CG1 4.47Å; L112-I116 HydrophobicContact CG-CD1 3.92Å; L112-I116 VanDerWaalsContact O-CG1 3.32Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.48Å; Y113-I116 PolarHBondContact O-N 2.9Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 2.98Å
117	S	85.7	Confident	86.5	Confident	74 Å²	74	70.8 Å²	70.8	52%	0.517	39%	0.393	S	S	.	.	H	α-helix	trans	-73.5	-18.4	-177.6	-173	0	0	0	0	113.2	Y113 P119	Y113-S117 WeakPolarHBondContact O-CB 3.28Å; Y113-S117 PolarHBondContact O-N 3.44Å; S117-P119 WeakPolarHBondContact O-CD 3.38Å
118	S	84.7	Confident	86.7	Confident	33 Å²	33	70.8 Å²	70.8	23%	0.231	39%	0.393	C	S	.	.			trans	-110.1	100.7	180	-175.1	0	0	0	0	111.4	C114 I116 M120 L121 L122	C114-S118 WeakPolarHBondContact O-CB 3.41Å; C114-S118 PolarHBondContact O-N 3.38Å; C114-S118 VanDerWaalsContact O-N 3.15Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 2.98Å; S118-M120 VanDerWaalsContact C-N 3.27Å; S118-M120 PolarHBondContact O-N 3.47Å; S118-L121 PolarHBondContact O-N 2.82Å; S118-L122 PolarHBondContact O-N 3.28Å; S118-L122 VanDerWaalsContact O-N 3.14Å
119	P	84.1	Confident	86.7	Confident	92 Å²	92	68.3 Å²	68.3	60%	0.597	39%	0.388	S	S	*	.	H	α-helix	trans	-62.9	-33.3	-178	24.3	-33.3	0	0	0	112.7	S117 L122 I123	S117-P119 WeakPolarHBondContact O-CD 3.38Å; P119-L122 PolarHBondContact O-N 3.42Å; P119-I123 VanDerWaalsContact O-CG1 3.32Å; P119-I123 WeakPolarHBondContact O-CG1 3.47Å; P119-I123 PolarHBondContact O-N 2.85Å
120	M	86.5	Confident	86.8	Confident	124 Å²	124	67.9 Å²	67.9	61%	0.611	38%	0.383	S	S	*	.	H	α-helix	trans	-66.1	-41.6	176.6	-82.6	-64.4	-151.7	0	0	112.5	S118 L122 I123 A124	S118-M120 VanDerWaalsContact C-N 3.27Å; S118-M120 PolarHBondContact O-N 3.47Å; M120-L122 VanDerWaalsContact C-N 3.31Å; M120-L122 PolarHBondContact O-N 2.96Å; M120-I123 PolarHBondContact O-N 3.23Å; M120-A124 PolarHBondContact O-N 3.33Å
121	L	86.1	Confident	86.7	Confident	20 Å²	20	67.7 Å²	67.7	11%	0.105	39%	0.388	C	S	.	.	H	α-helix	trans	-65.8	-38.4	178.1	-159.4	94.1	0	0	0	111	I115 S118 A124 L125 A173 A176	I115-L121 HydrophobicContact CB-CD2 4.35Å; I115-L121 HydrophobicContact CG1-CD2 3.84Å; S118-L121 PolarHBondContact O-N 2.82Å; L121-A124 PolarHBondContact O-N 3.04Å; L121-L125 WeakPolarHBondContact O-CB 3.15Å; L121-L125 PolarHBondContact O-N 3.31Å; L121-A173 VanDerWaalsContact CD1-CA 3.48Å; L121-A173 HydrophobicContact CD1-CB 3.72Å; L121-A176 HydrophobicContact CD1-CB 4.13Å
122	L	87.3	Confident	86.5	Confident	83 Å²	83	69.6 Å²	69.6	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-45.5	177.4	-157.2	166.1	0	0	0	111	S118 P119 M120 L125 A126	S118-L122 PolarHBondContact O-N 3.28Å; S118-L122 VanDerWaalsContact O-N 3.14Å; P119-L122 PolarHBondContact O-N 3.42Å; M120-L122 VanDerWaalsContact C-N 3.31Å; M120-L122 PolarHBondContact O-N 2.96Å; L122-L125 PolarHBondContact O-N 2.86Å; L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 2.89Å
123	I	87.8	Confident	86.4	Confident	103 Å²	103	71 Å²	71	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-61.5	-46.8	175.7	-66.7	165.2	0	0	0	110.8	P119 M120 L125 A126 V127	P119-I123 VanDerWaalsContact O-CG1 3.32Å; P119-I123 WeakPolarHBondContact O-CG1 3.47Å; P119-I123 PolarHBondContact O-N 2.85Å; M120-I123 PolarHBondContact O-N 3.23Å; I123-L125 VanDerWaalsContact C-N 3.3Å; I123-L125 PolarHBondContact O-N 2.91Å; I123-A126 PolarHBondContact O-N 3.33Å; I123-A126 VanDerWaalsContact O-N 3.16Å; I123-V127 HydrophobicContact CG2-CG2 4.43Å; I123-V127 WeakPolarHBondContact O-CG2 3.42Å; I123-V127 PolarHBondContact O-N 2.86Å
124	A	87.4	Confident	86.1	Confident	5 Å²	5	68.4 Å²	68.4	4%	0.041	39%	0.388	C	S	.	.	H	α-helix	trans	-59.1	-42.6	177.4	0	0	0	0	0	111.9	M120 L121 V127 F128 V167 F168 A171	M120-A124 PolarHBondContact O-N 3.33Å; L121-A124 PolarHBondContact O-N 3.04Å; A124-V127 PolarHBondContact O-N 3.46Å; A124-F128 WeakPolarHBondContact O-CB 3.31Å; A124-F128 PolarHBondContact O-N 3.12Å; A124-V167 HydrophobicContact CB-CG1 4.18Å; A124-F168 HydrophobicContact CB-CD1 4.06Å; A124-F168 HydrophobicContact CB-CE1 4.05Å; A124-A171 HydrophobicContact CB-CB 3.6Å
125	L	88.4	Confident	85.8	Confident	75 Å²	75	68.7 Å²	68.7	39%	0.393	39%	0.389	S	S	.	.	H	α-helix	trans	-65.3	-39.5	175.9	-169	68.5	0	0	0	112	I115 L121 L122 I123 F128 A129 F168	I115-L125 HydrophobicContact CG2-CD2 4.14Å; L121-L125 WeakPolarHBondContact O-CB 3.15Å; L121-L125 PolarHBondContact O-N 3.31Å; L122-L125 PolarHBondContact O-N 2.86Å; I123-L125 VanDerWaalsContact C-N 3.3Å; I123-L125 PolarHBondContact O-N 2.91Å; L125-F128 PolarHBondContact O-N 3.37Å; L125-A129 VanDerWaalsContact O-CB 3.23Å; L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 3.05Å; L125-F168 HydrophobicContact CD1-CE1 4.42Å; L125-F168 HydrophobicContact CD1-CZ 4.22Å
126	A	88.1	Confident	85.4	Confident	57 Å²	57	71 Å²	71	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-43.2	177.4	0	0	0	0	0	111.9	L122 I123 A129 G130	L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 2.89Å; I123-A126 PolarHBondContact O-N 3.33Å; I123-A126 VanDerWaalsContact O-N 3.16Å; A126-A129 PolarHBondContact O-N 3.15Å; A126-G130 PolarHBondContact O-N 3.07Å
127	V	87.3	Confident	85	Confident	90 Å²	90	68.4 Å²	68.4	55%	0.545	39%	0.385	S	S	.	.	H	α-helix	trans	-63.2	-44.3	174.9	173.2	0	0	0	0	110.5	I123 A124 G130 A131	I123-V127 HydrophobicContact CG2-CG2 4.43Å; I123-V127 WeakPolarHBondContact O-CG2 3.42Å; I123-V127 PolarHBondContact O-N 2.86Å; A124-V127 PolarHBondContact O-N 3.46Å; V127-G130 PolarHBondContact O-N 3.18Å; V127-A131 WeakPolarHBondContact O-CB 3.32Å; V127-A131 PolarHBondContact O-N 3.33Å
128	F	86.9	Confident	84.3	Confident	61 Å²	61	70 Å²	70	27%	0.268	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-46.7	177.2	-178.2	-107	0	0	0	112.5	A124 L125 G130 A131 F132 S164 F168	A124-F128 WeakPolarHBondContact O-CB 3.31Å; A124-F128 PolarHBondContact O-N 3.12Å; L125-F128 PolarHBondContact O-N 3.37Å; F128-G130 VanDerWaalsContact C-N 3.33Å; F128-G130 PolarHBondContact O-N 2.86Å; F128-A131 PolarHBondContact O-N 3.45Å; F128-F132 WeakPolarHBondContact O-CB 3.47Å; F128-F132 PolarHBondContact O-N 2.94Å; F128-S164 WeakPolarHBondContact CE2-OG 3.45Å; F128-F168 HydrophobicContact CB-CE2 3.78Å; F128-F168 HydrophobicContact CB-CZ 3.75Å; F128-F168 HydrophobicContact CD1-CE2 4.23Å; F128-F168 HydrophobicContact CD1-CZ 4.24Å; F128-F168 AromaticContact CD2-CE2 3.95Å; F128-F168 HydrophobicContact CD2-CE2 3.95Å; F128-F168 AromaticContact CG-CE2 3.71Å; F128-F168 HydrophobicContact CG-CE2 3.71Å; F128-F168 AromaticContact CG-CZ 3.97Å; F128-F168 HydrophobicContact CG-CZ 3.97Å
129	A	87.6	Confident	83.5	Confident	53 Å²	53	70.7 Å²	70.7	44%	0.438	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-39.6	176.7	0	0	0	0	0	111.6	L125 A126 F132 Y133	L125-A129 VanDerWaalsContact O-CB 3.23Å; L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 3.05Å; A126-A129 PolarHBondContact O-N 3.15Å; A129-F132 PolarHBondContact O-N 3.3Å; A129-Y133 WeakPolarHBondContact O-CB 3.42Å; A129-Y133 PolarHBondContact O-N 3.38Å
130	G	87.5	Confident	82.7	Confident	30 Å²	30	72.3 Å²	72.3	31%	0.309	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-47.2	173.8	0	0	0	0	0	112.2	A126 V127 F128 Y133 I134	A126-G130 PolarHBondContact O-N 3.07Å; V127-G130 PolarHBondContact O-N 3.18Å; F128-G130 VanDerWaalsContact C-N 3.33Å; F128-G130 PolarHBondContact O-N 2.86Å; G130-Y133 PolarHBondContact O-N 2.96Å; G130-I134 WeakPolarHBondContact O-CB 3.24Å; G130-I134 VanDerWaalsContact O-CG1 3.23Å; G130-I134 WeakPolarHBondContact O-CG1 3.32Å; G130-I134 PolarHBondContact O-N 3.14Å
131	A	84.6	Confident	81.5	Confident	37 Å²	37	73.9 Å²	73.9	31%	0.306	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-46.3	176	0	0	0	0	0	111.7	V127 F128 Y133 I134 I135	V127-A131 WeakPolarHBondContact O-CB 3.32Å; V127-A131 PolarHBondContact O-N 3.33Å; F128-A131 PolarHBondContact O-N 3.45Å; A131-Y133 PolarHBondContact O-N 3.38Å; A131-I134 PolarHBondContact O-N 3.39Å; A131-I135 WeakPolarHBondContact O-CD1 3.43Å; A131-I135 VanDerWaalsContact O-CG1 3.25Å; A131-I135 WeakPolarHBondContact O-CG1 3.39Å; A131-I135 PolarHBondContact O-N 2.9Å
132	F	83.3	Confident	79.8	Confident	95 Å²	95	76 Å²	76	42%	0.417	41%	0.413	S	S	.	.	H	α-helix	trans	-60.7	-44	176.2	-171.4	-92	0	0	0	111.9	F128 A129 I135 H136 M157	F128-F132 WeakPolarHBondContact O-CB 3.47Å; F128-F132 PolarHBondContact O-N 2.94Å; A129-F132 PolarHBondContact O-N 3.3Å; F132-I135 PolarHBondContact O-N 2.86Å; F132-H136 VanDerWaalsContact O-CB 3.27Å; F132-H136 WeakPolarHBondContact O-CB 3.36Å; F132-H136 PolarHBondContact O-N 3.07Å; F132-M157 HydrophobicContact CD2-CE 3.39Å; F132-M157 HydrophobicContact CD2-SD 3.28Å; F132-M157 WeakPolarHBondContact CD2-SD 3.34Å; F132-M157 HydrophobicContact CE2-CE 3.32Å; F132-M157 HydrophobicContact CE2-SD 3.28Å; F132-M157 WeakPolarHBondContact CE2-SD 3.47Å; F132-M157 HydrophobicContact CG-SD 4.44Å; F132-M157 HydrophobicContact CZ-SD 4.44Å
133	Y	84.4	Confident	78	Confident	129 Å²	129	79.7 Å²	79.7	51%	0.506	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-43	178.7	-178.1	-106.3	0	0	0	112	A129 G130 A131 H136 L137	A129-Y133 WeakPolarHBondContact O-CB 3.42Å; A129-Y133 PolarHBondContact O-N 3.38Å; G130-Y133 PolarHBondContact O-N 2.96Å; A131-Y133 PolarHBondContact O-N 3.38Å; Y133-H136 PolarHBondContact O-N 2.82Å; Y133-L137 HydrophobicContact CD1-CD1 3.88Å; Y133-L137 HydrophobicContact CD1-CG 4.36Å; Y133-L137 HydrophobicContact CE1-CD1 3.3Å; Y133-L137 HydrophobicContact CE1-CG 3.97Å; Y133-L137 HydrophobicContact CE2-CD1 4.46Å; Y133-L137 HydrophobicContact CE2-CD2 4.48Å; Y133-L137 HydrophobicContact CE2-CG 4.29Å; Y133-L137 WeakPolarHBondContact O-CB 3.13Å; Y133-L137 WeakPolarHBondContact O-CG 3.41Å; Y133-L137 PolarHBondContact O-N 3.41Å
134	I	82.1	Confident	76.1	Confident	98 Å²	98	76.8 Å²	76.8	50%	0.503	41%	0.411	S	S	.	.	H	α-helix	trans	-62	-44.3	175.2	-68.9	165	0	0	0	110.7	G130 A131 H136 L137 K138	G130-I134 WeakPolarHBondContact O-CB 3.24Å; G130-I134 VanDerWaalsContact O-CG1 3.23Å; G130-I134 WeakPolarHBondContact O-CG1 3.32Å; G130-I134 PolarHBondContact O-N 3.14Å; A131-I134 PolarHBondContact O-N 3.39Å; I134-H136 VanDerWaalsContact C-N 3.35Å; I134-L137 PolarHBondContact O-N 3.23Å; I134-K138 WeakPolarHBondContact O-CB 3.35Å; I134-K138 PolarHBondContact O-N 2.85Å
135	I	79.3	Confident	74.4	Confident	25 Å²	25	80.4 Å²	80.4	13%	0.128	43%	0.432	C	S	.	.	H	α-helix	trans	-62.6	-44	176.5	-69	164.5	0	0	0	110.5	A131 F132 K138 S139 Q156 M157 A160	A131-I135 WeakPolarHBondContact O-CD1 3.43Å; A131-I135 VanDerWaalsContact O-CG1 3.25Å; A131-I135 WeakPolarHBondContact O-CG1 3.39Å; A131-I135 PolarHBondContact O-N 2.9Å; F132-I135 PolarHBondContact O-N 2.86Å; I135-K138 PolarHBondContact O-N 3.42Å; I135-S139 WeakPolarHBondContact O-CB 3.49Å; I135-S139 PolarHBondContact O-N 3.1Å; I135-Q156 HydrophobicContact CG2-CB 4.13Å; I135-M157 HydrophobicContact CD1-SD 4.49Å; I135-M157 HydrophobicContact CG2-CG 4.49Å; I135-M157 HydrophobicContact CG2-SD 4.29Å; I135-A160 HydrophobicContact CD1-CB 3.5Å; I135-A160 VanDerWaalsContact CD1-CB 3.5Å
136	H	78.9	Confident	72.6	Confident	91 Å²	91	80.4 Å²	80.4	42%	0.421	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-45.6	178.5	-178.9	-90.1	0	0	0	111.9	F132 Y133 I134 S139 L140	F132-H136 VanDerWaalsContact O-CB 3.27Å; F132-H136 WeakPolarHBondContact O-CB 3.36Å; F132-H136 PolarHBondContact O-N 3.07Å; Y133-H136 PolarHBondContact O-N 2.82Å; I134-H136 VanDerWaalsContact C-N 3.35Å; H136-S139 WeakPolarHBondContact O-CB 3Å; H136-S139 PolarHBondContact O-N 2.92Å; H136-L140 VanDerWaalsContact CE1-CD1 3.47Å; H136-L140 WeakPolarHBondContact CE1-CD1 3.22Å; H136-L140 WeakPolarHBondContact O-CG 3.5Å; H136-L140 PolarHBondContact O-N 3.45Å
137	L	76.4	Confident	70.5	Confident	61 Å²	61	86 Å²	86	32%	0.319	46%	0.457	S	S	.	.	H	α-helix	trans	-60	-46.7	174	-76.5	-179.2	0	0	0	111.6	Y133 I134 S139 L140 E141	Y133-L137 HydrophobicContact CD1-CD1 3.88Å; Y133-L137 HydrophobicContact CD1-CG 4.36Å; Y133-L137 HydrophobicContact CE1-CD1 3.3Å; Y133-L137 HydrophobicContact CE1-CG 3.97Å; Y133-L137 HydrophobicContact CE2-CD1 4.46Å; Y133-L137 HydrophobicContact CE2-CD2 4.48Å; Y133-L137 HydrophobicContact CE2-CG 4.29Å; Y133-L137 WeakPolarHBondContact O-CB 3.13Å; Y133-L137 WeakPolarHBondContact O-CG 3.41Å; Y133-L137 PolarHBondContact O-N 3.41Å; I134-L137 PolarHBondContact O-N 3.23Å; L137-S139 PolarHBondContact O-N 3.13Å; L137-L140 PolarHBondContact O-N 3.47Å; L137-E141 PolarHBondContact O-N 3.35Å
138	K	72	Confident	68.9	Low	107 Å²	107	85.1 Å²	85.1	47%	0.465	47%	0.465	S	S	.	.	H	α-helix	trans	-59.2	-36.9	175.7	-105.4	173	166	74	0	112.5	I134 I135 L140 S142 L144	I134-K138 WeakPolarHBondContact O-CB 3.35Å; I134-K138 PolarHBondContact O-N 2.85Å; I135-K138 PolarHBondContact O-N 3.42Å; K138-L140 VanDerWaalsContact C-N 3.33Å; K138-S142 PolarHBondContact O-N 3.45Å; K138-L144 HydrophobicContact CB-CD1 3.76Å; K138-L144 HydrophobicContact CD-CD1 3.84Å; K138-L144 HydrophobicContact CG-CD1 3.9Å
139	S	68.2	Low	67.2	Low	49 Å²	49	90.3 Å²	90.3	34%	0.343	49%	0.488	S	S	.	.	H	α-helix	trans	-68.9	-29	175.9	-175.5	0	0	0	0	113.2	I135 H136 L137 V153	I135-S139 WeakPolarHBondContact O-CB 3.49Å; I135-S139 PolarHBondContact O-N 3.1Å; H136-S139 WeakPolarHBondContact O-CB 3Å; H136-S139 PolarHBondContact O-N 2.92Å; L137-S139 PolarHBondContact O-N 3.13Å; S139-V153 VanDerWaalsContact OG-CG2 3.28Å; S139-V153 WeakPolarHBondContact OG-CG2 3.35Å
140	L	66.1	Low	65.7	Low	125 Å²	125	93.4 Å²	93.4	65%	0.654	49%	0.493	S	S	*	.	H	α-helix	trans	-81.7	-37.9	177.1	-71.7	176.8	0	0	0	112.3	H136 L137 K138	H136-L140 VanDerWaalsContact CE1-CD1 3.47Å; H136-L140 WeakPolarHBondContact CE1-CD1 3.22Å; H136-L140 WeakPolarHBondContact O-CG 3.5Å; H136-L140 PolarHBondContact O-N 3.45Å; L137-L140 PolarHBondContact O-N 3.47Å; K138-L140 VanDerWaalsContact C-N 3.33Å
141	E	62	Low	64.1	Low	158 Å²	158	95.6 Å²	95.6	74%	0.738	50%	0.497	S	S	*	.	H	α-helix	trans	-85.1	-21.2	-176.5	-68	-171.7	150.6	0	0	113.5	L137	L137-E141 PolarHBondContact O-N 3.35Å
142	S	51.5	Low	63.2	Low	64 Å²	64	97.8 Å²	97.8	45%	0.448	51%	0.507	S	S	.	.			trans	-154.9	130.7	-178	-67	0	0	0	0	112	K138 L144	K138-S142 PolarHBondContact O-N 3.45Å; S142-L144 PolarHBondContact O-N 3Å
143	K	49.1	Very low	62.3	Low	160 Å²	160	96.3 Å²	96.3	70%	0.696	51%	0.506	S	S	*	.			trans	-58.6	96.5	146.6	-98	-171.9	167.5	-159.8	0	105.8	V145 E150	K143-V145 VanDerWaalsContact C-N 3.27Å; K143-V145 PolarHBondContact O-N 2.8Å; K143-E150 IonicContact NZ-OE1 2.61Å; K143-E150 PolarHBondContact NZ-OE1 3.24Å; K143-E150 IonicContact NZ-OE2 2.82Å
144	L	47.8	Very low	61.7	Low	42 Å²	42	94.3 Å²	94.3	22%	0.22	51%	0.508	C	S	.	.			trans	-66.6	89.4	179.8	-85.7	168.4	0	0	0	109.5	K138 S142 V146 L151 Q156	K138-L144 HydrophobicContact CB-CD1 3.76Å; K138-L144 HydrophobicContact CD-CD1 3.84Å; K138-L144 HydrophobicContact CG-CD1 3.9Å; S142-L144 PolarHBondContact O-N 3Å; L144-V146 PolarHBondContact O-N 3.4Å; L144-L151 PolarHBondContact O-N 3.17Å; L144-Q156 VanDerWaalsContact CD1-NE2 3.35Å
145	V	51.7	Low	61.5	Low	81 Å²	81	95.4 Å²	95.4	49%	0.491	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	94.8	165.9	-175.7	0	0	0	0	106.7	K143 E150	K143-V145 VanDerWaalsContact C-N 3.27Å; K143-V145 PolarHBondContact O-N 2.8Å; V145-E150 HydrophobicContact CG2-CG 4.3Å
146	V	50.4	Low	61.3	Low	75 Å²	75	96 Å²	96	46%	0.455	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.2	168.4	-179.7	0	0	0	0	106.5	L144 G148 L151	L144-V146 PolarHBondContact O-N 3.4Å; V146-G148 PolarHBondContact O-N 2.88Å; V146-L151 HydrophobicContact CB-CD1 4.2Å
147	L	43.7	Very low	61.3	Low	176 Å²	176	94 Å²	94	92%	0.921	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	25.9	178.3	-107.4	84.5	0	0	0	116.5	K149	L147-K149 PolarHBondContact O-N 3.44Å
148	G	53.3	Low	61.5	Low	70 Å²	70	94.4 Å²	94.4	72%	0.722	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	8.1	178.4	0	0	0	0	0	114.9	V146	V146-G148 PolarHBondContact O-N 2.88Å
149	K	50.7	Low	62	Low	170 Å²	170	94.5 Å²	94.5	74%	0.739	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.9	166.5	-107.7	169.7	-171.8	163.2	0	108.6	L147 L151	L147-K149 PolarHBondContact O-N 3.44Å; K149-L151 PolarHBondContact O-N 2.93Å
150	E	56.3	Low	62.6	Low	119 Å²	119	93 Å²	93	56%	0.556	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	105.3	170.7	-60.9	-165.9	154	0	0	108	K143 V145 T152	K143-E150 IonicContact NZ-OE1 2.61Å; K143-E150 PolarHBondContact NZ-OE1 3.24Å; K143-E150 IonicContact NZ-OE2 2.82Å; V145-E150 HydrophobicContact CG2-CG 4.3Å; E150-T152 VanDerWaalsContact C-N 3.32Å; E150-T152 PolarHBondContact O-N 2.88Å
151	L	53.9	Low	63.5	Low	76 Å²	76	88 Å²	88	40%	0.398	49%	0.486	S	S	.	.			trans	-73.3	97.1	170.8	-101.6	170	0	0	0	106.8	L144 V146 K149 V153 H155	L144-L151 PolarHBondContact O-N 3.17Å; V146-L151 HydrophobicContact CB-CD1 4.2Å; K149-L151 PolarHBondContact O-N 2.93Å; L151-V153 PolarHBondContact O-N 2.82Å; L151-H155 HydrophobicContact CD2-CB 4.15Å
152	T	65.4	Low	64.6	Low	83 Å²	83	83.1 Å²	83.1	51%	0.509	47%	0.473	S	S	.	.			trans	-57.9	130.6	-178	-26	0	0	0	0	108.9	E150 P154 H155	E150-T152 VanDerWaalsContact C-N 3.32Å; E150-T152 PolarHBondContact O-N 2.88Å; T152-P154 HydrophobicContact CG2-CG 3.66Å; T152-H155 WeakPolarHBondContact O-CB 3.27Å; T152-H155 PolarHBondContact O-N 3.35Å
153	V	66.3	Low	66.2	Low	64 Å²	64	85.1 Å²	85.1	39%	0.388	48%	0.478	S	S	.	.	H	α-helix	trans	-35.4	-43.4	173.5	-178	0	0	0	0	114.6	S139 L151 H155 Q156 M157	S139-V153 VanDerWaalsContact OG-CG2 3.28Å; S139-V153 WeakPolarHBondContact OG-CG2 3.35Å; L151-V153 PolarHBondContact O-N 2.82Å; V153-H155 VanDerWaalsContact C-N 3.3Å; V153-H155 PolarHBondContact O-N 2.9Å; V153-Q156 PolarHBondContact O-N 3.32Å; V153-M157 PolarHBondContact O-N 3.39Å
154	P	70.4	Confident	67.9	Low	86 Å²	86	78.3 Å²	78.3	56%	0.558	45%	0.451	S	S	*	.	H	α-helix	trans	-57.1	-32.9	175	16	-32.1	0	0	0	115.4	T152 S158	T152-P154 HydrophobicContact CG2-CG 3.66Å; P154-S158 WeakPolarHBondContact O-CB 3.25Å; P154-S158 PolarHBondContact O-N 3.12Å; P154-S158 PolarHBondContact O-OG 2.95Å
155	H	77.2	Confident	69.7	Low	122 Å²	122	82.1 Å²	82.1	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-72	-36.2	176.8	-99.1	110.5	0	0	0	112.6	L151 T152 V153 M157 S158 L159	L151-H155 HydrophobicContact CD2-CB 4.15Å; T152-H155 WeakPolarHBondContact O-CB 3.27Å; T152-H155 PolarHBondContact O-N 3.35Å; V153-H155 VanDerWaalsContact C-N 3.3Å; V153-H155 PolarHBondContact O-N 2.9Å; H155-M157 VanDerWaalsContact C-N 3.33Å; H155-S158 WeakPolarHBondContact CA-OG 3.27Å; H155-S158 PolarHBondContact O-OG 3.23Å; H155-L159 WeakPolarHBondContact O-CB 3.41Å; H155-L159 PolarHBondContact O-N 2.91Å
156	Q	75.9	Confident	71.4	Confident	36 Å²	36	82.1 Å²	82.1	17%	0.168	47%	0.472	C	S	.	.	H	α-helix	trans	-69.3	-39.1	175.7	-65.2	-179.1	12	0	0	110.5	I135 L144 V153 L159 A160	I135-Q156 HydrophobicContact CG2-CB 4.13Å; L144-Q156 VanDerWaalsContact CD1-NE2 3.35Å; V153-Q156 PolarHBondContact O-N 3.32Å; Q156-L159 PolarHBondContact O-N 3.42Å; Q156-A160 WeakPolarHBondContact O-CB 3.18Å; Q156-A160 PolarHBondContact O-N 3.02Å
157	M	78.1	Confident	73	Confident	51 Å²	51	81.5 Å²	81.5	25%	0.251	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-39.2	174.7	-83.1	-55.3	-50	0	0	113.3	F132 I135 V153 H155 G161	F132-M157 HydrophobicContact CD2-CE 3.39Å; F132-M157 HydrophobicContact CD2-SD 3.28Å; F132-M157 WeakPolarHBondContact CD2-SD 3.34Å; F132-M157 HydrophobicContact CE2-CE 3.32Å; F132-M157 HydrophobicContact CE2-SD 3.28Å; F132-M157 WeakPolarHBondContact CE2-SD 3.47Å; F132-M157 HydrophobicContact CG-SD 4.44Å; F132-M157 HydrophobicContact CZ-SD 4.44Å; I135-M157 HydrophobicContact CD1-SD 4.49Å; I135-M157 HydrophobicContact CG2-CG 4.49Å; I135-M157 HydrophobicContact CG2-SD 4.29Å; V153-M157 PolarHBondContact O-N 3.39Å; H155-M157 VanDerWaalsContact C-N 3.33Å; M157-G161 PolarHBondContact O-N 3.31Å
158	S	80.9	Confident	75.1	Confident	68 Å²	68	75.2 Å²	75.2	48%	0.476	43%	0.434	S	S	.	.	H	α-helix	trans	-67.8	-39.2	176	67.5	0	0	0	0	111.6	P154 H155 G161 A162	P154-S158 WeakPolarHBondContact O-CB 3.25Å; P154-S158 PolarHBondContact O-N 3.12Å; P154-S158 PolarHBondContact O-OG 2.95Å; H155-S158 WeakPolarHBondContact CA-OG 3.27Å; H155-S158 PolarHBondContact O-OG 3.23Å; S158-G161 PolarHBondContact O-N 3.12Å; S158-A162 VanDerWaalsContact O-CB 3.28Å; S158-A162 WeakPolarHBondContact O-CB 3.21Å; S158-A162 PolarHBondContact O-N 3.41Å
159	L	83.1	Confident	76.7	Confident	109 Å²	109	82.2 Å²	82.2	57%	0.571	44%	0.439	S	S	*	.	H	α-helix	trans	-65.7	-45.3	174.8	-176.7	61.9	0	0	0	111.8	H155 Q156 G161 A162 I163	H155-L159 WeakPolarHBondContact O-CB 3.41Å; H155-L159 PolarHBondContact O-N 2.91Å; Q156-L159 PolarHBondContact O-N 3.42Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-G161 PolarHBondContact O-N 2.81Å; L159-A162 PolarHBondContact O-N 2.66Å; L159-I163 HydrophobicContact CD1-CD1 4.15Å; L159-I163 HydrophobicContact CD1-CG1 4.5Å; L159-I163 HydrophobicContact CG-CD1 4.08Å; L159-I163 WeakPolarHBondContact O-CG1 3.26Å; L159-I163 PolarHBondContact O-N 3.3Å
160	A	81.6	Confident	78.4	Confident	17 Å²	17	81.9 Å²	81.9	14%	0.14	44%	0.444	C	S	.	.	H	α-helix	trans	-61.9	-41.8	175.4	0	0	0	0	0	111.7	I135 Q156 I163 S164	I135-A160 HydrophobicContact CD1-CB 3.5Å; I135-A160 VanDerWaalsContact CD1-CB 3.5Å; Q156-A160 WeakPolarHBondContact O-CB 3.18Å; Q156-A160 PolarHBondContact O-N 3.02Å; A160-I163 PolarHBondContact O-N 2.86Å; A160-S164 VanDerWaalsContact O-CB 3.25Å; A160-S164 WeakPolarHBondContact O-CB 3.43Å; A160-S164 PolarHBondContact O-N 2.89Å; A160-S164 PolarHBondContact O-OG 3.39Å
161	G	83.6	Confident	79.8	Confident	20 Å²	20	76.8 Å²	76.8	21%	0.206	42%	0.423	C	S	.	.	H	α-helix	trans	-59.5	-48.5	172.5	0	0	0	0	0	112.3	M157 S158 L159 I163 S164 L165	M157-G161 PolarHBondContact O-N 3.31Å; S158-G161 PolarHBondContact O-N 3.12Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-G161 PolarHBondContact O-N 2.81Å; G161-I163 VanDerWaalsContact C-N 3.32Å; G161-I163 PolarHBondContact O-N 3.46Å; G161-S164 WeakPolarHBondContact CA-OG 3.45Å; G161-S164 PolarHBondContact O-N 2.93Å; G161-S164 VanDerWaalsContact O-N 3.13Å; G161-S164 PolarHBondContact O-OG 2.9Å; G161-L165 PolarHBondContact O-N 2.86Å
162	A	86.7	Confident	81.4	Confident	56 Å²	56	74.6 Å²	74.6	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-61.3	-38.1	179.4	0	0	0	0	0	112.8	S158 L159 P166	S158-A162 VanDerWaalsContact O-CB 3.28Å; S158-A162 WeakPolarHBondContact O-CB 3.21Å; S158-A162 PolarHBondContact O-N 3.41Å; L159-A162 PolarHBondContact O-N 2.66Å; A162-P166 WeakPolarHBondContact O-CD 3.37Å
163	I	84.9	Confident	82.4	Confident	107 Å²	107	71.6 Å²	71.6	55%	0.549	40%	0.402	S	S	.	.	H	α-helix	trans	-74.2	-35.2	175.4	-64.4	166.7	0	0	0	111	L159 A160 G161 P166 V167	L159-I163 HydrophobicContact CD1-CD1 4.15Å; L159-I163 HydrophobicContact CD1-CG1 4.5Å; L159-I163 HydrophobicContact CG-CD1 4.08Å; L159-I163 WeakPolarHBondContact O-CG1 3.26Å; L159-I163 PolarHBondContact O-N 3.3Å; A160-I163 PolarHBondContact O-N 2.86Å; G161-I163 VanDerWaalsContact C-N 3.32Å; G161-I163 PolarHBondContact O-N 3.46Å; I163-P166 WeakPolarHBondContact O-CD 3.23Å; I163-V167 WeakPolarHBondContact O-CG2 3.34Å
164	S	83.6	Confident	83.4	Confident	17 Å²	17	71.1 Å²	71.1	12%	0.119	41%	0.41	C	S	.	.	H	α-helix	trans	-70.1	-31.6	-179.7	74	0	0	0	0	113.4	F128 A160 G161 V167 F168	F128-S164 WeakPolarHBondContact CE2-OG 3.45Å; A160-S164 VanDerWaalsContact O-CB 3.25Å; A160-S164 WeakPolarHBondContact O-CB 3.43Å; A160-S164 PolarHBondContact O-N 2.89Å; A160-S164 PolarHBondContact O-OG 3.39Å; G161-S164 WeakPolarHBondContact CA-OG 3.45Å; G161-S164 PolarHBondContact O-N 2.93Å; G161-S164 VanDerWaalsContact O-N 3.13Å; G161-S164 PolarHBondContact O-OG 2.9Å; S164-V167 WeakPolarHBondContact O-CB 3.28Å; S164-V167 PolarHBondContact O-N 3.18Å; S164-V167 VanDerWaalsContact O-N 3.14Å; S164-F168 WeakPolarHBondContact O-CD2 3.17Å; S164-F168 PolarHBondContact O-N 2.9Å
165	L	85.4	Confident	84.3	Confident	121 Å²	121	70.4 Å²	70.4	63%	0.634	41%	0.411	S	S	*	.	H	α-helix	trans	-58.8	-51.1	-177.8	-83.1	172.1	0	0	0	113	G161 V167 F168 W169	G161-L165 PolarHBondContact O-N 2.86Å; L165-V167 VanDerWaalsContact C-N 3.3Å; L165-V167 PolarHBondContact O-N 3.07Å; L165-F168 PolarHBondContact O-N 3.46Å; L165-W169 PolarHBondContact O-N 3.05Å
166	P	87.1	Confident	84.8	Confident	82 Å²	82	65.3 Å²	65.3	53%	0.532	39%	0.39	S	S	.	.	H	α-helix	trans	-59	-39	172.3	-25.7	32.9	0	0	0	113.4	A162 I163 W169 L170	A162-P166 WeakPolarHBondContact O-CD 3.37Å; I163-P166 WeakPolarHBondContact O-CD 3.23Å; P166-W169 PolarHBondContact O-N 3.33Å; P166-L170 WeakPolarHBondContact O-CB 3.05Å; P166-L170 PolarHBondContact O-N 3.01Å
167	V	85.8	Confident	85.4	Confident	62 Å²	62	67.3 Å²	67.3	38%	0.376	40%	0.404	S	S	.	.	H	α-helix	trans	-65.7	-44.4	179.6	176.3	0	0	0	0	110.8	A124 I163 S164 L165 L170 A171	A124-V167 HydrophobicContact CB-CG1 4.18Å; I163-V167 WeakPolarHBondContact O-CG2 3.34Å; S164-V167 WeakPolarHBondContact O-CB 3.28Å; S164-V167 PolarHBondContact O-N 3.18Å; S164-V167 VanDerWaalsContact O-N 3.14Å; L165-V167 VanDerWaalsContact C-N 3.3Å; L165-V167 PolarHBondContact O-N 3.07Å; V167-L170 PolarHBondContact O-N 3.43Å; V167-A171 VanDerWaalsContact O-CB 3.26Å; V167-A171 WeakPolarHBondContact O-CB 3.38Å; V167-A171 PolarHBondContact O-N 3.34Å
168	F	86.8	Confident	85.9	Confident	44 Å²	44	72.7 Å²	72.7	19%	0.193	43%	0.427	C	S	.	.	H	α-helix	trans	-65.8	-37.9	175.8	-84	-67.2	0	0	0	112.3	A124 L125 F128 S164 L165 A171 G172 A173	A124-F168 HydrophobicContact CB-CD1 4.06Å; A124-F168 HydrophobicContact CB-CE1 4.05Å; L125-F168 HydrophobicContact CD1-CE1 4.42Å; L125-F168 HydrophobicContact CD1-CZ 4.22Å; F128-F168 HydrophobicContact CB-CE2 3.78Å; F128-F168 HydrophobicContact CB-CZ 3.75Å; F128-F168 HydrophobicContact CD1-CE2 4.23Å; F128-F168 HydrophobicContact CD1-CZ 4.24Å; F128-F168 AromaticContact CD2-CE2 3.95Å; F128-F168 HydrophobicContact CD2-CE2 3.95Å; F128-F168 AromaticContact CG-CE2 3.71Å; F128-F168 HydrophobicContact CG-CE2 3.71Å; F128-F168 AromaticContact CG-CZ 3.97Å; F128-F168 HydrophobicContact CG-CZ 3.97Å; S164-F168 WeakPolarHBondContact O-CD2 3.17Å; S164-F168 PolarHBondContact O-N 2.9Å; L165-F168 PolarHBondContact O-N 3.46Å; F168-A171 PolarHBondContact O-N 2.67Å; F168-G172 PolarHBondContact O-N 2.92Å; F168-A173 HydrophobicContact CB-CB 4.07Å; F168-A173 HydrophobicContact CD1-CB 4.27Å; F168-A173 WeakPolarHBondContact O-CB 3.28Å; F168-A173 PolarHBondContact O-N 3.4Å
169	W	86.8	Confident	86.4	Confident	217 Å²	217	78.1 Å²	78.1	82%	0.822	44%	0.437	S	S	*	.	H	α-helix	trans	-60	-51.8	172.3	-168.1	-37.8	0	0	0	110.4	L165 P166 A171 G172	L165-W169 PolarHBondContact O-N 3.05Å; P166-W169 PolarHBondContact O-N 3.33Å; W169-A171 VanDerWaalsContact C-N 3.26Å; W169-A171 PolarHBondContact O-N 3.35Å; W169-G172 WeakPolarHBondContact O-CA 3.06Å; W169-G172 PolarHBondContact O-N 2.86Å
170	L	85.8	Confident	86.6	Confident	162 Å²	162	73.3 Å²	73.3	85%	0.848	41%	0.412	S	S	*	.	H	α-helix	trans	-63.6	-33.6	-178.4	-158.5	71.2	0	0	0	112.3	P166 V167 G172	P166-L170 WeakPolarHBondContact O-CB 3.05Å; P166-L170 PolarHBondContact O-N 3.01Å; V167-L170 PolarHBondContact O-N 3.43Å; L170-G172 PolarHBondContact O-N 3.42Å
171	A	86.5	Confident	87	Confident	13 Å²	13	77.7 Å²	77.7	11%	0.107	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-2.8	172.9	0	0	0	0	0	113.9	A124 V167 F168 W169	A124-A171 HydrophobicContact CB-CB 3.6Å; V167-A171 VanDerWaalsContact O-CB 3.26Å; V167-A171 WeakPolarHBondContact O-CB 3.38Å; V167-A171 PolarHBondContact O-N 3.34Å; F168-A171 PolarHBondContact O-N 2.67Å; W169-A171 VanDerWaalsContact C-N 3.26Å; W169-A171 PolarHBondContact O-N 3.35Å
172	G	86.9	Confident	87.2	Confident	29 Å²	29	78.5 Å²	78.5	30%	0.299	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	23.9	176.5	0	0	0	0	0	114.2	F168 W169 L170 G174 A175 A176	F168-G172 PolarHBondContact O-N 2.92Å; W169-G172 WeakPolarHBondContact O-CA 3.06Å; W169-G172 PolarHBondContact O-N 2.86Å; L170-G172 PolarHBondContact O-N 3.42Å; G172-G174 PolarHBondContact O-N 3.46Å; G172-A175 PolarHBondContact O-N 2.96Å; G172-A175 VanDerWaalsContact O-N 3.12Å; G172-A176 PolarHBondContact O-N 2.79Å
173	A	88	Confident	87.3	Confident	21 Å²	21	77 Å²	77	17%	0.174	42%	0.424	C	S	.	.	H	α-helix	trans	-57.1	-36.9	-179.3	0	0	0	0	0	112.9	L121 F168 A176 V177	L121-A173 VanDerWaalsContact CD1-CA 3.48Å; L121-A173 HydrophobicContact CD1-CB 3.72Å; F168-A173 HydrophobicContact CB-CB 4.07Å; F168-A173 HydrophobicContact CD1-CB 4.27Å; F168-A173 WeakPolarHBondContact O-CB 3.28Å; F168-A173 PolarHBondContact O-N 3.4Å; A173-A176 PolarHBondContact O-N 3.27Å; A173-V177 WeakPolarHBondContact O-CB 3.44Å; A173-V177 VanDerWaalsContact O-CG2 3.23Å; A173-V177 WeakPolarHBondContact O-CG2 3.1Å; A173-V177 PolarHBondContact O-N 3.08Å
174	G	86.4	Confident	87.3	Confident	54 Å²	54	72.6 Å²	72.6	56%	0.557	40%	0.402	S	S	*	.	H	α-helix	trans	-62.3	-44.6	176.2	0	0	0	0	0	113.1	G172 V177 F178	G172-G174 PolarHBondContact O-N 3.46Å; G174-V177 PolarHBondContact O-N 3.36Å; G174-F178 WeakPolarHBondContact O-CB 3.16Å; G174-F178 PolarHBondContact O-N 3.5Å
175	A	88.3	Confident	87.4	Confident	71 Å²	71	77.9 Å²	77.9	59%	0.587	43%	0.428	S	S	*	.	H	α-helix	trans	-66.2	-40.5	177.6	0	0	0	0	0	111.6	G172 F178 W179	G172-A175 PolarHBondContact O-N 2.96Å; G172-A175 VanDerWaalsContact O-N 3.12Å; A175-F178 PolarHBondContact O-N 3.18Å; A175-W179 WeakPolarHBondContact O-CB 3.19Å; A175-W179 PolarHBondContact O-N 3.42Å
176	A	89.1	Confident	87.5	Confident	14 Å²	14	79.3 Å²	79.3	12%	0.116	43%	0.43	C	S	.	.	H	α-helix	trans	-59.5	-47.5	174.1	0	0	0	0	0	111.9	C114 L121 G172 A173 W179 V180	C114-A176 VanDerWaalsContact SG-CB 3.53Å; L121-A176 HydrophobicContact CD1-CB 4.13Å; G172-A176 PolarHBondContact O-N 2.79Å; A173-A176 PolarHBondContact O-N 3.27Å; A176-W179 PolarHBondContact O-N 2.99Å; A176-V180 VanDerWaalsContact O-CG2 3.32Å; A176-V180 WeakPolarHBondContact O-CG2 3.3Å; A176-V180 PolarHBondContact O-N 2.82Å
177	V	87.6	Confident	87.3	Confident	78 Å²	78	78.6 Å²	78.6	47%	0.473	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-46.9	177.5	170.1	0	0	0	0	110.9	A173 G174 W179 V180 F181	A173-V177 WeakPolarHBondContact O-CB 3.44Å; A173-V177 VanDerWaalsContact O-CG2 3.23Å; A173-V177 WeakPolarHBondContact O-CG2 3.1Å; A173-V177 PolarHBondContact O-N 3.08Å; G174-V177 PolarHBondContact O-N 3.36Å; V177-W179 VanDerWaalsContact C-N 3.32Å; V177-W179 PolarHBondContact O-N 2.78Å; V177-V180 PolarHBondContact O-N 2.86Å; V177-F181 HydrophobicContact CG1-CD2 3.49Å; V177-F181 VanDerWaalsContact CG1-CD2 3.49Å; V177-F181 HydrophobicContact CG1-CE2 3.49Å; V177-F181 VanDerWaalsContact CG1-CE2 3.49Å; V177-F181 VanDerWaalsContact O-CD2 3.26Å; V177-F181 WeakPolarHBondContact O-CD2 3.19Å; V177-F181 PolarHBondContact O-N 2.81Å
178	F	89.8	Confident	87.1	Confident	164 Å²	164	76.8 Å²	76.8	72%	0.719	41%	0.412	S	S	*	.	H	α-helix	trans	-60.2	-42	177.4	-174.4	-97.3	0	0	0	112.1	G174 A175 F181 G182	G174-F178 WeakPolarHBondContact O-CB 3.16Å; G174-F178 PolarHBondContact O-N 3.5Å; A175-F178 PolarHBondContact O-N 3.18Å; F178-F181 PolarHBondContact O-N 3.45Å; F178-G182 PolarHBondContact O-N 3.46Å
179	W	89.9	Confident	86.5	Confident	182 Å²	182	75.8 Å²	75.8	69%	0.689	41%	0.414	S	S	*	.	H	α-helix	trans	-61.5	-47.2	175.1	-176.7	-97.8	0	0	0	112.1	A175 A176 V177 G182 A183	A175-W179 WeakPolarHBondContact O-CB 3.19Å; A175-W179 PolarHBondContact O-N 3.42Å; A176-W179 PolarHBondContact O-N 2.99Å; V177-W179 VanDerWaalsContact C-N 3.32Å; V177-W179 PolarHBondContact O-N 2.78Å; W179-G182 PolarHBondContact O-N 2.83Å; W179-A183 VanDerWaalsContact O-CB 3.27Å; W179-A183 WeakPolarHBondContact O-CB 3.39Å; W179-A183 PolarHBondContact O-N 3.38Å
180	V	89	Confident	86.1	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.048	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-45.4	178.3	168.8	0	0	0	0	111	F107 L110 I111 C114 A176 V177 T184	F107-V180 HydrophobicContact CD2-CG1 4.26Å; F107-V180 HydrophobicContact CE2-CG1 3.92Å; L110-V180 HydrophobicContact CB-CG1 4.31Å; I111-V180 HydrophobicContact CG1-CG1 3.81Å; C114-V180 HydrophobicContact CB-CG2 3.43Å; C114-V180 VanDerWaalsContact CB-CG2 3.43Å; A176-V180 VanDerWaalsContact O-CG2 3.32Å; A176-V180 WeakPolarHBondContact O-CG2 3.3Å; A176-V180 PolarHBondContact O-N 2.82Å; V177-V180 PolarHBondContact O-N 2.86Å; V180-T184 WeakPolarHBondContact O-CB 3.26Å; V180-T184 PolarHBondContact O-N 3.25Å; V180-T184 PolarHBondContact O-OG1 3.14Å
181	F	88.3	Confident	85.5	Confident	110 Å²	110	61.4 Å²	61.4	48%	0.482	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-45.6	175.8	-85.8	-69.8	0	0	0	111.7	F107 V177 F178 T184 L185	F107-F181 HydrophobicContact CE2-CD1 4.45Å; F107-F181 HydrophobicContact CE2-CE1 4.26Å; F107-F181 HydrophobicContact CZ-CE1 4.25Å; F107-F181 HydrophobicContact CZ-CZ 4.31Å; V177-F181 HydrophobicContact CG1-CD2 3.49Å; V177-F181 VanDerWaalsContact CG1-CD2 3.49Å; V177-F181 HydrophobicContact CG1-CE2 3.49Å; V177-F181 VanDerWaalsContact CG1-CE2 3.49Å; V177-F181 VanDerWaalsContact O-CD2 3.26Å; V177-F181 WeakPolarHBondContact O-CD2 3.19Å; V177-F181 PolarHBondContact O-N 2.81Å; F178-F181 PolarHBondContact O-N 3.45Å; F181-T184 PolarHBondContact O-N 3.47Å; F181-L185 WeakPolarHBondContact O-CB 3.15Å; F181-L185 VanDerWaalsContact O-CG 3.3Å; F181-L185 WeakPolarHBondContact O-CG 3.45Å; F181-L185 PolarHBondContact O-N 3.38Å
182	G	89.2	Confident	84.7	Confident	36 Å²	36	60.8 Å²	60.8	37%	0.371	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-47.4	177.8	0	0	0	0	0	112.5	F178 W179 T184 L185 F186	F178-G182 PolarHBondContact O-N 3.46Å; W179-G182 PolarHBondContact O-N 2.83Å; G182-T184 VanDerWaalsContact C-N 3.33Å; G182-T184 PolarHBondContact O-N 2.85Å; G182-L185 PolarHBondContact O-N 2.85Å; G182-F186 VanDerWaalsContact O-CB 3.28Å; G182-F186 WeakPolarHBondContact O-CB 3.49Å; G182-F186 PolarHBondContact O-N 3.4Å
183	A	88	Confident	83.7	Confident	26 Å²	26	60.4 Å²	60.4	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-37.6	177.2	0	0	0	0	0	111.8	L110 W179 F186 V187	L110-A183 HydrophobicContact CD2-CB 3.58Å; W179-A183 VanDerWaalsContact O-CB 3.27Å; W179-A183 WeakPolarHBondContact O-CB 3.39Å; W179-A183 PolarHBondContact O-N 3.38Å; A183-F186 PolarHBondContact O-N 3.49Å; A183-V187 WeakPolarHBondContact O-CB 3.01Å; A183-V187 WeakPolarHBondContact O-CG2 3.5Å; A183-V187 PolarHBondContact O-N 3.47Å
184	T	85.3	Confident	82.6	Confident	13 Å²	13	64.5 Å²	64.5	8%	0.08	36%	0.358	C	S	.	.	H	α-helix	trans	-65.6	-49.6	175.4	-61	0	0	0	0	111.3	F107 L110 V180 F181 G182 F186 V187 I188	F107-T184 HydrophobicContact CB-CG2 4.33Å; F107-T184 HydrophobicContact CD2-CG2 3.73Å; F107-T184 WeakPolarHBondContact CD2-OG1 3.29Å; F107-T184 HydrophobicContact CG-CG2 4.43Å; L110-T184 VanDerWaalsContact CD2-OG1 3.27Å; L110-T184 WeakPolarHBondContact CD2-OG1 3.31Å; V180-T184 WeakPolarHBondContact O-CB 3.26Å; V180-T184 PolarHBondContact O-N 3.25Å; V180-T184 PolarHBondContact O-OG1 3.14Å; F181-T184 PolarHBondContact O-N 3.47Å; G182-T184 VanDerWaalsContact C-N 3.33Å; G182-T184 PolarHBondContact O-N 2.85Å; T184-F186 VanDerWaalsContact C-N 3.27Å; T184-F186 PolarHBondContact O-N 3.39Å; T184-V187 PolarHBondContact O-N 2.82Å; T184-I188 HydrophobicContact CG2-CD1 3.37Å; T184-I188 HydrophobicContact CG2-CG1 4.06Å; T184-I188 WeakPolarHBondContact O-CB 3Å; T184-I188 VanDerWaalsContact O-CG1 3.25Å; T184-I188 WeakPolarHBondContact O-CG1 3.09Å; T184-I188 PolarHBondContact O-N 3.22Å
185	L	85.5	Confident	81.6	Confident	128 Å²	128	63.2 Å²	63.2	67%	0.67	34%	0.337	S	S	*	.	H	α-helix	trans	-60.3	-39.2	176	-73.4	174.6	0	0	0	111.4	F181 G182 G189	F181-L185 WeakPolarHBondContact O-CB 3.15Å; F181-L185 VanDerWaalsContact O-CG 3.3Å; F181-L185 WeakPolarHBondContact O-CG 3.45Å; F181-L185 PolarHBondContact O-N 3.38Å; G182-L185 PolarHBondContact O-N 2.85Å; L185-G189 WeakPolarHBondContact O-CA 3.44Å; L185-G189 PolarHBondContact O-N 2.89Å
186	F	86.8	Confident	80.2	Confident	151 Å²	151	63.5 Å²	63.5	66%	0.662	33%	0.326	S	S	*	.	H	α-helix	trans	-66.8	-48.8	177.3	-175.9	-102.7	0	0	0	112	G182 A183 T184 S190	G182-F186 VanDerWaalsContact O-CB 3.28Å; G182-F186 WeakPolarHBondContact O-CB 3.49Å; G182-F186 PolarHBondContact O-N 3.4Å; A183-F186 PolarHBondContact O-N 3.49Å; T184-F186 VanDerWaalsContact C-N 3.27Å; T184-F186 PolarHBondContact O-N 3.39Å; F186-S190 WeakPolarHBondContact O-CB 3.33Å; F186-S190 PolarHBondContact O-N 3.39Å; F186-S190 PolarHBondContact O-OG 3.05Å
187	V	83	Confident	78.6	Confident	68 Å²	68	64.4 Å²	64.4	41%	0.412	33%	0.329	S	S	.	.	H	α-helix	trans	-68.7	-51.3	-177.9	171.4	0	0	0	0	111.1	I106 A183 T184 H191	I106-V187 HydrophobicContact CG2-CG1 4.46Å; A183-V187 WeakPolarHBondContact O-CB 3.01Å; A183-V187 WeakPolarHBondContact O-CG2 3.5Å; A183-V187 PolarHBondContact O-N 3.47Å; T184-V187 PolarHBondContact O-N 2.82Å; V187-H191 WeakPolarHBondContact O-CB 3.34Å; V187-H191 PolarHBondContact O-N 3.23Å
188	I	81.3	Confident	76.9	Confident	23 Å²	23	66.2 Å²	66.2	12%	0.118	33%	0.332	C	S	.	.	H	α-helix	trans	-68.7	-47.8	-179.7	-61.6	-177.2	0	0	0	110.3	V96 Y103 T184 S190 H191 A192	V96-I188 HydrophobicContact CG2-CG2 3.95Å; Y103-I188 HydrophobicContact CD1-CB 4.1Å; Y103-I188 HydrophobicContact CD1-CD1 3.83Å; Y103-I188 HydrophobicContact CD1-CG1 3.59Å; Y103-I188 HydrophobicContact CD1-CG2 3.68Å; Y103-I188 HydrophobicContact CD2-CG2 4.28Å; Y103-I188 HydrophobicContact CE1-CB 4.19Å; Y103-I188 HydrophobicContact CE1-CG1 4.13Å; Y103-I188 HydrophobicContact CE1-CG2 3.65Å; Y103-I188 HydrophobicContact CE2-CG2 4.31Å; Y103-I188 HydrophobicContact CG-CD1 3.96Å; Y103-I188 HydrophobicContact CG-CG1 4.23Å; Y103-I188 HydrophobicContact CG-CG2 4Å; T184-I188 HydrophobicContact CG2-CD1 3.37Å; T184-I188 HydrophobicContact CG2-CG1 4.06Å; T184-I188 WeakPolarHBondContact O-CB 3Å; T184-I188 VanDerWaalsContact O-CG1 3.25Å; T184-I188 WeakPolarHBondContact O-CG1 3.09Å; T184-I188 PolarHBondContact O-N 3.22Å; I188-S190 PolarHBondContact O-N 3.16Å; I188-H191 PolarHBondContact O-N 3.46Å; I188-A192 WeakPolarHBondContact O-CB 3.33Å; I188-A192 PolarHBondContact O-N 3.34Å
189	G	75.4	Confident	74.9	Confident	23 Å²	23	60.5 Å²	60.5	24%	0.237	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-44.5	-179.2	0	0	0	0	0	111.6	L185 A193	L185-G189 WeakPolarHBondContact O-CA 3.44Å; L185-G189 PolarHBondContact O-N 2.89Å; G189-A193 WeakPolarHBondContact O-CB 3.42Å; G189-A193 PolarHBondContact O-N 2.61Å
190	S	77.1	Confident	73.1	Confident	38 Å²	38	56.5 Å²	56.5	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-47.7	174.2	-58.8	0	0	0	0	110.9	F186 I188 A192 A193 F194	F186-S190 WeakPolarHBondContact O-CB 3.33Å; F186-S190 PolarHBondContact O-N 3.39Å; F186-S190 PolarHBondContact O-OG 3.05Å; I188-S190 PolarHBondContact O-N 3.16Å; S190-A192 PolarHBondContact O-N 3.12Å; S190-A193 PolarHBondContact O-N 3.18Å; S190-F194 WeakPolarHBondContact O-CD2 3.46Å; S190-F194 PolarHBondContact O-N 3.21Å; S190-F194 VanDerWaalsContact O-N 3.08Å
191	H	74.1	Confident	71.5	Confident	40 Å²	40	59.8 Å²	59.8	19%	0.185	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-46.4	-179.9	-173.5	77.3	0	0	0	112.2	F73 Y103 V187 I188 R195	F73-H191 AromaticContact CD1-NE2 3.84Å; F73-H191 AromaticContact CD2-NE2 3.9Å; F73-H191 AromaticContact CE1-CD2 3.93Å; F73-H191 AromaticContact CE1-NE2 3.65Å; F73-H191 AromaticContact CE2-CD2 3.87Å; F73-H191 AromaticContact CE2-NE2 3.73Å; F73-H191 AromaticContact CG-NE2 3.98Å; F73-H191 AromaticContact CZ-CD2 3.58Å; F73-H191 AromaticContact CZ-NE2 3.62Å; F73-H191 PolarHBondContact O-CE1 3.25Å; F73-H191 PolarHBondContact O-NE2 2.74Å; Y103-H191 PolarHBondContact OH-CD2 3Å; V187-H191 WeakPolarHBondContact O-CB 3.34Å; V187-H191 PolarHBondContact O-N 3.23Å; I188-H191 PolarHBondContact O-N 3.46Å; H191-R195 WeakPolarHBondContact O-CB 3.4Å; H191-R195 PolarHBondContact O-N 3.16Å
192	A	69.9	Low	70.1	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-73.5	-31.3	-179.5	0	0	0	0	0	113.2	V92 N95 I188 S190	V92-A192 HydrophobicContact CB-CB 4.37Å; V92-A192 HydrophobicContact CG1-CB 4.28Å; V92-A192 HydrophobicContact CG2-CB 4.13Å; N95-A192 HydrophobicContact CB-CB 4.11Å; N95-A192 PolarHBondContact ND2-O 3.46Å; I188-A192 WeakPolarHBondContact O-CB 3.33Å; I188-A192 PolarHBondContact O-N 3.34Å; S190-A192 PolarHBondContact O-N 3.12Å
193	A	65.5	Low	68.6	Low	20 Å²	20	59.9 Å²	59.9	17%	0.165	33%	0.329	C	S	.	.	H	α-helix	trans	-70.3	-36.8	176.5	0	0	0	0	0	112.5	L88 V92 G189 S190	L88-A193 HydrophobicContact CD2-CB 3.75Å; V92-A193 HydrophobicContact CG2-CB 4.3Å; G189-A193 WeakPolarHBondContact O-CB 3.42Å; G189-A193 PolarHBondContact O-N 2.61Å; S190-A193 PolarHBondContact O-N 3.18Å
194	F	65.2	Low	67.4	Low	107 Å²	107	65.1 Å²	65.1	47%	0.469	35%	0.349	S	S	.	.	H	α-helix	trans	-83.2	-24.2	179.5	-68.6	-61.8	0	0	0	112.9	F79 S80 S190 Q196	F79-F194 WeakPolarHBondContact CA-O 3.25Å; F79-F194 HydrophobicContact CD1-CB 3.54Å; F79-F194 WeakPolarHBondContact CD1-O 3.11Å; F79-F194 HydrophobicContact CE1-CB 3.78Å; S80-F194 PolarHBondContact N-O 2.91Å; S190-F194 WeakPolarHBondContact O-CD2 3.46Å; S190-F194 PolarHBondContact O-N 3.21Å; S190-F194 VanDerWaalsContact O-N 3.08Å; F194-Q196 PolarHBondContact O-N 3.24Å
195	R	65.8	Low	66.2	Low	28 Å²	28	69.1 Å²	69.1	11%	0.106	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-69.3	119.8	177.3	-120.9	-78.8	-162.2	135.9	2.1	111.1	S72 N95 Y99 H191	S72-R195 PolarHBondContact O-NH2 2.93Å; N95-R195 PolarHBondContact ND2-O 2.97Å; Y99-R195 PolarHBondContact OH-NH1 3.5Å; Y99-R195 PolarHBondContact OH-NH2 3.16Å; H191-R195 WeakPolarHBondContact O-CB 3.4Å; H191-R195 PolarHBondContact O-N 3.16Å
196	Q	59.2	Low	65	Low	76 Å²	76	69.6 Å²	69.6	36%	0.355	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-66.5	131.4	179.6	-162.3	167.5	23.8	0	0	111.1	K78 S80 F194	K78-Q196 HydrophobicContact CB-CB 4.26Å; K78-Q196 WeakPolarHBondContact O-CB 3.46Å; K78-Q196 PolarHBondContact O-N 3.37Å; S80-Q196 PolarHBondContact OG-NE2 3.45Å; F194-Q196 PolarHBondContact O-N 3.24Å
197	L	54.6	Low	63.8	Low	34 Å²	34	70 Å²	70	18%	0.178	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-75.9	140.7	160.2	-106	127	0	0	0	108.8	R91 K94 G199 D201	R91-L197 HydrophobicContact CB-CD1 3.56Å; R91-L197 HydrophobicContact CG-CB 4.2Å; R91-L197 HydrophobicContact CG-CD1 3.22Å; R91-L197 HydrophobicContact CG-CG 4.31Å; K94-L197 HydrophobicContact CB-CD1 4.35Å; K94-L197 HydrophobicContact CB-CD2 4.34Å; L197-G199 PolarHBondContact O-N 3.14Å; L197-D201 HydrophobicContact CD2-CB 4.07Å
198	E	52.1	Low	62.6	Low	116 Å²	116	73.8 Å²	73.8	54%	0.542	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-54.2	123.7	166.4	-110.8	101.5	-159.3	0	0	107.8	K78 T200 D201	K78-E198 IonicContact NZ-OE1 3.16Å; K78-E198 PolarHBondContact NZ-OE1 3.49Å; K78-E198 IonicContact NZ-OE2 2.75Å; E198-T200 PolarHBondContact O-N 3.45Å; E198-D201 PolarHBondContact O-N 3.46Å
199	G	48.5	Very low	61.3	Low	44 Å²	44	78.2 Å²	78.2	45%	0.454	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.8	-173.4	0	0	0	0	0	114.6	L197 D201 L202 D203	L197-G199 PolarHBondContact O-N 3.14Å; G199-D201 VanDerWaalsContact C-N 3.29Å; G199-D201 PolarHBondContact O-N 2.87Å; G199-L202 PolarHBondContact O-N 3.33Å; G199-L202 VanDerWaalsContact O-N 3.17Å; G199-D203 PolarHBondContact O-N 3.17Å; G199-D203 VanDerWaalsContact O-N 3.16Å
200	T	51.4	Low	60.2	Low	98 Å²	98	86.6 Å²	86.6	60%	0.601	47%	0.467	S	S	*	.	H	α-helix	trans	-59.3	-36.1	177.4	-48.1	0	0	0	0	112.8	E198 L202 E204	E198-T200 PolarHBondContact O-N 3.45Å; T200-L202 VanDerWaalsContact C-N 3.32Å; T200-L202 PolarHBondContact O-N 3.19Å; T200-E204 WeakPolarHBondContact O-CB 3.36Å; T200-E204 PolarHBondContact O-N 3.16Å; T200-E204 VanDerWaalsContact O-N 3.12Å
201	D	55.6	Low	59.4	Low	77 Å²	77	89 Å²	89	41%	0.412	48%	0.477	S	S	.	.	H	α-helix	trans	-73.8	-24.7	-179.5	-59.6	-27	0	0	0	112.5	L197 E198 G199	L197-D201 HydrophobicContact CD2-CB 4.07Å; E198-D201 PolarHBondContact O-N 3.46Å; G199-D201 VanDerWaalsContact C-N 3.29Å; G199-D201 PolarHBondContact O-N 2.87Å
202	L	59	Low	58.6	Low	50 Å²	50	91.6 Å²	91.6	26%	0.262	49%	0.493	S	S	.	.	H	α-helix	trans	-81.4	-39.3	177.7	-177.3	68.2	0	0	0	111.2	E87 G199 T200 E204 L205 L206	E87-L202 HydrophobicContact CG-CD1 4.14Å; E87-L202 HydrophobicContact CG-CD2 4.13Å; E87-L202 WeakPolarHBondContact OE1-CD2 3.27Å; G199-L202 PolarHBondContact O-N 3.33Å; G199-L202 VanDerWaalsContact O-N 3.17Å; T200-L202 VanDerWaalsContact C-N 3.32Å; T200-L202 PolarHBondContact O-N 3.19Å; L202-E204 VanDerWaalsContact C-N 3.34Å; L202-L205 PolarHBondContact O-N 3.17Å; L202-L206 PolarHBondContact O-N 3.42Å; L202-L206 VanDerWaalsContact O-N 3.13Å
203	D	58.2	Low	58	Low	98 Å²	98	96.7 Å²	96.7	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-69.1	-34	177.4	-66.8	-38	0	0	0	111.4	G199 L206 M207	G199-D203 PolarHBondContact O-N 3.17Å; G199-D203 VanDerWaalsContact O-N 3.16Å; D203-L206 PolarHBondContact O-N 3.4Å; D203-M207 WeakPolarHBondContact O-CB 3.43Å; D203-M207 PolarHBondContact O-N 3.1Å; D203-M207 VanDerWaalsContact O-N 3.1Å
204	E	61.8	Low	57.5	Low	135 Å²	135	101.2 Å²	101.2	63%	0.631	54%	0.541	S	S	*	.	H	α-helix	trans	-65.7	-39.3	174	-166.1	170.2	-177	0	0	112.1	T200 L202 M207 E208	T200-E204 WeakPolarHBondContact O-CB 3.36Å; T200-E204 PolarHBondContact O-N 3.16Å; T200-E204 VanDerWaalsContact O-N 3.12Å; L202-E204 VanDerWaalsContact C-N 3.34Å; E204-M207 PolarHBondContact O-N 3.13Å; E204-E208 PolarHBondContact O-N 3.41Å
205	L	60	Low	57.1	Low	98 Å²	98	100.8 Å²	100.8	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-71.6	-27.9	175.7	-90.3	160.8	0	0	0	113.9	L202 M207	L202-L205 PolarHBondContact O-N 3.17Å; L205-M207 VanDerWaalsContact C-N 3.3Å
206	L	60.3	Low	56.5	Low	137 Å²	137	105.7 Å²	105.7	72%	0.717	58%	0.575	S	S	*	*	H	α-helix	trans	-81.2	-12	171.2	-69.7	175.8	0	0	0	112.7	L202 D203	L202-L206 PolarHBondContact O-N 3.42Å; L202-L206 VanDerWaalsContact O-N 3.13Å; D203-L206 PolarHBondContact O-N 3.4Å
207	M	61.7	Low	56.3	Low	159 Å²	159	107.8 Å²	107.8	78%	0.783	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	7.7	176	-84	-161.6	-167.7	0	0	114.3	D203 E204 L205 P209	D203-M207 WeakPolarHBondContact O-CB 3.43Å; D203-M207 PolarHBondContact O-N 3.1Å; D203-M207 VanDerWaalsContact O-N 3.1Å; E204-M207 PolarHBondContact O-N 3.13Å; L205-M207 VanDerWaalsContact C-N 3.3Å; M207-P209 WeakPolarHBondContact O-CD 2.86Å
208	E	58	Low	56.4	Low	149 Å²	149	113.5 Å²	113.5	70%	0.696	62%	0.622	S	S	*	*			trans	-97.5	82.9	167	-161.1	-176.9	143.6	0	0	110.2	E204 V210	E204-E208 PolarHBondContact O-N 3.41Å; E208-V210 PolarHBondContact O-N 3.5Å
209	P	54.2	Low	56.8	Low	115 Å²	115	113.3 Å²	113.3	75%	0.747	63%	0.629	S	S	*	*			trans	-77	118.8	165.4	32.2	-32	0	0	0	109	M207	M207-P209 WeakPolarHBondContact O-CD 2.86Å
210	V	52.7	Low	57.5	Low	199 Å²	199	119.5 Å²	119.5	100%	1.206	65%	0.645	S	S	*	*			trans	-80.9	0	158.5	172.3	0	0	0	0	109.3	E208	E208-V210 PolarHBondContact O-N 3.5Å

Retrieved 210 of 210 residues in 201.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).